G4V7R9_SCHMA Loading...

Dolichyl-diphosphooligosaccharide--protein glycosyltransferase 48 kDa subunit

Subunit of the oligosaccharyl transferase (OST) complex that catalyzes the initial transfer of a defined glycan (Glc(3)Man(9)GlcNAc(2) in eukaryotes) from the lipid carrier dolichol-pyrophosphate to an asparagine residue within an Asn-X-Ser/Thr consensus motif in nascent polypeptide chains, the first step in protein N-glycosylation. N-glycosylation occurs cotranslationally and the complex associates with the Sec61 complex at the channel-forming translocon complex that mediates protein translocation across the endoplasmic reticulum (ER).

AlphaFold DB , UniProt , Accession G4V7R9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 432 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	48.5	Very low	51.3	Low	218 Å²	218	168.4 Å²	168.4	100%	1.074	85%	0.854	S	S	*	*				0	113.7	0	-164.4	169.4	81.5	0	0	107.1	L3	M1-L3 HydrophobicContact CE-CD1 4.11Å
2	W	48	Very low	51.3	Low	261 Å²	261	163.3 Å²	163.3	99%	0.989	84%	0.841	S	S	*	*			trans	-62.4	133.8	174.2	-84.9	13	0	0	0	109.9
3	L	53	Low	50.9	Low	146 Å²	146	166.4 Å²	166.4	76%	0.764	85%	0.845	S	S	*	*			trans	-131.1	119.9	167	-110.4	149.7	0	0	0	108.3	M1	M1-L3 HydrophobicContact CE-CD1 4.11Å
4	L	52.2	Low	50.5	Low	172 Å²	172	163.6 Å²	163.6	90%	0.901	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-60.2	126.7	-177.6	-74.7	127	0	0	0	111.5
5	L	55.9	Low	50.3	Low	171 Å²	171	158.1 Å²	158.1	90%	0.895	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-88.7	116.1	165.5	-95.2	144.2	0	0	0	108.8
6	L	52.5	Low	49.9	Very low	160 Å²	160	154.9 Å²	154.9	84%	0.838	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-65.1	129.7	177.8	-148.5	101.2	0	0	0	110.2	L8	L6-L8 PolarHBondContact O-N 3.02Å
7	P	52.4	Low	50	Low	109 Å²	109	158.1 Å²	158.1	71%	0.708	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-79.6	121.9	177.4	29.3	-28.4	0	0	0	110.3	L9	P7-L9 PolarHBondContact O-N 3.27Å; P7-L9 VanDerWaalsContact O-N 3.15Å
8	L	54.4	Low	50.5	Low	156 Å²	156	155.6 Å²	155.6	82%	0.817	81%	0.807	S	S	*	*			trans	-60.6	113.1	168.9	-91.3	110.9	0	0	0	109.5	L6 F10	L6-L8 PolarHBondContact O-N 3.02Å; L8-F10 PolarHBondContact O-N 3.07Å
9	L	52.3	Low	51.6	Low	170 Å²	170	151.7 Å²	151.7	89%	0.89	79%	0.787	S	S	*	*			trans	-61.7	98.8	165.1	-78.8	154.4	0	0	0	108.8	P7 S11	P7-L9 PolarHBondContact O-N 3.27Å; P7-L9 VanDerWaalsContact O-N 3.15Å; L9-S11 VanDerWaalsContact C-N 3.31Å; L9-S11 PolarHBondContact O-N 3.02Å
10	F	48.7	Very low	52.7	Low	193 Å²	193	149.4 Å²	149.4	85%	0.846	77%	0.771	S	S	*	*			trans	-67.5	93.3	162.3	-90.3	-92.6	0	0	0	108.3	L8 P12	L8-F10 PolarHBondContact O-N 3.07Å; F10-P12 WeakPolarHBondContact O-CD 3.3Å
11	S	46.6	Very low	54.2	Low	96 Å²	96	145.4 Å²	145.4	67%	0.671	76%	0.756	S	S	*	*			trans	-65.2	121.1	158.3	170.3	0	0	0	0	107.6	L9 F13	L9-S11 VanDerWaalsContact C-N 3.31Å; L9-S11 PolarHBondContact O-N 3.02Å; S11-F13 PolarHBondContact O-N 2.96Å
12	P	51.3	Low	56.3	Low	107 Å²	107	137.4 Å²	137.4	70%	0.695	72%	0.715	S	S	*	*			trans	-65.3	112.7	171.6	26.3	-29.6	0	0	0	107.6	F10 V14	F10-P12 WeakPolarHBondContact O-CD 3.3Å; P12-V14 VanDerWaalsContact C-N 3.28Å; P12-V14 PolarHBondContact O-N 2.96Å
13	F	45.7	Very low	58.6	Low	204 Å²	204	125.7 Å²	125.7	90%	0.895	67%	0.672	S	S	*	*			trans	-59	96.3	166.4	-131.7	-97.1	0	0	0	106.6	S11 A15	S11-F13 PolarHBondContact O-N 2.96Å; F13-A15 PolarHBondContact O-N 3.43Å
14	V	46.1	Very low	60.7	Low	128 Å²	128	118.8 Å²	118.8	78%	0.776	64%	0.636	S	S	*	*			trans	-69.1	94.3	165.2	179.2	0	0	0	0	104.3	P12 S16	P12-V14 VanDerWaalsContact C-N 3.28Å; P12-V14 PolarHBondContact O-N 2.96Å; V14-S16 PolarHBondContact O-N 3.32Å
15	A	46.6	Very low	62.9	Low	80 Å²	80	110.6 Å²	110.6	66%	0.661	59%	0.593	S	S	*	*			trans	-53.4	110.4	163.2	0	0	0	0	0	105.9	F13 Y17	F13-A15 PolarHBondContact O-N 3.43Å; A15-Y17 PolarHBondContact O-N 3.29Å
16	S	44.9	Very low	65	Low	108 Å²	108	102.5 Å²	102.5	76%	0.755	55%	0.55	S	S	*	*			trans	-52.3	110.9	168.7	-177.2	0	0	0	0	105.9	V14 E18	V14-S16 PolarHBondContact O-N 3.32Å; S16-E18 PolarHBondContact O-N 2.71Å
17	Y	50.5	Low	67.1	Low	208 Å²	208	94.9 Å²	94.9	82%	0.816	51%	0.511	S	S	*	.			trans	-67.2	94.5	172.3	-176.1	-94.4	0	0	0	105.5	A15 D19	A15-Y17 PolarHBondContact O-N 3.29Å; Y17-D19 PolarHBondContact O-N 3.01Å; Y17-D19 VanDerWaalsContact O-N 3.09Å
18	E	59.2	Low	69.3	Low	113 Å²	113	89.8 Å²	89.8	53%	0.528	48%	0.477	S	S	.	.			trans	-64.2	112.1	176	-169.5	177.7	167.1	0	0	107.3	S16 K20 N23	S16-E18 PolarHBondContact O-N 2.71Å; E18-K20 VanDerWaalsContact C-N 3.3Å; E18-K20 PolarHBondContact O-N 3.16Å; E18-N23 PolarHBondContact OE1-ND2 3.4Å; E18-N23 PolarHBondContact OE1-OD1 2.71Å
19	D	71.2	Confident	71.3	Confident	82 Å²	82	85.2 Å²	85.2	44%	0.439	45%	0.452	S	S	.	.			trans	-69.5	91.9	176.4	-174.3	0.5	0	0	0	108.7	Y17 S21 K22	Y17-D19 PolarHBondContact O-N 3.01Å; Y17-D19 VanDerWaalsContact O-N 3.09Å; D19-S21 PolarHBondContact O-N 2.92Å; D19-S21 VanDerWaalsContact OD1-CB 3.23Å; D19-S21 WeakPolarHBondContact OD1-CB 3.3Å; D19-S21 PolarHBondContact OD1-N 3.37Å; D19-S21 VanDerWaalsContact OD1-N 3.13Å; D19-S21 PolarHBondContact OD1-OG 2.91Å; D19-S21 PolarHBondContact OD2-OG 3.27Å; D19-S21 VanDerWaalsContact OD2-OG 3.07Å; D19-K22 PolarHBondContact O-N 3.45Å
20	K	75	Confident	73.4	Confident	106 Å²	106	79.8 Å²	79.8	46%	0.461	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-53	-22.4	178.4	-64.6	-173.8	-179.4	-173.6	0	112.6	E18 K22 N23 E68	E18-K20 VanDerWaalsContact C-N 3.3Å; E18-K20 PolarHBondContact O-N 3.16Å; K20-K22 PolarHBondContact O-N 2.82Å; K20-K22 VanDerWaalsContact O-N 3.17Å; K20-N23 PolarHBondContact O-N 3.41Å; K20-E68 IonicContact NZ-OE2 2.63Å; K20-E68 PolarHBondContact NZ-OE2 2.83Å
21	S	83.9	Confident	75.6	Confident	66 Å²	66	75 Å²	75	46%	0.462	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-65	-15.2	176.8	78.7	0	0	0	0	113.5	D19 S72	D19-S21 PolarHBondContact O-N 2.92Å; D19-S21 VanDerWaalsContact OD1-CB 3.23Å; D19-S21 WeakPolarHBondContact OD1-CB 3.3Å; D19-S21 PolarHBondContact OD1-N 3.37Å; D19-S21 VanDerWaalsContact OD1-N 3.13Å; D19-S21 PolarHBondContact OD1-OG 2.91Å; D19-S21 PolarHBondContact OD2-OG 3.27Å; D19-S21 VanDerWaalsContact OD2-OG 3.07Å; S21-S72 VanDerWaalsContact O-CB 3.28Å; S21-S72 WeakPolarHBondContact O-CB 3.49Å; S21-S72 PolarHBondContact O-OG 3.07Å
22	K	92.3	Very high	78	Confident	50 Å²	50	78.4 Å²	78.4	22%	0.217	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-107.7	8.8	179.8	-72	-66.9	-171.2	168.5	0	114.6	D19 K20 R47 Y49 N50 E276	D19-K22 PolarHBondContact O-N 3.45Å; K20-K22 PolarHBondContact O-N 2.82Å; K20-K22 VanDerWaalsContact O-N 3.17Å; K22-R47 PolarHBondContact NZ-O 2.75Å; K22-Y49 HydrophobicContact CB-CD1 4.31Å; K22-Y49 HydrophobicContact CD-CD1 3.66Å; K22-Y49 HydrophobicContact CD-CE1 3.53Å; K22-Y49 HydrophobicContact CD-CE2 4.46Å; K22-Y49 HydrophobicContact CD-CG 4.18Å; K22-Y49 PolarHBondContact NZ-OH 2.87Å; K22-Y49 CarbonylContact O-C 3.47Å; K22-Y49 VanDerWaalsContact O-CA 3.26Å; K22-Y49 WeakPolarHBondContact O-CA 3.49Å; K22-Y49 WeakPolarHBondContact O-CD1 3.31Å; K22-N50 PolarHBondContact O-N 3.01Å; K22-E276 IonicContact NZ-OE1 3.79Å; K22-E276 PolarHBondContact NZ-OE1 3.41Å
23	N	96.6	Very high	80.1	Confident	15 Å²	15	73.5 Å²	73.5	8%	0.08	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	124	176.9	-71.2	-4.5	0	0	0	111	E18 K20 N50 Y71 S72	E18-N23 PolarHBondContact OE1-ND2 3.4Å; E18-N23 PolarHBondContact OE1-OD1 2.71Å; K20-N23 PolarHBondContact O-N 3.41Å; N23-N50 WeakPolarHBondContact OD1-CB 3.43Å; N23-N50 PolarHBondContact OD1-ND2 2.99Å; N23-N50 VanDerWaalsContact OD1-ND2 3.1Å; N23-Y71 HydrophobicContact CB-CD1 4.13Å; N23-Y71 CarbonylContact O-C 3.51Å; N23-Y71 VanDerWaalsContact O-CA 3.3Å; N23-Y71 WeakPolarHBondContact O-CA 3.22Å; N23-S72 PolarHBondContact O-N 2.82Å; N23-S72 PolarHBondContact O-OG 3.12Å
24	L	97.8	Very high	82.5	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	135.6	176.8	-59.3	179	0	0	0	111	L44 Y49 N50 L51 T52 G73 I75 L274	L24-L44 HydrophobicContact CD1-CD1 4.48Å; L24-L44 HydrophobicContact CD1-CD2 4.01Å; L24-Y49 HydrophobicContact CD1-CD1 3.54Å; L24-Y49 HydrophobicContact CD1-CD2 4.13Å; L24-Y49 HydrophobicContact CD1-CE1 4.2Å; L24-Y49 HydrophobicContact CD1-CG 3.53Å; L24-Y49 HydrophobicContact CD2-CD1 4Å; L24-Y49 HydrophobicContact CD2-CE1 4.26Å; L24-Y49 HydrophobicContact CG-CD1 3.56Å; L24-Y49 HydrophobicContact CG-CE1 4.28Å; L24-Y49 HydrophobicContact CG-CG 3.98Å; L24-N50 PolarHBondContact N-O 3.48Å; L24-L51 HydrophobicContact CB-CD2 3.87Å; L24-L51 HydrophobicContact CD1-CD2 3.95Å; L24-L51 HydrophobicContact CG-CD2 4.37Å; L24-T52 PolarHBondContact O-N 3.47Å; L24-G73 WeakPolarHBondContact CA-O 3.47Å; L24-I75 HydrophobicContact CD1-CD1 4.19Å; L24-L274 HydrophobicContact CD1-CD1 4.18Å; L24-L274 HydrophobicContact CD1-CD2 4.36Å; L24-L274 HydrophobicContact CD2-CD2 4.04Å
25	L	98.1	Very high	85	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.005	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	125	167	179	60.8	0	0	0	108.8	L27 T52 K54 I61 L63 Y71 G73 L74 I75	L25-L27 HydrophobicContact CD1-CD2 4.04Å; L25-L27 HydrophobicContact CD2-CD2 4.07Å; L25-L27 HydrophobicContact CG-CD2 3.92Å; L25-L27 HydrophobicContact CG-CG 4.36Å; L25-T52 HydrophobicContact CD1-CG2 4.14Å; L25-T52 WeakPolarHBondContact CD1-O 3.29Å; L25-K54 HydrophobicContact CD1-CD 4.33Å; L25-K54 HydrophobicContact CD1-CG 4.35Å; L25-I61 HydrophobicContact CD2-CG2 4.08Å; L25-L63 HydrophobicContact CD2-CD2 3.76Å; L25-Y71 HydrophobicContact CB-CD1 3.87Å; L25-Y71 HydrophobicContact CB-CD2 3.7Å; L25-Y71 HydrophobicContact CB-CE1 4.03Å; L25-Y71 HydrophobicContact CB-CE2 3.86Å; L25-Y71 HydrophobicContact CB-CG 3.7Å; L25-Y71 HydrophobicContact CD1-CE2 4.34Å; L25-Y71 HydrophobicContact CD2-CD2 4.17Å; L25-Y71 HydrophobicContact CD2-CE2 3.93Å; L25-Y71 HydrophobicContact CG-CD2 4.49Å; L25-Y71 HydrophobicContact CG-CE2 4.27Å; L25-G73 PolarHBondContact N-O 2.78Å; L25-G73 VanDerWaalsContact N-O 3.1Å; L25-L74 HydrophobicContact CB-CD1 4Å; L25-L74 HydrophobicContact CD2-CD1 3.87Å; L25-L74 HydrophobicContact CG-CD1 3.87Å; L25-L74 WeakPolarHBondContact O-CA 3.23Å; L25-I75 PolarHBondContact O-N 2.8Å
26	V	98.3	Very high	87.4	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	113.7	175.7	-172.7	0	0	0	0	108.6	L28 L41 L51 T52 T53 K54 I75 L77	V26-L28 HydrophobicContact CG1-CD2 3.77Å; V26-L41 HydrophobicContact CG1-CD2 4.11Å; V26-L51 HydrophobicContact CG2-CB 4.43Å; V26-L51 HydrophobicContact CG2-CD2 4.15Å; V26-T52 PolarHBondContact N-O 2.88Å; V26-T53 HydrophobicContact CB-CG2 3.98Å; V26-T53 VanDerWaalsContact O-CA 3.32Å; V26-T53 WeakPolarHBondContact O-CA 3.45Å; V26-K54 PolarHBondContact O-N 2.91Å; V26-I75 CarbonylContact C-O 3.58Å; V26-I75 WeakPolarHBondContact CA-O 3.32Å; V26-I75 HydrophobicContact CG1-CB 4.39Å; V26-I75 HydrophobicContact CG1-CG2 4.37Å; V26-I75 HydrophobicContact CG2-CB 4.31Å; V26-L77 HydrophobicContact CG1-CD1 4.16Å; V26-L77 HydrophobicContact CG1-CG 4.41Å
27	L	98.4	Very high	89.9	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	131.3	174.7	-57.3	-177.1	0	0	0	109.3	L25 K54 A56 I61 L74 I75 I76 L77 F84 L88	L25-L27 HydrophobicContact CD1-CD2 4.04Å; L25-L27 HydrophobicContact CD2-CD2 4.07Å; L25-L27 HydrophobicContact CG-CD2 3.92Å; L25-L27 HydrophobicContact CG-CG 4.36Å; L27-K54 CarbonylContact C-O 3.52Å; L27-K54 WeakPolarHBondContact CA-O 3.37Å; L27-K54 HydrophobicContact CD2-CB 4.15Å; L27-A56 HydrophobicContact CB-CB 4.2Å; L27-I61 HydrophobicContact CD2-CD1 3.94Å; L27-I61 HydrophobicContact CD2-CG1 4.22Å; L27-I61 HydrophobicContact CD2-CG2 4.42Å; L27-L74 HydrophobicContact CD1-CD1 3.99Å; L27-L74 HydrophobicContact CG-CD1 3.98Å; L27-I75 PolarHBondContact N-O 3.4Å; L27-I76 HydrophobicContact CB-CG2 4.49Å; L27-I76 HydrophobicContact CD1-CG1 4.34Å; L27-L77 CarbonylContact O-C 3.51Å; L27-L77 WeakPolarHBondContact O-CA 3.25Å; L27-L77 PolarHBondContact O-N 2.9Å; L27-F84 HydrophobicContact CD1-CD1 4.09Å; L27-F84 HydrophobicContact CD1-CE1 4.14Å; L27-L88 HydrophobicContact CD1-CD2 3.39Å
28	L	98.1	Very high	92.2	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.01	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	142.3	-177.5	-53	176	0	0	0	109.5	V26 N30 I33 K34 K54 L55 A56 L77	V26-L28 HydrophobicContact CG1-CD2 3.77Å; L28-N30 VanDerWaalsContact C-N 3.34Å; L28-I33 HydrophobicContact CD2-CB 4.2Å; L28-I33 HydrophobicContact CD2-CG2 3.76Å; L28-K34 HydrophobicContact CD1-CD 4.07Å; L28-K34 VanDerWaalsContact CD1-CE 3.43Å; L28-K34 HydrophobicContact CD1-CG 3.44Å; L28-K34 VanDerWaalsContact CD1-CG 3.44Å; L28-K54 PolarHBondContact N-O 3.31Å; L28-L55 HydrophobicContact CB-CD2 4.47Å; L28-L55 CarbonylContact O-C 3.43Å; L28-L55 WeakPolarHBondContact O-CA 3.38Å; L28-A56 PolarHBondContact O-N 2.86Å; L28-L77 HydrophobicContact CD2-CB 4.14Å; L28-L77 HydrophobicContact CD2-CD1 3.96Å; L28-L77 HydrophobicContact CD2-CG 4.46Å
29	E	96.2	Very high	94	Very high	60 Å²	60	51.4 Å²	51.4	28%	0.28	26%	0.26	S	S	.	.	S	Bend	trans	-62.7	-45.5	168.3	-160.4	168.4	110.9	0	0	111.5	I33 L77 A78 P79 S80	E29-I33 HydrophobicContact CB-CD1 3.68Å; E29-L77 PolarHBondContact N-O 2.79Å; E29-A78 HydrophobicContact CB-CB 4.21Å; E29-P79 WeakPolarHBondContact OE2-CD 3.37Å; E29-P79 VanDerWaalsContact OE2-CG 3.31Å; E29-P79 WeakPolarHBondContact OE2-CG 3.37Å; E29-S80 PolarHBondContact OE1-OG 3.25Å; E29-S80 VanDerWaalsContact OE1-OG 3.09Å; E29-S80 PolarHBondContact OE2-N 3.03Å; E29-S80 PolarHBondContact OE2-OG 3.47Å
30	N	95.5	Very high	95.3	Very high	56 Å²	56	47.5 Å²	47.5	30%	0.299	24%	0.239	S	C	.	.	S	Bend	trans	-148.8	165.9	-177.1	67.8	51.6	0	0	0	110.3	L28 Y32 I33	L28-N30 VanDerWaalsContact C-N 3.34Å; N30-Y32 VanDerWaalsContact C-N 3.28Å; N30-Y32 HydrophobicContact CB-CD2 4.46Å; N30-Y32 PolarHBondContact O-N 3.42Å; N30-Y32 WeakPolarHBondContact OD1-CA 3.24Å; N30-Y32 VanDerWaalsContact OD1-CB 3.31Å; N30-Y32 WeakPolarHBondContact OD1-CB 3.4Å; N30-Y32 PolarHBondContact OD1-N 2.98Å; N30-I33 PolarHBondContact O-N 2.81Å; N30-I33 PolarHBondContact OD1-N 2.85Å
31	V	95.4	Very high	96.4	Very high	92 Å²	92	43.3 Å²	43.3	56%	0.558	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-28.2	-175.6	-174.1	0	0	0	0	112.4	I33 K34 L55	V31-I33 PolarHBondContact O-N 3.48Å; V31-K34 WeakPolarHBondContact O-CB 3.32Å; V31-K34 PolarHBondContact O-N 3.33Å; V31-K34 VanDerWaalsContact O-N 3.11Å; V31-L55 HydrophobicContact CG2-CD2 4.14Å
32	Y	96.3	Very high	97.1	Very high	168 Å²	168	44 Å²	44	66%	0.659	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-21.4	-179.3	-54.5	-73.8	0	0	0	113.2	N30 K34 E35 T36	N30-Y32 VanDerWaalsContact C-N 3.28Å; N30-Y32 HydrophobicContact CB-CD2 4.46Å; N30-Y32 PolarHBondContact O-N 3.42Å; N30-Y32 WeakPolarHBondContact OD1-CA 3.24Å; N30-Y32 VanDerWaalsContact OD1-CB 3.31Å; N30-Y32 WeakPolarHBondContact OD1-CB 3.4Å; N30-Y32 PolarHBondContact OD1-N 2.98Å; Y32-K34 PolarHBondContact O-N 3.43Å; Y32-E35 PolarHBondContact O-N 2.94Å; Y32-E35 VanDerWaalsContact O-N 3.07Å; Y32-T36 PolarHBondContact O-N 2.9Å; Y32-T36 PolarHBondContact O-OG1 3.24Å
33	I	96.8	Very high	97.3	Very high	4 Å²	4	42.3 Å²	42.3	2%	0.021	21%	0.213	C	C	.	.	H	α-helix	trans	-59	-32.4	174	-64.9	178	0	0	0	111.1	L28 E29 N30 V31 E35 T36 H37 L77 L238	L28-I33 HydrophobicContact CD2-CB 4.2Å; L28-I33 HydrophobicContact CD2-CG2 3.76Å; E29-I33 HydrophobicContact CB-CD1 3.68Å; N30-I33 PolarHBondContact O-N 2.81Å; N30-I33 PolarHBondContact OD1-N 2.85Å; V31-I33 PolarHBondContact O-N 3.48Å; I33-E35 PolarHBondContact O-N 3.39Å; I33-T36 VanDerWaalsContact CA-OG1 3.32Å; I33-T36 WeakPolarHBondContact CA-OG1 3.26Å; I33-T36 PolarHBondContact O-N 3.03Å; I33-H37 HydrophobicContact CG2-CB 4.17Å; I33-H37 VanDerWaalsContact O-CB 3.31Å; I33-H37 WeakPolarHBondContact O-CB 3.42Å; I33-H37 PolarHBondContact O-N 3.48Å; I33-L77 WeakPolarHBondContact CD1-O 3.34Å; I33-L77 HydrophobicContact CG2-CB 4.06Å; I33-L77 HydrophobicContact CG2-CD1 3.83Å; I33-L238 HydrophobicContact CD1-CD2 4.1Å
34	K	96.3	Very high	97.4	Very high	86 Å²	86	41.6 Å²	41.6	37%	0.374	21%	0.209	S	C	.	.	H	α-helix	trans	-58.8	-35.9	175.9	-65.8	-172.4	173.4	-177.1	0	112.9	L28 V31 Y32 S38 T53	L28-K34 HydrophobicContact CD1-CD 4.07Å; L28-K34 VanDerWaalsContact CD1-CE 3.43Å; L28-K34 HydrophobicContact CD1-CG 3.44Å; L28-K34 VanDerWaalsContact CD1-CG 3.44Å; V31-K34 WeakPolarHBondContact O-CB 3.32Å; V31-K34 PolarHBondContact O-N 3.33Å; V31-K34 VanDerWaalsContact O-N 3.11Å; Y32-K34 PolarHBondContact O-N 3.43Å; K34-S38 WeakPolarHBondContact O-CA 3.4Å; K34-S38 WeakPolarHBondContact O-CB 3.44Å; K34-S38 PolarHBondContact O-N 3.34Å; K34-T53 WeakPolarHBondContact CE-OG1 3.35Å; K34-T53 PolarHBondContact NZ-OG1 3.49Å
35	E	97.1	Very high	97.3	Very high	144 Å²	144	44.5 Å²	44.5	67%	0.673	23%	0.227	S	C	*	.	H	α-helix	trans	-86.2	-47.2	-179.1	-63.8	-179.9	176.4	0	0	111.1	Y32 I33 H37 S38 N243	Y32-E35 PolarHBondContact O-N 2.94Å; Y32-E35 VanDerWaalsContact O-N 3.07Å; I33-E35 PolarHBondContact O-N 3.39Å; E35-H37 VanDerWaalsContact C-N 3.27Å; E35-H37 PolarHBondContact O-N 3.24Å; E35-S38 PolarHBondContact O-N 2.99Å; E35-S38 PolarHBondContact O-OG 3.04Å; E35-N243 PolarHBondContact O-ND2 3.46Å
36	T	97.9	Very high	97.2	Very high	69 Å²	69	50.9 Å²	50.9	42%	0.423	26%	0.261	S	S	.	.	H	α-helix	trans	-70.5	-22.4	-176.4	52.5	0	0	0	0	113.7	Y32 I33 N243	Y32-T36 PolarHBondContact O-N 2.9Å; Y32-T36 PolarHBondContact O-OG1 3.24Å; I33-T36 VanDerWaalsContact CA-OG1 3.32Å; I33-T36 WeakPolarHBondContact CA-OG1 3.26Å; I33-T36 PolarHBondContact O-N 3.03Å; T36-N243 WeakPolarHBondContact O-CB 3.43Å; T36-N243 PolarHBondContact O-N 3.06Å; T36-N243 PolarHBondContact O-ND2 2.83Å
37	H	98.2	Very high	96.9	Very high	7 Å²	7	53 Å²	53	3%	0.032	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121	23.7	-180	-59.5	67.9	0	0	0	111.9	I33 E35 T39 F40 L41 L238 L241	I33-H37 HydrophobicContact CG2-CB 4.17Å; I33-H37 VanDerWaalsContact O-CB 3.31Å; I33-H37 WeakPolarHBondContact O-CB 3.42Å; I33-H37 PolarHBondContact O-N 3.48Å; E35-H37 VanDerWaalsContact C-N 3.27Å; E35-H37 PolarHBondContact O-N 3.24Å; H37-T39 VanDerWaalsContact C-N 3.26Å; H37-T39 PolarHBondContact O-N 3.27Å; H37-F40 HydrophobicContact CB-CB 4.48Å; H37-F40 WeakPolarHBondContact O-CB 3.23Å; H37-F40 PolarHBondContact O-N 3Å; H37-F40 VanDerWaalsContact O-N 3.1Å; H37-L41 PolarHBondContact O-N 3.17Å; H37-L41 VanDerWaalsContact O-N 3.11Å; H37-L238 WeakPolarHBondContact NE2-CD1 3.41Å; H37-L238 WeakPolarHBondContact NE2-CG 3.43Å; H37-L238 PolarHBondContact NE2-O 3.31Å; H37-L238 VanDerWaalsContact NE2-O 3.1Å; H37-L241 VanDerWaalsContact CD2-C 3.46Å; H37-L241 PolarHBondContact CD2-O 3.17Å
38	S	97.9	Very high	96.6	Very high	38 Å²	38	55 Å²	55	27%	0.266	29%	0.291	S	S	.	.	H	α-helix	trans	-56.2	-40	-178.1	62.6	0	0	0	0	112.5	K34 E35 F40 L41 D42 N243	K34-S38 WeakPolarHBondContact O-CA 3.4Å; K34-S38 WeakPolarHBondContact O-CB 3.44Å; K34-S38 PolarHBondContact O-N 3.34Å; E35-S38 PolarHBondContact O-N 2.99Å; E35-S38 PolarHBondContact O-OG 3.04Å; S38-F40 VanDerWaalsContact C-N 3.3Å; S38-F40 PolarHBondContact O-N 2.83Å; S38-L41 PolarHBondContact O-N 2.98Å; S38-L41 VanDerWaalsContact O-N 3.15Å; S38-D42 WeakPolarHBondContact O-CB 3.36Å; S38-D42 PolarHBondContact O-N 3.34Å; S38-N243 PolarHBondContact N-OD1 3.2Å; S38-N243 PolarHBondContact OG-ND2 3.24Å
39	T	97.9	Very high	96.5	Very high	33 Å²	33	55.5 Å²	55.5	20%	0.202	29%	0.293	C	S	.	.	H	α-helix	trans	-61.8	-38.8	178.9	-53.5	0	0	0	0	111.7	H37 D42 M43 N243 F246	H37-T39 VanDerWaalsContact C-N 3.26Å; H37-T39 PolarHBondContact O-N 3.27Å; T39-D42 PolarHBondContact O-N 2.91Å; T39-M43 HydrophobicContact CG2-CE 4.43Å; T39-M43 WeakPolarHBondContact O-CG 3.42Å; T39-M43 PolarHBondContact O-N 3.38Å; T39-N243 WeakPolarHBondContact CB-OD1 3.4Å; T39-N243 PolarHBondContact N-OD1 2.85Å; T39-N243 PolarHBondContact OG1-OD1 3.01Å; T39-F246 HydrophobicContact CG2-CD2 3.76Å; T39-F246 HydrophobicContact CG2-CE2 4.24Å
40	F	98.3	Very high	96.6	Very high	1 Å²	1	56.7 Å²	56.7	0%	0.004	30%	0.301	C	S	.	.	H	α-helix	trans	-65.6	-45.1	174.8	168.4	-95.2	0	0	0	111.4	H37 S38 D42 M43 L44 I75 L77 L241 F246 T266 L270	H37-F40 HydrophobicContact CB-CB 4.48Å; H37-F40 WeakPolarHBondContact O-CB 3.23Å; H37-F40 PolarHBondContact O-N 3Å; H37-F40 VanDerWaalsContact O-N 3.1Å; S38-F40 VanDerWaalsContact C-N 3.3Å; S38-F40 PolarHBondContact O-N 2.83Å; F40-D42 VanDerWaalsContact C-N 3.3Å; F40-D42 PolarHBondContact O-N 3.28Å; F40-M43 WeakPolarHBondContact O-CB 3.26Å; F40-M43 PolarHBondContact O-N 2.84Å; F40-L44 HydrophobicContact CE1-CD1 4.05Å; F40-L44 HydrophobicContact CZ-CD1 4.38Å; F40-I75 HydrophobicContact CE1-CG2 4.15Å; F40-I75 HydrophobicContact CZ-CD1 4.41Å; F40-I75 HydrophobicContact CZ-CG2 4.2Å; F40-L77 HydrophobicContact CD1-CD1 4.21Å; F40-L77 HydrophobicContact CE1-CD1 4.05Å; F40-L77 HydrophobicContact CE1-CD2 4.23Å; F40-L241 HydrophobicContact CD2-CB 4.3Å; F40-L241 HydrophobicContact CD2-CD1 4.21Å; F40-L241 HydrophobicContact CD2-CD2 4.02Å; F40-L241 HydrophobicContact CD2-CG 4.42Å; F40-L241 HydrophobicContact CE2-CD1 3.92Å; F40-L241 HydrophobicContact CE2-CD2 4.08Å; F40-L241 HydrophobicContact CG-CB 4.46Å; F40-L241 HydrophobicContact CZ-CD1 4.19Å; F40-F246 HydrophobicContact CB-CE2 4.17Å; F40-T266 HydrophobicContact CD2-CG2 3.72Å; F40-T266 HydrophobicContact CE2-CG2 4.01Å; F40-L270 HydrophobicContact CD2-CD1 4.09Å; F40-L270 HydrophobicContact CE2-CD1 3.75Å; F40-L270 HydrophobicContact CE2-CD2 3.84Å; F40-L270 HydrophobicContact CE2-CG 4.15Å; F40-L270 HydrophobicContact CZ-CD1 4.49Å; F40-L270 HydrophobicContact CZ-CD2 4.11Å
41	L	98.3	Very high	96.6	Very high	17 Å²	17	56.1 Å²	56.1	9%	0.089	30%	0.297	C	S	.	.	H	α-helix	trans	-64	-38.4	176.8	-61.9	176.3	0	0	0	111.4	V26 H37 S38 M43 L44 T45 L51 L77	V26-L41 HydrophobicContact CG1-CD2 4.11Å; H37-L41 PolarHBondContact O-N 3.17Å; H37-L41 VanDerWaalsContact O-N 3.11Å; S38-L41 PolarHBondContact O-N 2.98Å; S38-L41 VanDerWaalsContact O-N 3.15Å; L41-M43 VanDerWaalsContact C-N 3.3Å; L41-M43 PolarHBondContact O-N 2.86Å; L41-L44 WeakPolarHBondContact O-CB 3.43Å; L41-L44 PolarHBondContact O-N 2.82Å; L41-T45 PolarHBondContact O-N 3.01Å; L41-T45 VanDerWaalsContact O-N 3.08Å; L41-L51 HydrophobicContact CB-CD1 4.26Å; L41-L51 HydrophobicContact CD2-CD1 4.27Å; L41-L77 HydrophobicContact CD2-CD1 4.44Å
42	D	97.8	Very high	96.7	Very high	82 Å²	82	54.2 Å²	54.2	44%	0.439	29%	0.286	S	S	.	.	H	α-helix	trans	-64.7	-33.3	176.2	-72.2	-22.1	0	0	0	111.8	S38 T39 F40 L44 T45 N46	S38-D42 WeakPolarHBondContact O-CB 3.36Å; S38-D42 PolarHBondContact O-N 3.34Å; T39-D42 PolarHBondContact O-N 2.91Å; F40-D42 VanDerWaalsContact C-N 3.3Å; F40-D42 PolarHBondContact O-N 3.28Å; D42-L44 PolarHBondContact O-N 2.8Å; D42-T45 WeakPolarHBondContact CA-OG1 3.42Å; D42-T45 PolarHBondContact O-N 2.7Å; D42-T45 PolarHBondContact O-OG1 2.89Å; D42-T45 VanDerWaalsContact O-OG1 3.14Å; D42-N46 WeakPolarHBondContact O-CB 3.3Å; D42-N46 PolarHBondContact O-N 3.28Å; D42-N46 PolarHBondContact O-ND2 3.39Å
43	M	97.2	Very high	96.8	Very high	13 Å²	13	48.4 Å²	48.4	6%	0.064	27%	0.268	C	S	.	.	H	α-helix	trans	-57.2	-39.3	171.4	-70.3	176.9	-175.4	0	0	111.4	T39 F40 L41 R47 F246 Q263 T266 D267 L270	T39-M43 HydrophobicContact CG2-CE 4.43Å; T39-M43 WeakPolarHBondContact O-CG 3.42Å; T39-M43 PolarHBondContact O-N 3.38Å; F40-M43 WeakPolarHBondContact O-CB 3.26Å; F40-M43 PolarHBondContact O-N 2.84Å; L41-M43 VanDerWaalsContact C-N 3.3Å; L41-M43 PolarHBondContact O-N 2.86Å; M43-R47 VanDerWaalsContact O-CD 3.22Å; M43-R47 WeakPolarHBondContact O-CD 3.37Å; M43-R47 VanDerWaalsContact O-CG 3.29Å; M43-R47 WeakPolarHBondContact O-CG 3.45Å; M43-R47 PolarHBondContact O-NH1 2.89Å; M43-F246 HydrophobicContact CE-CD2 4.41Å; M43-F246 HydrophobicContact CE-CE2 3.93Å; M43-F246 HydrophobicContact CE-CZ 4.33Å; M43-Q263 HydrophobicContact CE-CB 4.35Å; M43-Q263 HydrophobicContact CE-CG 3.21Å; M43-T266 HydrophobicContact SD-CG2 4.13Å; M43-D267 HydrophobicContact SD-CB 4.35Å; M43-L270 HydrophobicContact CB-CD1 4.05Å; M43-L270 HydrophobicContact SD-CD1 4.18Å
44	L	97.2	Very high	96.8	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-73.1	-47.7	179.9	-57.8	166.3	0	0	0	111.5	L24 F40 L41 D42 N46 R47 Y49 L51 I75 L270 L274	L24-L44 HydrophobicContact CD1-CD1 4.48Å; L24-L44 HydrophobicContact CD1-CD2 4.01Å; F40-L44 HydrophobicContact CE1-CD1 4.05Å; F40-L44 HydrophobicContact CZ-CD1 4.38Å; L41-L44 WeakPolarHBondContact O-CB 3.43Å; L41-L44 PolarHBondContact O-N 2.82Å; D42-L44 PolarHBondContact O-N 2.8Å; L44-N46 VanDerWaalsContact C-N 3.33Å; L44-N46 PolarHBondContact O-N 3.41Å; L44-R47 WeakPolarHBondContact O-CB 3.45Å; L44-R47 PolarHBondContact O-N 2.95Å; L44-R47 VanDerWaalsContact O-N 3.1Å; L44-Y49 WeakPolarHBondContact O-CD2 3.49Å; L44-Y49 PolarHBondContact O-N 3.1Å; L44-L51 HydrophobicContact CB-CD1 4.17Å; L44-L51 HydrophobicContact CB-CD2 3.89Å; L44-L51 HydrophobicContact CB-CG 4.5Å; L44-L51 HydrophobicContact CD1-CD1 4.25Å; L44-L51 HydrophobicContact CD1-CD2 4.03Å; L44-I75 HydrophobicContact CD1-CD1 3.45Å; L44-I75 VanDerWaalsContact CD1-CD1 3.45Å; L44-I75 HydrophobicContact CD2-CD1 4.06Å; L44-I75 HydrophobicContact CG-CD1 4.42Å; L44-L270 HydrophobicContact CD2-CD1 3.94Å; L44-L270 HydrophobicContact CD2-CD2 4.02Å; L44-L270 HydrophobicContact CD2-CG 4.47Å; L44-L270 HydrophobicContact CG-CD1 4.39Å; L44-L274 HydrophobicContact CD2-CD1 3.66Å
45	T	96.4	Very high	96.9	Very high	61 Å²	61	48.7 Å²	48.7	37%	0.374	27%	0.272	S	S	.	.	H	α-helix	trans	-63.6	-39.3	179.9	58.7	0	0	0	0	111.7	L41 D42 R47 G48 L51	L41-T45 PolarHBondContact O-N 3.01Å; L41-T45 VanDerWaalsContact O-N 3.08Å; D42-T45 WeakPolarHBondContact CA-OG1 3.42Å; D42-T45 PolarHBondContact O-N 2.7Å; D42-T45 PolarHBondContact O-OG1 2.89Å; D42-T45 VanDerWaalsContact O-OG1 3.14Å; T45-R47 PolarHBondContact O-N 2.84Å; T45-R47 VanDerWaalsContact O-N 3.14Å; T45-G48 WeakPolarHBondContact O-CA 3.42Å; T45-G48 PolarHBondContact O-N 3.27Å; T45-L51 HydrophobicContact CG2-CD1 3.67Å; T45-L51 HydrophobicContact CG2-CG 3.97Å
46	N	95.5	Very high	96.9	Very high	135 Å²	135	42 Å²	42	72%	0.722	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-19	176.2	-73.2	-38.5	0	0	0	113.6	D42 L44 G48	D42-N46 WeakPolarHBondContact O-CB 3.3Å; D42-N46 PolarHBondContact O-N 3.28Å; D42-N46 PolarHBondContact O-ND2 3.39Å; L44-N46 VanDerWaalsContact C-N 3.33Å; L44-N46 PolarHBondContact O-N 3.41Å; N46-G48 VanDerWaalsContact C-N 3.33Å
47	R	91.9	Very high	96.7	Very high	44 Å²	44	44 Å²	44	17%	0.166	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	6	173.5	-68	162.7	172.8	58.1	-2.6	113.4	K22 M43 L44 T45 Y49 D267 E276	K22-R47 PolarHBondContact NZ-O 2.75Å; M43-R47 VanDerWaalsContact O-CD 3.22Å; M43-R47 WeakPolarHBondContact O-CD 3.37Å; M43-R47 VanDerWaalsContact O-CG 3.29Å; M43-R47 WeakPolarHBondContact O-CG 3.45Å; M43-R47 PolarHBondContact O-NH1 2.89Å; L44-R47 WeakPolarHBondContact O-CB 3.45Å; L44-R47 PolarHBondContact O-N 2.95Å; L44-R47 VanDerWaalsContact O-N 3.1Å; T45-R47 PolarHBondContact O-N 2.84Å; T45-R47 VanDerWaalsContact O-N 3.14Å; R47-Y49 HydrophobicContact CB-CD2 3.79Å; R47-Y49 HydrophobicContact CB-CE2 3.83Å; R47-D267 IonicContact CZ-OD1 3.46Å; R47-D267 IonicContact NH1-OD1 2.68Å; R47-D267 PolarHBondContact NH1-OD1 2.85Å; R47-D267 PolarHBondContact NH2-O 2.81Å; R47-D267 IonicContact NH2-OD1 3.18Å; R47-D267 PolarHBondContact NH2-OD1 2.86Å; R47-D267 IonicContact NH2-OD2 2.76Å; R47-D267 PolarHBondContact NH2-OD2 2.89Å; R47-D267 VanDerWaalsContact NH2-OD2 3.12Å; R47-E276 IonicContact NE-OE2 3.38Å
48	G	93	Very high	96.6	Very high	44 Å²	44	47 Å²	47	45%	0.454	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.2	20.4	-178.8	0	0	0	0	0	114.4	T45 N46	T45-G48 WeakPolarHBondContact O-CA 3.42Å; T45-G48 PolarHBondContact O-N 3.27Å; N46-G48 VanDerWaalsContact C-N 3.33Å
49	Y	95.9	Very high	96.5	Very high	12 Å²	12	50.4 Å²	50.4	5%	0.047	29%	0.287	C	S	.	.			trans	-79.5	135.8	170.4	-68.7	-79.9	0	0	0	111.4	K22 L24 L44 R47 L274 E276	K22-Y49 HydrophobicContact CB-CD1 4.31Å; K22-Y49 HydrophobicContact CD-CD1 3.66Å; K22-Y49 HydrophobicContact CD-CE1 3.53Å; K22-Y49 HydrophobicContact CD-CE2 4.46Å; K22-Y49 HydrophobicContact CD-CG 4.18Å; K22-Y49 PolarHBondContact NZ-OH 2.87Å; K22-Y49 CarbonylContact O-C 3.47Å; K22-Y49 VanDerWaalsContact O-CA 3.26Å; K22-Y49 WeakPolarHBondContact O-CA 3.49Å; K22-Y49 WeakPolarHBondContact O-CD1 3.31Å; L24-Y49 HydrophobicContact CD1-CD1 3.54Å; L24-Y49 HydrophobicContact CD1-CD2 4.13Å; L24-Y49 HydrophobicContact CD1-CE1 4.2Å; L24-Y49 HydrophobicContact CD1-CG 3.53Å; L24-Y49 HydrophobicContact CD2-CD1 4Å; L24-Y49 HydrophobicContact CD2-CE1 4.26Å; L24-Y49 HydrophobicContact CG-CD1 3.56Å; L24-Y49 HydrophobicContact CG-CE1 4.28Å; L24-Y49 HydrophobicContact CG-CG 3.98Å; L44-Y49 WeakPolarHBondContact O-CD2 3.49Å; L44-Y49 PolarHBondContact O-N 3.1Å; R47-Y49 HydrophobicContact CB-CD2 3.79Å; R47-Y49 HydrophobicContact CB-CE2 3.83Å; Y49-L274 HydrophobicContact CD2-CD1 4.21Å; Y49-L274 HydrophobicContact CE1-CD1 4.35Å; Y49-L274 HydrophobicContact CE2-CD1 3.6Å; Y49-L274 WeakPolarHBondContact OH-CB 3.14Å; Y49-E276 WeakPolarHBondContact CE2-OE1 3.36Å; Y49-E276 VanDerWaalsContact CZ-OE1 3.26Å; Y49-E276 WeakPolarHBondContact OH-CG 3.32Å; Y49-E276 PolarHBondContact OH-OE1 2.89Å
50	N	96.9	Very high	96.3	Very high	84 Å²	84	51.6 Å²	51.6	45%	0.449	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	112.4	171.1	-61.5	-38.2	0	0	0	108.9	K22 N23 L24	K22-N50 PolarHBondContact O-N 3.01Å; N23-N50 WeakPolarHBondContact OD1-CB 3.43Å; N23-N50 PolarHBondContact OD1-ND2 2.99Å; N23-N50 VanDerWaalsContact OD1-ND2 3.1Å; L24-N50 PolarHBondContact N-O 3.48Å
51	L	97.4	Very high	96.2	Very high	44 Å²	44	51.6 Å²	51.6	23%	0.23	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	119.9	-177.2	-53.4	-173.3	0	0	0	110.9	L24 V26 L41 L44 T45	L24-L51 HydrophobicContact CB-CD2 3.87Å; L24-L51 HydrophobicContact CD1-CD2 3.95Å; L24-L51 HydrophobicContact CG-CD2 4.37Å; V26-L51 HydrophobicContact CG2-CB 4.43Å; V26-L51 HydrophobicContact CG2-CD2 4.15Å; L41-L51 HydrophobicContact CB-CD1 4.26Å; L41-L51 HydrophobicContact CD2-CD1 4.27Å; L44-L51 HydrophobicContact CB-CD1 4.17Å; L44-L51 HydrophobicContact CB-CD2 3.89Å; L44-L51 HydrophobicContact CB-CG 4.5Å; L44-L51 HydrophobicContact CD1-CD1 4.25Å; L44-L51 HydrophobicContact CD1-CD2 4.03Å; T45-L51 HydrophobicContact CG2-CD1 3.67Å; T45-L51 HydrophobicContact CG2-CG 3.97Å
52	T	97	Very high	96	Very high	53 Å²	53	52.5 Å²	52.5	33%	0.325	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	115.1	161.8	-59.8	0	0	0	0	108.1	L24 L25 V26 K54 Y71	L24-T52 PolarHBondContact O-N 3.47Å; L25-T52 HydrophobicContact CD1-CG2 4.14Å; L25-T52 WeakPolarHBondContact CD1-O 3.29Å; V26-T52 PolarHBondContact N-O 2.88Å; T52-K54 HydrophobicContact CG2-CG 4.42Å; T52-Y71 HydrophobicContact CG2-CE1 4.44Å
53	T	97.2	Very high	95.8	Very high	46 Å²	46	48.7 Å²	48.7	28%	0.282	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	129.2	-179.4	53.8	0	0	0	0	110.2	V26 K34	V26-T53 HydrophobicContact CB-CG2 3.98Å; V26-T53 VanDerWaalsContact O-CA 3.32Å; V26-T53 WeakPolarHBondContact O-CA 3.45Å; K34-T53 WeakPolarHBondContact CE-OG1 3.35Å; K34-T53 PolarHBondContact NZ-OG1 3.49Å
54	K	97.7	Very high	95.6	Very high	40 Å²	40	52 Å²	52	17%	0.174	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	158.1	177.1	-67.2	-170.8	178.1	-168.2	0	110	L25 V26 L27 L28 T52 E58 S60 I61	L25-K54 HydrophobicContact CD1-CD 4.33Å; L25-K54 HydrophobicContact CD1-CG 4.35Å; V26-K54 PolarHBondContact O-N 2.91Å; L27-K54 CarbonylContact C-O 3.52Å; L27-K54 WeakPolarHBondContact CA-O 3.37Å; L27-K54 HydrophobicContact CD2-CB 4.15Å; L28-K54 PolarHBondContact N-O 3.31Å; T52-K54 HydrophobicContact CG2-CG 4.42Å; K54-E58 WeakPolarHBondContact CB-OE2 3.14Å; K54-S60 WeakPolarHBondContact CE-OG 3.25Å; K54-S60 PolarHBondContact NZ-O 3.42Å; K54-S60 PolarHBondContact NZ-OG 3.22Å; K54-I61 HydrophobicContact CB-CG1 4.32Å; K54-I61 HydrophobicContact CD-CG1 3.88Å
55	L	97.9	Very high	95.3	Very high	56 Å²	56	59.6 Å²	59.6	29%	0.293	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	146.7	165.9	-65.4	174.6	0	0	0	108.9	L28 V31 D57 E58 I61	L28-L55 HydrophobicContact CB-CD2 4.47Å; L28-L55 CarbonylContact O-C 3.43Å; L28-L55 WeakPolarHBondContact O-CA 3.38Å; V31-L55 HydrophobicContact CG2-CD2 4.14Å; L55-D57 WeakPolarHBondContact CB-OD1 3.38Å; L55-D57 PolarHBondContact O-N 2.81Å; L55-E58 HydrophobicContact CB-CB 4.36Å; L55-E58 VanDerWaalsContact O-CB 3.29Å; L55-E58 WeakPolarHBondContact O-CB 3.48Å; L55-E58 PolarHBondContact O-N 2.83Å; L55-E58 VanDerWaalsContact O-N 3.17Å; L55-I61 WeakPolarHBondContact O-CD1 3.35Å
56	A	96.8	Very high	94.9	Very high	4 Å²	4	64 Å²	64	3%	0.033	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-23.8	-174.1	0	0	0	0	0	113.7	L27 L28 I61 A78 V81 F84 G85	L27-A56 HydrophobicContact CB-CB 4.2Å; L28-A56 PolarHBondContact O-N 2.86Å; A56-I61 VanDerWaalsContact O-CD1 3.3Å; A56-I61 WeakPolarHBondContact O-CD1 3.11Å; A56-A78 HydrophobicContact CB-CB 3.52Å; A56-V81 HydrophobicContact CB-CB 4.2Å; A56-V81 HydrophobicContact CB-CG2 3.89Å; A56-F84 HydrophobicContact CB-CD1 4.48Å; A56-F84 WeakPolarHBondContact O-CA 3.39Å; A56-G85 PolarHBondContact O-N 3.04Å
57	D	95.1	Very high	94.6	Very high	110 Å²	110	60.4 Å²	60.4	59%	0.588	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	5.6	178.9	64.2	-17.5	0	0	0	113.3	L55 S59	L55-D57 WeakPolarHBondContact CB-OD1 3.38Å; L55-D57 PolarHBondContact O-N 2.81Å; D57-S59 PolarHBondContact O-N 2.9Å
58	E	96	Very high	94.6	Very high	71 Å²	71	63.8 Å²	63.8	33%	0.332	36%	0.361	S	S	.	.			trans	-70.5	126.3	-175.7	-165.3	-175.5	144.1	0	0	112.2	K54 L55 S60 I61 G85 G86	K54-E58 WeakPolarHBondContact CB-OE2 3.14Å; L55-E58 HydrophobicContact CB-CB 4.36Å; L55-E58 VanDerWaalsContact O-CB 3.29Å; L55-E58 WeakPolarHBondContact O-CB 3.48Å; L55-E58 PolarHBondContact O-N 2.83Å; L55-E58 VanDerWaalsContact O-N 3.17Å; E58-S60 PolarHBondContact O-N 2.88Å; E58-S60 WeakPolarHBondContact OE1-CB 3.47Å; E58-S60 PolarHBondContact OE1-OG 2.84Å; E58-I61 HydrophobicContact CB-CD1 4.23Å; E58-I61 HydrophobicContact CB-CG1 4.19Å; E58-I61 VanDerWaalsContact O-CD1 3.26Å; E58-I61 WeakPolarHBondContact O-CD1 3.32Å; E58-I61 WeakPolarHBondContact O-CG1 3.34Å; E58-I61 PolarHBondContact O-N 2.86Å; E58-G85 CarbonylContact O-C 3.6Å; E58-G85 WeakPolarHBondContact O-CA 3.26Å; E58-G86 PolarHBondContact O-N 2.8Å
59	S	94.8	Very high	94.6	Very high	109 Å²	109	64 Å²	64	76%	0.762	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-14.5	-179.7	61.4	0	0	0	0	115.7	D57 I61 G86	D57-S59 PolarHBondContact O-N 2.9Å; S59-I61 VanDerWaalsContact C-N 3.35Å; S59-G86 WeakPolarHBondContact O-CA 3.48Å
60	S	94.1	Very high	94.6	Very high	57 Å²	57	66.5 Å²	66.5	40%	0.399	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-2.3	-177.6	84.1	0	0	0	0	113.8	K54 E58 S62	K54-S60 WeakPolarHBondContact CE-OG 3.25Å; K54-S60 PolarHBondContact NZ-O 3.42Å; K54-S60 PolarHBondContact NZ-OG 3.22Å; E58-S60 PolarHBondContact O-N 2.88Å; E58-S60 WeakPolarHBondContact OE1-CB 3.47Å; E58-S60 PolarHBondContact OE1-OG 2.84Å; S60-S62 PolarHBondContact O-N 3.31Å
61	I	95.7	Very high	94.6	Very high	2 Å²	2	63.8 Å²	63.8	1%	0.01	35%	0.346	C	S	.	.			trans	-69.9	131.1	-176.1	-58.6	161.2	0	0	0	110	L25 L27 K54 L55 A56 E58 S59 G85 T87 L88	L25-I61 HydrophobicContact CD2-CG2 4.08Å; L27-I61 HydrophobicContact CD2-CD1 3.94Å; L27-I61 HydrophobicContact CD2-CG1 4.22Å; L27-I61 HydrophobicContact CD2-CG2 4.42Å; K54-I61 HydrophobicContact CB-CG1 4.32Å; K54-I61 HydrophobicContact CD-CG1 3.88Å; L55-I61 WeakPolarHBondContact O-CD1 3.35Å; A56-I61 VanDerWaalsContact O-CD1 3.3Å; A56-I61 WeakPolarHBondContact O-CD1 3.11Å; E58-I61 HydrophobicContact CB-CD1 4.23Å; E58-I61 HydrophobicContact CB-CG1 4.19Å; E58-I61 VanDerWaalsContact O-CD1 3.26Å; E58-I61 WeakPolarHBondContact O-CD1 3.32Å; E58-I61 WeakPolarHBondContact O-CG1 3.34Å; E58-I61 PolarHBondContact O-N 2.86Å; S59-I61 VanDerWaalsContact C-N 3.35Å; I61-G85 WeakPolarHBondContact CB-O 3.23Å; I61-T87 PolarHBondContact O-N 2.95Å; I61-L88 HydrophobicContact CB-CB 4.5Å; I61-L88 HydrophobicContact CG2-CB 3.79Å; I61-L88 HydrophobicContact CG2-CD2 3.86Å; I61-L88 HydrophobicContact CG2-CG 4.35Å
62	S	94.8	Very high	94.5	Very high	35 Å²	35	63.1 Å²	63.1	25%	0.245	35%	0.345	C	S	.	.			trans	-153.2	137.5	167.8	-166.8	0	0	0	0	109.5	S60 K64 T87	S60-S62 PolarHBondContact O-N 3.31Å; S62-K64 PolarHBondContact OG-O 3.04Å; S62-K64 VanDerWaalsContact OG-O 3.09Å; S62-T87 PolarHBondContact OG-OG1 3.04Å
63	L	94.2	Very high	94.5	Very high	2 Å²	2	60.6 Å²	60.6	1%	0.01	33%	0.329	C	S	.	.	S	Bend	trans	-85.7	-24.7	175.1	-66.7	178.1	0	0	0	112.6	L25 Y69 L70 Y71 L88 F96	L25-L63 HydrophobicContact CD2-CD2 3.76Å; L63-Y69 HydrophobicContact CB-CD1 4.18Å; L63-Y69 HydrophobicContact CB-CE1 4.32Å; L63-Y69 WeakPolarHBondContact O-CA 3.43Å; L63-L70 PolarHBondContact O-N 2.77Å; L63-Y71 HydrophobicContact CD2-CD2 4.21Å; L63-L88 HydrophobicContact CD1-CD1 3.5Å; L63-L88 VanDerWaalsContact CD1-CD1 3.5Å; L63-L88 HydrophobicContact CD2-CD1 4.41Å; L63-L88 HydrophobicContact CG-CD1 3.72Å; L63-F96 HydrophobicContact CD1-CB 4.02Å; L63-F96 HydrophobicContact CD1-CG 4.22Å
64	K	92.7	Very high	94.5	Very high	84 Å²	84	58.4 Å²	58.4	37%	0.365	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	142.6	-173.9	-68.8	-173.6	178.8	-174	0	111.4	S62 E68 Y69 D99	S62-K64 PolarHBondContact OG-O 3.04Å; S62-K64 VanDerWaalsContact OG-O 3.09Å; K64-E68 CarbonylContact C-O 3.5Å; K64-E68 VanDerWaalsContact CA-O 3.24Å; K64-E68 WeakPolarHBondContact CA-O 3.39Å; K64-Y69 HydrophobicContact CD-CE1 4.13Å; K64-Y69 WeakPolarHBondContact CE-OH 3.26Å; K64-Y69 HydrophobicContact CG-CD1 3.77Å; K64-Y69 HydrophobicContact CG-CE1 3.77Å; K64-Y69 HydrophobicContact CG-CG 4.42Å; K64-Y69 PolarHBondContact NZ-OH 2.87Å; K64-D99 IonicContact NZ-OD2 3.41Å
65	Y	90.4	Very high	94.6	Very high	159 Å²	159	56.5 Å²	56.5	62%	0.624	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.3	122.7	164.8	-176.6	-106.8	0	0	0	108.6	G67 E68	Y65-G67 PolarHBondContact O-N 2.9Å; Y65-E68 PolarHBondContact N-O 3.29Å; Y65-E68 PolarHBondContact O-N 2.91Å; Y65-E68 VanDerWaalsContact O-N 3.15Å
66	L	88.7	Confident	94.6	Very high	152 Å²	152	53.8 Å²	53.8	80%	0.796	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	35.1	-176.7	-58.1	175	0	0	0	113.9	E68	L66-E68 VanDerWaalsContact C-N 3.31Å; L66-E68 PolarHBondContact O-N 2.85Å
67	G	88.3	Confident	94.7	Very high	60 Å²	60	53.6 Å²	53.6	62%	0.619	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.7	-9.3	177.8	0	0	0	0	0	115.4	Y65	Y65-G67 PolarHBondContact O-N 2.9Å
68	E	91.1	Very high	94.8	Very high	116 Å²	116	48.4 Å²	48.4	54%	0.542	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	145.4	174.3	-65.3	-171.5	177.1	0	0	111.4	K20 K64 Y65 L66	K20-E68 IonicContact NZ-OE2 2.63Å; K20-E68 PolarHBondContact NZ-OE2 2.83Å; K64-E68 CarbonylContact C-O 3.5Å; K64-E68 VanDerWaalsContact CA-O 3.24Å; K64-E68 WeakPolarHBondContact CA-O 3.39Å; Y65-E68 PolarHBondContact N-O 3.29Å; Y65-E68 PolarHBondContact O-N 2.91Å; Y65-E68 VanDerWaalsContact O-N 3.15Å; L66-E68 VanDerWaalsContact C-N 3.31Å; L66-E68 PolarHBondContact O-N 2.85Å
69	Y	94.7	Very high	94.9	Very high	48 Å²	48	45.1 Å²	45.1	19%	0.188	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	135.2	172.3	-71.3	-73.5	0	0	0	111.5	L63 K64 N95 F96 D99	L63-Y69 HydrophobicContact CB-CD1 4.18Å; L63-Y69 HydrophobicContact CB-CE1 4.32Å; L63-Y69 WeakPolarHBondContact O-CA 3.43Å; K64-Y69 HydrophobicContact CD-CE1 4.13Å; K64-Y69 WeakPolarHBondContact CE-OH 3.26Å; K64-Y69 HydrophobicContact CG-CD1 3.77Å; K64-Y69 HydrophobicContact CG-CE1 3.77Å; K64-Y69 HydrophobicContact CG-CG 4.42Å; K64-Y69 PolarHBondContact NZ-OH 2.87Å; Y69-N95 PolarHBondContact OH-O 2.9Å; Y69-F96 AromaticContact CD1-CD2 3.47Å; Y69-F96 HydrophobicContact CD1-CD2 3.47Å; Y69-F96 VanDerWaalsContact CD1-CD2 3.47Å; Y69-F96 AromaticContact CD1-CE2 3.99Å; Y69-F96 HydrophobicContact CD1-CE2 3.99Å; Y69-F96 HydrophobicContact CE1-CB 3.89Å; Y69-F96 AromaticContact CE1-CD2 3.41Å; Y69-F96 HydrophobicContact CE1-CD2 3.41Å; Y69-F96 VanDerWaalsContact CE1-CD2 3.41Å; Y69-F96 HydrophobicContact CE1-CE2 4.36Å; Y69-F96 HydrophobicContact CE1-CG 4.11Å; Y69-F96 HydrophobicContact CG-CD2 4.04Å; Y69-F96 HydrophobicContact CG-CE2 4.29Å; Y69-F96 AromaticContact CZ-CD2 3.94Å; Y69-F96 WeakPolarHBondContact OH-CA 3.5Å; Y69-F96 PolarHBondContact OH-N 2.92Å; Y69-D99 HydrophobicContact CD2-CB 4.48Å; Y69-D99 HydrophobicContact CE2-CB 3.48Å; Y69-D99 VanDerWaalsContact CE2-CB 3.48Å; Y69-D99 WeakPolarHBondContact CE2-OD2 3.4Å; Y69-D99 PolarHBondContact OH-OD2 3.16Å
70	L	94.9	Very high	95	Very high	65 Å²	65	42 Å²	42	34%	0.34	23%	0.227	S	C	.	.	S	Bend	trans	-80.4	-22	176.9	-67.3	177.7	0	0	0	112.9	L63	L63-L70 PolarHBondContact O-N 2.77Å
71	Y	96.4	Very high	95.1	Very high	26 Å²	26	40 Å²	40	10%	0.102	21%	0.212	C	C	.	.			trans	-131.3	145.3	-170.8	-51.2	-74.8	0	0	0	110.2	N23 L25 T52 L63 F96	N23-Y71 HydrophobicContact CB-CD1 4.13Å; N23-Y71 CarbonylContact O-C 3.51Å; N23-Y71 VanDerWaalsContact O-CA 3.3Å; N23-Y71 WeakPolarHBondContact O-CA 3.22Å; L25-Y71 HydrophobicContact CB-CD1 3.87Å; L25-Y71 HydrophobicContact CB-CD2 3.7Å; L25-Y71 HydrophobicContact CB-CE1 4.03Å; L25-Y71 HydrophobicContact CB-CE2 3.86Å; L25-Y71 HydrophobicContact CB-CG 3.7Å; L25-Y71 HydrophobicContact CD1-CE2 4.34Å; L25-Y71 HydrophobicContact CD2-CD2 4.17Å; L25-Y71 HydrophobicContact CD2-CE2 3.93Å; L25-Y71 HydrophobicContact CG-CD2 4.49Å; L25-Y71 HydrophobicContact CG-CE2 4.27Å; T52-Y71 HydrophobicContact CG2-CE1 4.44Å; L63-Y71 HydrophobicContact CD2-CD2 4.21Å; Y71-F96 WeakPolarHBondContact O-CE2 3.37Å
72	S	95.4	Very high	95.1	Very high	30 Å²	30	43.6 Å²	43.6	21%	0.21	24%	0.238	C	C	.	.	S	Bend	trans	-86.3	-19.1	172.1	63.1	0	0	0	0	112.8	S21 N23 N102	S21-S72 VanDerWaalsContact O-CB 3.28Å; S21-S72 WeakPolarHBondContact O-CB 3.49Å; S21-S72 PolarHBondContact O-OG 3.07Å; N23-S72 PolarHBondContact O-N 2.82Å; N23-S72 PolarHBondContact O-OG 3.12Å; S72-N102 PolarHBondContact O-N 2.86Å; S72-N102 VanDerWaalsContact O-N 3.14Å
73	G	97.1	Very high	95.1	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	154.9	176.5	0	0	0	0	0	113.4	L24 L25 N102	L24-G73 WeakPolarHBondContact CA-O 3.47Å; L25-G73 PolarHBondContact N-O 2.78Å; L25-G73 VanDerWaalsContact N-O 3.1Å; G73-N102 CarbonylContact C-O 3.51Å; G73-N102 WeakPolarHBondContact CA-O 3.46Å
74	L	98.4	Very high	95.2	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	131	177.1	176.3	60.2	0	0	0	109	L25 L27 I76 I93 F96 N102 L103 V104	L25-L74 HydrophobicContact CB-CD1 4Å; L25-L74 HydrophobicContact CD2-CD1 3.87Å; L25-L74 HydrophobicContact CG-CD1 3.87Å; L25-L74 WeakPolarHBondContact O-CA 3.23Å; L27-L74 HydrophobicContact CD1-CD1 3.99Å; L27-L74 HydrophobicContact CG-CD1 3.98Å; L74-I76 HydrophobicContact CD1-CG1 4.3Å; L74-I76 HydrophobicContact CD2-CD1 3.98Å; L74-I76 HydrophobicContact CD2-CG1 4.19Å; L74-I76 HydrophobicContact CG-CD1 4.26Å; L74-I76 HydrophobicContact CG-CG1 3.91Å; L74-I93 HydrophobicContact CD2-CD1 4.16Å; L74-I93 HydrophobicContact CD2-CG1 3.87Å; L74-I93 HydrophobicContact CD2-CG2 4.1Å; L74-F96 HydrophobicContact CB-CD1 4.35Å; L74-F96 HydrophobicContact CB-CE1 3.78Å; L74-N102 PolarHBondContact N-O 2.69Å; L74-L103 HydrophobicContact CB-CD1 3.96Å; L74-L103 HydrophobicContact CD2-CD1 3.95Å; L74-L103 HydrophobicContact CG-CD1 3.89Å; L74-L103 CarbonylContact O-C 3.5Å; L74-L103 WeakPolarHBondContact O-CA 3.45Å; L74-V104 PolarHBondContact O-N 3.19Å
75	I	98.6	Very high	95.4	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	122.5	175.3	-57.9	-179.3	0	0	0	107.9	L24 L25 V26 L27 F40 L44 L77 V104	L24-I75 HydrophobicContact CD1-CD1 4.19Å; L25-I75 PolarHBondContact O-N 2.8Å; V26-I75 CarbonylContact C-O 3.58Å; V26-I75 WeakPolarHBondContact CA-O 3.32Å; V26-I75 HydrophobicContact CG1-CB 4.39Å; V26-I75 HydrophobicContact CG1-CG2 4.37Å; V26-I75 HydrophobicContact CG2-CB 4.31Å; L27-I75 PolarHBondContact N-O 3.4Å; F40-I75 HydrophobicContact CE1-CG2 4.15Å; F40-I75 HydrophobicContact CZ-CD1 4.41Å; F40-I75 HydrophobicContact CZ-CG2 4.2Å; L44-I75 HydrophobicContact CD1-CD1 3.45Å; L44-I75 VanDerWaalsContact CD1-CD1 3.45Å; L44-I75 HydrophobicContact CD2-CD1 4.06Å; L44-I75 HydrophobicContact CG-CD1 4.42Å; I75-L77 HydrophobicContact CG2-CD2 3.9Å; I75-L77 HydrophobicContact CG2-CG 4Å; I75-V104 CarbonylContact C-O 3.56Å; I75-V104 WeakPolarHBondContact CA-O 3.39Å; I75-V104 HydrophobicContact CB-CB 4.44Å; I75-V104 HydrophobicContact CG1-CB 4.13Å; I75-V104 HydrophobicContact CG1-CG2 4.31Å; I75-V104 HydrophobicContact CG2-CB 4.18Å; I75-V104 HydrophobicContact CG2-CG1 4.41Å
76	I	98.6	Very high	95.5	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	100.6	-177.5	-49.3	-178.4	0	0	0	108.1	L27 L74 A78 F84 I93 L103 V104 V105 V106 I115 L118	L27-I76 HydrophobicContact CB-CG2 4.49Å; L27-I76 HydrophobicContact CD1-CG1 4.34Å; L74-I76 HydrophobicContact CD1-CG1 4.3Å; L74-I76 HydrophobicContact CD2-CD1 3.98Å; L74-I76 HydrophobicContact CD2-CG1 4.19Å; L74-I76 HydrophobicContact CG-CD1 4.26Å; L74-I76 HydrophobicContact CG-CG1 3.91Å; I76-A78 VanDerWaalsContact C-N 3.29Å; I76-A78 HydrophobicContact CG2-CB 3.97Å; I76-F84 HydrophobicContact CD1-CE1 4.04Å; I76-F84 HydrophobicContact CD1-CZ 3.79Å; I76-F84 HydrophobicContact CG2-CE1 4.01Å; I76-F84 HydrophobicContact CG2-CZ 4.35Å; I76-I93 HydrophobicContact CD1-CD1 4.02Å; I76-L103 HydrophobicContact CD1-CD1 4.11Å; I76-L103 HydrophobicContact CG1-CD1 4.29Å; I76-V104 PolarHBondContact N-O 3.44Å; I76-V105 HydrophobicContact CD1-CG2 4.26Å; I76-V106 PolarHBondContact O-N 3.13Å; I76-I115 HydrophobicContact CG2-CD1 3.87Å; I76-L118 HydrophobicContact CD1-CD2 3.98Å
77	L	98.5	Very high	95.7	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	51.9	171.4	-51.8	-178.6	0	0	0	108.9	V26 L27 L28 E29 I33 F40 L41 I75 V106 L238 L241	V26-L77 HydrophobicContact CG1-CD1 4.16Å; V26-L77 HydrophobicContact CG1-CG 4.41Å; L27-L77 CarbonylContact O-C 3.51Å; L27-L77 WeakPolarHBondContact O-CA 3.25Å; L27-L77 PolarHBondContact O-N 2.9Å; L28-L77 HydrophobicContact CD2-CB 4.14Å; L28-L77 HydrophobicContact CD2-CD1 3.96Å; L28-L77 HydrophobicContact CD2-CG 4.46Å; E29-L77 PolarHBondContact N-O 2.79Å; I33-L77 WeakPolarHBondContact CD1-O 3.34Å; I33-L77 HydrophobicContact CG2-CB 4.06Å; I33-L77 HydrophobicContact CG2-CD1 3.83Å; F40-L77 HydrophobicContact CD1-CD1 4.21Å; F40-L77 HydrophobicContact CE1-CD1 4.05Å; F40-L77 HydrophobicContact CE1-CD2 4.23Å; L41-L77 HydrophobicContact CD2-CD1 4.44Å; I75-L77 HydrophobicContact CG2-CD2 3.9Å; I75-L77 HydrophobicContact CG2-CG 4Å; L77-V106 HydrophobicContact CD2-CB 4.34Å; L77-V106 HydrophobicContact CD2-CG2 3.59Å; L77-L238 HydrophobicContact CB-CD1 4.28Å; L77-L238 HydrophobicContact CD2-CD1 4.48Å; L77-L241 HydrophobicContact CD2-CD1 4.1Å
78	A	98.1	Very high	96.1	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.197	C	C	.	.			trans	-138.2	67.4	-175.4	0	0	0	0	0	110.8	E29 A56 I76 S80 V81	E29-A78 HydrophobicContact CB-CB 4.21Å; A56-A78 HydrophobicContact CB-CB 3.52Å; I76-A78 VanDerWaalsContact C-N 3.29Å; I76-A78 HydrophobicContact CG2-CB 3.97Å; A78-S80 PolarHBondContact O-N 2.87Å; A78-V81 HydrophobicContact CB-CB 4.16Å; A78-V81 HydrophobicContact CB-CG1 4.21Å; A78-V81 VanDerWaalsContact O-CG1 3.23Å; A78-V81 WeakPolarHBondContact O-CG1 3.4Å; A78-V81 PolarHBondContact O-N 3.01Å
79	P	97.6	Very high	96.3	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.019	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-35.9	-173.4	20.7	-31.1	0	0	0	113	E29 V106 V111 G112 L238	E29-P79 WeakPolarHBondContact OE2-CD 3.37Å; E29-P79 VanDerWaalsContact OE2-CG 3.31Å; E29-P79 WeakPolarHBondContact OE2-CG 3.37Å; P79-V106 WeakPolarHBondContact CA-O 3.37Å; P79-V111 CarbonylContact O-C 3.41Å; P79-V111 VanDerWaalsContact O-CA 3.26Å; P79-V111 WeakPolarHBondContact O-CA 3.46Å; P79-G112 PolarHBondContact O-N 3.11Å; P79-L238 HydrophobicContact CG-CD2 4.17Å
80	S	97.1	Very high	96.5	Very high	43 Å²	43	29.2 Å²	29.2	30%	0.301	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	10.2	-177.1	65.8	0	0	0	0	116.6	E29 A78 S82 N110	E29-S80 PolarHBondContact OE1-OG 3.25Å; E29-S80 VanDerWaalsContact OE1-OG 3.09Å; E29-S80 PolarHBondContact OE2-N 3.03Å; E29-S80 PolarHBondContact OE2-OG 3.47Å; A78-S80 PolarHBondContact O-N 2.87Å; S80-S82 PolarHBondContact O-N 3.11Å; S80-S82 VanDerWaalsContact O-N 3.16Å; S80-N110 WeakPolarHBondContact CA-O 3.49Å; S80-N110 WeakPolarHBondContact CB-ND2 3.41Å; S80-N110 WeakPolarHBondContact CB-O 3.46Å
81	V	96.7	Very high	96.6	Very high	14 Å²	14	35.1 Å²	35.1	9%	0.085	20%	0.199	C	C	.	.			trans	-64.4	119.9	179.3	68.8	0	0	0	0	110.9	A56 A78 E83 F84 G112 I115	A56-V81 HydrophobicContact CB-CB 4.2Å; A56-V81 HydrophobicContact CB-CG2 3.89Å; A78-V81 HydrophobicContact CB-CB 4.16Å; A78-V81 HydrophobicContact CB-CG1 4.21Å; A78-V81 VanDerWaalsContact O-CG1 3.23Å; A78-V81 WeakPolarHBondContact O-CG1 3.4Å; A78-V81 PolarHBondContact O-N 3.01Å; V81-E83 VanDerWaalsContact CG2-O 3.23Å; V81-E83 WeakPolarHBondContact CG2-O 3.24Å; V81-F84 HydrophobicContact CG1-CD1 4.23Å; V81-F84 HydrophobicContact CG1-CE1 3.6Å; V81-F84 HydrophobicContact CG1-CZ 3.85Å; V81-F84 HydrophobicContact CG2-CD1 4.07Å; V81-F84 HydrophobicContact CG2-CE1 4.27Å; V81-G112 CarbonylContact O-C 3.6Å; V81-G112 WeakPolarHBondContact O-CA 3.42Å; V81-I115 HydrophobicContact CG1-CD1 3.65Å; V81-I115 HydrophobicContact CG1-CG1 3.67Å
82	S	94.4	Very high	96.6	Very high	78 Å²	78	37 Å²	37	55%	0.545	21%	0.208	S	C	.	.	S	Bend	trans	-84.5	-39.9	174.7	53.7	0	0	0	0	111.7	S80 S114	S80-S82 PolarHBondContact O-N 3.11Å; S80-S82 VanDerWaalsContact O-N 3.16Å; S82-S114 WeakPolarHBondContact O-CB 3.17Å; S82-S114 PolarHBondContact O-N 2.86Å; S82-S114 PolarHBondContact O-OG 2.94Å
83	E	95.5	Very high	96.7	Very high	153 Å²	153	35.6 Å²	35.6	72%	0.715	20%	0.198	S	C	*	.	S	Bend	trans	-140.5	133.3	178.7	-172.1	175.3	-169.6	0	0	109.9	V81	V81-E83 VanDerWaalsContact CG2-O 3.23Å; V81-E83 WeakPolarHBondContact CG2-O 3.24Å
84	F	97.1	Very high	96.7	Very high	12 Å²	12	36.4 Å²	36.4	5%	0.053	20%	0.203	C	C	.	.			trans	-77.2	147.4	175.7	-67.8	-68.9	0	0	0	111.6	L27 A56 I76 V81 L88 V90 I93 I115	L27-F84 HydrophobicContact CD1-CD1 4.09Å; L27-F84 HydrophobicContact CD1-CE1 4.14Å; A56-F84 HydrophobicContact CB-CD1 4.48Å; A56-F84 WeakPolarHBondContact O-CA 3.39Å; I76-F84 HydrophobicContact CD1-CE1 4.04Å; I76-F84 HydrophobicContact CD1-CZ 3.79Å; I76-F84 HydrophobicContact CG2-CE1 4.01Å; I76-F84 HydrophobicContact CG2-CZ 4.35Å; V81-F84 HydrophobicContact CG1-CD1 4.23Å; V81-F84 HydrophobicContact CG1-CE1 3.6Å; V81-F84 HydrophobicContact CG1-CZ 3.85Å; V81-F84 HydrophobicContact CG2-CD1 4.07Å; V81-F84 HydrophobicContact CG2-CE1 4.27Å; F84-L88 HydrophobicContact CB-CB 3.96Å; F84-L88 HydrophobicContact CB-CD2 3.92Å; F84-L88 HydrophobicContact CB-CG 3.92Å; F84-L88 WeakPolarHBondContact CB-O 3.39Å; F84-L88 HydrophobicContact CD1-CD2 3.82Å; F84-L88 HydrophobicContact CD2-CG 4.48Å; F84-L88 HydrophobicContact CE1-CD2 4.49Å; F84-L88 HydrophobicContact CG-CD2 3.84Å; F84-L88 HydrophobicContact CG-CG 4.09Å; F84-V90 HydrophobicContact CE2-CG2 4.44Å; F84-I93 HydrophobicContact CD2-CD1 4Å; F84-I93 HydrophobicContact CE2-CD1 3.54Å; F84-I93 HydrophobicContact CZ-CD1 3.89Å; F84-I115 HydrophobicContact CZ-CD1 4.04Å
85	G	95	Very high	96.6	Very high	8 Å²	8	39.6 Å²	39.6	8%	0.082	22%	0.22	C	C	.	.	S	Bend	trans	-77.9	160.7	177.8	0	0	0	0	0	114.1	A56 E58 I61 L88	A56-G85 PolarHBondContact O-N 3.04Å; E58-G85 CarbonylContact O-C 3.6Å; E58-G85 WeakPolarHBondContact O-CA 3.26Å; I61-G85 WeakPolarHBondContact CB-O 3.23Å; G85-L88 WeakPolarHBondContact O-CB 3.43Å; G85-L88 PolarHBondContact O-N 3.21Å
86	G	94	Very high	96.5	Very high	46 Å²	46	39.7 Å²	39.7	47%	0.474	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	73	-132	170.9	0	0	0	0	0	112.9	E58 S59	E58-G86 PolarHBondContact O-N 2.8Å; S59-G86 WeakPolarHBondContact O-CA 3.48Å
87	T	93.1	Very high	96.5	Very high	71 Å²	71	40 Å²	40	44%	0.436	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-13.9	174.3	68.2	0	0	0	0	112.4	I61 S62 S89 E92	I61-T87 PolarHBondContact O-N 2.95Å; S62-T87 PolarHBondContact OG-OG1 3.04Å; T87-S89 PolarHBondContact O-N 2.72Å; T87-E92 VanDerWaalsContact C-OE2 3.29Å; T87-E92 VanDerWaalsContact O-OE1 3.09Å; T87-E92 PolarHBondContact OG1-OE2 2.68Å
88	L	96.1	Very high	96.4	Very high	8 Å²	8	45.2 Å²	45.2	4%	0.042	25%	0.25	C	S	.	.			trans	-65.6	129.2	-170.3	-171.2	67.2	0	0	0	110.6	L27 I61 L63 F84 G85 E92 I93	L27-L88 HydrophobicContact CD1-CD2 3.39Å; I61-L88 HydrophobicContact CB-CB 4.5Å; I61-L88 HydrophobicContact CG2-CB 3.79Å; I61-L88 HydrophobicContact CG2-CD2 3.86Å; I61-L88 HydrophobicContact CG2-CG 4.35Å; L63-L88 HydrophobicContact CD1-CD1 3.5Å; L63-L88 VanDerWaalsContact CD1-CD1 3.5Å; L63-L88 HydrophobicContact CD2-CD1 4.41Å; L63-L88 HydrophobicContact CG-CD1 3.72Å; F84-L88 HydrophobicContact CB-CB 3.96Å; F84-L88 HydrophobicContact CB-CD2 3.92Å; F84-L88 HydrophobicContact CB-CG 3.92Å; F84-L88 WeakPolarHBondContact CB-O 3.39Å; F84-L88 HydrophobicContact CD1-CD2 3.82Å; F84-L88 HydrophobicContact CD2-CG 4.48Å; F84-L88 HydrophobicContact CE1-CD2 4.49Å; F84-L88 HydrophobicContact CG-CD2 3.84Å; F84-L88 HydrophobicContact CG-CG 4.09Å; G85-L88 WeakPolarHBondContact O-CB 3.43Å; G85-L88 PolarHBondContact O-N 3.21Å; L88-E92 HydrophobicContact CD1-CB 4.5Å; L88-I93 HydrophobicContact CD1-CD1 4.12Å; L88-I93 HydrophobicContact CD1-CG1 3.59Å; L88-I93 HydrophobicContact CD2-CD1 4.31Å; L88-I93 HydrophobicContact CG-CD1 4.18Å; L88-I93 HydrophobicContact CG-CG1 4.2Å
89	S	96.1	Very high	96.3	Very high	50 Å²	50	50 Å²	50	35%	0.35	28%	0.276	S	S	.	.			trans	-138.9	165.6	172.1	61.4	0	0	0	0	109.4	T87 R91 E92 I93	T87-S89 PolarHBondContact O-N 2.72Å; S89-R91 PolarHBondContact O-N 2.88Å; S89-E92 PolarHBondContact O-N 2.91Å; S89-E92 PolarHBondContact OG-N 2.88Å; S89-I93 WeakPolarHBondContact O-CG1 3.4Å; S89-I93 PolarHBondContact O-N 2.9Å
90	V	97.3	Very high	96.2	Very high	7 Å²	7	51.7 Å²	51.7	4%	0.042	29%	0.294	C	S	.	.	H	α-helix	trans	-52.9	-43.3	174.7	178.1	0	0	0	0	110.7	F84 E92 I93 T94 S114 E117 L118 E121	F84-V90 HydrophobicContact CE2-CG2 4.44Å; V90-E92 PolarHBondContact O-N 2.8Å; V90-I93 WeakPolarHBondContact O-CB 3.36Å; V90-I93 PolarHBondContact O-N 3.09Å; V90-I93 VanDerWaalsContact O-N 3.13Å; V90-T94 HydrophobicContact CG1-CG2 4.45Å; V90-T94 WeakPolarHBondContact O-CG2 3.42Å; V90-T94 PolarHBondContact O-N 2.98Å; V90-T94 PolarHBondContact O-OG1 2.68Å; V90-S114 WeakPolarHBondContact CG2-O 3.4Å; V90-E117 HydrophobicContact CB-CG 4.4Å; V90-E117 HydrophobicContact CG1-CB 4.34Å; V90-E117 HydrophobicContact CG1-CG 3.98Å; V90-E117 HydrophobicContact CG2-CB 4.15Å; V90-E117 HydrophobicContact CG2-CG 4.29Å; V90-L118 HydrophobicContact CG1-CB 3.99Å; V90-L118 HydrophobicContact CG1-CD1 4.22Å; V90-L118 HydrophobicContact CG2-CB 4.47Å; V90-E121 HydrophobicContact CG1-CG 4.21Å
91	R	96.7	Very high	96.1	Very high	189 Å²	189	49.8 Å²	49.8	71%	0.713	28%	0.281	S	S	*	.	H	α-helix	trans	-61.8	-37.2	175.1	-176.4	176.2	178.2	169.5	0	113.9	S89 I93 T94 N95	S89-R91 PolarHBondContact O-N 2.88Å; R91-I93 VanDerWaalsContact C-N 3.32Å; R91-T94 WeakPolarHBondContact CA-OG1 3.22Å; R91-T94 PolarHBondContact O-OG1 3.46Å; R91-N95 WeakPolarHBondContact O-CB 3.2Å; R91-N95 VanDerWaalsContact O-CG 3.22Å; R91-N95 PolarHBondContact O-N 2.88Å; R91-N95 VanDerWaalsContact O-N 3.12Å; R91-N95 PolarHBondContact O-ND2 2.48Å
92	E	96.6	Very high	96.2	Very high	65 Å²	65	50.3 Å²	50.3	30%	0.304	28%	0.283	S	S	.	.	H	α-helix	trans	-67.6	-36.6	174.9	-73.5	-163.9	169.5	0	0	111.7	T87 L88 S89 V90 F96	T87-E92 VanDerWaalsContact C-OE2 3.29Å; T87-E92 VanDerWaalsContact O-OE1 3.09Å; T87-E92 PolarHBondContact OG1-OE2 2.68Å; L88-E92 HydrophobicContact CD1-CB 4.5Å; S89-E92 PolarHBondContact O-N 2.91Å; S89-E92 PolarHBondContact OG-N 2.88Å; V90-E92 PolarHBondContact O-N 2.8Å; E92-F96 WeakPolarHBondContact O-CB 3.45Å; E92-F96 PolarHBondContact O-N 3.15Å
93	I	97.8	Very high	96.4	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-68.9	-42.9	177	-60.1	167	0	0	0	110.6	L74 I76 F84 L88 S89 V90 R91 F96 I97 L103 L118	L74-I93 HydrophobicContact CD2-CD1 4.16Å; L74-I93 HydrophobicContact CD2-CG1 3.87Å; L74-I93 HydrophobicContact CD2-CG2 4.1Å; I76-I93 HydrophobicContact CD1-CD1 4.02Å; F84-I93 HydrophobicContact CD2-CD1 4Å; F84-I93 HydrophobicContact CE2-CD1 3.54Å; F84-I93 HydrophobicContact CZ-CD1 3.89Å; L88-I93 HydrophobicContact CD1-CD1 4.12Å; L88-I93 HydrophobicContact CD1-CG1 3.59Å; L88-I93 HydrophobicContact CD2-CD1 4.31Å; L88-I93 HydrophobicContact CG-CD1 4.18Å; L88-I93 HydrophobicContact CG-CG1 4.2Å; S89-I93 WeakPolarHBondContact O-CG1 3.4Å; S89-I93 PolarHBondContact O-N 2.9Å; V90-I93 WeakPolarHBondContact O-CB 3.36Å; V90-I93 PolarHBondContact O-N 3.09Å; V90-I93 VanDerWaalsContact O-N 3.13Å; R91-I93 VanDerWaalsContact C-N 3.32Å; I93-F96 WeakPolarHBondContact O-CA 3.5Å; I93-F96 VanDerWaalsContact O-CB 3.3Å; I93-F96 WeakPolarHBondContact O-CB 3.44Å; I93-F96 PolarHBondContact O-N 3.28Å; I93-F96 VanDerWaalsContact O-N 3.11Å; I93-I97 WeakPolarHBondContact O-CG1 3.41Å; I93-I97 PolarHBondContact O-N 3.46Å; I93-L103 HydrophobicContact CG2-CD1 4.18Å; I93-L103 HydrophobicContact CG2-CD2 3.94Å; I93-L118 HydrophobicContact CB-CD1 4.02Å; I93-L118 HydrophobicContact CD1-CD2 4.07Å; I93-L118 HydrophobicContact CG2-CD1 3.59Å; I93-L118 HydrophobicContact CG2-CD2 4Å; I93-L118 HydrophobicContact CG2-CG 4.47Å
94	T	97	Very high	96.5	Very high	18 Å²	18	39.3 Å²	39.3	11%	0.11	22%	0.224	C	C	.	.	H	α-helix	trans	-63.1	-44.3	176.8	55.9	0	0	0	0	111.5	V90 R91 F96 I97 D98 L118 E121	V90-T94 HydrophobicContact CG1-CG2 4.45Å; V90-T94 WeakPolarHBondContact O-CG2 3.42Å; V90-T94 PolarHBondContact O-N 2.98Å; V90-T94 PolarHBondContact O-OG1 2.68Å; R91-T94 WeakPolarHBondContact CA-OG1 3.22Å; R91-T94 PolarHBondContact O-OG1 3.46Å; T94-F96 VanDerWaalsContact C-N 3.26Å; T94-F96 PolarHBondContact O-N 3.37Å; T94-I97 WeakPolarHBondContact O-CB 3.47Å; T94-I97 PolarHBondContact O-N 3.36Å; T94-I97 VanDerWaalsContact O-N 3.11Å; T94-D98 PolarHBondContact O-N 3.31Å; T94-L118 HydrophobicContact CG2-CD1 4.27Å; T94-E121 HydrophobicContact CG2-CB 3.63Å; T94-E121 HydrophobicContact CG2-CG 3.97Å
95	N	96.6	Very high	96.6	Very high	66 Å²	66	38.8 Å²	38.8	35%	0.353	22%	0.221	S	C	.	.	H	α-helix	trans	-59.4	-37.7	172	-69.9	-38.5	0	0	0	112.1	Y69 R91 I97 D98 D99	Y69-N95 PolarHBondContact OH-O 2.9Å; R91-N95 WeakPolarHBondContact O-CB 3.2Å; R91-N95 VanDerWaalsContact O-CG 3.22Å; R91-N95 PolarHBondContact O-N 2.88Å; R91-N95 VanDerWaalsContact O-N 3.12Å; R91-N95 PolarHBondContact O-ND2 2.48Å; N95-I97 VanDerWaalsContact C-N 3.35Å; N95-D98 PolarHBondContact O-N 3.02Å; N95-D99 VanDerWaalsContact O-CB 3.31Å; N95-D99 WeakPolarHBondContact O-CB 3.22Å; N95-D99 PolarHBondContact O-N 2.89Å
96	F	97.5	Very high	96.8	Very high	3 Å²	3	38.4 Å²	38.4	1%	0.013	22%	0.217	C	C	.	.	H	α-helix	trans	-61.3	-41.7	175	172.5	-111.6	0	0	0	112.3	L63 Y69 Y71 L74 E92 I93 T94 D99 G100 G101 N102	L63-F96 HydrophobicContact CD1-CB 4.02Å; L63-F96 HydrophobicContact CD1-CG 4.22Å; Y69-F96 AromaticContact CD1-CD2 3.47Å; Y69-F96 HydrophobicContact CD1-CD2 3.47Å; Y69-F96 VanDerWaalsContact CD1-CD2 3.47Å; Y69-F96 AromaticContact CD1-CE2 3.99Å; Y69-F96 HydrophobicContact CD1-CE2 3.99Å; Y69-F96 HydrophobicContact CE1-CB 3.89Å; Y69-F96 AromaticContact CE1-CD2 3.41Å; Y69-F96 HydrophobicContact CE1-CD2 3.41Å; Y69-F96 VanDerWaalsContact CE1-CD2 3.41Å; Y69-F96 HydrophobicContact CE1-CE2 4.36Å; Y69-F96 HydrophobicContact CE1-CG 4.11Å; Y69-F96 HydrophobicContact CG-CD2 4.04Å; Y69-F96 HydrophobicContact CG-CE2 4.29Å; Y69-F96 AromaticContact CZ-CD2 3.94Å; Y69-F96 WeakPolarHBondContact OH-CA 3.5Å; Y69-F96 PolarHBondContact OH-N 2.92Å; Y71-F96 WeakPolarHBondContact O-CE2 3.37Å; L74-F96 HydrophobicContact CB-CD1 4.35Å; L74-F96 HydrophobicContact CB-CE1 3.78Å; E92-F96 WeakPolarHBondContact O-CB 3.45Å; E92-F96 PolarHBondContact O-N 3.15Å; I93-F96 WeakPolarHBondContact O-CA 3.5Å; I93-F96 VanDerWaalsContact O-CB 3.3Å; I93-F96 WeakPolarHBondContact O-CB 3.44Å; I93-F96 PolarHBondContact O-N 3.28Å; I93-F96 VanDerWaalsContact O-N 3.11Å; T94-F96 VanDerWaalsContact C-N 3.26Å; T94-F96 PolarHBondContact O-N 3.37Å; F96-D99 PolarHBondContact O-N 3.34Å; F96-G100 PolarHBondContact O-N 2.91Å; F96-G101 VanDerWaalsContact CZ-CA 3.43Å; F96-G101 WeakPolarHBondContact O-CA 3.24Å; F96-G101 PolarHBondContact O-N 2.87Å; F96-N102 WeakPolarHBondContact CE1-O 3.29Å
97	I	97.3	Very high	96.9	Very high	6 Å²	6	36.2 Å²	36.2	3%	0.031	19%	0.194	C	C	.	.	H	α-helix	trans	-64	-47.3	173.9	-59.6	167.2	0	0	0	110.4	I93 T94 N95 D99 G100 L103 A226 N228 A230	I93-I97 WeakPolarHBondContact O-CG1 3.41Å; I93-I97 PolarHBondContact O-N 3.46Å; T94-I97 WeakPolarHBondContact O-CB 3.47Å; T94-I97 PolarHBondContact O-N 3.36Å; T94-I97 VanDerWaalsContact O-N 3.11Å; N95-I97 VanDerWaalsContact C-N 3.35Å; I97-D99 PolarHBondContact O-N 3.19Å; I97-G100 PolarHBondContact O-N 2.86Å; I97-L103 HydrophobicContact CD1-CB 4.49Å; I97-L103 HydrophobicContact CD1-CD2 3.64Å; I97-L103 HydrophobicContact CG1-CB 4.34Å; I97-L103 HydrophobicContact CG1-CD2 4.25Å; I97-A226 HydrophobicContact CG2-CB 4.26Å; I97-N228 PolarHBondContact O-ND2 2.81Å; I97-A230 HydrophobicContact CG2-CB 4.16Å; I97-A230 VanDerWaalsContact O-CB 3.24Å; I97-A230 WeakPolarHBondContact O-CB 3.27Å
98	D	96.3	Very high	97.1	Very high	109 Å²	109	33 Å²	33	58%	0.583	18%	0.175	S	C	*	.	H	α-helix	trans	-63.2	-27.6	-180	-77.1	-23	0	0	0	113.3	T94 N95 N228	T94-D98 PolarHBondContact O-N 3.31Å; N95-D98 PolarHBondContact O-N 3.02Å; D98-N228 PolarHBondContact O-ND2 3.01Å
99	D	95.9	Very high	97.1	Very high	101 Å²	101	34.5 Å²	34.5	54%	0.54	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	1.8	175.7	-73.3	-20.5	0	0	0	113.4	K64 Y69 N95 F96 I97	K64-D99 IonicContact NZ-OD2 3.41Å; Y69-D99 HydrophobicContact CD2-CB 4.48Å; Y69-D99 HydrophobicContact CE2-CB 3.48Å; Y69-D99 VanDerWaalsContact CE2-CB 3.48Å; Y69-D99 WeakPolarHBondContact CE2-OD2 3.4Å; Y69-D99 PolarHBondContact OH-OD2 3.16Å; N95-D99 VanDerWaalsContact O-CB 3.31Å; N95-D99 WeakPolarHBondContact O-CB 3.22Å; N95-D99 PolarHBondContact O-N 2.89Å; F96-D99 PolarHBondContact O-N 3.34Å; I97-D99 PolarHBondContact O-N 3.19Å
100	G	94.8	Very high	97.1	Very high	38 Å²	38	35.5 Å²	35.5	39%	0.392	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	110.1	3.7	171.9	0	0	0	0	0	115.7	F96 I97 N228	F96-G100 PolarHBondContact O-N 2.91Å; I97-G100 PolarHBondContact O-N 2.86Å; G100-N228 PolarHBondContact N-ND2 2.81Å; G100-N228 VanDerWaalsContact N-ND2 3.19Å
101	G	96.6	Very high	97.1	Very high	4 Å²	4	35.2 Å²	35.2	4%	0.041	19%	0.185	C	C	.	.			trans	-75	137.8	-178.9	0	0	0	0	0	113.3	F96	F96-G101 VanDerWaalsContact CZ-CA 3.43Å; F96-G101 WeakPolarHBondContact O-CA 3.24Å; F96-G101 PolarHBondContact O-N 2.87Å
102	N	97.9	Very high	97	Very high	24 Å²	24	26.6 Å²	26.6	13%	0.128	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	146	177.1	-60.5	-51.3	0	0	0	111.4	S72 G73 L74 F96 R231 V273 L274	S72-N102 PolarHBondContact O-N 2.86Å; S72-N102 VanDerWaalsContact O-N 3.14Å; G73-N102 CarbonylContact C-O 3.51Å; G73-N102 WeakPolarHBondContact CA-O 3.46Å; L74-N102 PolarHBondContact N-O 2.69Å; F96-N102 WeakPolarHBondContact CE1-O 3.29Å; N102-R231 CarbonylContact C-O 3.59Å; N102-R231 VanDerWaalsContact CA-O 3.29Å; N102-R231 WeakPolarHBondContact CA-O 3.23Å; N102-R231 PolarHBondContact OD1-N 3.28Å; N102-R231 VanDerWaalsContact OD1-N 3.08Å; N102-V273 WeakPolarHBondContact CB-O 3.38Å; N102-V273 PolarHBondContact OD1-O 3.27Å; N102-L274 HydrophobicContact CB-CD2 4.5Å
103	L	98.5	Very high	97	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	137.8	-174.2	179.1	66	0	0	0	111.3	L74 I76 I93 I97 V105 L118 R231 A232 L233 V273	L74-L103 HydrophobicContact CB-CD1 3.96Å; L74-L103 HydrophobicContact CD2-CD1 3.95Å; L74-L103 HydrophobicContact CG-CD1 3.89Å; L74-L103 CarbonylContact O-C 3.5Å; L74-L103 WeakPolarHBondContact O-CA 3.45Å; I76-L103 HydrophobicContact CD1-CD1 4.11Å; I76-L103 HydrophobicContact CG1-CD1 4.29Å; I93-L103 HydrophobicContact CG2-CD1 4.18Å; I93-L103 HydrophobicContact CG2-CD2 3.94Å; I97-L103 HydrophobicContact CD1-CB 4.49Å; I97-L103 HydrophobicContact CD1-CD2 3.64Å; I97-L103 HydrophobicContact CG1-CB 4.34Å; I97-L103 HydrophobicContact CG1-CD2 4.25Å; L103-V105 HydrophobicContact CD1-CG2 3.72Å; L103-V105 HydrophobicContact CD2-CG2 3.55Å; L103-V105 HydrophobicContact CG-CG2 3.54Å; L103-L118 HydrophobicContact CD2-CD1 4.37Å; L103-L118 HydrophobicContact CD2-CD2 4.17Å; L103-L118 HydrophobicContact CD2-CG 4.49Å; L103-R231 PolarHBondContact N-O 2.62Å; L103-A232 HydrophobicContact CB-CB 3.9Å; L103-A232 HydrophobicContact CD2-CB 4.21Å; L103-A232 HydrophobicContact CG-CB 4.41Å; L103-A232 CarbonylContact O-C 3.58Å; L103-A232 VanDerWaalsContact O-CA 3.24Å; L103-A232 WeakPolarHBondContact O-CA 3.49Å; L103-L233 PolarHBondContact O-N 2.89Å; L103-V273 WeakPolarHBondContact O-CG2 3Å
104	V	98.7	Very high	97	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.006	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	121.4	163.8	-179	0	0	0	0	107.5	L74 I75 I76 L233 I235 V273	L74-V104 PolarHBondContact O-N 3.19Å; I75-V104 CarbonylContact C-O 3.56Å; I75-V104 WeakPolarHBondContact CA-O 3.39Å; I75-V104 HydrophobicContact CB-CB 4.44Å; I75-V104 HydrophobicContact CG1-CB 4.13Å; I75-V104 HydrophobicContact CG1-CG2 4.31Å; I75-V104 HydrophobicContact CG2-CB 4.18Å; I75-V104 HydrophobicContact CG2-CG1 4.41Å; I76-V104 PolarHBondContact N-O 3.44Å; V104-L233 CarbonylContact C-O 3.3Å; V104-L233 WeakPolarHBondContact CA-O 3.39Å; V104-L233 HydrophobicContact CG2-CB 4.38Å; V104-I235 HydrophobicContact CG1-CD1 4.29Å; V104-V273 HydrophobicContact CG2-CG1 3.76Å; V104-V273 HydrophobicContact CG2-CG2 4.21Å
105	V	98.5	Very high	97.1	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	131	177.6	-173	0	0	0	0	109	I76 L103 I115 L118 L233 F234 I235	I76-V105 HydrophobicContact CD1-CG2 4.26Å; L103-V105 HydrophobicContact CD1-CG2 3.72Å; L103-V105 HydrophobicContact CD2-CG2 3.55Å; L103-V105 HydrophobicContact CG-CG2 3.54Å; V105-I115 HydrophobicContact CG1-CD1 3.88Å; V105-I115 HydrophobicContact CG1-CG2 3.89Å; V105-L118 HydrophobicContact CG2-CD2 3.81Å; V105-L233 PolarHBondContact N-O 3.03Å; V105-F234 HydrophobicContact CB-CD1 3.87Å; V105-F234 HydrophobicContact CB-CE1 4.16Å; V105-F234 HydrophobicContact CG1-CD1 4.46Å; V105-F234 HydrophobicContact CG2-CD1 4.19Å; V105-F234 HydrophobicContact CG2-CE1 3.97Å; V105-F234 WeakPolarHBondContact O-CA 3.45Å; V105-I235 PolarHBondContact O-N 3.13Å
106	V	98.4	Very high	97.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	125.4	174.2	179.8	0	0	0	0	108.7	I76 L77 P79 I235 L238 L241	I76-V106 PolarHBondContact O-N 3.13Å; L77-V106 HydrophobicContact CD2-CB 4.34Å; L77-V106 HydrophobicContact CD2-CG2 3.59Å; P79-V106 WeakPolarHBondContact CA-O 3.37Å; V106-I235 CarbonylContact C-O 3.54Å; V106-I235 WeakPolarHBondContact CA-O 3.4Å; V106-I235 HydrophobicContact CG2-CB 4.41Å; V106-I235 HydrophobicContact CG2-CD1 4.5Å; V106-L238 VanDerWaalsContact CG1-CA 3.42Å; V106-L238 HydrophobicContact CG1-CB 3.76Å; V106-L238 HydrophobicContact CG1-CD1 3.83Å; V106-L238 HydrophobicContact CG1-CG 4.42Å; V106-L241 HydrophobicContact CG2-CD1 3.62Å
107	A	97.8	Very high	97.1	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.188	C	C	.	.			trans	-105.2	178.6	170	0	0	0	0	0	110.4	V111 I115 F126 I177 I235 G236 S237 L238	A107-V111 HydrophobicContact CB-CB 4.33Å; A107-V111 HydrophobicContact CB-CG2 3.93Å; A107-I115 HydrophobicContact CB-CG2 4.1Å; A107-F126 HydrophobicContact CB-CD1 3.49Å; A107-F126 VanDerWaalsContact CB-CD1 3.49Å; A107-F126 HydrophobicContact CB-CD2 4.48Å; A107-F126 HydrophobicContact CB-CE1 3.28Å; A107-F126 HydrophobicContact CB-CE2 4.31Å; A107-F126 HydrophobicContact CB-CG 4.11Å; A107-F126 HydrophobicContact CB-CZ 3.72Å; A107-I177 HydrophobicContact CB-CG2 4.14Å; A107-I235 PolarHBondContact N-O 3.01Å; A107-G236 CarbonylContact O-C 3.53Å; A107-G236 VanDerWaalsContact O-C 3.3Å; A107-S237 PolarHBondContact O-N 2.95Å; A107-L238 PolarHBondContact O-N 2.96Å
108	G	96.2	Very high	97.2	Very high	3 Å²	3	34.4 Å²	34.4	3%	0.031	19%	0.187	C	C	.	.			trans	-167.3	-176.3	178.5	0	0	0	0	0	110.9	N110 V111	G108-N110 PolarHBondContact O-N 3Å; G108-N110 VanDerWaalsContact O-N 3.16Å; G108-V111 VanDerWaalsContact O-CB 3.27Å; G108-V111 WeakPolarHBondContact O-CB 3.21Å; G108-V111 PolarHBondContact O-N 3.12Å
109	P	96.1	Very high	97.2	Very high	40 Å²	40	29.2 Å²	29.2	26%	0.26	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-30	-179.7	-25.4	35.7	0	0	0	113.2	V111 E129 N130 L132	P109-V111 VanDerWaalsContact C-N 3.32Å; P109-V111 PolarHBondContact O-N 3.24Å; P109-E129 CarbonylContact O-C 3.32Å; P109-E129 WeakPolarHBondContact O-CA 3.31Å; P109-N130 PolarHBondContact O-N 3.41Å; P109-L132 HydrophobicContact CG-CD2 3.53Å; P109-L132 HydrophobicContact CG-CG 4.06Å
110	N	95.9	Very high	97.3	Very high	72 Å²	72	27.8 Å²	27.8	39%	0.385	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	35.9	176.1	61	-23.7	0	0	0	112.3	S80 G108 G112	S80-N110 WeakPolarHBondContact CA-O 3.49Å; S80-N110 WeakPolarHBondContact CB-ND2 3.41Å; S80-N110 WeakPolarHBondContact CB-O 3.46Å; G108-N110 PolarHBondContact O-N 3Å; G108-N110 VanDerWaalsContact O-N 3.16Å; N110-G112 PolarHBondContact O-N 3Å
111	V	96.9	Very high	97.3	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.166	C	C	.	.			trans	-61.8	125.1	-174.3	62.1	0	0	0	0	112.1	P79 A107 G108 P109 I115 R116 F126 I177	P79-V111 CarbonylContact O-C 3.41Å; P79-V111 VanDerWaalsContact O-CA 3.26Å; P79-V111 WeakPolarHBondContact O-CA 3.46Å; A107-V111 HydrophobicContact CB-CB 4.33Å; A107-V111 HydrophobicContact CB-CG2 3.93Å; G108-V111 VanDerWaalsContact O-CB 3.27Å; G108-V111 WeakPolarHBondContact O-CB 3.21Å; G108-V111 PolarHBondContact O-N 3.12Å; P109-V111 VanDerWaalsContact C-N 3.32Å; P109-V111 PolarHBondContact O-N 3.24Å; V111-I115 HydrophobicContact CG2-CB 3.74Å; V111-I115 HydrophobicContact CG2-CG2 3.55Å; V111-R116 HydrophobicContact CG1-CG 4.27Å; V111-R116 HydrophobicContact CG2-CG 4.06Å; V111-F126 HydrophobicContact CG1-CB 4.26Å; V111-F126 HydrophobicContact CG2-CB 4.47Å; V111-F126 HydrophobicContact CG2-CD2 4.21Å; V111-F126 HydrophobicContact CG2-CG 4.31Å; V111-I177 HydrophobicContact CB-CD1 4.49Å; V111-I177 HydrophobicContact CG1-CD1 3.64Å
112	G	96.6	Very high	97.3	Very high	8 Å²	8	32.1 Å²	32.1	8%	0.082	17%	0.167	C	C	.	.			trans	-82.3	163.2	-177.8	0	0	0	0	0	114	P79 V81 N110 S114 I115 R116	P79-G112 PolarHBondContact O-N 3.11Å; V81-G112 CarbonylContact O-C 3.6Å; V81-G112 WeakPolarHBondContact O-CA 3.42Å; N110-G112 PolarHBondContact O-N 3Å; G112-S114 PolarHBondContact O-N 3.34Å; G112-I115 PolarHBondContact O-N 3.28Å; G112-I115 VanDerWaalsContact O-N 3.13Å; G112-R116 PolarHBondContact O-N 2.79Å; G112-R116 VanDerWaalsContact O-N 3.08Å
113	E	96.6	Very high	97.2	Very high	144 Å²	144	31.8 Å²	31.8	67%	0.673	17%	0.169	S	C	*	.	H	α-helix	trans	-57.2	-45.7	-175.9	-66.5	-176	165.2	0	0	112.9	I115 R116 E117	E113-I115 VanDerWaalsContact C-N 3.28Å; E113-I115 PolarHBondContact O-N 3.32Å; E113-R116 WeakPolarHBondContact O-CB 3.42Å; E113-R116 PolarHBondContact O-N 3.11Å; E113-R116 VanDerWaalsContact O-N 3.15Å; E113-E117 PolarHBondContact O-N 2.9Å
114	S	97.2	Very high	97.2	Very high	11 Å²	11	31.8 Å²	31.8	8%	0.077	17%	0.169	C	C	.	.	H	α-helix	trans	-60.8	-35.2	178.2	-79.5	0	0	0	0	113	S82 V90 G112 L118	S82-S114 WeakPolarHBondContact O-CB 3.17Å; S82-S114 PolarHBondContact O-N 2.86Å; S82-S114 PolarHBondContact O-OG 2.94Å; V90-S114 WeakPolarHBondContact CG2-O 3.4Å; G112-S114 PolarHBondContact O-N 3.34Å; S114-L118 VanDerWaalsContact O-CB 3.24Å; S114-L118 WeakPolarHBondContact O-CB 3.44Å; S114-L118 PolarHBondContact O-N 3.34Å
115	I	98.1	Very high	97.1	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-71.8	-40.2	177.1	-59.1	-62.6	0	0	0	110.6	I76 V81 F84 V105 A107 V111 G112 E113 L118 G119 F126	I76-I115 HydrophobicContact CG2-CD1 3.87Å; V81-I115 HydrophobicContact CG1-CD1 3.65Å; V81-I115 HydrophobicContact CG1-CG1 3.67Å; F84-I115 HydrophobicContact CZ-CD1 4.04Å; V105-I115 HydrophobicContact CG1-CD1 3.88Å; V105-I115 HydrophobicContact CG1-CG2 3.89Å; A107-I115 HydrophobicContact CB-CG2 4.1Å; V111-I115 HydrophobicContact CG2-CB 3.74Å; V111-I115 HydrophobicContact CG2-CG2 3.55Å; G112-I115 PolarHBondContact O-N 3.28Å; G112-I115 VanDerWaalsContact O-N 3.13Å; E113-I115 VanDerWaalsContact C-N 3.28Å; E113-I115 PolarHBondContact O-N 3.32Å; I115-L118 PolarHBondContact O-N 3.19Å; I115-G119 PolarHBondContact O-N 3.45Å; I115-F126 HydrophobicContact CG2-CD2 4.28Å; I115-F126 HydrophobicContact CG2-CE2 3.73Å; I115-F126 HydrophobicContact CG2-CZ 4.16Å; I115-F126 WeakPolarHBondContact O-CE2 3.49Å
116	R	97.7	Very high	97.1	Very high	62 Å²	62	38.1 Å²	38.1	23%	0.234	20%	0.198	C	C	.	.	H	α-helix	trans	-62.3	-47.5	174.6	-68.2	179.8	-178.3	-74.4	-1	112	V111 G112 E113 G119 S120 F126 D127 E128 E129	V111-R116 HydrophobicContact CG1-CG 4.27Å; V111-R116 HydrophobicContact CG2-CG 4.06Å; G112-R116 PolarHBondContact O-N 2.79Å; G112-R116 VanDerWaalsContact O-N 3.08Å; E113-R116 WeakPolarHBondContact O-CB 3.42Å; E113-R116 PolarHBondContact O-N 3.11Å; E113-R116 VanDerWaalsContact O-N 3.15Å; R116-G119 PolarHBondContact O-N 3.03Å; R116-S120 WeakPolarHBondContact O-CB 3.48Å; R116-S120 PolarHBondContact O-N 2.92Å; R116-F126 PolarHBondContact NH1-O 3.48Å; R116-D127 VanDerWaalsContact CZ-O 3.25Å; R116-D127 PolarHBondContact NH1-O 3.39Å; R116-D127 PolarHBondContact NH2-O 3.48Å; R116-E128 VanDerWaalsContact NH2-C 3.25Å; R116-E129 VanDerWaalsContact NH2-CG 3.34Å
117	E	97.8	Very high	96.9	Very high	106 Å²	106	38.5 Å²	38.5	50%	0.495	20%	0.2	S	C	.	.	H	α-helix	trans	-61.6	-45.5	178.2	-169.8	-172.2	166.1	0	0	110.9	V90 E113 G119 S120 E121	V90-E117 HydrophobicContact CB-CG 4.4Å; V90-E117 HydrophobicContact CG1-CB 4.34Å; V90-E117 HydrophobicContact CG1-CG 3.98Å; V90-E117 HydrophobicContact CG2-CB 4.15Å; V90-E117 HydrophobicContact CG2-CG 4.29Å; E113-E117 PolarHBondContact O-N 2.9Å; E117-G119 VanDerWaalsContact C-N 3.34Å; E117-G119 PolarHBondContact O-N 2.87Å; E117-S120 WeakPolarHBondContact O-CB 3.41Å; E117-S120 PolarHBondContact O-N 3.27Å; E117-S120 VanDerWaalsContact O-N 3.12Å; E117-E121 WeakPolarHBondContact O-CG 3.48Å; E117-E121 PolarHBondContact O-N 2.76Å
118	L	98	Very high	96.8	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-61.6	-40.3	176.7	178.8	59.3	0	0	0	112.9	I76 V90 I93 T94 L103 V105 S114 I115 C122	I76-L118 HydrophobicContact CD1-CD2 3.98Å; V90-L118 HydrophobicContact CG1-CB 3.99Å; V90-L118 HydrophobicContact CG1-CD1 4.22Å; V90-L118 HydrophobicContact CG2-CB 4.47Å; I93-L118 HydrophobicContact CB-CD1 4.02Å; I93-L118 HydrophobicContact CD1-CD2 4.07Å; I93-L118 HydrophobicContact CG2-CD1 3.59Å; I93-L118 HydrophobicContact CG2-CD2 4Å; I93-L118 HydrophobicContact CG2-CG 4.47Å; T94-L118 HydrophobicContact CG2-CD1 4.27Å; L103-L118 HydrophobicContact CD2-CD1 4.37Å; L103-L118 HydrophobicContact CD2-CD2 4.17Å; L103-L118 HydrophobicContact CD2-CG 4.49Å; V105-L118 HydrophobicContact CG2-CD2 3.81Å; S114-L118 VanDerWaalsContact O-CB 3.24Å; S114-L118 WeakPolarHBondContact O-CB 3.44Å; S114-L118 PolarHBondContact O-N 3.34Å; I115-L118 PolarHBondContact O-N 3.19Å; L118-C122 PolarHBondContact O-N 2.89Å; L118-C122 PolarHBondContact O-SG 2.95Å
119	G	97.5	Very high	96.6	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-59.4	-49.4	171.2	0	0	0	0	0	111.3	I115 R116 E117 E121 C122 G123 V124	I115-G119 PolarHBondContact O-N 3.45Å; R116-G119 PolarHBondContact O-N 3.03Å; E117-G119 VanDerWaalsContact C-N 3.34Å; E117-G119 PolarHBondContact O-N 2.87Å; G119-E121 VanDerWaalsContact C-N 3.35Å; G119-E121 PolarHBondContact O-N 3.44Å; G119-C122 CarbonylContact O-C 3.59Å; G119-C122 WeakPolarHBondContact O-CA 3.42Å; G119-C122 WeakPolarHBondContact O-CB 3.24Å; G119-C122 PolarHBondContact O-N 2.85Å; G119-G123 PolarHBondContact O-N 2.77Å; G119-G123 VanDerWaalsContact O-N 3.09Å; G119-V124 CarbonylContact C-O 3.59Å; G119-V124 VanDerWaalsContact CA-O 3.23Å; G119-V124 WeakPolarHBondContact CA-O 3.3Å; G119-V124 PolarHBondContact O-N 2.93Å
120	S	97	Very high	96.6	Very high	70 Å²	70	51.1 Å²	51.1	49%	0.49	26%	0.258	S	S	.	.	H	α-helix	trans	-59.8	-42.3	-177	-169.9	0	0	0	0	112.4	R116 E117 C122 G123 V124	R116-S120 WeakPolarHBondContact O-CB 3.48Å; R116-S120 PolarHBondContact O-N 2.92Å; E117-S120 WeakPolarHBondContact O-CB 3.41Å; E117-S120 PolarHBondContact O-N 3.27Å; E117-S120 VanDerWaalsContact O-N 3.12Å; S120-C122 PolarHBondContact O-N 3.47Å; S120-C122 VanDerWaalsContact O-N 3.15Å; S120-G123 PolarHBondContact O-N 3.41Å; S120-V124 PolarHBondContact N-O 2.97Å; S120-V124 VanDerWaalsContact N-O 3.14Å
121	E	96	Very high	96.6	Very high	125 Å²	125	48 Å²	48	58%	0.584	24%	0.242	S	C	*	.	H	α-helix	trans	-60	-24.2	173.6	-71.7	-66.8	138.8	0	0	113	V90 T94 E117 G119	V90-E121 HydrophobicContact CG1-CG 4.21Å; T94-E121 HydrophobicContact CG2-CB 3.63Å; T94-E121 HydrophobicContact CG2-CG 3.97Å; E117-E121 WeakPolarHBondContact O-CG 3.48Å; E117-E121 PolarHBondContact O-N 2.76Å; G119-E121 VanDerWaalsContact C-N 3.35Å; G119-E121 PolarHBondContact O-N 3.44Å
122	C	96.2	Very high	96.6	Very high	9 Å²	9	49 Å²	49	6%	0.061	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98	-0	176.4	-64.2	0	0	0	0	113.7	L118 G119 S120 L224 F234	L118-C122 PolarHBondContact O-N 2.89Å; L118-C122 PolarHBondContact O-SG 2.95Å; G119-C122 CarbonylContact O-C 3.59Å; G119-C122 WeakPolarHBondContact O-CA 3.42Å; G119-C122 WeakPolarHBondContact O-CB 3.24Å; G119-C122 PolarHBondContact O-N 2.85Å; S120-C122 PolarHBondContact O-N 3.47Å; S120-C122 VanDerWaalsContact O-N 3.15Å; C122-L224 HydrophobicContact CB-CD2 4.13Å; C122-F234 HydrophobicContact CB-CE2 3.85Å; C122-F234 HydrophobicContact CB-CZ 3.55Å
123	G	96.7	Very high	96.7	Very high	16 Å²	16	48.6 Å²	48.6	17%	0.165	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.3	21.7	-175.4	0	0	0	0	0	114.6	G119 S120 D182 L188	G119-G123 PolarHBondContact O-N 2.77Å; G119-G123 VanDerWaalsContact O-N 3.09Å; S120-G123 PolarHBondContact O-N 3.41Å; G123-D182 PolarHBondContact O-N 3.12Å; G123-L188 WeakPolarHBondContact O-CD1 3.45Å
124	V	97.5	Very high	96.7	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	122.5	178.8	175.9	0	0	0	0	109.3	G119 S120 F126 I179 L188 T222 F234	G119-V124 CarbonylContact C-O 3.59Å; G119-V124 VanDerWaalsContact CA-O 3.23Å; G119-V124 WeakPolarHBondContact CA-O 3.3Å; G119-V124 PolarHBondContact O-N 2.93Å; S120-V124 PolarHBondContact N-O 2.97Å; S120-V124 VanDerWaalsContact N-O 3.14Å; V124-F126 HydrophobicContact CG1-CE1 4.44Å; V124-F126 HydrophobicContact CG1-CZ 4.25Å; V124-I179 HydrophobicContact CG1-CG2 3.5Å; V124-L188 HydrophobicContact CG2-CD2 3.78Å; V124-T222 HydrophobicContact CG2-CG2 3.97Å; V124-F234 HydrophobicContact CB-CD2 4.44Å; V124-F234 HydrophobicContact CB-CG 4.41Å; V124-F234 HydrophobicContact CG1-CB 4.13Å; V124-F234 HydrophobicContact CG1-CD1 4.37Å; V124-F234 HydrophobicContact CG1-CG 4.09Å; V124-F234 HydrophobicContact CG2-CD2 3.79Å; V124-F234 HydrophobicContact CG2-CE2 4.05Å; V124-F234 HydrophobicContact CG2-CG 4.2Å
125	E	97.1	Very high	96.6	Very high	120 Å²	120	41.5 Å²	41.5	56%	0.561	21%	0.208	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-111.5	124.6	178.4	-69.9	178.5	171.6	0	0	109.5	I179 S180	E125-I179 CarbonylContact O-C 3.56Å; E125-I179 WeakPolarHBondContact O-CA 3.35Å; E125-S180 WeakPolarHBondContact CB-OG 3.34Å; E125-S180 PolarHBondContact N-O 2.9Å; E125-S180 PolarHBondContact O-N 2.91Å; E125-S180 PolarHBondContact O-OG 2.79Å
126	F	97.4	Very high	96.5	Very high	14 Å²	14	45.8 Å²	45.8	6%	0.061	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	142.9	170.4	-58.9	-75.4	0	0	0	109.4	A107 V111 I115 R116 V124 I177 I179 F234	A107-F126 HydrophobicContact CB-CD1 3.49Å; A107-F126 VanDerWaalsContact CB-CD1 3.49Å; A107-F126 HydrophobicContact CB-CD2 4.48Å; A107-F126 HydrophobicContact CB-CE1 3.28Å; A107-F126 HydrophobicContact CB-CE2 4.31Å; A107-F126 HydrophobicContact CB-CG 4.11Å; A107-F126 HydrophobicContact CB-CZ 3.72Å; V111-F126 HydrophobicContact CG1-CB 4.26Å; V111-F126 HydrophobicContact CG2-CB 4.47Å; V111-F126 HydrophobicContact CG2-CD2 4.21Å; V111-F126 HydrophobicContact CG2-CG 4.31Å; I115-F126 HydrophobicContact CG2-CD2 4.28Å; I115-F126 HydrophobicContact CG2-CE2 3.73Å; I115-F126 HydrophobicContact CG2-CZ 4.16Å; I115-F126 WeakPolarHBondContact O-CE2 3.49Å; R116-F126 PolarHBondContact NH1-O 3.48Å; V124-F126 HydrophobicContact CG1-CE1 4.44Å; V124-F126 HydrophobicContact CG1-CZ 4.25Å; F126-I177 HydrophobicContact CB-CD1 4.36Å; F126-I177 HydrophobicContact CD1-CG2 4.08Å; F126-I179 HydrophobicContact CD1-CD1 4.34Å; F126-I179 HydrophobicContact CD1-CG1 3.82Å; F126-I179 HydrophobicContact CE1-CD1 3.9Å; F126-I179 HydrophobicContact CE1-CG1 3.91Å; F126-F234 HydrophobicContact CZ-CB 4.39Å; F126-F234 AromaticContact CZ-CD1 4Å; F126-F234 HydrophobicContact CZ-CD1 4Å
127	D	95.8	Very high	96.3	Very high	8 Å²	8	50.3 Å²	50.3	4%	0.043	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-61.9	172.8	175.3	-167.2	17.8	0	0	0	112.4	R116 T131 I177 G178 S200 N212	R116-D127 VanDerWaalsContact CZ-O 3.25Å; R116-D127 PolarHBondContact NH1-O 3.39Å; R116-D127 PolarHBondContact NH2-O 3.48Å; D127-T131 WeakPolarHBondContact CB-OG1 3.25Å; D127-T131 VanDerWaalsContact OD2-CB 3.27Å; D127-T131 WeakPolarHBondContact OD2-CB 3.48Å; D127-T131 PolarHBondContact OD2-OG1 2.76Å; D127-I177 HydrophobicContact CB-CD1 4.28Å; D127-I177 HydrophobicContact CB-CG1 3.84Å; D127-I177 WeakPolarHBondContact O-CD1 3.17Å; D127-G178 PolarHBondContact N-O 3.15Å; D127-S200 WeakPolarHBondContact OD2-CB 3.48Å; D127-S200 PolarHBondContact OD2-OG 3.33Å; D127-N212 WeakPolarHBondContact OD1-CB 3.4Å; D127-N212 PolarHBondContact OD1-ND2 3.17Å
128	E	93.9	Very high	96.1	Very high	116 Å²	116	47.8 Å²	47.8	54%	0.542	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-60.1	160.8	-176.7	-67.4	-165.1	170.5	0	0	113.8	R116 T131 I177	R116-E128 VanDerWaalsContact NH2-C 3.25Å; E128-T131 HydrophobicContact CB-CG2 3.91Å; E128-T131 WeakPolarHBondContact O-CG2 3.38Å; E128-T131 PolarHBondContact O-N 3.18Å; E128-T131 PolarHBondContact O-OG1 2.97Å; E128-I177 WeakPolarHBondContact O-CD1 3.25Å
129	E	93.4	Very high	95.9	Very high	101 Å²	101	51 Å²	51	47%	0.472	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	146.7	176.9	-65.5	-178.9	-173.4	0	0	111.4	P109 R116 T131	P109-E129 CarbonylContact O-C 3.32Å; P109-E129 WeakPolarHBondContact O-CA 3.31Å; R116-E129 VanDerWaalsContact NH2-CG 3.34Å; E129-T131 PolarHBondContact O-N 3.42Å
130	N	94.7	Very high	95.7	Very high	92 Å²	92	51 Å²	51	49%	0.492	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.9	19.3	-177.7	-47.7	-72.7	0	0	0	113.6	P109 N202	P109-N130 PolarHBondContact O-N 3.41Å; N130-N202 WeakPolarHBondContact CB-ND2 3.37Å; N130-N202 WeakPolarHBondContact O-CA 3.39Å; N130-N202 WeakPolarHBondContact O-CB 3.46Å; N130-N202 VanDerWaalsContact O-CG 3.23Å; N130-N202 PolarHBondContact O-ND2 3.1Å
131	T	96.3	Very high	95.4	Very high	7 Å²	7	52.2 Å²	52.2	4%	0.043	25%	0.25	C	S	.	.			trans	-90.8	150.9	167.5	73	0	0	0	0	111.3	D127 E128 E129 Y201 N202	D127-T131 WeakPolarHBondContact CB-OG1 3.25Å; D127-T131 VanDerWaalsContact OD2-CB 3.27Å; D127-T131 WeakPolarHBondContact OD2-CB 3.48Å; D127-T131 PolarHBondContact OD2-OG1 2.76Å; E128-T131 HydrophobicContact CB-CG2 3.91Å; E128-T131 WeakPolarHBondContact O-CG2 3.38Å; E128-T131 PolarHBondContact O-N 3.18Å; E128-T131 PolarHBondContact O-OG1 2.97Å; E129-T131 PolarHBondContact O-N 3.42Å; T131-Y201 WeakPolarHBondContact CA-O 3.49Å; T131-N202 HydrophobicContact CG2-CB 4.33Å
132	L	97.4	Very high	95.2	Very high	19 Å²	19	51.7 Å²	51.7	10%	0.099	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	150.2	177.2	-78.4	158.5	0	0	0	108.3	P109 I134 R175 G176 S200 Y201 P203	P109-L132 HydrophobicContact CG-CD2 3.53Å; P109-L132 HydrophobicContact CG-CG 4.06Å; L132-I134 PolarHBondContact O-N 2.84Å; L132-R175 HydrophobicContact CD2-CG 4.15Å; L132-G176 WeakPolarHBondContact CA-O 3.3Å; L132-S200 WeakPolarHBondContact O-CA 3.28Å; L132-Y201 PolarHBondContact N-O 3.18Å; L132-Y201 PolarHBondContact O-N 2.69Å; L132-Y201 VanDerWaalsContact O-O 3.06Å; L132-P203 HydrophobicContact CD1-CG 3.89Å
133	V	97.8	Very high	95	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	120.7	168.2	-173.5	0	0	0	0	108.8	I150 Y174 G176 Y199 T218 L220	V133-I150 HydrophobicContact CB-CD1 4.28Å; V133-I150 HydrophobicContact CG1-CD1 3.68Å; V133-Y174 HydrophobicContact CB-CD1 4.47Å; V133-Y174 HydrophobicContact CB-CE1 4.24Å; V133-Y174 HydrophobicContact CG2-CE1 3.92Å; V133-G176 PolarHBondContact N-O 3.32Å; V133-Y199 WeakPolarHBondContact CA-O 3.4Å; V133-T218 HydrophobicContact CG1-CG2 4.04Å; V133-T218 HydrophobicContact CG2-CG2 3.84Å; V133-L220 HydrophobicContact CB-CD2 4.38Å; V133-L220 HydrophobicContact CG1-CD2 4.2Å; V133-L220 HydrophobicContact CG2-CD2 3.8Å
134	I	97	Very high	94.8	Very high	5 Å²	5	56 Å²	56	3%	0.026	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	134.8	-177.2	-60.4	166.9	0	0	0	108.7	L132 H147 S198 Y199 P203	L132-I134 PolarHBondContact O-N 2.84Å; I134-H147 WeakPolarHBondContact CA-O 3.47Å; I134-H147 HydrophobicContact CG2-CB 4.25Å; I134-S198 CarbonylContact O-C 3.52Å; I134-S198 VanDerWaalsContact O-CA 3.25Å; I134-S198 WeakPolarHBondContact O-CA 3.45Å; I134-Y199 HydrophobicContact CB-CE1 4.18Å; I134-Y199 HydrophobicContact CB-CE2 4.23Å; I134-Y199 HydrophobicContact CD1-CE2 4.18Å; I134-Y199 HydrophobicContact CG2-CE1 4.02Å; I134-Y199 PolarHBondContact N-O 2.93Å; I134-Y199 PolarHBondContact O-N 3.21Å; I134-P203 HydrophobicContact CD1-CB 4.07Å
135	D	96.3	Very high	94.5	Very high	1 Å²	1	58.5 Å²	58.5	1%	0.005	29%	0.288	C	S	.	.			trans	-141.3	109	171.7	-169.7	-18.7	0	0	0	110.5	F137 N138 H147 I150 T197	D135-F137 PolarHBondContact O-N 3.13Å; D135-F137 WeakPolarHBondContact OD1-CB 3.36Å; D135-F137 PolarHBondContact OD1-N 2.79Å; D135-N138 PolarHBondContact OD1-N 3.2Å; D135-N138 WeakPolarHBondContact OD2-CB 3.31Å; D135-N138 PolarHBondContact OD2-ND2 3.21Å; D135-H147 PolarHBondContact N-O 2.77Å; D135-I150 HydrophobicContact CB-CB 4.28Å; D135-I150 HydrophobicContact CB-CG2 3.65Å; D135-T197 VanDerWaalsContact CG-OG1 3.27Å; D135-T197 WeakPolarHBondContact OD1-CB 3.23Å; D135-T197 PolarHBondContact OD1-OG1 2.99Å; D135-T197 PolarHBondContact OD2-OG1 2.92Å
136	H	94.5	Very high	94.3	Very high	91 Å²	91	56 Å²	56	42%	0.421	28%	0.278	S	S	.	.	S	Bend	trans	-76.3	-4.1	-179.3	-53.3	-59	0	0	0	114.4	F139 H147 Y199	H136-F139 WeakPolarHBondContact O-CE1 3.47Å; H136-H147 WeakPolarHBondContact CA-ND1 3.44Å; H136-H147 AromaticContact CG-ND1 3.58Å; H136-H147 AromaticContact ND1-CE1 3.96Å; H136-H147 AromaticContact ND1-CG 3.56Å; H136-H147 AromaticContact ND1-ND1 2.92Å; H136-H147 PolarHBondContact ND1-ND1 2.85Å; H136-Y199 AromaticContact NE2-CE1 3.8Å; H136-Y199 AromaticContact NE2-CZ 3.78Å; H136-Y199 PolarHBondContact NE2-OH 3.27Å
137	F	94	Very high	94.2	Very high	156 Å²	156	57.6 Å²	57.6	68%	0.684	29%	0.285	S	S	*	.	S	Bend	trans	-108.3	-34.7	-179.8	-64.2	-94.7	0	0	0	112.5	D135 T197	D135-F137 PolarHBondContact O-N 3.13Å; D135-F137 WeakPolarHBondContact OD1-CB 3.36Å; D135-F137 PolarHBondContact OD1-N 2.79Å; F137-T197 HydrophobicContact CB-CG2 4.32Å; F137-T197 HydrophobicContact CD2-CG2 3.59Å; F137-T197 HydrophobicContact CE2-CG2 4.01Å; F137-T197 HydrophobicContact CG-CG2 3.97Å
138	N	93.4	Very high	94.2	Very high	54 Å²	54	57.2 Å²	57.2	29%	0.289	28%	0.283	S	S	.	.	S	Bend	trans	-122.1	72.8	-176.5	-47.7	-73.8	0	0	0	110.8	D135 I150 T151 T197	D135-N138 PolarHBondContact OD1-N 3.2Å; D135-N138 WeakPolarHBondContact OD2-CB 3.31Å; D135-N138 PolarHBondContact OD2-ND2 3.21Å; N138-I150 WeakPolarHBondContact O-CA 3.33Å; N138-T151 WeakPolarHBondContact CB-O 3.3Å; N138-T151 PolarHBondContact O-N 2.92Å; N138-T151 PolarHBondContact O-OG1 3.47Å; N138-T197 PolarHBondContact ND2-OG1 3.28Å; N138-T197 VanDerWaalsContact ND2-OG1 3.13Å
139	F	93.9	Very high	94.3	Very high	66 Å²	66	52.5 Å²	52.5	29%	0.289	26%	0.262	S	S	.	.	B	Isolated β-bridge	trans	-122.6	157.2	176.7	66.2	-83.8	0	0	0	111.8	H136 D143 H147 L149	H136-F139 WeakPolarHBondContact O-CE1 3.47Å; F139-D143 HydrophobicContact CD2-CB 4.21Å; F139-H147 HydrophobicContact CB-CB 4.4Å; F139-H147 HydrophobicContact CD1-CB 4.45Å; F139-H147 AromaticContact CE1-CE1 3.93Å; F139-H147 AromaticContact CE2-CD2 4Å; F139-H147 AromaticContact CE2-NE2 3.99Å; F139-H147 HydrophobicContact CG-CB 4.36Å; F139-H147 AromaticContact CZ-NE2 3.75Å; F139-L149 WeakPolarHBondContact CA-O 3.27Å
140	D	93.8	Very high	94.5	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.24	C	C	.	.			trans	-82.6	143.9	177.2	-169.9	-86.5	0	0	0	110.7	R142 D143 L149 T151 L173 V250 E251	D140-R142 PolarHBondContact O-N 3.39Å; D140-R142 VanDerWaalsContact O-N 3.09Å; D140-R142 VanDerWaalsContact OD1-CB 3.28Å; D140-R142 WeakPolarHBondContact OD1-CB 3.3Å; D140-R142 WeakPolarHBondContact OD1-CG 3.38Å; D140-R142 IonicContact OD1-CZ 2.74Å; D140-R142 PolarHBondContact OD1-N 3.14Å; D140-R142 IonicContact OD1-NE 3.53Å; D140-R142 PolarHBondContact OD1-NE 3.03Å; D140-R142 IonicContact OD1-NH2 3.84Å; D140-R142 PolarHBondContact OD1-NH2 2.8Å; D140-R142 IonicContact OD2-NE 3.67Å; D140-R142 IonicContact OD2-NH2 2.74Å; D140-R142 PolarHBondContact OD2-NH2 3.03Å; D140-D143 WeakPolarHBondContact O-CB 3.17Å; D140-D143 PolarHBondContact O-N 3.36Å; D140-L149 HydrophobicContact CB-CD2 3.8Å; D140-L149 HydrophobicContact CB-CG 3.83Å; D140-L149 PolarHBondContact N-O 3.05Å; D140-T151 HydrophobicContact CB-CG2 3.97Å; D140-L173 HydrophobicContact CB-CD2 3.9Å; D140-V250 WeakPolarHBondContact OD2-CA 3.4Å; D140-E251 PolarHBondContact OD2-N 3.07Å
141	K	91	Very high	94.5	Very high	97 Å²	97	43.9 Å²	43.9	42%	0.422	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-19.1	-178.5	-73	179.6	-178.7	-169.3	0	114.8	E251 E253	K141-E251 HydrophobicContact CB-CB 4.13Å; K141-E251 HydrophobicContact CD-CB 4.29Å; K141-E251 HydrophobicContact CG-CB 4.38Å; K141-E251 WeakPolarHBondContact CG-O 3.31Å; K141-E251 PolarHBondContact N-O 2.88Å; K141-E253 WeakPolarHBondContact CE-OE1 3.39Å; K141-E253 IonicContact NZ-OE1 2.76Å; K141-E253 PolarHBondContact NZ-OE1 2.92Å
142	R	90.9	Very high	94.5	Very high	113 Å²	113	43.6 Å²	43.6	43%	0.426	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-2.6	177.3	-60.2	171.4	-67.6	152.9	-1.5	113	D140 L149 T249	D140-R142 PolarHBondContact O-N 3.39Å; D140-R142 VanDerWaalsContact O-N 3.09Å; D140-R142 VanDerWaalsContact OD1-CB 3.28Å; D140-R142 WeakPolarHBondContact OD1-CB 3.3Å; D140-R142 WeakPolarHBondContact OD1-CG 3.38Å; D140-R142 IonicContact OD1-CZ 2.74Å; D140-R142 PolarHBondContact OD1-N 3.14Å; D140-R142 IonicContact OD1-NE 3.53Å; D140-R142 PolarHBondContact OD1-NE 3.03Å; D140-R142 IonicContact OD1-NH2 3.84Å; D140-R142 PolarHBondContact OD1-NH2 2.8Å; D140-R142 IonicContact OD2-NE 3.67Å; D140-R142 IonicContact OD2-NH2 2.74Å; D140-R142 PolarHBondContact OD2-NH2 3.03Å; R142-L149 HydrophobicContact CB-CD2 4.28Å; R142-T249 PolarHBondContact NH2-O 3.36Å
143	D	93	Very high	94.4	Very high	23 Å²	23	45 Å²	45	12%	0.123	23%	0.228	C	C	.	.	S	Bend	trans	-55.6	149.3	175.1	-176.3	83.1	0	0	0	111.6	F139 D140 G145 L146 H147 S148 L149	F139-D143 HydrophobicContact CD2-CB 4.21Å; D140-D143 WeakPolarHBondContact O-CB 3.17Å; D140-D143 PolarHBondContact O-N 3.36Å; D143-G145 PolarHBondContact O-N 2.85Å; D143-G145 WeakPolarHBondContact OD2-CA 3.34Å; D143-G145 PolarHBondContact OD2-N 3.08Å; D143-L146 PolarHBondContact OD2-N 3.25Å; D143-L146 VanDerWaalsContact OD2-N 3.09Å; D143-H147 PolarHBondContact OD1-N 3.2Å; D143-H147 VanDerWaalsContact OD2-CA 3.28Å; D143-H147 WeakPolarHBondContact OD2-CA 3.1Å; D143-H147 IonicContact OD2-CD2 3.56Å; D143-H147 PolarHBondContact OD2-N 3Å; D143-S148 PolarHBondContact OD1-N 3.03Å; D143-L149 HydrophobicContact CB-CB 4.05Å; D143-L149 WeakPolarHBondContact OD1-CB 3.45Å; D143-L149 PolarHBondContact OD1-N 3.23Å
144	D	91.6	Very high	94.2	Very high	92 Å²	92	47.1 Å²	47.1	49%	0.492	24%	0.241	S	C	.	.			trans	-80.4	5.8	-176.5	49.8	20.8	0	0	0	113.8	L146 R175	D144-L146 WeakPolarHBondContact OD1-CB 3.49Å; D144-L146 WeakPolarHBondContact OD1-CG 3.43Å; D144-L146 PolarHBondContact OD1-N 3.32Å; D144-R175 IonicContact OD2-CZ 3.28Å; D144-R175 IonicContact OD2-NH2 3.15Å; D144-R175 PolarHBondContact OD2-NH2 3.09Å
145	G	91.4	Very high	94.1	Very high	54 Å²	54	53.8 Å²	53.8	56%	0.557	28%	0.276	S	S	*	.	S	Bend	trans	98.3	-3.4	-178.8	0	0	0	0	0	113.5	D143 H147	D143-G145 PolarHBondContact O-N 2.85Å; D143-G145 WeakPolarHBondContact OD2-CA 3.34Å; D143-G145 PolarHBondContact OD2-N 3.08Å; G145-H147 VanDerWaalsContact C-N 3.35Å
146	L	93	Very high	94.1	Very high	67 Å²	67	54.7 Å²	54.7	35%	0.351	28%	0.281	S	S	.	.	S	Bend	trans	-87	-7.4	176.5	-57.3	178.6	0	0	0	112.9	D143 D144 S148 P203	D143-L146 PolarHBondContact OD2-N 3.25Å; D143-L146 VanDerWaalsContact OD2-N 3.09Å; D144-L146 WeakPolarHBondContact OD1-CB 3.49Å; D144-L146 WeakPolarHBondContact OD1-CG 3.43Å; D144-L146 PolarHBondContact OD1-N 3.32Å; L146-S148 PolarHBondContact O-N 3.18Å; L146-P203 HydrophobicContact CB-CB 4.31Å; L146-P203 HydrophobicContact CD1-CB 4.29Å; L146-P203 HydrophobicContact CD1-CG 4.37Å; L146-P203 HydrophobicContact CD2-CB 4.42Å
147	H	94.7	Very high	94.3	Very high	47 Å²	47	51 Å²	51	22%	0.218	26%	0.264	C	S	.	.	S	Bend	trans	54.5	38.8	-175.6	-56.5	177.3	0	0	0	112.2	I134 D135 H136 F139 D143 G145	I134-H147 WeakPolarHBondContact CA-O 3.47Å; I134-H147 HydrophobicContact CG2-CB 4.25Å; D135-H147 PolarHBondContact N-O 2.77Å; H136-H147 WeakPolarHBondContact CA-ND1 3.44Å; H136-H147 AromaticContact CG-ND1 3.58Å; H136-H147 AromaticContact ND1-CE1 3.96Å; H136-H147 AromaticContact ND1-CG 3.56Å; H136-H147 AromaticContact ND1-ND1 2.92Å; H136-H147 PolarHBondContact ND1-ND1 2.85Å; F139-H147 HydrophobicContact CB-CB 4.4Å; F139-H147 HydrophobicContact CD1-CB 4.45Å; F139-H147 AromaticContact CE1-CE1 3.93Å; F139-H147 AromaticContact CE2-CD2 4Å; F139-H147 AromaticContact CE2-NE2 3.99Å; F139-H147 HydrophobicContact CG-CB 4.36Å; F139-H147 AromaticContact CZ-NE2 3.75Å; D143-H147 PolarHBondContact OD1-N 3.2Å; D143-H147 VanDerWaalsContact OD2-CA 3.28Å; D143-H147 WeakPolarHBondContact OD2-CA 3.1Å; D143-H147 IonicContact OD2-CD2 3.56Å; D143-H147 PolarHBondContact OD2-N 3Å; G145-H147 VanDerWaalsContact C-N 3.35Å
148	S	96.1	Very high	94.4	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.239	C	C	.	.			trans	-101.5	-20.3	-176.9	70.4	0	0	0	0	113.2	D143 L146 I150	D143-S148 PolarHBondContact OD1-N 3.03Å; L146-S148 PolarHBondContact O-N 3.18Å; S148-I150 PolarHBondContact O-N 2.88Å
149	L	97	Very high	94.4	Very high	17 Å²	17	52.1 Å²	52.1	9%	0.089	27%	0.269	C	S	.	.	S	Bend	trans	-84.9	87.4	166.4	-179.5	61.9	0	0	0	108.8	F139 D140 R142 D143 L173 R175 F245	F139-L149 WeakPolarHBondContact CA-O 3.27Å; D140-L149 HydrophobicContact CB-CD2 3.8Å; D140-L149 HydrophobicContact CB-CG 3.83Å; D140-L149 PolarHBondContact N-O 3.05Å; R142-L149 HydrophobicContact CB-CD2 4.28Å; D143-L149 HydrophobicContact CB-CB 4.05Å; D143-L149 WeakPolarHBondContact OD1-CB 3.45Å; D143-L149 PolarHBondContact OD1-N 3.23Å; L149-L173 HydrophobicContact CD1-CD2 4.34Å; L149-R175 HydrophobicContact CD1-CB 4.26Å; L149-F245 HydrophobicContact CD1-CE1 4.25Å; L149-F245 HydrophobicContact CD1-CE2 4.2Å; L149-F245 HydrophobicContact CD1-CZ 3.57Å
150	I	96.5	Very high	94.4	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.01	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	152.1	-174.5	69.3	167.4	0	0	0	112	V133 D135 N138 S148 V152 Y174 L220	V133-I150 HydrophobicContact CB-CD1 4.28Å; V133-I150 HydrophobicContact CG1-CD1 3.68Å; D135-I150 HydrophobicContact CB-CB 4.28Å; D135-I150 HydrophobicContact CB-CG2 3.65Å; N138-I150 WeakPolarHBondContact O-CA 3.33Å; S148-I150 PolarHBondContact O-N 2.88Å; I150-V152 HydrophobicContact CD1-CG2 3.89Å; I150-V152 HydrophobicContact CG1-CG2 4.09Å; I150-Y174 HydrophobicContact CD1-CD1 4.18Å; I150-Y174 HydrophobicContact CG1-CD1 4.22Å; I150-Y174 WeakPolarHBondContact CG1-O 3.35Å; I150-Y174 PolarHBondContact N-O 2.84Å; I150-Y174 PolarHBondContact O-N 3.49Å; I150-L220 HydrophobicContact CD1-CD1 4.4Å
151	T	95.4	Very high	94.4	Very high	11 Å²	11	55.2 Å²	55.2	7%	0.067	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	119.5	172.4	62.6	0	0	0	0	109.4	N138 D140 L172 L173 V250 T252	N138-T151 WeakPolarHBondContact CB-O 3.3Å; N138-T151 PolarHBondContact O-N 2.92Å; N138-T151 PolarHBondContact O-OG1 3.47Å; D140-T151 HydrophobicContact CB-CG2 3.97Å; T151-L172 CarbonylContact C-O 3.6Å; T151-L172 WeakPolarHBondContact CA-O 3.35Å; T151-L173 HydrophobicContact CG2-CD2 3.94Å; T151-V250 HydrophobicContact CG2-CG1 3.72Å; T151-T252 HydrophobicContact CG2-CG2 3.61Å
152	V	96.1	Very high	94.5	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	120	-176.9	-168.9	0	0	0	0	109.2	I150 N156 L172 L192 H193 L220	I150-V152 HydrophobicContact CD1-CG2 3.89Å; I150-V152 HydrophobicContact CG1-CG2 4.09Å; V152-N156 HydrophobicContact CG1-CB 3.9Å; V152-L172 HydrophobicContact CB-CB 4.28Å; V152-L172 PolarHBondContact N-O 2.95Å; V152-L172 PolarHBondContact O-N 3.08Å; V152-L192 HydrophobicContact CG1-CD1 3.71Å; V152-L192 HydrophobicContact CG1-CG 4.35Å; V152-H193 WeakPolarHBondContact CG1-O 3.35Å; V152-L220 HydrophobicContact CG1-CD1 4.29Å; V152-L220 HydrophobicContact CG2-CD1 3.56Å
153	P	94.5	Very high	94.8	Very high	48 Å²	48	46 Å²	46	31%	0.312	25%	0.254	S	S	.	.			trans	-69.7	148.9	179.5	28.7	-33.4	0	0	0	111.1	N155 N156	P153-N155 PolarHBondContact O-N 2.89Å; P153-N156 WeakPolarHBondContact CG-OD1 3.39Å; P153-N156 WeakPolarHBondContact O-CB 3.47Å; P153-N156 PolarHBondContact O-N 3.48Å
154	V	94.4	Very high	94.9	Very high	46 Å²	46	45.4 Å²	45.4	28%	0.279	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-54.8	-28.8	179.6	-179.5	0	0	0	0	112.7	N156 L157 V168 A170	V154-N156 PolarHBondContact O-N 2.63Å; V154-N156 VanDerWaalsContact O-N 3.16Å; V154-L157 HydrophobicContact CG1-CD1 4.02Å; V154-L157 VanDerWaalsContact O-CB 3.31Å; V154-L157 WeakPolarHBondContact O-CB 3.45Å; V154-L157 PolarHBondContact O-N 3.2Å; V154-V168 HydrophobicContact CG1-CB 4.44Å; V154-V168 HydrophobicContact CG1-CG1 4.44Å; V154-V168 WeakPolarHBondContact CG1-O 3.29Å; V154-V168 HydrophobicContact CG2-CG1 4.16Å; V154-A170 WeakPolarHBondContact CG2-O 3.49Å
155	N	95.1	Very high	94.9	Very high	144 Å²	144	41.8 Å²	41.8	77%	0.77	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-64	-17.7	179.4	-69.7	-18.9	0	0	0	114.1	P153 L157	P153-N155 PolarHBondContact O-N 2.89Å; N155-L157 VanDerWaalsContact C-N 3.27Å
156	N	96.7	Very high	94.7	Very high	20 Å²	20	41.5 Å²	41.5	11%	0.107	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-84.2	-3	176.5	-63.5	17	0	0	0	112.7	V152 P153 V154 L192 H193 G194 S195	V152-N156 HydrophobicContact CG1-CB 3.9Å; P153-N156 WeakPolarHBondContact CG-OD1 3.39Å; P153-N156 WeakPolarHBondContact O-CB 3.47Å; P153-N156 PolarHBondContact O-N 3.48Å; V154-N156 PolarHBondContact O-N 2.63Å; V154-N156 VanDerWaalsContact O-N 3.16Å; N156-L192 HydrophobicContact CB-CD1 4.32Å; N156-H193 VanDerWaalsContact CB-O 3.24Å; N156-H193 WeakPolarHBondContact CB-O 3.48Å; N156-H193 PolarHBondContact ND2-O 2.96Å; N156-H193 PolarHBondContact O-CE1 2.62Å; N156-H193 PolarHBondContact O-N 2.93Å; N156-H193 PolarHBondContact O-ND1 3.07Å; N156-G194 VanDerWaalsContact ND2-C 3.35Å; N156-G194 PolarHBondContact ND2-O 2.88Å; N156-S195 PolarHBondContact ND2-N 3Å
157	L	97.2	Very high	94.2	Very high	13 Å²	13	45.3 Å²	45.3	7%	0.068	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-72.4	151.1	171.9	-72	167.9	0	0	0	111.3	V154 N155 K159 T164 V168 L172 V191 L192 L265	V154-L157 HydrophobicContact CG1-CD1 4.02Å; V154-L157 VanDerWaalsContact O-CB 3.31Å; V154-L157 WeakPolarHBondContact O-CB 3.45Å; V154-L157 PolarHBondContact O-N 3.2Å; N155-L157 VanDerWaalsContact C-N 3.27Å; L157-K159 PolarHBondContact O-N 2.75Å; L157-T164 HydrophobicContact CB-CG2 4.15Å; L157-T164 HydrophobicContact CD1-CG2 4.47Å; L157-T164 HydrophobicContact CD2-CG2 4.35Å; L157-V168 HydrophobicContact CD1-CB 4.07Å; L157-V168 HydrophobicContact CD1-CG1 4.04Å; L157-V168 HydrophobicContact CD1-CG2 4.27Å; L157-L172 HydrophobicContact CD1-CD1 4.39Å; L157-L172 HydrophobicContact CD2-CD1 4.08Å; L157-L172 HydrophobicContact CG-CD1 4.28Å; L157-V191 WeakPolarHBondContact CA-O 3.17Å; L157-L192 HydrophobicContact CD2-CB 4.16Å; L157-L192 HydrophobicContact CD2-CD1 3.66Å; L157-L192 HydrophobicContact CD2-CG 4.42Å; L157-L192 HydrophobicContact CG-CD1 4.04Å; L157-L265 HydrophobicContact CD1-CD1 4.47Å; L157-L265 HydrophobicContact CD1-CD2 4.39Å; L157-L265 HydrophobicContact CD2-CD1 3.96Å; L157-L265 HydrophobicContact CD2-CD2 3.46Å; L157-L265 VanDerWaalsContact CD2-CD2 3.46Å; L157-L265 HydrophobicContact CD2-CG 4.41Å
158	V	96.2	Very high	94	Very high	26 Å²	26	43.7 Å²	43.7	16%	0.158	24%	0.24	C	C	.	.			trans	-50.8	134.9	168	65.9	0	0	0	0	110.9	S160 I163 T164 I189 D190 V191 V372	V158-S160 PolarHBondContact O-N 3.15Å; V158-I163 HydrophobicContact CG1-CB 4.12Å; V158-I163 HydrophobicContact CG1-CD1 4.22Å; V158-I163 HydrophobicContact CG1-CG2 4.05Å; V158-T164 HydrophobicContact CG1-CG2 3.65Å; V158-I189 HydrophobicContact CG2-CG2 3.97Å; V158-D190 WeakPolarHBondContact CB-O 3.23Å; V158-V191 HydrophobicContact CG1-CG1 4.47Å; V158-V191 PolarHBondContact N-O 3.1Å; V158-V372 HydrophobicContact CG2-CG1 4.48Å
159	K	94.4	Very high	93.6	Very high	209 Å²	209	47.4 Å²	47.4	91%	0.909	28%	0.277	S	S	*	.	S	Bend	trans	-76.7	60	176.9	-64.2	-178	-178.8	176.3	0	111.3	L157	L157-K159 PolarHBondContact O-N 2.75Å
160	S	94.2	Very high	93.3	Very high	11 Å²	11	47.2 Å²	47.2	8%	0.077	28%	0.279	C	S	.	.			trans	-142	106.8	175.8	-177.4	0	0	0	0	111	V158 V162 I163 T164 V372	V158-S160 PolarHBondContact O-N 3.15Å; S160-V162 PolarHBondContact O-N 3.4Å; S160-I163 PolarHBondContact O-N 3.39Å; S160-I163 VanDerWaalsContact O-N 3.12Å; S160-T164 PolarHBondContact O-N 3.31Å; S160-T164 PolarHBondContact O-OG1 3.15Å; S160-T164 VanDerWaalsContact O-OG1 3.07Å; S160-V372 PolarHBondContact OG-O 2.96Å
161	N	93.4	Very high	93.2	Very high	120 Å²	120	47.9 Å²	47.9	64%	0.642	28%	0.283	S	S	*	.	H	α-helix	trans	-63.2	-21.2	176.3	-67.5	-10.9	0	0	0	112.5	I163 G165	N161-I163 VanDerWaalsContact C-N 3.33Å; N161-G165 CarbonylContact O-C 3.53Å; N161-G165 WeakPolarHBondContact O-CA 3.5Å; N161-G165 PolarHBondContact O-N 3.25Å
162	V	93.8	Very high	93.3	Very high	17 Å²	17	47.4 Å²	47.4	10%	0.103	28%	0.28	C	S	.	.	H	α-helix	trans	-67.8	-38.2	176.7	-174.2	0	0	0	0	110.6	S160 R277 G278 G373 Y374	S160-V162 PolarHBondContact O-N 3.4Å; V162-R277 HydrophobicContact CG1-CG 4.2Å; V162-R277 WeakPolarHBondContact O-CD 3.36Å; V162-G278 VanDerWaalsContact CG1-CA 3.44Å; V162-G373 WeakPolarHBondContact CG1-O 3.15Å; V162-Y374 HydrophobicContact CG1-CD1 4.41Å; V162-Y374 HydrophobicContact CG1-CE1 4.26Å; V162-Y374 HydrophobicContact CG2-CD2 4.16Å; V162-Y374 HydrophobicContact CG2-CE1 3.9Å; V162-Y374 HydrophobicContact CG2-CE2 3.49Å; V162-Y374 VanDerWaalsContact CG2-CE2 3.49Å; V162-Y374 WeakPolarHBondContact CG2-OH 3.46Å
163	I	96.2	Very high	93.3	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-83.1	-50.5	-179.7	-58.2	179.6	0	0	0	110.1	V158 S160 N161 I189 V191 L269 W272 V372	V158-I163 HydrophobicContact CG1-CB 4.12Å; V158-I163 HydrophobicContact CG1-CD1 4.22Å; V158-I163 HydrophobicContact CG1-CG2 4.05Å; S160-I163 PolarHBondContact O-N 3.39Å; S160-I163 VanDerWaalsContact O-N 3.12Å; N161-I163 VanDerWaalsContact C-N 3.33Å; I163-I189 HydrophobicContact CD1-CD1 4.2Å; I163-I189 HydrophobicContact CD1-CG2 4.05Å; I163-V191 HydrophobicContact CG2-CG1 4.37Å; I163-L269 HydrophobicContact CG2-CD2 3.67Å; I163-W272 HydrophobicContact CB-CD2 4.41Å; I163-W272 HydrophobicContact CB-CG 4.47Å; I163-W272 HydrophobicContact CD1-CH2 4.42Å; I163-W272 HydrophobicContact CD1-CZ2 4.03Å; I163-W272 HydrophobicContact CG1-CD2 3.97Å; I163-W272 HydrophobicContact CG1-CG 4.22Å; I163-W272 HydrophobicContact CG1-CZ2 4.11Å; I163-W272 HydrophobicContact CG2-CD2 4.16Å; I163-W272 HydrophobicContact CG2-CE3 4.11Å; I163-V372 HydrophobicContact CD1-CG1 4.04Å
164	T	95.1	Very high	93.5	Very high	10 Å²	10	45.1 Å²	45.1	6%	0.061	27%	0.265	C	S	.	.	H	α-helix	trans	-90.6	-8.8	-171.3	65.1	0	0	0	0	113.9	L157 V158 S160 G166 L265 N268	L157-T164 HydrophobicContact CB-CG2 4.15Å; L157-T164 HydrophobicContact CD1-CG2 4.47Å; L157-T164 HydrophobicContact CD2-CG2 4.35Å; V158-T164 HydrophobicContact CG1-CG2 3.65Å; S160-T164 PolarHBondContact O-N 3.31Å; S160-T164 PolarHBondContact O-OG1 3.15Å; S160-T164 VanDerWaalsContact O-OG1 3.07Å; T164-G166 PolarHBondContact O-N 2.88Å; T164-L265 HydrophobicContact CG2-CD1 4.41Å; T164-N268 WeakPolarHBondContact O-CB 3.35Å; T164-N268 PolarHBondContact O-ND2 2.82Å
165	G	91	Very high	93.7	Very high	16 Å²	16	46.8 Å²	46.8	17%	0.165	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.1	-6.9	-176	0	0	0	0	0	115.6	N161 K167 N268	N161-G165 CarbonylContact O-C 3.53Å; N161-G165 WeakPolarHBondContact O-CA 3.5Å; N161-G165 PolarHBondContact O-N 3.25Å; G165-K167 PolarHBondContact O-N 3.49Å; G165-K167 VanDerWaalsContact O-N 3.09Å; G165-N268 WeakPolarHBondContact CA-OD1 3.06Å
166	G	87.2	Confident	93.8	Very high	48 Å²	48	40 Å²	40	50%	0.495	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.9	9.8	-179.4	0	0	0	0	0	115.2	T164	T164-G166 PolarHBondContact O-N 2.88Å
167	K	83.4	Confident	93.8	Very high	146 Å²	146	39 Å²	39	64%	0.635	23%	0.225	S	C	*	.			trans	-110.5	-1.3	-175	-69.2	176.3	-174.2	174.8	0	113.8	G165 G169 V264	G165-K167 PolarHBondContact O-N 3.49Å; G165-K167 VanDerWaalsContact O-N 3.09Å; K167-G169 PolarHBondContact O-N 3.02Å; K167-V264 HydrophobicContact CB-CG1 4.32Å
168	V	90	Very high	93.9	Very high	14 Å²	14	38.4 Å²	38.4	9%	0.085	22%	0.222	C	C	.	.			trans	-72.9	99.5	178.1	-173.4	0	0	0	0	108.2	V154 L157 L172 V264 L265	V154-V168 HydrophobicContact CG1-CB 4.44Å; V154-V168 HydrophobicContact CG1-CG1 4.44Å; V154-V168 WeakPolarHBondContact CG1-O 3.29Å; V154-V168 HydrophobicContact CG2-CG1 4.16Å; L157-V168 HydrophobicContact CD1-CB 4.07Å; L157-V168 HydrophobicContact CD1-CG1 4.04Å; L157-V168 HydrophobicContact CD1-CG2 4.27Å; V168-L172 HydrophobicContact CG1-CD2 4.21Å; V168-V264 HydrophobicContact CG2-CG1 4.25Å; V168-L265 HydrophobicContact CG2-CB 3.9Å; V168-L265 HydrophobicContact CG2-CD1 4.13Å
169	G	87.2	Confident	93.9	Very high	77 Å²	77	37.1 Å²	37.1	79%	0.794	21%	0.214	S	C	*	.			trans	-100.8	-10.4	-176.7	0	0	0	0	0	114.9	K167	K167-G169 PolarHBondContact O-N 3.02Å
170	A	92.1	Very high	94	Very high	14 Å²	14	28.8 Å²	28.8	12%	0.116	18%	0.182	C	C	.	.	S	Bend	trans	-117.2	150.8	-176.7	0	0	0	0	0	111.1	V154 V258 V259	V154-A170 WeakPolarHBondContact CG2-O 3.49Å; A170-V258 HydrophobicContact CB-CG1 3.86Å; A170-V259 WeakPolarHBondContact CB-O 3.36Å
171	P	94.6	Very high	94	Very high	16 Å²	16	29.2 Å²	29.2	10%	0.104	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-57.1	154.9	172.7	-20.5	31.4	0	0	0	112.2	V250 C260 G261	P171-V250 HydrophobicContact CB-CG1 4.34Å; P171-V250 HydrophobicContact CB-CG2 4.35Å; P171-C260 WeakPolarHBondContact O-CA 3.45Å; P171-G261 PolarHBondContact O-N 2.78Å
172	L	96.5	Very high	93.9	Very high	0 Å²	0	27 Å²	27	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	147.1	-179.2	-57.8	164.1	0	0	0	109.7	T151 V152 L157 V168 L192 F240 N262 L265	T151-L172 CarbonylContact C-O 3.6Å; T151-L172 WeakPolarHBondContact CA-O 3.35Å; V152-L172 HydrophobicContact CB-CB 4.28Å; V152-L172 PolarHBondContact N-O 2.95Å; V152-L172 PolarHBondContact O-N 3.08Å; L157-L172 HydrophobicContact CD1-CD1 4.39Å; L157-L172 HydrophobicContact CD2-CD1 4.08Å; L157-L172 HydrophobicContact CG-CD1 4.28Å; V168-L172 HydrophobicContact CG1-CD2 4.21Å; L172-L192 HydrophobicContact CD1-CD1 3.63Å; L172-L192 HydrophobicContact CD1-CD2 3.78Å; L172-L192 HydrophobicContact CD1-CG 4.37Å; L172-F240 HydrophobicContact CB-CE2 4.47Å; L172-F240 HydrophobicContact CD2-CZ 4.46Å; L172-N262 VanDerWaalsContact CA-OD1 3.3Å; L172-N262 WeakPolarHBondContact CA-OD1 3.36Å; L172-L265 HydrophobicContact CD1-CD2 3.53Å; L172-L265 HydrophobicContact CD2-CB 4.09Å; L172-L265 HydrophobicContact CD2-CD2 3.8Å; L172-L265 HydrophobicContact CG-CD2 4.33Å
173	L	97	Very high	93.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	138.4	167.9	-70.8	166.6	0	0	0	109.4	D140 L149 T151 F240 F245 S248 V250 C260 N262	D140-L173 HydrophobicContact CB-CD2 3.9Å; L149-L173 HydrophobicContact CD1-CD2 4.34Å; T151-L173 HydrophobicContact CG2-CD2 3.94Å; L173-F240 WeakPolarHBondContact O-CD2 3.38Å; L173-F245 HydrophobicContact CB-CD2 3.92Å; L173-F245 HydrophobicContact CB-CE2 3.96Å; L173-S248 WeakPolarHBondContact CD1-OG 3.35Å; L173-V250 HydrophobicContact CD1-CG2 4.25Å; L173-V250 HydrophobicContact CD2-CG2 4.12Å; L173-V250 HydrophobicContact CG-CG2 3.88Å; L173-C260 HydrophobicContact CD1-CB 3.83Å; L173-C260 HydrophobicContact CG-CB 4.03Å; L173-N262 PolarHBondContact N-OD1 3.3Å; L173-N262 PolarHBondContact O-ND2 3.32Å
174	Y	98.1	Very high	93.5	Very high	0 Å²	0	40 Å²	40	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	135.1	177.6	-172	-89.5	0	0	0	110.3	V133 I150 I177 L220 G236 F240	V133-Y174 HydrophobicContact CB-CD1 4.47Å; V133-Y174 HydrophobicContact CB-CE1 4.24Å; V133-Y174 HydrophobicContact CG2-CE1 3.92Å; I150-Y174 HydrophobicContact CD1-CD1 4.18Å; I150-Y174 HydrophobicContact CG1-CD1 4.22Å; I150-Y174 WeakPolarHBondContact CG1-O 3.35Å; I150-Y174 PolarHBondContact N-O 2.84Å; I150-Y174 PolarHBondContact O-N 3.49Å; Y174-I177 PolarHBondContact OH-O 2.99Å; Y174-L220 HydrophobicContact CD1-CD1 4.17Å; Y174-L220 HydrophobicContact CD1-CD2 3.94Å; Y174-L220 HydrophobicContact CD2-CB 3.96Å; Y174-L220 HydrophobicContact CD2-CD1 4.1Å; Y174-L220 HydrophobicContact CD2-CG 4.45Å; Y174-L220 HydrophobicContact CE1-CB 4.4Å; Y174-L220 HydrophobicContact CE1-CD2 3.6Å; Y174-L220 HydrophobicContact CE1-CG 4.38Å; Y174-L220 HydrophobicContact CE2-CB 3.58Å; Y174-L220 HydrophobicContact CE2-CD1 4.47Å; Y174-L220 HydrophobicContact CE2-CD2 4.36Å; Y174-L220 HydrophobicContact CE2-CG 4.33Å; Y174-L220 HydrophobicContact CG-CD1 3.92Å; Y174-L220 HydrophobicContact CG-CD2 4.43Å; Y174-G236 WeakPolarHBondContact OH-CA 3.42Å; Y174-G236 PolarHBondContact OH-O 2.84Å; Y174-F240 AromaticContact CD2-CD2 3.95Å; Y174-F240 HydrophobicContact CD2-CD2 3.95Å
175	R	97.8	Very high	93.4	Very high	82 Å²	82	41.2 Å²	41.2	31%	0.309	25%	0.248	S	C	.	.			trans	-145.5	113.7	169	-175.7	-175.3	-172.1	165.6	12.3	107.5	L132 D144 L149 S237 F245	L132-R175 HydrophobicContact CD2-CG 4.15Å; D144-R175 IonicContact OD2-CZ 3.28Å; D144-R175 IonicContact OD2-NH2 3.15Å; D144-R175 PolarHBondContact OD2-NH2 3.09Å; L149-R175 HydrophobicContact CD1-CB 4.26Å; R175-S237 WeakPolarHBondContact O-CB 3.33Å; R175-S237 PolarHBondContact O-OG 2.74Å; R175-F245 HydrophobicContact CB-CE2 4.39Å; R175-F245 HydrophobicContact CB-CZ 3.91Å
176	G	97.7	Very high	93.6	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	27%	0.272	C	S	.	.	S	Bend	trans	169.3	-170.1	-173.8	0	0	0	0	0	112.4	L132 V133 G236	L132-G176 WeakPolarHBondContact CA-O 3.3Å; V133-G176 PolarHBondContact N-O 3.32Å; G176-G236 CarbonylContact C-O 3.52Å; G176-G236 VanDerWaalsContact CA-O 3.29Å; G176-G236 WeakPolarHBondContact CA-O 3.41Å
177	I	97.5	Very high	94	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	26%	0.257	C	S	.	.			trans	-80.8	152.1	-176.5	-159.3	163.9	0	0	0	111.5	A107 V111 F126 D127 E128 Y174 G236	A107-I177 HydrophobicContact CB-CG2 4.14Å; V111-I177 HydrophobicContact CB-CD1 4.49Å; V111-I177 HydrophobicContact CG1-CD1 3.64Å; F126-I177 HydrophobicContact CB-CD1 4.36Å; F126-I177 HydrophobicContact CD1-CG2 4.08Å; D127-I177 HydrophobicContact CB-CD1 4.28Å; D127-I177 HydrophobicContact CB-CG1 3.84Å; D127-I177 WeakPolarHBondContact O-CD1 3.17Å; E128-I177 WeakPolarHBondContact O-CD1 3.25Å; Y174-I177 PolarHBondContact OH-O 2.99Å; I177-G236 WeakPolarHBondContact CG2-O 3.45Å; I177-G236 PolarHBondContact N-O 3.28Å
178	G	97.6	Very high	94.6	Very high	0 Å²	0	39 Å²	39	0%	0	23%	0.233	C	C	.	.			trans	-75.7	149	169.5	0	0	0	0	0	112	D127 S200	D127-G178 PolarHBondContact N-O 3.15Å; G178-S200 PolarHBondContact N-OG 2.76Å
179	I	97.9	Very high	94.9	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	133.3	172	-59.8	175.1	0	0	0	108.8	V124 E125 F126 Q219 T222 F234	V124-I179 HydrophobicContact CG1-CG2 3.5Å; E125-I179 CarbonylContact O-C 3.56Å; E125-I179 WeakPolarHBondContact O-CA 3.35Å; F126-I179 HydrophobicContact CD1-CD1 4.34Å; F126-I179 HydrophobicContact CD1-CG1 3.82Å; F126-I179 HydrophobicContact CE1-CD1 3.9Å; F126-I179 HydrophobicContact CE1-CG1 3.91Å; I179-Q219 HydrophobicContact CB-CB 3.99Å; I179-Q219 WeakPolarHBondContact CB-O 3.48Å; I179-Q219 HydrophobicContact CG2-CB 4.28Å; I179-Q219 PolarHBondContact N-O 2.74Å; I179-Q219 WeakPolarHBondContact O-CA 3.24Å; I179-Q219 WeakPolarHBondContact O-CB 3.39Å; I179-Q219 PolarHBondContact O-N 3.34Å; I179-T222 WeakPolarHBondContact CG2-OG1 3.38Å; I179-F234 HydrophobicContact CD1-CB 4.44Å
180	S	96.1	Very high	95.4	Very high	33 Å²	33	38 Å²	38	23%	0.231	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	140.5	159.9	41.6	0	0	0	0	109.5	E125	E125-S180 WeakPolarHBondContact CB-OG 3.34Å; E125-S180 PolarHBondContact N-O 2.9Å; E125-S180 PolarHBondContact O-N 2.91Å; E125-S180 PolarHBondContact O-OG 2.79Å
181	A	93.1	Very high	95.7	Very high	21 Å²	21	37.3 Å²	37.3	17%	0.174	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	146	175.5	0	0	0	0	0	110	Q183 L188 T222	A181-Q183 PolarHBondContact O-N 3.02Å; A181-Q183 VanDerWaalsContact O-N 3.13Å; A181-L188 HydrophobicContact CB-CD1 3.99Å; A181-T222 HydrophobicContact CB-CG2 4.1Å
182	D	91.3	Very high	95.8	Very high	74 Å²	74	36.6 Å²	36.6	40%	0.396	20%	0.199	S	C	.	.			trans	-64.7	112.6	174.1	178.4	9.8	0	0	0	110.7	G123 T184 N185 L188	G123-D182 PolarHBondContact O-N 3.12Å; D182-T184 VanDerWaalsContact CG-OG1 3.23Å; D182-T184 PolarHBondContact O-N 3.4Å; D182-T184 WeakPolarHBondContact OD1-CB 3.49Å; D182-T184 PolarHBondContact OD1-N 3.14Å; D182-T184 PolarHBondContact OD1-OG1 3.02Å; D182-T184 PolarHBondContact OD2-OG1 3.06Å; D182-N185 HydrophobicContact CB-CB 4.24Å; D182-N185 PolarHBondContact O-N 2.93Å; D182-L188 HydrophobicContact CB-CD1 4.44Å
183	Q	88.9	Confident	95.9	Very high	172 Å²	172	38.2 Å²	38.2	80%	0.804	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-18.1	179.8	-62.3	-177.2	6.1	0	0	113.1	A181	A181-Q183 PolarHBondContact O-N 3.02Å; A181-Q183 VanDerWaalsContact O-N 3.13Å
184	T	92.6	Very high	95.9	Very high	116 Å²	116	38.2 Å²	38.2	71%	0.712	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84	-15	178.6	75.6	0	0	0	0	112.8	D182 P186	D182-T184 VanDerWaalsContact CG-OG1 3.23Å; D182-T184 PolarHBondContact O-N 3.4Å; D182-T184 WeakPolarHBondContact OD1-CB 3.49Å; D182-T184 PolarHBondContact OD1-N 3.14Å; D182-T184 PolarHBondContact OD1-OG1 3.02Å; D182-T184 PolarHBondContact OD2-OG1 3.06Å; T184-P186 VanDerWaalsContact O-CD 3.22Å; T184-P186 WeakPolarHBondContact O-CD 3.24Å
185	N	94.2	Very high	95.9	Very high	37 Å²	37	38.8 Å²	38.8	20%	0.198	21%	0.21	C	C	.	.			trans	-88.3	105.6	179.2	-174.4	-4.2	0	0	0	111.3	D182 L187 L188	D182-N185 HydrophobicContact CB-CB 4.24Å; D182-N185 PolarHBondContact O-N 2.93Å; N185-L187 PolarHBondContact O-N 2.94Å; N185-L187 VanDerWaalsContact OD1-CB 3.31Å; N185-L187 WeakPolarHBondContact OD1-CB 3.46Å; N185-L187 PolarHBondContact OD1-N 2.85Å; N185-L187 VanDerWaalsContact OD1-N 3.1Å; N185-L188 HydrophobicContact CB-CD1 3.94Å; N185-L188 HydrophobicContact CB-CG 4.27Å; N185-L188 PolarHBondContact O-N 2.88Å
186	P	93.9	Very high	95.8	Very high	101 Å²	101	43.5 Å²	43.5	66%	0.656	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-2.5	-176.5	35	-38.6	0	0	0	113.9	T184 Y370	T184-P186 VanDerWaalsContact O-CD 3.22Å; T184-P186 WeakPolarHBondContact O-CD 3.24Å; P186-Y370 PolarHBondContact O-OH 3.46Å
187	L	95.6	Very high	95.7	Very high	36 Å²	36	46.1 Å²	46.1	19%	0.188	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-17.3	177.1	-56.7	179.7	0	0	0	112	N185 L224 Q225 R227	N185-L187 PolarHBondContact O-N 2.94Å; N185-L187 VanDerWaalsContact OD1-CB 3.31Å; N185-L187 WeakPolarHBondContact OD1-CB 3.46Å; N185-L187 PolarHBondContact OD1-N 2.85Å; N185-L187 VanDerWaalsContact OD1-N 3.1Å; L187-L224 HydrophobicContact CB-CD1 3.64Å; L187-Q225 WeakPolarHBondContact CB-O 3.4Å; L187-Q225 WeakPolarHBondContact CD2-O 3.34Å; L187-Q225 PolarHBondContact O-N 2.8Å; L187-R227 HydrophobicContact CD1-CG 4.25Å; L187-R227 HydrophobicContact CD2-CG 4.39Å
188	L	97.3	Very high	95.7	Very high	25 Å²	25	46.2 Å²	46.2	13%	0.131	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	143.4	177.3	-68.5	171.6	0	0	0	111.1	G123 V124 A181 D182 N185 T222 A223 L224	G123-L188 WeakPolarHBondContact O-CD1 3.45Å; V124-L188 HydrophobicContact CG2-CD2 3.78Å; A181-L188 HydrophobicContact CB-CD1 3.99Å; D182-L188 HydrophobicContact CB-CD1 4.44Å; N185-L188 HydrophobicContact CB-CD1 3.94Å; N185-L188 HydrophobicContact CB-CG 4.27Å; N185-L188 PolarHBondContact O-N 2.88Å; L188-T222 HydrophobicContact CD2-CG2 4.08Å; L188-A223 CarbonylContact C-O 3.52Å; L188-A223 WeakPolarHBondContact CA-O 3.17Å; L188-L224 HydrophobicContact CD2-CB 3.99Å; L188-L224 HydrophobicContact CD2-CD1 3.6Å; L188-L224 HydrophobicContact CD2-CG 4.42Å; L188-L224 HydrophobicContact CG-CD1 4.01Å
189	I	96.8	Very high	95.6	Very high	21 Å²	21	47.8 Å²	47.8	11%	0.108	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	115.8	-179.6	-57.9	167.8	0	0	0	106.6	V158 I163 V191 A223 W272 V372	V158-I189 HydrophobicContact CG2-CG2 3.97Å; I163-I189 HydrophobicContact CD1-CD1 4.2Å; I163-I189 HydrophobicContact CD1-CG2 4.05Å; I189-V191 HydrophobicContact CG2-CG2 4.26Å; I189-V191 PolarHBondContact O-N 3.38Å; I189-V191 VanDerWaalsContact O-N 3.08Å; I189-A223 HydrophobicContact CB-CB 4.34Å; I189-A223 PolarHBondContact N-O 2.7Å; I189-A223 PolarHBondContact O-N 2.92Å; I189-W272 HydrophobicContact CD1-CH2 4.03Å; I189-W272 HydrophobicContact CD1-CZ2 4.1Å; I189-V372 HydrophobicContact CD1-CG1 4.21Å; I189-V372 HydrophobicContact CG1-CG1 4.45Å; I189-V372 HydrophobicContact CG2-CG1 4.22Å
190	D	96.9	Very high	95.6	Very high	50 Å²	50	47.8 Å²	47.8	27%	0.267	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	102	165.8	173	17.7	0	0	0	108.6	V158 L192 H193 Q219	V158-D190 WeakPolarHBondContact CB-O 3.23Å; D190-L192 PolarHBondContact OD1-N 3.09Å; D190-H193 IonicContact OD1-ND1 3.39Å; D190-H193 IonicContact OD2-CE1 3.46Å; D190-H193 IonicContact OD2-CG 2.91Å; D190-H193 IonicContact OD2-ND1 3.82Å; D190-H193 PolarHBondContact OD2-ND1 2.81Å; D190-Q219 HydrophobicContact CB-CG 4.49Å
191	V	97.8	Very high	95.6	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	-42	-177.2	174.8	0	0	0	0	110.5	L157 V158 I163 I189 I221 A223 L233 L269	L157-V191 WeakPolarHBondContact CA-O 3.17Å; V158-V191 HydrophobicContact CG1-CG1 4.47Å; V158-V191 PolarHBondContact N-O 3.1Å; I163-V191 HydrophobicContact CG2-CG1 4.37Å; I189-V191 HydrophobicContact CG2-CG2 4.26Å; I189-V191 PolarHBondContact O-N 3.38Å; I189-V191 VanDerWaalsContact O-N 3.08Å; V191-I221 HydrophobicContact CB-CB 4.11Å; V191-I221 HydrophobicContact CB-CG2 3.85Å; V191-I221 WeakPolarHBondContact CB-O 3.34Å; V191-I221 HydrophobicContact CG1-CB 4.28Å; V191-I221 HydrophobicContact CG1-CG2 3.93Å; V191-I221 HydrophobicContact CG2-CG2 4.4Å; V191-I221 PolarHBondContact N-O 2.8Å; V191-A223 HydrophobicContact CG2-CB 3.57Å; V191-L233 HydrophobicContact CG2-CD1 4.41Å; V191-L269 HydrophobicContact CG1-CD1 4.35Å; V191-L269 HydrophobicContact CG1-CD2 3.64Å
192	L	98.2	Very high	95.7	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	126.8	179.2	-179.6	67.9	0	0	0	109.4	V152 N156 L157 L172 D190 L220 I221 F240	V152-L192 HydrophobicContact CG1-CD1 3.71Å; V152-L192 HydrophobicContact CG1-CG 4.35Å; N156-L192 HydrophobicContact CB-CD1 4.32Å; L157-L192 HydrophobicContact CD2-CB 4.16Å; L157-L192 HydrophobicContact CD2-CD1 3.66Å; L157-L192 HydrophobicContact CD2-CG 4.42Å; L157-L192 HydrophobicContact CG-CD1 4.04Å; L172-L192 HydrophobicContact CD1-CD1 3.63Å; L172-L192 HydrophobicContact CD1-CD2 3.78Å; L172-L192 HydrophobicContact CD1-CG 4.37Å; D190-L192 PolarHBondContact OD1-N 3.09Å; L192-L220 HydrophobicContact CB-CB 4.5Å; L192-L220 HydrophobicContact CD2-CB 4.13Å; L192-L220 HydrophobicContact CD2-CD1 4.12Å; L192-L220 HydrophobicContact CG-CB 4.17Å; L192-L220 HydrophobicContact CG-CD1 4.12Å; L192-L220 WeakPolarHBondContact O-CB 3.39Å; L192-L220 PolarHBondContact O-N 3.06Å; L192-I221 HydrophobicContact CB-CB 3.96Å; L192-I221 HydrophobicContact CB-CD1 4.25Å; L192-I221 HydrophobicContact CB-CG1 4.11Å; L192-I221 HydrophobicContact CD2-CD1 3.96Å; L192-I221 HydrophobicContact CD2-CG1 4.19Å; L192-I221 PolarHBondContact N-O 2.8Å; L192-I221 VanDerWaalsContact N-O 3.09Å; L192-I221 PolarHBondContact O-N 3.28Å; L192-I221 VanDerWaalsContact O-N 3.09Å; L192-F240 HydrophobicContact CD2-CE2 4.32Å
193	H	97.8	Very high	95.7	Very high	34 Å²	34	45.3 Å²	45.3	16%	0.157	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	159.9	173.3	54.5	-96.8	0	0	0	113	V152 N156 D190 T218	V152-H193 WeakPolarHBondContact CG1-O 3.35Å; N156-H193 VanDerWaalsContact CB-O 3.24Å; N156-H193 WeakPolarHBondContact CB-O 3.48Å; N156-H193 PolarHBondContact ND2-O 2.96Å; N156-H193 PolarHBondContact O-CE1 2.62Å; N156-H193 PolarHBondContact O-N 2.93Å; N156-H193 PolarHBondContact O-ND1 3.07Å; D190-H193 IonicContact OD1-ND1 3.39Å; D190-H193 IonicContact OD2-CE1 3.46Å; D190-H193 IonicContact OD2-CG 2.91Å; D190-H193 IonicContact OD2-ND1 3.82Å; D190-H193 PolarHBondContact OD2-ND1 2.81Å; H193-T218 CarbonylContact C-O 3.54Å; H193-T218 WeakPolarHBondContact CA-O 3.12Å; H193-T218 WeakPolarHBondContact CB-O 3.43Å
194	G	97.3	Very high	95.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.234	C	C	.	.			trans	-67.3	160.7	174.1	0	0	0	0	0	113.1	N156 S198 T218	N156-G194 VanDerWaalsContact ND2-C 3.35Å; N156-G194 PolarHBondContact ND2-O 2.88Å; G194-S198 WeakPolarHBondContact CA-OG 3.42Å; G194-T218 PolarHBondContact N-O 2.86Å
195	S	96.8	Very high	95.8	Very high	12 Å²	12	44 Å²	44	8%	0.084	23%	0.225	C	C	.	.			trans	-66.6	161.6	174.9	-69.7	0	0	0	0	111.4	N156 T197 S198 G215	N156-S195 PolarHBondContact ND2-N 3Å; S195-T197 PolarHBondContact O-N 3.13Å; S195-S198 PolarHBondContact N-OG 2.81Å; S195-S198 WeakPolarHBondContact O-CB 3.5Å; S195-S198 PolarHBondContact O-N 2.85Å; S195-S198 PolarHBondContact O-OG 3.47Å; S195-G215 CarbonylContact O-C 3.49Å; S195-G215 WeakPolarHBondContact O-CA 3.5Å
196	K	96.9	Very high	95.6	Very high	182 Å²	182	47.4 Å²	47.4	79%	0.791	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-20.2	179	-67.3	179.3	-179.2	-177.7	0	114.5	T216	K196-T216 HydrophobicContact CG-CG2 3.78Å
197	T	95.9	Very high	95.3	Very high	54 Å²	54	47.1 Å²	47.1	33%	0.331	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	-7.7	179.9	48.4	0	0	0	0	113.8	D135 F137 N138 S195	D135-T197 VanDerWaalsContact CG-OG1 3.27Å; D135-T197 WeakPolarHBondContact OD1-CB 3.23Å; D135-T197 PolarHBondContact OD1-OG1 2.99Å; D135-T197 PolarHBondContact OD2-OG1 2.92Å; F137-T197 HydrophobicContact CB-CG2 4.32Å; F137-T197 HydrophobicContact CD2-CG2 3.59Å; F137-T197 HydrophobicContact CE2-CG2 4.01Å; F137-T197 HydrophobicContact CG-CG2 3.97Å; N138-T197 PolarHBondContact ND2-OG1 3.28Å; N138-T197 VanDerWaalsContact ND2-OG1 3.13Å; S195-T197 PolarHBondContact O-N 3.13Å
198	S	96.7	Very high	94.9	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.014	26%	0.264	C	S	.	.			trans	-81.1	153.7	179.7	69.1	0	0	0	0	112	I134 G194 S195 G215	I134-S198 CarbonylContact O-C 3.52Å; I134-S198 VanDerWaalsContact O-CA 3.25Å; I134-S198 WeakPolarHBondContact O-CA 3.45Å; G194-S198 WeakPolarHBondContact CA-OG 3.42Å; S195-S198 PolarHBondContact N-OG 2.81Å; S195-S198 WeakPolarHBondContact O-CB 3.5Å; S195-S198 PolarHBondContact O-N 2.85Å; S195-S198 PolarHBondContact O-OG 3.47Å; S198-G215 WeakPolarHBondContact O-CA 3.46Å; S198-G215 PolarHBondContact O-N 2.57Å
199	Y	96.7	Very high	94.6	Very high	33 Å²	33	56.1 Å²	56.1	13%	0.129	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	157.1	172.4	62.6	-82.5	0	0	0	109.6	V133 I134 H136 I207 P211 T213	V133-Y199 WeakPolarHBondContact CA-O 3.4Å; I134-Y199 HydrophobicContact CB-CE1 4.18Å; I134-Y199 HydrophobicContact CB-CE2 4.23Å; I134-Y199 HydrophobicContact CD1-CE2 4.18Å; I134-Y199 HydrophobicContact CG2-CE1 4.02Å; I134-Y199 PolarHBondContact N-O 2.93Å; I134-Y199 PolarHBondContact O-N 3.21Å; H136-Y199 AromaticContact NE2-CE1 3.8Å; H136-Y199 AromaticContact NE2-CZ 3.78Å; H136-Y199 PolarHBondContact NE2-OH 3.27Å; Y199-I207 HydrophobicContact CE2-CD1 3.85Å; Y199-I207 WeakPolarHBondContact OH-CD1 3.26Å; Y199-P211 HydrophobicContact CD2-CB 4.18Å; Y199-P211 HydrophobicContact CD2-CG 3.74Å; Y199-P211 HydrophobicContact CG-CG 4.26Å; Y199-T213 WeakPolarHBondContact CA-O 3.29Å
200	S	96.1	Very high	94.3	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	122.4	178.4	-165.4	0	0	0	0	110.6	D127 L132 G178 P211 T213	D127-S200 WeakPolarHBondContact OD2-CB 3.48Å; D127-S200 PolarHBondContact OD2-OG 3.33Å; L132-S200 WeakPolarHBondContact O-CA 3.28Å; G178-S200 PolarHBondContact N-OG 2.76Å; S200-P211 WeakPolarHBondContact O-CB 3.47Å; S200-T213 VanDerWaalsContact CB-OG1 3.29Å; S200-T213 WeakPolarHBondContact CB-OG1 3.32Å; S200-T213 PolarHBondContact N-O 2.84Å
201	Y	96	Very high	94	Very high	30 Å²	30	62 Å²	62	12%	0.118	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	165.8	-179.7	-159.4	-104.6	0	0	0	111.5	T131 L132 P203 K205 T206 I207 I208 P211	T131-Y201 WeakPolarHBondContact CA-O 3.49Å; L132-Y201 PolarHBondContact N-O 3.18Å; L132-Y201 PolarHBondContact O-N 2.69Å; L132-Y201 VanDerWaalsContact O-O 3.06Å; Y201-P203 WeakPolarHBondContact O-CD 3.39Å; Y201-K205 HydrophobicContact CE1-CB 4.05Å; Y201-T206 PolarHBondContact OH-O 3.29Å; Y201-I207 HydrophobicContact CD1-CG1 3.75Å; Y201-I207 HydrophobicContact CE1-CB 4.26Å; Y201-I207 HydrophobicContact CE1-CG1 3.76Å; Y201-I207 HydrophobicContact CG-CG1 4.39Å; Y201-I208 PolarHBondContact OH-N 3.17Å; Y201-P211 HydrophobicContact CD2-CG 4.45Å
202	N	95.5	Very high	93.5	Very high	14 Å²	14	67 Å²	67	8%	0.075	33%	0.334	C	S	.	.			trans	-79.7	115.8	173.5	-177.1	-40.6	0	0	0	110.1	N130 T131 D204 K205	N130-N202 WeakPolarHBondContact CB-ND2 3.37Å; N130-N202 WeakPolarHBondContact O-CA 3.39Å; N130-N202 WeakPolarHBondContact O-CB 3.46Å; N130-N202 VanDerWaalsContact O-CG 3.23Å; N130-N202 PolarHBondContact O-ND2 3.1Å; T131-N202 HydrophobicContact CG2-CB 4.33Å; N202-D204 PolarHBondContact O-N 3.35Å; N202-D204 WeakPolarHBondContact OD1-CB 3.4Å; N202-D204 PolarHBondContact OD1-N 3.38Å; N202-K205 HydrophobicContact CB-CB 4.29Å; N202-K205 HydrophobicContact CB-CD 4.08Å; N202-K205 HydrophobicContact CB-CG 4.17Å; N202-K205 PolarHBondContact O-N 2.85Å
203	P	92.4	Very high	93.3	Very high	33 Å²	33	67.4 Å²	67.4	21%	0.214	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-19.9	-175.1	28.8	-36	0	0	0	114.1	L132 I134 L146 Y201 K205	L132-P203 HydrophobicContact CD1-CG 3.89Å; I134-P203 HydrophobicContact CD1-CB 4.07Å; L146-P203 HydrophobicContact CB-CB 4.31Å; L146-P203 HydrophobicContact CD1-CB 4.29Å; L146-P203 HydrophobicContact CD1-CG 4.37Å; L146-P203 HydrophobicContact CD2-CB 4.42Å; Y201-P203 WeakPolarHBondContact O-CD 3.39Å; P203-K205 VanDerWaalsContact C-N 3.35Å
204	D	91.7	Very high	93.2	Very high	138 Å²	138	67.8 Å²	67.8	74%	0.738	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-15	178.9	-61.4	-40.1	0	0	0	112.6	N202	N202-D204 PolarHBondContact O-N 3.35Å; N202-D204 WeakPolarHBondContact OD1-CB 3.4Å; N202-D204 PolarHBondContact OD1-N 3.38Å
205	K	91.7	Very high	93.1	Very high	122 Å²	122	68.2 Å²	68.2	53%	0.53	35%	0.346	S	S	.	.	S	Bend	trans	-98.4	142.7	179.6	-66	-177.3	-175.3	173.4	0	110	Y201 N202 P203	Y201-K205 HydrophobicContact CE1-CB 4.05Å; N202-K205 HydrophobicContact CB-CB 4.29Å; N202-K205 HydrophobicContact CB-CD 4.08Å; N202-K205 HydrophobicContact CB-CG 4.17Å; N202-K205 PolarHBondContact O-N 2.85Å; P203-K205 VanDerWaalsContact C-N 3.35Å
206	T	89.9	Confident	93	Very high	108 Å²	108	70.6 Å²	70.6	66%	0.663	36%	0.36	S	S	*	.			trans	-65	139.5	166.8	50.8	0	0	0	0	109.7	Y201 I208	Y201-T206 PolarHBondContact OH-O 3.29Å; T206-I208 PolarHBondContact O-N 3.24Å
207	I	86.9	Confident	92.9	Very high	96 Å²	96	66.5 Å²	66.5	49%	0.492	35%	0.346	S	S	.	.			trans	-72.5	101.4	177.6	-57.1	166.4	0	0	0	108.1	Y199 Y201	Y199-I207 HydrophobicContact CE2-CD1 3.85Å; Y199-I207 WeakPolarHBondContact OH-CD1 3.26Å; Y201-I207 HydrophobicContact CD1-CG1 3.75Å; Y201-I207 HydrophobicContact CE1-CB 4.26Å; Y201-I207 HydrophobicContact CE1-CG1 3.76Å; Y201-I207 HydrophobicContact CG-CG1 4.39Å
208	I	88.8	Confident	93	Very high	135 Å²	135	63.9 Å²	63.9	69%	0.692	33%	0.33	S	S	*	.			trans	-107.3	-45.6	177.1	-59.5	169.6	0	0	0	108.7	Y201 T206	Y201-I208 PolarHBondContact OH-N 3.17Å; T206-I208 PolarHBondContact O-N 3.24Å
209	D	89.4	Confident	93	Very high	115 Å²	115	65 Å²	65	62%	0.615	34%	0.335	S	S	*	.	S	Bend	trans	-94.7	160.2	-179	-58.7	-50.5	0	0	0	111.4
210	Y	90.1	Very high	93.1	Very high	178 Å²	178	63.5 Å²	63.5	70%	0.698	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-69.9	130.6	175.1	-169.1	-97.8	0	0	0	109.8	V214	Y210-V214 HydrophobicContact CE1-CG1 3.94Å; Y210-V214 HydrophobicContact CE1-CG2 4.24Å; Y210-V214 VanDerWaalsContact OH-CG2 3.23Å; Y210-V214 WeakPolarHBondContact OH-CG2 3.3Å
211	P	91.4	Very high	93.2	Very high	15 Å²	15	63.5 Å²	63.5	10%	0.097	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-55.2	141.3	176.4	-28	36.3	0	0	0	112.8	Y199 S200 Y201 T213 V214	Y199-P211 HydrophobicContact CD2-CB 4.18Å; Y199-P211 HydrophobicContact CD2-CG 3.74Å; Y199-P211 HydrophobicContact CG-CG 4.26Å; S200-P211 WeakPolarHBondContact O-CB 3.47Å; Y201-P211 HydrophobicContact CD2-CG 4.45Å; P211-T213 VanDerWaalsContact C-N 3.29Å; P211-T213 PolarHBondContact O-N 3.1Å; P211-V214 HydrophobicContact CB-CG1 3.89Å; P211-V214 HydrophobicContact CG-CG1 4.29Å
212	N	87.4	Confident	93.3	Very high	107 Å²	107	62 Å²	62	57%	0.572	32%	0.324	S	S	*	.	S	Bend	trans	-61.8	-37.6	-178.8	-72.8	-29.1	0	0	0	112.3	D127	D127-N212 WeakPolarHBondContact OD1-CB 3.4Å; D127-N212 PolarHBondContact OD1-ND2 3.17Å
213	T	93.2	Very high	93.5	Very high	8 Å²	8	61.4 Å²	61.4	5%	0.049	32%	0.32	C	S	.	.	S	Bend	trans	-128.2	139.2	173.4	68.2	0	0	0	0	111.2	Y199 S200 P211 T218	Y199-T213 WeakPolarHBondContact CA-O 3.29Å; S200-T213 VanDerWaalsContact CB-OG1 3.29Å; S200-T213 WeakPolarHBondContact CB-OG1 3.32Å; S200-T213 PolarHBondContact N-O 2.84Å; P211-T213 VanDerWaalsContact C-N 3.29Å; P211-T213 PolarHBondContact O-N 3.1Å; T213-T218 VanDerWaalsContact CB-OG1 3.28Å; T213-T218 WeakPolarHBondContact CB-OG1 3.17Å; T213-T218 PolarHBondContact O-OG1 3.47Å; T213-T218 WeakPolarHBondContact OG1-CG2 3.29Å; T213-T218 PolarHBondContact OG1-OG1 3.07Å
214	V	96	Very high	93.7	Very high	41 Å²	41	60.5 Å²	60.5	25%	0.248	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-135.6	146.3	-179.9	-64.9	0	0	0	0	112	Y210 P211 T216 N217 T218	Y210-V214 HydrophobicContact CE1-CG1 3.94Å; Y210-V214 HydrophobicContact CE1-CG2 4.24Å; Y210-V214 VanDerWaalsContact OH-CG2 3.23Å; Y210-V214 WeakPolarHBondContact OH-CG2 3.3Å; P211-V214 HydrophobicContact CB-CG1 3.89Å; P211-V214 HydrophobicContact CG-CG1 4.29Å; V214-T216 PolarHBondContact O-N 3.3Å; V214-N217 WeakPolarHBondContact O-CB 3.46Å; V214-N217 PolarHBondContact O-N 2.77Å; V214-N217 VanDerWaalsContact O-N 3.17Å; V214-T218 PolarHBondContact N-OG1 2.89Å
215	G	95.6	Very high	94	Very high	10 Å²	10	54.2 Å²	54.2	10%	0.103	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	55.3	-134.7	175.6	0	0	0	0	0	112.9	S195 S198 N217 T218	S195-G215 CarbonylContact O-C 3.49Å; S195-G215 WeakPolarHBondContact O-CA 3.5Å; S198-G215 WeakPolarHBondContact O-CA 3.46Å; S198-G215 PolarHBondContact O-N 2.57Å; G215-N217 PolarHBondContact O-N 2.84Å; G215-T218 WeakPolarHBondContact O-CB 3.49Å; G215-T218 PolarHBondContact O-N 2.88Å; G215-T218 VanDerWaalsContact O-N 3.16Å
216	T	95.1	Very high	94.2	Very high	62 Å²	62	49 Å²	49	38%	0.38	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-71.6	-7.7	-179.3	54	0	0	0	0	113.9	K196 V214 T218	K196-T216 HydrophobicContact CG-CG2 3.78Å; V214-T216 PolarHBondContact O-N 3.3Å; T216-T218 VanDerWaalsContact C-N 3.3Å
217	N	94.9	Very high	94.4	Very high	95 Å²	95	54.1 Å²	54.1	51%	0.508	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-83.3	-11	173.3	-64.9	-13.4	0	0	0	112	V214 G215 Q219	V214-N217 WeakPolarHBondContact O-CB 3.46Å; V214-N217 PolarHBondContact O-N 2.77Å; V214-N217 VanDerWaalsContact O-N 3.17Å; G215-N217 PolarHBondContact O-N 2.84Å; N217-Q219 PolarHBondContact O-N 3.03Å
218	T	97.3	Very high	94.8	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.259	C	S	.	.			trans	-79.1	99.9	170.6	-55.3	0	0	0	0	109	V133 H193 G194 T213 V214 G215 T216 L220	V133-T218 HydrophobicContact CG1-CG2 4.04Å; V133-T218 HydrophobicContact CG2-CG2 3.84Å; H193-T218 CarbonylContact C-O 3.54Å; H193-T218 WeakPolarHBondContact CA-O 3.12Å; H193-T218 WeakPolarHBondContact CB-O 3.43Å; G194-T218 PolarHBondContact N-O 2.86Å; T213-T218 VanDerWaalsContact CB-OG1 3.28Å; T213-T218 WeakPolarHBondContact CB-OG1 3.17Å; T213-T218 PolarHBondContact O-OG1 3.47Å; T213-T218 WeakPolarHBondContact OG1-CG2 3.29Å; T213-T218 PolarHBondContact OG1-OG1 3.07Å; V214-T218 PolarHBondContact N-OG1 2.89Å; G215-T218 WeakPolarHBondContact O-CB 3.49Å; G215-T218 PolarHBondContact O-N 2.88Å; G215-T218 VanDerWaalsContact O-N 3.16Å; T216-T218 VanDerWaalsContact C-N 3.3Å; T218-L220 HydrophobicContact CG2-CD2 4.2Å
219	Q	97.8	Very high	95.1	Very high	26 Å²	26	48.1 Å²	48.1	12%	0.121	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	149.1	173	-59.9	-179.3	6.4	0	0	109.8	I179 D190 N217 T222	I179-Q219 HydrophobicContact CB-CB 3.99Å; I179-Q219 WeakPolarHBondContact CB-O 3.48Å; I179-Q219 HydrophobicContact CG2-CB 4.28Å; I179-Q219 PolarHBondContact N-O 2.74Å; I179-Q219 WeakPolarHBondContact O-CA 3.24Å; I179-Q219 WeakPolarHBondContact O-CB 3.39Å; I179-Q219 PolarHBondContact O-N 3.34Å; D190-Q219 HydrophobicContact CB-CG 4.49Å; N217-Q219 PolarHBondContact O-N 3.03Å; Q219-T222 VanDerWaalsContact OE1-CG2 3.26Å; Q219-T222 PolarHBondContact OE1-OG1 3.36Å
220	L	98.4	Very high	95.5	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	-36.8	-179.4	-52.3	-176.3	0	0	0	110.2	V133 I150 V152 Y174 L192 T218 G236	V133-L220 HydrophobicContact CB-CD2 4.38Å; V133-L220 HydrophobicContact CG1-CD2 4.2Å; V133-L220 HydrophobicContact CG2-CD2 3.8Å; I150-L220 HydrophobicContact CD1-CD1 4.4Å; V152-L220 HydrophobicContact CG1-CD1 4.29Å; V152-L220 HydrophobicContact CG2-CD1 3.56Å; Y174-L220 HydrophobicContact CD1-CD1 4.17Å; Y174-L220 HydrophobicContact CD1-CD2 3.94Å; Y174-L220 HydrophobicContact CD2-CB 3.96Å; Y174-L220 HydrophobicContact CD2-CD1 4.1Å; Y174-L220 HydrophobicContact CD2-CG 4.45Å; Y174-L220 HydrophobicContact CE1-CB 4.4Å; Y174-L220 HydrophobicContact CE1-CD2 3.6Å; Y174-L220 HydrophobicContact CE1-CG 4.38Å; Y174-L220 HydrophobicContact CE2-CB 3.58Å; Y174-L220 HydrophobicContact CE2-CD1 4.47Å; Y174-L220 HydrophobicContact CE2-CD2 4.36Å; Y174-L220 HydrophobicContact CE2-CG 4.33Å; Y174-L220 HydrophobicContact CG-CD1 3.92Å; Y174-L220 HydrophobicContact CG-CD2 4.43Å; L192-L220 HydrophobicContact CB-CB 4.5Å; L192-L220 HydrophobicContact CD2-CB 4.13Å; L192-L220 HydrophobicContact CD2-CD1 4.12Å; L192-L220 HydrophobicContact CG-CB 4.17Å; L192-L220 HydrophobicContact CG-CD1 4.12Å; L192-L220 WeakPolarHBondContact O-CB 3.39Å; L192-L220 PolarHBondContact O-N 3.06Å; T218-L220 HydrophobicContact CG2-CD2 4.2Å; L220-G236 PolarHBondContact O-N 2.82Å
221	I	98.5	Very high	95.9	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	126.1	172.2	-53.9	177.4	0	0	0	108	V191 L192 L233 F234 I235 F240 L269	V191-I221 HydrophobicContact CB-CB 4.11Å; V191-I221 HydrophobicContact CB-CG2 3.85Å; V191-I221 WeakPolarHBondContact CB-O 3.34Å; V191-I221 HydrophobicContact CG1-CB 4.28Å; V191-I221 HydrophobicContact CG1-CG2 3.93Å; V191-I221 HydrophobicContact CG2-CG2 4.4Å; V191-I221 PolarHBondContact N-O 2.8Å; L192-I221 HydrophobicContact CB-CB 3.96Å; L192-I221 HydrophobicContact CB-CD1 4.25Å; L192-I221 HydrophobicContact CB-CG1 4.11Å; L192-I221 HydrophobicContact CD2-CD1 3.96Å; L192-I221 HydrophobicContact CD2-CG1 4.19Å; L192-I221 PolarHBondContact N-O 2.8Å; L192-I221 VanDerWaalsContact N-O 3.09Å; L192-I221 PolarHBondContact O-N 3.28Å; L192-I221 VanDerWaalsContact O-N 3.09Å; I221-L233 HydrophobicContact CG2-CD1 3.51Å; I221-L233 HydrophobicContact CG2-CG 4.2Å; I221-F234 WeakPolarHBondContact CA-O 3.32Å; I221-I235 HydrophobicContact CG1-CG1 4.39Å; I221-I235 HydrophobicContact CG1-CG2 4.27Å; I221-I235 HydrophobicContact CG2-CG1 4.12Å; I221-F240 HydrophobicContact CD1-CD1 4.29Å; I221-F240 HydrophobicContact CD1-CE1 3.75Å; I221-F240 HydrophobicContact CD1-CE2 4.34Å; I221-F240 HydrophobicContact CD1-CZ 3.79Å; I221-L269 HydrophobicContact CD1-CD1 4.06Å; I221-L269 HydrophobicContact CG2-CD1 4.4Å
222	T	98.4	Very high	96.2	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	135.2	178.9	-50.8	0	0	0	0	108.5	V124 I179 A181 L188 Q219 F234	V124-T222 HydrophobicContact CG2-CG2 3.97Å; I179-T222 WeakPolarHBondContact CG2-OG1 3.38Å; A181-T222 HydrophobicContact CB-CG2 4.1Å; L188-T222 HydrophobicContact CD2-CG2 4.08Å; Q219-T222 VanDerWaalsContact OE1-CG2 3.26Å; Q219-T222 PolarHBondContact OE1-OG1 3.36Å; T222-F234 PolarHBondContact N-O 3.01Å; T222-F234 PolarHBondContact O-N 2.7Å
223	A	98.1	Very high	96.7	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	152.9	173.7	0	0	0	0	0	111.3	L188 I189 V191 A232 L233 W272	L188-A223 CarbonylContact C-O 3.52Å; L188-A223 WeakPolarHBondContact CA-O 3.17Å; I189-A223 HydrophobicContact CB-CB 4.34Å; I189-A223 PolarHBondContact N-O 2.7Å; I189-A223 PolarHBondContact O-N 2.92Å; V191-A223 HydrophobicContact CG2-CB 3.57Å; A223-A232 CarbonylContact C-O 3.57Å; A223-A232 VanDerWaalsContact CA-O 3.23Å; A223-A232 WeakPolarHBondContact CA-O 3.37Å; A223-L233 HydrophobicContact CB-CD1 4.01Å; A223-W272 HydrophobicContact CB-CH2 3.65Å; A223-W272 HydrophobicContact CB-CZ3 3.49Å; A223-W272 VanDerWaalsContact CB-CZ3 3.49Å
224	L	97.5	Very high	97	Very high	14 Å²	14	28.1 Å²	28.1	7%	0.073	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	130.5	169.5	-179.1	81.8	0	0	0	107.8	C122 L187 L188 R231 A232	C122-L224 HydrophobicContact CB-CD2 4.13Å; L187-L224 HydrophobicContact CB-CD1 3.64Å; L188-L224 HydrophobicContact CD2-CB 3.99Å; L188-L224 HydrophobicContact CD2-CD1 3.6Å; L188-L224 HydrophobicContact CD2-CG 4.42Å; L188-L224 HydrophobicContact CG-CD1 4.01Å; L224-R231 CarbonylContact O-C 3.56Å; L224-R231 WeakPolarHBondContact O-CA 3.38Å; L224-A232 HydrophobicContact CB-CB 4.19Å; L224-A232 PolarHBondContact N-O 3.49Å; L224-A232 PolarHBondContact O-N 3.08Å
225	Q	97.1	Very high	97.1	Very high	7 Å²	7	26.3 Å²	26.3	3%	0.033	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	108.6	163.5	-173.7	171.8	-45.8	0	0	109	L187 N229 R231 Y374	L187-Q225 WeakPolarHBondContact CB-O 3.4Å; L187-Q225 WeakPolarHBondContact CD2-O 3.34Å; L187-Q225 PolarHBondContact O-N 2.8Å; Q225-N229 PolarHBondContact NE2-OD1 3.3Å; Q225-R231 HydrophobicContact CG-CG 4.36Å; Q225-Y374 PolarHBondContact NE2-O 2.83Å; Q225-Y374 PolarHBondContact OE1-O 2.82Å
226	A	95.9	Very high	97.2	Very high	11 Å²	11	25.9 Å²	25.9	9%	0.091	13%	0.125	C	C	.	.			trans	-69.8	163.4	-179.7	0	0	0	0	0	111.7	I97 N228 N229 A230	I97-A226 HydrophobicContact CG2-CB 4.26Å; A226-N228 WeakPolarHBondContact CB-OD1 3.42Å; A226-N228 PolarHBondContact O-N 3.16Å; A226-N229 WeakPolarHBondContact O-CA 3.38Å; A226-N229 PolarHBondContact O-N 3.13Å; A226-A230 HydrophobicContact CB-CB 4.21Å; A226-A230 PolarHBondContact N-O 2.82Å
227	R	94.5	Very high	97.4	Very high	216 Å²	216	23 Å²	23	82%	0.815	11%	0.107	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-24.5	-177.5	-65.7	179.6	179.2	168.9	1.7	113.6	L187 N229	L187-R227 HydrophobicContact CD1-CG 4.25Å; L187-R227 HydrophobicContact CD2-CG 4.39Å; R227-N229 VanDerWaalsContact C-N 3.26Å
228	N	94.9	Very high	97.5	Very high	62 Å²	62	20 Å²	20	33%	0.332	9%	0.091	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	4.5	173.2	66.4	-5.9	0	0	0	112.9	I97 D98 G100 A226 A230	I97-N228 PolarHBondContact O-ND2 2.81Å; D98-N228 PolarHBondContact O-ND2 3.01Å; G100-N228 PolarHBondContact N-ND2 2.81Å; G100-N228 VanDerWaalsContact N-ND2 3.19Å; A226-N228 WeakPolarHBondContact CB-OD1 3.42Å; A226-N228 PolarHBondContact O-N 3.16Å; N228-A230 VanDerWaalsContact C-N 3.31Å; N228-A230 PolarHBondContact O-N 2.77Å; N228-A230 VanDerWaalsContact OD1-CB 3.25Å; N228-A230 WeakPolarHBondContact OD1-CB 3.23Å; N228-A230 PolarHBondContact OD1-N 2.88Å
229	N	96.1	Very high	97.5	Very high	43 Å²	43	22.9 Å²	22.9	23%	0.23	11%	0.107	C	C	.	.	S	Bend	trans	70.6	8.4	-173.8	-62.6	-57.9	0	0	0	117	Q225 A226 R227 T375 H376	Q225-N229 PolarHBondContact NE2-OD1 3.3Å; A226-N229 WeakPolarHBondContact O-CA 3.38Å; A226-N229 PolarHBondContact O-N 3.13Å; R227-N229 VanDerWaalsContact C-N 3.26Å; N229-T375 HydrophobicContact CB-CG2 3.93Å; N229-T375 WeakPolarHBondContact OD1-CA 3.27Å; N229-H376 PolarHBondContact ND2-O 2.84Å; N229-H376 WeakPolarHBondContact OD1-CB 3.23Å; N229-H376 PolarHBondContact OD1-N 2.93Å
230	A	96.9	Very high	97.6	Very high	2 Å²	2	21.7 Å²	21.7	2%	0.017	10%	0.101	C	C	.	.			trans	-61.5	147.8	165.7	0	0	0	0	0	110.3	I97 A226 N228	I97-A230 HydrophobicContact CG2-CB 4.16Å; I97-A230 VanDerWaalsContact O-CB 3.24Å; I97-A230 WeakPolarHBondContact O-CB 3.27Å; A226-A230 HydrophobicContact CB-CB 4.21Å; A226-A230 PolarHBondContact N-O 2.82Å; N228-A230 VanDerWaalsContact C-N 3.31Å; N228-A230 PolarHBondContact O-N 2.77Å; N228-A230 VanDerWaalsContact OD1-CB 3.25Å; N228-A230 WeakPolarHBondContact OD1-CB 3.23Å; N228-A230 PolarHBondContact OD1-N 2.88Å
231	R	97.9	Very high	97.6	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	131.1	-178.2	-65.9	173.7	176.2	157	0.5	110.3	N102 L103 L224 Q225 W272 V273 R277 G278 G373	N102-R231 CarbonylContact C-O 3.59Å; N102-R231 VanDerWaalsContact CA-O 3.29Å; N102-R231 WeakPolarHBondContact CA-O 3.23Å; N102-R231 PolarHBondContact OD1-N 3.28Å; N102-R231 VanDerWaalsContact OD1-N 3.08Å; L103-R231 PolarHBondContact N-O 2.62Å; L224-R231 CarbonylContact O-C 3.56Å; L224-R231 WeakPolarHBondContact O-CA 3.38Å; Q225-R231 HydrophobicContact CG-CG 4.36Å; R231-W272 VanDerWaalsContact CD-O 3.27Å; R231-W272 WeakPolarHBondContact CD-O 3.07Å; R231-W272 HydrophobicContact CG-CH2 4.43Å; R231-W272 HydrophobicContact CG-CZ2 4.4Å; R231-W272 VanDerWaalsContact CZ-NE1 3.32Å; R231-W272 PolarHBondContact NH1-O 3.03Å; R231-V273 HydrophobicContact CB-CG2 3.88Å; R231-R277 PolarHBondContact NH1-O 3.05Å; R231-G278 PolarHBondContact NH2-O 3.02Å; R231-G373 PolarHBondContact NH2-O 3.09Å
232	A	98.3	Very high	97.5	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	141	168.2	0	0	0	0	0	109.9	L103 A223 L224 F234	L103-A232 HydrophobicContact CB-CB 3.9Å; L103-A232 HydrophobicContact CD2-CB 4.21Å; L103-A232 HydrophobicContact CG-CB 4.41Å; L103-A232 CarbonylContact O-C 3.58Å; L103-A232 VanDerWaalsContact O-CA 3.24Å; L103-A232 WeakPolarHBondContact O-CA 3.49Å; A223-A232 CarbonylContact C-O 3.57Å; A223-A232 VanDerWaalsContact CA-O 3.23Å; A223-A232 WeakPolarHBondContact CA-O 3.37Å; L224-A232 HydrophobicContact CB-CB 4.19Å; L224-A232 PolarHBondContact N-O 3.49Å; L224-A232 PolarHBondContact O-N 3.08Å; A232-F234 HydrophobicContact CB-CE2 3.73Å; A232-F234 HydrophobicContact CB-CZ 4.14Å
233	L	98.6	Very high	97.5	Very high	2 Å²	2	23.2 Å²	23.2	1%	0.01	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	121.7	177	-175.4	71.4	0	0	0	108.9	L103 V104 V105 V191 I221 A223 I235 L269 V273	L103-L233 PolarHBondContact O-N 2.89Å; V104-L233 CarbonylContact C-O 3.3Å; V104-L233 WeakPolarHBondContact CA-O 3.39Å; V104-L233 HydrophobicContact CG2-CB 4.38Å; V105-L233 PolarHBondContact N-O 3.03Å; V191-L233 HydrophobicContact CG2-CD1 4.41Å; I221-L233 HydrophobicContact CG2-CD1 3.51Å; I221-L233 HydrophobicContact CG2-CG 4.2Å; A223-L233 HydrophobicContact CB-CD1 4.01Å; L233-I235 HydrophobicContact CD2-CD1 3.95Å; L233-I235 HydrophobicContact CD2-CG1 4.25Å; L233-I235 HydrophobicContact CG-CD1 4.35Å; L233-I235 HydrophobicContact CG-CG1 4.12Å; L233-L269 HydrophobicContact CD2-CB 4.04Å; L233-L269 HydrophobicContact CD2-CD1 4.28Å; L233-V273 HydrophobicContact CB-CB 4.38Å; L233-V273 HydrophobicContact CB-CG2 3.83Å
234	F	98.6	Very high	97.5	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	123.4	178.5	-60.4	-90.1	0	0	0	108.9	V105 C122 V124 F126 I179 I221 T222 A232	V105-F234 HydrophobicContact CB-CD1 3.87Å; V105-F234 HydrophobicContact CB-CE1 4.16Å; V105-F234 HydrophobicContact CG1-CD1 4.46Å; V105-F234 HydrophobicContact CG2-CD1 4.19Å; V105-F234 HydrophobicContact CG2-CE1 3.97Å; V105-F234 WeakPolarHBondContact O-CA 3.45Å; C122-F234 HydrophobicContact CB-CE2 3.85Å; C122-F234 HydrophobicContact CB-CZ 3.55Å; V124-F234 HydrophobicContact CB-CD2 4.44Å; V124-F234 HydrophobicContact CB-CG 4.41Å; V124-F234 HydrophobicContact CG1-CB 4.13Å; V124-F234 HydrophobicContact CG1-CD1 4.37Å; V124-F234 HydrophobicContact CG1-CG 4.09Å; V124-F234 HydrophobicContact CG2-CD2 3.79Å; V124-F234 HydrophobicContact CG2-CE2 4.05Å; V124-F234 HydrophobicContact CG2-CG 4.2Å; F126-F234 HydrophobicContact CZ-CB 4.39Å; F126-F234 AromaticContact CZ-CD1 4Å; F126-F234 HydrophobicContact CZ-CD1 4Å; I179-F234 HydrophobicContact CD1-CB 4.44Å; I221-F234 WeakPolarHBondContact CA-O 3.32Å; T222-F234 PolarHBondContact N-O 3.01Å; T222-F234 PolarHBondContact O-N 2.7Å; A232-F234 HydrophobicContact CB-CE2 3.73Å; A232-F234 HydrophobicContact CB-CZ 4.14Å
235	I	98.7	Very high	97.4	Very high	3 Å²	3	27.4 Å²	27.4	2%	0.015	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	121.2	-177.4	-57	169.8	0	0	0	107.3	V104 V105 V106 A107 I221 L233 S237 F240 L241	V104-I235 HydrophobicContact CG1-CD1 4.29Å; V105-I235 PolarHBondContact O-N 3.13Å; V106-I235 CarbonylContact C-O 3.54Å; V106-I235 WeakPolarHBondContact CA-O 3.4Å; V106-I235 HydrophobicContact CG2-CB 4.41Å; V106-I235 HydrophobicContact CG2-CD1 4.5Å; A107-I235 PolarHBondContact N-O 3.01Å; I221-I235 HydrophobicContact CG1-CG1 4.39Å; I221-I235 HydrophobicContact CG1-CG2 4.27Å; I221-I235 HydrophobicContact CG2-CG1 4.12Å; L233-I235 HydrophobicContact CD2-CD1 3.95Å; L233-I235 HydrophobicContact CD2-CG1 4.25Å; L233-I235 HydrophobicContact CG-CD1 4.35Å; L233-I235 HydrophobicContact CG-CG1 4.12Å; I235-S237 WeakPolarHBondContact CG2-O 3.27Å; I235-S237 PolarHBondContact O-N 2.83Å; I235-S237 VanDerWaalsContact O-N 3.1Å; I235-F240 HydrophobicContact CG2-CB 4.28Å; I235-F240 HydrophobicContact CG2-CD1 4.31Å; I235-F240 HydrophobicContact CG2-CG 4.45Å; I235-L241 HydrophobicContact CD1-CD1 4.01Å; I235-L241 HydrophobicContact CD1-CD2 4.09Å; I235-L241 HydrophobicContact CD1-CG 4.33Å
236	G	98.2	Very high	97.4	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.137	C	C	.	.	S	Bend	trans	-77.1	12.1	-178	0	0	0	0	0	114.7	A107 Y174 G176 I177 L220	A107-G236 CarbonylContact O-C 3.53Å; A107-G236 VanDerWaalsContact O-C 3.3Å; Y174-G236 WeakPolarHBondContact OH-CA 3.42Å; Y174-G236 PolarHBondContact OH-O 2.84Å; G176-G236 CarbonylContact C-O 3.52Å; G176-G236 VanDerWaalsContact CA-O 3.29Å; G176-G236 WeakPolarHBondContact CA-O 3.41Å; I177-G236 WeakPolarHBondContact CG2-O 3.45Å; I177-G236 PolarHBondContact N-O 3.28Å; L220-G236 PolarHBondContact O-N 2.82Å
237	S	98.2	Very high	97.4	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.007	17%	0.166	C	C	.	.			trans	-149.3	120	-172.8	173.7	0	0	0	0	111.6	A107 R175 I235 D239 F240	A107-S237 PolarHBondContact O-N 2.95Å; R175-S237 WeakPolarHBondContact O-CB 3.33Å; R175-S237 PolarHBondContact O-OG 2.74Å; I235-S237 WeakPolarHBondContact CG2-O 3.27Å; I235-S237 PolarHBondContact O-N 2.83Å; I235-S237 VanDerWaalsContact O-N 3.1Å; S237-D239 PolarHBondContact OG-N 3.34Å; S237-F240 WeakPolarHBondContact O-CB 3.14Å; S237-F240 PolarHBondContact OG-N 3.16Å
238	L	98	Very high	97.3	Very high	32 Å²	32	23.9 Å²	23.9	17%	0.168	13%	0.13	C	C	.	.	S	Bend	trans	-68.8	-42.6	168	-174.2	63.1	0	0	0	111.3	I33 H37 L77 P79 V106 A107 F240 L241	I33-L238 HydrophobicContact CD1-CD2 4.1Å; H37-L238 WeakPolarHBondContact NE2-CD1 3.41Å; H37-L238 WeakPolarHBondContact NE2-CG 3.43Å; H37-L238 PolarHBondContact NE2-O 3.31Å; H37-L238 VanDerWaalsContact NE2-O 3.1Å; L77-L238 HydrophobicContact CB-CD1 4.28Å; L77-L238 HydrophobicContact CD2-CD1 4.48Å; P79-L238 HydrophobicContact CG-CD2 4.17Å; V106-L238 VanDerWaalsContact CG1-CA 3.42Å; V106-L238 HydrophobicContact CG1-CB 3.76Å; V106-L238 HydrophobicContact CG1-CD1 3.83Å; V106-L238 HydrophobicContact CG1-CG 4.42Å; A107-L238 PolarHBondContact O-N 2.96Å; L238-F240 PolarHBondContact O-N 2.72Å; L238-F240 VanDerWaalsContact O-N 3.09Å; L238-L241 PolarHBondContact O-N 2.92Å
239	D	97.9	Very high	97.2	Very high	62 Å²	62	23 Å²	23	33%	0.332	13%	0.126	S	C	.	.	G	3₁₀ helix	trans	-54.4	-33.5	177.7	-69.3	-16.4	0	0	0	112.7	S237 L241 S242 F245	S237-D239 PolarHBondContact OG-N 3.34Å; D239-L241 PolarHBondContact O-N 3.49Å; D239-L241 VanDerWaalsContact O-N 3.1Å; D239-S242 VanDerWaalsContact O-CB 3.29Å; D239-S242 WeakPolarHBondContact O-CB 3.41Å; D239-S242 PolarHBondContact O-N 3.3Å; D239-S242 PolarHBondContact O-OG 3Å; D239-F245 HydrophobicContact CB-CD1 4.25Å; D239-F245 HydrophobicContact CB-CD2 4.29Å; D239-F245 HydrophobicContact CB-CE1 3.85Å; D239-F245 HydrophobicContact CB-CE2 3.89Å; D239-F245 HydrophobicContact CB-CG 4.47Å; D239-F245 HydrophobicContact CB-CZ 3.65Å; D239-F245 VanDerWaalsContact O-CB 3.25Å; D239-F245 WeakPolarHBondContact O-CB 3.35Å; D239-F245 WeakPolarHBondContact O-CD2 3.46Å; D239-F245 WeakPolarHBondContact O-CG 3.32Å
240	F	98.3	Very high	96.8	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-53.8	-31.2	177.6	-170.1	-91.1	0	0	0	113.6	L172 L173 Y174 L192 I221 I235 S237 L238 F246 N262 L265	L172-F240 HydrophobicContact CB-CE2 4.47Å; L172-F240 HydrophobicContact CD2-CZ 4.46Å; L173-F240 WeakPolarHBondContact O-CD2 3.38Å; Y174-F240 AromaticContact CD2-CD2 3.95Å; Y174-F240 HydrophobicContact CD2-CD2 3.95Å; L192-F240 HydrophobicContact CD2-CE2 4.32Å; I221-F240 HydrophobicContact CD1-CD1 4.29Å; I221-F240 HydrophobicContact CD1-CE1 3.75Å; I221-F240 HydrophobicContact CD1-CE2 4.34Å; I221-F240 HydrophobicContact CD1-CZ 3.79Å; I235-F240 HydrophobicContact CG2-CB 4.28Å; I235-F240 HydrophobicContact CG2-CD1 4.31Å; I235-F240 HydrophobicContact CG2-CG 4.45Å; S237-F240 WeakPolarHBondContact O-CB 3.14Å; S237-F240 PolarHBondContact OG-N 3.16Å; L238-F240 PolarHBondContact O-N 2.72Å; L238-F240 VanDerWaalsContact O-N 3.09Å; F240-F246 VanDerWaalsContact O-CE1 3.3Å; F240-F246 WeakPolarHBondContact O-CE1 3.34Å; F240-N262 VanDerWaalsContact CD2-ND2 3.3Å; F240-N262 WeakPolarHBondContact CD2-ND2 3.29Å; F240-N262 WeakPolarHBondContact CE2-ND2 3.28Å; F240-N262 HydrophobicContact CZ-CB 4.41Å; F240-L265 HydrophobicContact CZ-CD2 4.02Å
241	L	98.3	Very high	96.3	Very high	1 Å²	1	24.4 Å²	24.4	1%	0.005	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-100.1	1.1	-179.6	-57.7	-179	0	0	0	113.6	H37 F40 L77 V106 I235 L238 D239 F246 T266	H37-L241 VanDerWaalsContact CD2-C 3.46Å; H37-L241 PolarHBondContact CD2-O 3.17Å; F40-L241 HydrophobicContact CD2-CB 4.3Å; F40-L241 HydrophobicContact CD2-CD1 4.21Å; F40-L241 HydrophobicContact CD2-CD2 4.02Å; F40-L241 HydrophobicContact CD2-CG 4.42Å; F40-L241 HydrophobicContact CE2-CD1 3.92Å; F40-L241 HydrophobicContact CE2-CD2 4.08Å; F40-L241 HydrophobicContact CG-CB 4.46Å; F40-L241 HydrophobicContact CZ-CD1 4.19Å; L77-L241 HydrophobicContact CD2-CD1 4.1Å; V106-L241 HydrophobicContact CG2-CD1 3.62Å; I235-L241 HydrophobicContact CD1-CD1 4.01Å; I235-L241 HydrophobicContact CD1-CD2 4.09Å; I235-L241 HydrophobicContact CD1-CG 4.33Å; L238-L241 PolarHBondContact O-N 2.92Å; D239-L241 PolarHBondContact O-N 3.49Å; D239-L241 VanDerWaalsContact O-N 3.1Å; L241-F246 WeakPolarHBondContact O-CE2 3.47Å; L241-F246 WeakPolarHBondContact O-CZ 3.23Å; L241-T266 HydrophobicContact CD2-CG2 3.52Å
242	S	98.1	Very high	95.3	Very high	8 Å²	8	25.4 Å²	25.4	6%	0.056	14%	0.137	C	C	.	.	S	Bend	trans	-76.2	152.8	-175.1	72.6	0	0	0	0	112.6	D239 S244 F245 F246	D239-S242 VanDerWaalsContact O-CB 3.29Å; D239-S242 WeakPolarHBondContact O-CB 3.41Å; D239-S242 PolarHBondContact O-N 3.3Å; D239-S242 PolarHBondContact O-OG 3Å; S242-S244 PolarHBondContact O-N 3.22Å; S242-F245 PolarHBondContact O-N 3.48Å; S242-F245 PolarHBondContact OG-N 2.85Å; S242-F245 VanDerWaalsContact OG-N 3.15Å; S242-F246 WeakPolarHBondContact O-CG 3.26Å; S242-F246 PolarHBondContact O-N 3.15Å; S242-F246 VanDerWaalsContact O-N 3.07Å
243	N	98.1	Very high	94.1	Very high	24 Å²	24	32.8 Å²	32.8	13%	0.128	17%	0.172	C	C	.	.	H	α-helix	trans	-55.9	-41.9	171.8	-65.8	-13.8	0	0	0	111.2	E35 T36 S38 T39 F245 F246 E247	E35-N243 PolarHBondContact O-ND2 3.46Å; T36-N243 WeakPolarHBondContact O-CB 3.43Å; T36-N243 PolarHBondContact O-N 3.06Å; T36-N243 PolarHBondContact O-ND2 2.83Å; S38-N243 PolarHBondContact N-OD1 3.2Å; S38-N243 PolarHBondContact OG-ND2 3.24Å; T39-N243 WeakPolarHBondContact CB-OD1 3.4Å; T39-N243 PolarHBondContact N-OD1 2.85Å; T39-N243 PolarHBondContact OG1-OD1 3.01Å; N243-F245 VanDerWaalsContact C-N 3.33Å; N243-F245 PolarHBondContact O-N 2.94Å; N243-F246 PolarHBondContact O-N 2.87Å; N243-E247 WeakPolarHBondContact O-CB 3.48Å; N243-E247 WeakPolarHBondContact O-CG 3.46Å; N243-E247 PolarHBondContact O-N 2.92Å
244	S	96.6	Very high	92.7	Very high	81 Å²	81	37.9 Å²	37.9	57%	0.566	21%	0.207	S	C	*	.	H	α-helix	trans	-56.3	-45.9	178.9	-179.3	0	0	0	0	111.9	S242 S248	S242-S244 PolarHBondContact O-N 3.22Å; S244-S248 VanDerWaalsContact O-CB 3.26Å; S244-S248 WeakPolarHBondContact O-CB 3.02Å; S244-S248 PolarHBondContact O-N 3.07Å
245	F	96.8	Very high	91.3	Very high	20 Å²	20	41.8 Å²	41.8	9%	0.088	23%	0.226	C	C	.	.	H	α-helix	trans	-69.3	-45.6	177.7	-87.2	34.8	0	0	0	110.9	L149 L173 R175 D239 S242 N243 E247 S248 C260	L149-F245 HydrophobicContact CD1-CE1 4.25Å; L149-F245 HydrophobicContact CD1-CE2 4.2Å; L149-F245 HydrophobicContact CD1-CZ 3.57Å; L173-F245 HydrophobicContact CB-CD2 3.92Å; L173-F245 HydrophobicContact CB-CE2 3.96Å; R175-F245 HydrophobicContact CB-CE2 4.39Å; R175-F245 HydrophobicContact CB-CZ 3.91Å; D239-F245 HydrophobicContact CB-CD1 4.25Å; D239-F245 HydrophobicContact CB-CD2 4.29Å; D239-F245 HydrophobicContact CB-CE1 3.85Å; D239-F245 HydrophobicContact CB-CE2 3.89Å; D239-F245 HydrophobicContact CB-CG 4.47Å; D239-F245 HydrophobicContact CB-CZ 3.65Å; D239-F245 VanDerWaalsContact O-CB 3.25Å; D239-F245 WeakPolarHBondContact O-CB 3.35Å; D239-F245 WeakPolarHBondContact O-CD2 3.46Å; D239-F245 WeakPolarHBondContact O-CG 3.32Å; S242-F245 PolarHBondContact O-N 3.48Å; S242-F245 PolarHBondContact OG-N 2.85Å; S242-F245 VanDerWaalsContact OG-N 3.15Å; N243-F245 VanDerWaalsContact C-N 3.33Å; N243-F245 PolarHBondContact O-N 2.94Å; F245-E247 VanDerWaalsContact C-N 3.25Å; F245-E247 PolarHBondContact O-N 3.08Å; F245-S248 PolarHBondContact O-N 3.46Å; F245-S248 PolarHBondContact O-OG 3.26Å; F245-C260 PolarHBondContact O-SG 2.73Å
246	F	97.1	Very high	90.1	Very high	4 Å²	4	50 Å²	50	2%	0.018	26%	0.261	C	S	.	.	H	α-helix	trans	-58	-35.6	179.8	-66.8	-12.4	0	0	0	113.8	T39 F40 M43 F240 L241 S242 N243 N262 Q263 T266	T39-F246 HydrophobicContact CG2-CD2 3.76Å; T39-F246 HydrophobicContact CG2-CE2 4.24Å; F40-F246 HydrophobicContact CB-CE2 4.17Å; M43-F246 HydrophobicContact CE-CD2 4.41Å; M43-F246 HydrophobicContact CE-CE2 3.93Å; M43-F246 HydrophobicContact CE-CZ 4.33Å; F240-F246 VanDerWaalsContact O-CE1 3.3Å; F240-F246 WeakPolarHBondContact O-CE1 3.34Å; L241-F246 WeakPolarHBondContact O-CE2 3.47Å; L241-F246 WeakPolarHBondContact O-CZ 3.23Å; S242-F246 WeakPolarHBondContact O-CG 3.26Å; S242-F246 PolarHBondContact O-N 3.15Å; S242-F246 VanDerWaalsContact O-N 3.07Å; N243-F246 PolarHBondContact O-N 2.87Å; F246-N262 HydrophobicContact CD1-CB 3.87Å; F246-N262 HydrophobicContact CE1-CB 4.05Å; F246-Q263 HydrophobicContact CB-CB 4Å; F246-Q263 HydrophobicContact CB-CG 4.23Å; F246-Q263 HydrophobicContact CD1-CB 3.8Å; F246-Q263 HydrophobicContact CD1-CG 4.35Å; F246-Q263 HydrophobicContact CD2-CB 4.34Å; F246-Q263 HydrophobicContact CD2-CG 4.01Å; F246-Q263 HydrophobicContact CE1-CB 4.36Å; F246-Q263 HydrophobicContact CE2-CG 4.46Å; F246-Q263 HydrophobicContact CG-CB 3.79Å; F246-Q263 HydrophobicContact CG-CG 3.95Å; F246-T266 HydrophobicContact CZ-CG2 4.03Å
247	E	94.6	Very high	89.2	Confident	148 Å²	148	52.1 Å²	52.1	69%	0.692	28%	0.283	S	S	*	.	H	α-helix	trans	-84.8	-13.2	179.1	-67.2	173.3	-172	0	0	113.2	N243 F245	N243-E247 WeakPolarHBondContact O-CB 3.48Å; N243-E247 WeakPolarHBondContact O-CG 3.46Å; N243-E247 PolarHBondContact O-N 2.92Å; F245-E247 VanDerWaalsContact C-N 3.25Å; F245-E247 PolarHBondContact O-N 3.08Å
248	S	93.9	Very high	88.7	Confident	9 Å²	9	55.1 Å²	55.1	6%	0.063	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-80	150.2	-173.9	68.6	0	0	0	0	114.5	L173 S244 F245 C260	L173-S248 WeakPolarHBondContact CD1-OG 3.35Å; S244-S248 VanDerWaalsContact O-CB 3.26Å; S244-S248 WeakPolarHBondContact O-CB 3.02Å; S244-S248 PolarHBondContact O-N 3.07Å; F245-S248 PolarHBondContact O-N 3.46Å; F245-S248 PolarHBondContact O-OG 3.26Å; S248-C260 PolarHBondContact O-N 2.79Å
249	T	92.3	Very high	88.4	Confident	42 Å²	42	57.6 Å²	57.6	26%	0.258	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	142.1	172.1	55.5	0	0	0	0	111.2	R142 V258 V259	R142-T249 PolarHBondContact NH2-O 3.36Å; T249-V258 CarbonylContact C-O 2.79Å; T249-V258 VanDerWaalsContact CA-O 3.27Å; T249-V258 WeakPolarHBondContact CA-O 3.33Å; T249-V259 HydrophobicContact CG2-CG2 4.28Å
250	V	88.7	Confident	88.1	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	123.8	171	178.8	0	0	0	0	109.3	D140 T151 P171 L173 T252 G257 V258 C260	D140-V250 WeakPolarHBondContact OD2-CA 3.4Å; T151-V250 HydrophobicContact CG2-CG1 3.72Å; P171-V250 HydrophobicContact CB-CG1 4.34Å; P171-V250 HydrophobicContact CB-CG2 4.35Å; L173-V250 HydrophobicContact CD1-CG2 4.25Å; L173-V250 HydrophobicContact CD2-CG2 4.12Å; L173-V250 HydrophobicContact CG-CG2 3.88Å; V250-T252 HydrophobicContact CG1-CG2 3.9Å; V250-G257 PolarHBondContact O-N 2.89Å; V250-V258 PolarHBondContact N-O 2.94Å; V250-C260 HydrophobicContact CG2-CB 3.69Å
251	E	85.4	Confident	88	Confident	76 Å²	76	55 Å²	55	36%	0.355	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	102.9	174.4	-65.9	-167.9	-176	0	0	110.5	D140 K141	D140-E251 PolarHBondContact OD2-N 3.07Å; K141-E251 HydrophobicContact CB-CB 4.13Å; K141-E251 HydrophobicContact CD-CB 4.29Å; K141-E251 HydrophobicContact CG-CB 4.38Å; K141-E251 WeakPolarHBondContact CG-O 3.31Å; K141-E251 PolarHBondContact N-O 2.88Å
252	T	77.8	Confident	87.9	Confident	20 Å²	20	55 Å²	55	12%	0.123	30%	0.304	C	S	.	.			trans	-122.3	178.7	172.9	64.1	0	0	0	0	110.6	T151 V250 S254 H255	T151-T252 HydrophobicContact CG2-CG2 3.61Å; V250-T252 HydrophobicContact CG1-CG2 3.9Å; T252-S254 PolarHBondContact O-N 2.97Å; T252-S254 PolarHBondContact OG1-N 2.81Å; T252-H255 PolarHBondContact N-O 3.18Å; T252-H255 VanDerWaalsContact O-O 3.05Å; T252-H255 PolarHBondContact OG1-N 2.72Å
253	E	71.4	Confident	87.9	Confident	156 Å²	156	58.4 Å²	58.4	73%	0.729	32%	0.319	S	S	*	.	S	Bend	trans	-61	-31.9	169.9	-70.7	-57.6	115.1	0	0	112.2	K141	K141-E253 WeakPolarHBondContact CE-OE1 3.39Å; K141-E253 IonicContact NZ-OE1 2.76Å; K141-E253 PolarHBondContact NZ-OE1 2.92Å
254	S	70.7	Confident	87.8	Confident	108 Å²	108	60.2 Å²	60.2	76%	0.755	33%	0.331	S	S	*	.	S	Bend	trans	-94.3	-27.6	-177.5	-61.1	0	0	0	0	114.6	T252	T252-S254 PolarHBondContact O-N 2.97Å; T252-S254 PolarHBondContact OG1-N 2.81Å
255	H	68.5	Low	87.9	Confident	83 Å²	83	56.3 Å²	56.3	38%	0.384	30%	0.304	S	S	.	.			trans	-121.9	124.5	-178.9	-62	-71.1	0	0	0	110.4	T252	T252-H255 PolarHBondContact N-O 3.18Å; T252-H255 VanDerWaalsContact O-O 3.05Å; T252-H255 PolarHBondContact OG1-N 2.72Å
256	K	73.9	Confident	87.9	Confident	176 Å²	176	55.6 Å²	55.6	77%	0.765	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.5	106.9	175.9	-68.4	-173.9	179.4	-178	0	110.2
257	G	79.4	Confident	87.9	Confident	43 Å²	43	57 Å²	57	44%	0.443	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	77.4	31.8	165.8	0	0	0	0	0	115.5	V250	V250-G257 PolarHBondContact O-N 2.89Å
258	V	87.1	Confident	88	Confident	64 Å²	64	50.3 Å²	50.3	39%	0.388	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	129.3	174	-177.4	0	0	0	0	109	A170 T249 V250 C260	A170-V258 HydrophobicContact CB-CG1 3.86Å; T249-V258 CarbonylContact C-O 2.79Å; T249-V258 VanDerWaalsContact CA-O 3.27Å; T249-V258 WeakPolarHBondContact CA-O 3.33Å; V250-V258 PolarHBondContact N-O 2.94Å; V258-C260 PolarHBondContact O-N 2.79Å
259	V	90.9	Very high	88.1	Confident	84 Å²	84	50 Å²	50	51%	0.509	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	133	174.5	-179.4	0	0	0	0	109.6	A170 T249	A170-V259 WeakPolarHBondContact CB-O 3.36Å; T249-V259 HydrophobicContact CG2-CG2 4.28Å
260	C	93	Very high	88.4	Confident	5 Å²	5	48.1 Å²	48.1	3%	0.034	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-64.9	154.8	-175.3	78.2	0	0	0	0	112.5	P171 L173 F245 S248 V250 V258 N262	P171-C260 WeakPolarHBondContact O-CA 3.45Å; L173-C260 HydrophobicContact CD1-CB 3.83Å; L173-C260 HydrophobicContact CG-CB 4.03Å; F245-C260 PolarHBondContact O-SG 2.73Å; S248-C260 PolarHBondContact O-N 2.79Å; V250-C260 HydrophobicContact CG2-CB 3.69Å; V258-C260 PolarHBondContact O-N 2.79Å; C260-N262 PolarHBondContact O-N 3.33Å
261	G	95.3	Very high	88.7	Confident	3 Å²	3	51 Å²	51	3%	0.031	28%	0.275	C	S	.	.	S	Bend	trans	-75.8	-2.3	-179.4	0	0	0	0	0	115	P171 Q263 V264 L265	P171-G261 PolarHBondContact O-N 2.78Å; G261-Q263 PolarHBondContact O-N 3.09Å; G261-V264 PolarHBondContact O-N 3.18Å; G261-L265 PolarHBondContact O-N 2.72Å
262	N	97.6	Very high	89.2	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60.3	-45.8	-167.6	-70.1	37.8	0	0	0	112.7	L172 L173 F240 F246 C260 V264 L265 T266	L172-N262 VanDerWaalsContact CA-OD1 3.3Å; L172-N262 WeakPolarHBondContact CA-OD1 3.36Å; L173-N262 PolarHBondContact N-OD1 3.3Å; L173-N262 PolarHBondContact O-ND2 3.32Å; F240-N262 VanDerWaalsContact CD2-ND2 3.3Å; F240-N262 WeakPolarHBondContact CD2-ND2 3.29Å; F240-N262 WeakPolarHBondContact CE2-ND2 3.28Å; F240-N262 HydrophobicContact CZ-CB 4.41Å; F246-N262 HydrophobicContact CD1-CB 3.87Å; F246-N262 HydrophobicContact CE1-CB 4.05Å; C260-N262 PolarHBondContact O-N 3.33Å; N262-V264 PolarHBondContact O-N 3.06Å; N262-L265 PolarHBondContact O-N 3.27Å; N262-T266 VanDerWaalsContact O-CB 3.27Å; N262-T266 WeakPolarHBondContact O-CB 3.31Å; N262-T266 PolarHBondContact O-N 2.74Å; N262-T266 PolarHBondContact O-OG1 2.92Å
263	Q	97	Very high	90.1	Very high	80 Å²	80	46.5 Å²	46.5	37%	0.374	25%	0.252	S	S	.	.	H	α-helix	trans	-62.2	-45.6	-179.6	-165.9	-175.5	15.2	0	0	110.9	M43 F246 G261 T266 D267	M43-Q263 HydrophobicContact CE-CB 4.35Å; M43-Q263 HydrophobicContact CE-CG 3.21Å; F246-Q263 HydrophobicContact CB-CB 4Å; F246-Q263 HydrophobicContact CB-CG 4.23Å; F246-Q263 HydrophobicContact CD1-CB 3.8Å; F246-Q263 HydrophobicContact CD1-CG 4.35Å; F246-Q263 HydrophobicContact CD2-CB 4.34Å; F246-Q263 HydrophobicContact CD2-CG 4.01Å; F246-Q263 HydrophobicContact CE1-CB 4.36Å; F246-Q263 HydrophobicContact CE2-CG 4.46Å; F246-Q263 HydrophobicContact CG-CB 3.79Å; F246-Q263 HydrophobicContact CG-CG 3.95Å; G261-Q263 PolarHBondContact O-N 3.09Å; Q263-T266 PolarHBondContact O-N 2.96Å; Q263-D267 WeakPolarHBondContact O-CB 3.47Å; Q263-D267 PolarHBondContact O-N 3.47Å
264	V	96.5	Very high	91.3	Very high	62 Å²	62	39.8 Å²	39.8	38%	0.376	22%	0.221	S	C	.	.	H	α-helix	trans	-65.5	-42.8	180	179.5	0	0	0	0	111	K167 V168 G261 N262 N268	K167-V264 HydrophobicContact CB-CG1 4.32Å; V168-V264 HydrophobicContact CG2-CG1 4.25Å; G261-V264 PolarHBondContact O-N 3.18Å; N262-V264 PolarHBondContact O-N 3.06Å; V264-N268 PolarHBondContact O-N 2.86Å; V264-N268 PolarHBondContact O-ND2 3.12Å
265	L	97.9	Very high	92.3	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65.8	-47.1	177.6	178.2	55.9	0	0	0	111	L157 T164 V168 L172 F240 G261 N262 D267 N268 L269	L157-L265 HydrophobicContact CD1-CD1 4.47Å; L157-L265 HydrophobicContact CD1-CD2 4.39Å; L157-L265 HydrophobicContact CD2-CD1 3.96Å; L157-L265 HydrophobicContact CD2-CD2 3.46Å; L157-L265 VanDerWaalsContact CD2-CD2 3.46Å; L157-L265 HydrophobicContact CD2-CG 4.41Å; T164-L265 HydrophobicContact CG2-CD1 4.41Å; V168-L265 HydrophobicContact CG2-CB 3.9Å; V168-L265 HydrophobicContact CG2-CD1 4.13Å; L172-L265 HydrophobicContact CD1-CD2 3.53Å; L172-L265 HydrophobicContact CD2-CB 4.09Å; L172-L265 HydrophobicContact CD2-CD2 3.8Å; L172-L265 HydrophobicContact CG-CD2 4.33Å; F240-L265 HydrophobicContact CZ-CD2 4.02Å; G261-L265 PolarHBondContact O-N 2.72Å; N262-L265 PolarHBondContact O-N 3.27Å; L265-D267 VanDerWaalsContact C-N 3.32Å; L265-D267 PolarHBondContact O-N 3.26Å; L265-N268 PolarHBondContact O-N 3.23Å; L265-N268 VanDerWaalsContact O-N 3.08Å; L265-L269 HydrophobicContact CD1-CD1 4.07Å; L265-L269 HydrophobicContact CD1-CD2 4.2Å; L265-L269 HydrophobicContact CD1-CG 3.86Å; L265-L269 HydrophobicContact CG-CD1 3.89Å; L265-L269 HydrophobicContact CG-CG 4.14Å; L265-L269 WeakPolarHBondContact O-CG 3.31Å; L265-L269 PolarHBondContact O-N 3.18Å
266	T	97.9	Very high	93.5	Very high	4 Å²	4	32.9 Å²	32.9	3%	0.025	18%	0.18	C	C	.	.	H	α-helix	trans	-56.8	-45.6	178	-58.9	0	0	0	0	111.6	F40 M43 L241 F246 N262 Q263 N268 L269 L270	F40-T266 HydrophobicContact CD2-CG2 3.72Å; F40-T266 HydrophobicContact CE2-CG2 4.01Å; M43-T266 HydrophobicContact SD-CG2 4.13Å; L241-T266 HydrophobicContact CD2-CG2 3.52Å; F246-T266 HydrophobicContact CZ-CG2 4.03Å; N262-T266 VanDerWaalsContact O-CB 3.27Å; N262-T266 WeakPolarHBondContact O-CB 3.31Å; N262-T266 PolarHBondContact O-N 2.74Å; N262-T266 PolarHBondContact O-OG1 2.92Å; Q263-T266 PolarHBondContact O-N 2.96Å; T266-N268 VanDerWaalsContact C-N 3.26Å; T266-N268 PolarHBondContact O-N 2.97Å; T266-L269 PolarHBondContact O-N 2.87Å; T266-L270 HydrophobicContact CG2-CD1 4.21Å; T266-L270 HydrophobicContact CG2-CG 4.37Å; T266-L270 WeakPolarHBondContact O-CB 3.15Å; T266-L270 WeakPolarHBondContact O-CG 3.11Å; T266-L270 PolarHBondContact O-N 3.5Å
267	D	96.3	Very high	94.4	Very high	35 Å²	35	25.7 Å²	25.7	19%	0.187	15%	0.148	C	C	.	.	H	α-helix	trans	-54.3	-42.7	176.1	-171.5	87.6	0	0	0	112.2	M43 R47 Q263 L265 R271	M43-D267 HydrophobicContact SD-CB 4.35Å; R47-D267 IonicContact CZ-OD1 3.46Å; R47-D267 IonicContact NH1-OD1 2.68Å; R47-D267 PolarHBondContact NH1-OD1 2.85Å; R47-D267 PolarHBondContact NH2-O 2.81Å; R47-D267 IonicContact NH2-OD1 3.18Å; R47-D267 PolarHBondContact NH2-OD1 2.86Å; R47-D267 IonicContact NH2-OD2 2.76Å; R47-D267 PolarHBondContact NH2-OD2 2.89Å; R47-D267 VanDerWaalsContact NH2-OD2 3.12Å; Q263-D267 WeakPolarHBondContact O-CB 3.47Å; Q263-D267 PolarHBondContact O-N 3.47Å; L265-D267 VanDerWaalsContact C-N 3.32Å; L265-D267 PolarHBondContact O-N 3.26Å; D267-R271 WeakPolarHBondContact O-CG 3.37Å; D267-R271 PolarHBondContact O-N 3.1Å; D267-R271 IonicContact OD2-CZ 3.45Å; D267-R271 IonicContact OD2-NE 3.2Å; D267-R271 PolarHBondContact OD2-NE 3.01Å; D267-R271 IonicContact OD2-NH2 2.79Å; D267-R271 PolarHBondContact OD2-NH2 3.07Å
268	N	95.9	Very high	95.1	Very high	6 Å²	6	23.7 Å²	23.7	3%	0.032	13%	0.127	C	C	.	.	H	α-helix	trans	-75.3	-41	-180	-72.8	-61	0	0	0	112.7	T164 G165 V264 L265 T266 L270 R271 W272 R277	T164-N268 WeakPolarHBondContact O-CB 3.35Å; T164-N268 PolarHBondContact O-ND2 2.82Å; G165-N268 WeakPolarHBondContact CA-OD1 3.06Å; V264-N268 PolarHBondContact O-N 2.86Å; V264-N268 PolarHBondContact O-ND2 3.12Å; L265-N268 PolarHBondContact O-N 3.23Å; L265-N268 VanDerWaalsContact O-N 3.08Å; T266-N268 VanDerWaalsContact C-N 3.26Å; T266-N268 PolarHBondContact O-N 2.97Å; N268-L270 VanDerWaalsContact C-N 3.32Å; N268-L270 PolarHBondContact O-N 3.25Å; N268-R271 PolarHBondContact O-N 2.9Å; N268-W272 PolarHBondContact O-N 2.81Å; N268-W272 VanDerWaalsContact O-N 3.09Å; N268-R277 PolarHBondContact OD1-NH1 3.31Å
269	L	97.6	Very high	95.5	Very high	3 Å²	3	22.6 Å²	22.6	2%	0.016	12%	0.118	C	C	.	.	H	α-helix	trans	-61.9	-41.2	176.1	-69.1	179	0	0	0	111.2	I163 V191 I221 L233 L265 T266 W272 V273	I163-L269 HydrophobicContact CG2-CD2 3.67Å; V191-L269 HydrophobicContact CG1-CD1 4.35Å; V191-L269 HydrophobicContact CG1-CD2 3.64Å; I221-L269 HydrophobicContact CD1-CD1 4.06Å; I221-L269 HydrophobicContact CG2-CD1 4.4Å; L233-L269 HydrophobicContact CD2-CB 4.04Å; L233-L269 HydrophobicContact CD2-CD1 4.28Å; L265-L269 HydrophobicContact CD1-CD1 4.07Å; L265-L269 HydrophobicContact CD1-CD2 4.2Å; L265-L269 HydrophobicContact CD1-CG 3.86Å; L265-L269 HydrophobicContact CG-CD1 3.89Å; L265-L269 HydrophobicContact CG-CG 4.14Å; L265-L269 WeakPolarHBondContact O-CG 3.31Å; L265-L269 PolarHBondContact O-N 3.18Å; T266-L269 PolarHBondContact O-N 2.87Å; L269-W272 PolarHBondContact O-N 3.44Å; L269-V273 WeakPolarHBondContact O-CG1 3.43Å; L269-V273 PolarHBondContact O-N 2.76Å
270	L	96.8	Very high	95.7	Very high	3 Å²	3	19.2 Å²	19.2	2%	0.016	10%	0.097	C	C	.	.	H	α-helix	trans	-61.4	-45.2	176.1	-73.7	179.2	0	0	0	112.4	F40 M43 L44 T266 N268 W272 V273 L274	F40-L270 HydrophobicContact CD2-CD1 4.09Å; F40-L270 HydrophobicContact CE2-CD1 3.75Å; F40-L270 HydrophobicContact CE2-CD2 3.84Å; F40-L270 HydrophobicContact CE2-CG 4.15Å; F40-L270 HydrophobicContact CZ-CD1 4.49Å; F40-L270 HydrophobicContact CZ-CD2 4.11Å; M43-L270 HydrophobicContact CB-CD1 4.05Å; M43-L270 HydrophobicContact SD-CD1 4.18Å; L44-L270 HydrophobicContact CD2-CD1 3.94Å; L44-L270 HydrophobicContact CD2-CD2 4.02Å; L44-L270 HydrophobicContact CD2-CG 4.47Å; L44-L270 HydrophobicContact CG-CD1 4.39Å; T266-L270 HydrophobicContact CG2-CD1 4.21Å; T266-L270 HydrophobicContact CG2-CG 4.37Å; T266-L270 WeakPolarHBondContact O-CB 3.15Å; T266-L270 WeakPolarHBondContact O-CG 3.11Å; T266-L270 PolarHBondContact O-N 3.5Å; N268-L270 VanDerWaalsContact C-N 3.32Å; N268-L270 PolarHBondContact O-N 3.25Å; L270-W272 PolarHBondContact O-N 2.82Å; L270-V273 HydrophobicContact CD2-CG1 4.45Å; L270-L274 VanDerWaalsContact O-CB 3.29Å; L270-L274 WeakPolarHBondContact O-CB 3.12Å; L270-L274 VanDerWaalsContact O-CG 3.31Å; L270-L274 WeakPolarHBondContact O-CG 3.26Å; L270-L274 PolarHBondContact O-N 2.82Å
271	R	94.9	Very high	95.8	Very high	61 Å²	61	23.5 Å²	23.5	23%	0.23	11%	0.112	C	C	.	.	H	α-helix	trans	-59	-37.6	175.3	-68.6	170	-165.2	-121.9	0.7	111.6	D267 N268 E276 R277	D267-R271 WeakPolarHBondContact O-CG 3.37Å; D267-R271 PolarHBondContact O-N 3.1Å; D267-R271 IonicContact OD2-CZ 3.45Å; D267-R271 IonicContact OD2-NE 3.2Å; D267-R271 PolarHBondContact OD2-NE 3.01Å; D267-R271 IonicContact OD2-NH2 2.79Å; D267-R271 PolarHBondContact OD2-NH2 3.07Å; N268-R271 PolarHBondContact O-N 2.9Å; R271-E276 HydrophobicContact CB-CB 4.31Å; R271-E276 CarbonylContact O-C 3.52Å; R271-E276 WeakPolarHBondContact O-CA 3.39Å; R271-E276 VanDerWaalsContact O-CB 3.31Å; R271-E276 WeakPolarHBondContact O-CB 3.39Å; R271-E276 PolarHBondContact O-N 2.78Å; R271-R277 HydrophobicContact CB-CB 4.27Å; R271-R277 PolarHBondContact O-N 3.37Å
272	W	96.1	Very high	95.9	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-74.7	-56.1	179.8	-179.8	73	0	0	0	112	I163 I189 A223 R231 N268 L269 L270 L274 G275 G373	I163-W272 HydrophobicContact CB-CD2 4.41Å; I163-W272 HydrophobicContact CB-CG 4.47Å; I163-W272 HydrophobicContact CD1-CH2 4.42Å; I163-W272 HydrophobicContact CD1-CZ2 4.03Å; I163-W272 HydrophobicContact CG1-CD2 3.97Å; I163-W272 HydrophobicContact CG1-CG 4.22Å; I163-W272 HydrophobicContact CG1-CZ2 4.11Å; I163-W272 HydrophobicContact CG2-CD2 4.16Å; I163-W272 HydrophobicContact CG2-CE3 4.11Å; I189-W272 HydrophobicContact CD1-CH2 4.03Å; I189-W272 HydrophobicContact CD1-CZ2 4.1Å; A223-W272 HydrophobicContact CB-CH2 3.65Å; A223-W272 HydrophobicContact CB-CZ3 3.49Å; A223-W272 VanDerWaalsContact CB-CZ3 3.49Å; R231-W272 VanDerWaalsContact CD-O 3.27Å; R231-W272 WeakPolarHBondContact CD-O 3.07Å; R231-W272 HydrophobicContact CG-CH2 4.43Å; R231-W272 HydrophobicContact CG-CZ2 4.4Å; R231-W272 VanDerWaalsContact CZ-NE1 3.32Å; R231-W272 PolarHBondContact NH1-O 3.03Å; N268-W272 PolarHBondContact O-N 2.81Å; N268-W272 VanDerWaalsContact O-N 3.09Å; L269-W272 PolarHBondContact O-N 3.44Å; L270-W272 PolarHBondContact O-N 2.82Å; W272-L274 VanDerWaalsContact C-N 3.28Å; W272-L274 PolarHBondContact O-N 3.27Å; W272-G275 PolarHBondContact O-N 2.67Å; W272-G373 PolarHBondContact NE1-O 3.16Å
273	V	97.4	Very high	95.7	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-61.8	-35	-176.1	73.3	0	0	0	0	112.2	N102 L103 V104 R231 L233 L269 L270 G275	N102-V273 WeakPolarHBondContact CB-O 3.38Å; N102-V273 PolarHBondContact OD1-O 3.27Å; L103-V273 WeakPolarHBondContact O-CG2 3Å; V104-V273 HydrophobicContact CG2-CG1 3.76Å; V104-V273 HydrophobicContact CG2-CG2 4.21Å; R231-V273 HydrophobicContact CB-CG2 3.88Å; L233-V273 HydrophobicContact CB-CB 4.38Å; L233-V273 HydrophobicContact CB-CG2 3.83Å; L269-V273 WeakPolarHBondContact O-CG1 3.43Å; L269-V273 PolarHBondContact O-N 2.76Å; L270-V273 HydrophobicContact CD2-CG1 4.45Å; V273-G275 VanDerWaalsContact C-N 3.25Å; V273-G275 PolarHBondContact O-N 3.09Å
274	L	95.6	Very high	95.7	Very high	15 Å²	15	29.8 Å²	29.8	8%	0.079	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	4.2	178.5	-58.6	174.2	0	0	0	113.9	L24 L44 Y49 N102 L270 W272 E276	L24-L274 HydrophobicContact CD1-CD1 4.18Å; L24-L274 HydrophobicContact CD1-CD2 4.36Å; L24-L274 HydrophobicContact CD2-CD2 4.04Å; L44-L274 HydrophobicContact CD2-CD1 3.66Å; Y49-L274 HydrophobicContact CD2-CD1 4.21Å; Y49-L274 HydrophobicContact CE1-CD1 4.35Å; Y49-L274 HydrophobicContact CE2-CD1 3.6Å; Y49-L274 WeakPolarHBondContact OH-CB 3.14Å; N102-L274 HydrophobicContact CB-CD2 4.5Å; L270-L274 VanDerWaalsContact O-CB 3.29Å; L270-L274 WeakPolarHBondContact O-CB 3.12Å; L270-L274 VanDerWaalsContact O-CG 3.31Å; L270-L274 WeakPolarHBondContact O-CG 3.26Å; L270-L274 PolarHBondContact O-N 2.82Å; W272-L274 VanDerWaalsContact C-N 3.28Å; W272-L274 PolarHBondContact O-N 3.27Å; L274-E276 PolarHBondContact O-N 3Å
275	G	93.2	Very high	95.7	Very high	9 Å²	9	28.7 Å²	28.7	9%	0.093	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.1	25.7	175.3	0	0	0	0	0	115	W272 V273 Q279 K314	W272-G275 PolarHBondContact O-N 2.67Å; V273-G275 VanDerWaalsContact C-N 3.25Å; V273-G275 PolarHBondContact O-N 3.09Å; G275-Q279 WeakPolarHBondContact O-CG 3.46Å; G275-K314 PolarHBondContact O-NZ 3.27Å
276	E	92.5	Very high	95.7	Very high	38 Å²	38	33.8 Å²	33.8	18%	0.178	16%	0.158	C	C	.	.	S	Bend	trans	-80.6	-34.8	170.1	-50.7	-172.6	147.3	0	0	110.6	K22 R47 Y49 R271 L274 K314	K22-E276 IonicContact NZ-OE1 3.79Å; K22-E276 PolarHBondContact NZ-OE1 3.41Å; R47-E276 IonicContact NE-OE2 3.38Å; Y49-E276 WeakPolarHBondContact CE2-OE1 3.36Å; Y49-E276 VanDerWaalsContact CZ-OE1 3.26Å; Y49-E276 WeakPolarHBondContact OH-CG 3.32Å; Y49-E276 PolarHBondContact OH-OE1 2.89Å; R271-E276 HydrophobicContact CB-CB 4.31Å; R271-E276 CarbonylContact O-C 3.52Å; R271-E276 WeakPolarHBondContact O-CA 3.39Å; R271-E276 VanDerWaalsContact O-CB 3.31Å; R271-E276 WeakPolarHBondContact O-CB 3.39Å; R271-E276 PolarHBondContact O-N 2.78Å; L274-E276 PolarHBondContact O-N 3Å; E276-K314 WeakPolarHBondContact O-CB 3.22Å
277	R	93	Very high	95.7	Very high	24 Å²	24	34.9 Å²	34.9	9%	0.091	16%	0.163	C	C	.	.	S	Bend	trans	-117.7	154.4	-179.9	-170.8	178.9	-75.1	161.1	-2.6	112.1	V162 R231 N268 R271 Q279 D316	V162-R277 HydrophobicContact CG1-CG 4.2Å; V162-R277 WeakPolarHBondContact O-CD 3.36Å; R231-R277 PolarHBondContact NH1-O 3.05Å; N268-R277 PolarHBondContact OD1-NH1 3.31Å; R271-R277 HydrophobicContact CB-CB 4.27Å; R271-R277 PolarHBondContact O-N 3.37Å; R277-Q279 PolarHBondContact O-N 3.27Å; R277-D316 IonicContact CZ-OD1 3.72Å; R277-D316 VanDerWaalsContact CZ-OD1 3.3Å; R277-D316 IonicContact NE-OD1 3.54Å; R277-D316 PolarHBondContact NE-OD1 3.45Å; R277-D316 IonicContact NH2-OD1 2.79Å; R277-D316 PolarHBondContact NH2-OD1 2.87Å; R277-D316 IonicContact NH2-OD2 3.87Å; R277-D316 PolarHBondContact NH2-OD2 3.08Å
278	G	93.9	Very high	95.7	Very high	1 Å²	1	35 Å²	35	1%	0.01	16%	0.163	C	C	.	.	S	Bend	trans	70	24	175	0	0	0	0	0	113.1	V162 R231 Y374 T375	V162-G278 VanDerWaalsContact CG1-CA 3.44Å; R231-G278 PolarHBondContact NH2-O 3.02Å; G278-Y374 CarbonylContact O-C 3.58Å; G278-Y374 WeakPolarHBondContact O-CA 3.49Å; G278-T375 PolarHBondContact O-N 3.11Å
279	Q	95.2	Very high	95.8	Very high	42 Å²	42	37.4 Å²	37.4	20%	0.196	17%	0.171	C	C	.	.			trans	-88.7	123.5	173.5	-68.7	-69.5	-42.8	0	0	108.8	G275 R277 T313 K314 W320	G275-Q279 WeakPolarHBondContact O-CG 3.46Å; R277-Q279 PolarHBondContact O-N 3.27Å; Q279-T313 WeakPolarHBondContact O-CA 3.38Å; Q279-T313 PolarHBondContact O-OG1 2.95Å; Q279-K314 HydrophobicContact CB-CB 4.41Å; Q279-K314 HydrophobicContact CB-CD 3.99Å; Q279-K314 HydrophobicContact CB-CG 4Å; Q279-K314 HydrophobicContact CG-CD 3.98Å; Q279-K314 PolarHBondContact O-N 2.96Å; Q279-W320 HydrophobicContact CB-CH2 3.86Å; Q279-W320 HydrophobicContact CB-CZ3 4.17Å
280	L	96.3	Very high	95.7	Very high	12 Å²	12	41.2 Å²	41.2	6%	0.063	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	138.7	172	-63.2	-177.4	0	0	0	109.9	E312 F323 Y369 Y374 T375 L377	L280-E312 WeakPolarHBondContact CA-O 3.21Å; L280-F323 HydrophobicContact CD1-CE1 4.32Å; L280-F323 HydrophobicContact CD1-CZ 4.29Å; L280-F323 HydrophobicContact CD2-CB 4.33Å; L280-F323 HydrophobicContact CD2-CD1 4.08Å; L280-F323 HydrophobicContact CD2-CD2 3.56Å; L280-F323 HydrophobicContact CD2-CE1 4.24Å; L280-F323 HydrophobicContact CD2-CE2 3.78Å; L280-F323 HydrophobicContact CD2-CG 3.73Å; L280-F323 HydrophobicContact CD2-CZ 4.1Å; L280-Y369 HydrophobicContact CD1-CD1 3.62Å; L280-Y369 HydrophobicContact CD1-CE1 3.83Å; L280-Y374 HydrophobicContact CD1-CD1 4Å; L280-Y374 HydrophobicContact CD1-CG 3.99Å; L280-Y374 HydrophobicContact CD2-CD1 3.87Å; L280-Y374 HydrophobicContact CD2-CE1 4.28Å; L280-Y374 HydrophobicContact CG-CD1 3.79Å; L280-Y374 HydrophobicContact CG-CG 4.25Å; L280-T375 WeakPolarHBondContact CA-OG1 3.31Å; L280-T375 PolarHBondContact N-OG1 3.27Å; L280-T375 PolarHBondContact O-OG1 2.78Å; L280-L377 HydrophobicContact CB-CB 4.33Å
281	R	95.5	Very high	95.5	Very high	96 Å²	96	45.1 Å²	45.1	36%	0.362	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	157.1	167.8	71.4	-178.5	-175	-177.1	1.3	110.1	I311 E312 W320	R281-I311 WeakPolarHBondContact O-CA 3.29Å; R281-E312 HydrophobicContact CG-CB 4.24Å; R281-E312 IonicContact CZ-OE2 3.12Å; R281-E312 PolarHBondContact N-O 3.36Å; R281-E312 IonicContact NE-OE2 2.92Å; R281-E312 PolarHBondContact NE-OE2 3.09Å; R281-E312 IonicContact NH2-OE2 3.33Å; R281-E312 PolarHBondContact NH2-OE2 2.74Å; R281-E312 PolarHBondContact O-N 2.81Å; R281-W320 HydrophobicContact CB-CH2 4.22Å; R281-W320 HydrophobicContact CB-CZ3 4.12Å; R281-W320 HydrophobicContact CG-CD2 4.46Å; R281-W320 HydrophobicContact CG-CE3 3.83Å; R281-W320 HydrophobicContact CG-CH2 3.93Å; R281-W320 HydrophobicContact CG-CZ3 3.54Å; R281-W320 VanDerWaalsContact CZ-CD1 3.48Å; R281-W320 VanDerWaalsContact CZ-CE2 3.46Å; R281-W320 VanDerWaalsContact NE-CD2 3.33Å; R281-W320 VanDerWaalsContact NH2-CD1 3.33Å
282	H	95.8	Very high	95.5	Very high	76 Å²	76	45.9 Å²	45.9	35%	0.352	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	136.3	165.1	66.7	-85.7	0	0	0	109.4	I309 K310 L377	H282-I309 HydrophobicContact CB-CD1 3.79Å; H282-I309 HydrophobicContact CB-CG1 3.9Å; H282-K310 CarbonylContact C-O 3.46Å; H282-K310 WeakPolarHBondContact CA-O 3.18Å; H282-L377 HydrophobicContact CB-CD1 4.09Å
283	T	94.9	Very high	95.2	Very high	68 Å²	68	51.8 Å²	51.8	42%	0.417	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	-41.4	-179.9	-49.8	0	0	0	0	110.7	K310 E312	T283-K310 PolarHBondContact N-O 3.27Å; T283-E312 PolarHBondContact OG1-OE1 2.98Å; T283-E312 PolarHBondContact OG1-OE2 3.47Å
284	Y	96.4	Very high	95.1	Very high	70 Å²	70	58 Å²	58	28%	0.275	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	162.8	176.8	61.8	-107.3	0	0	0	111.6	K286 K310 E349	Y284-K286 HydrophobicContact CD2-CD 4.08Å; Y284-K286 HydrophobicContact CD2-CG 3.92Å; Y284-K286 HydrophobicContact CE2-CD 3.73Å; Y284-K286 VanDerWaalsContact CE2-CE 3.44Å; Y284-K286 HydrophobicContact CE2-CG 4.06Å; Y284-K286 PolarHBondContact OH-NZ 2.53Å; Y284-K286 VanDerWaalsContact OH-NZ 3.13Å; Y284-K310 HydrophobicContact CD1-CB 4.18Å; Y284-K310 HydrophobicContact CD1-CD 4.43Å; Y284-K310 HydrophobicContact CD2-CB 4.36Å; Y284-K310 HydrophobicContact CE1-CB 3.96Å; Y284-K310 HydrophobicContact CE1-CD 3.81Å; Y284-K310 HydrophobicContact CE2-CB 4.12Å; Y284-K310 HydrophobicContact CG-CB 4.42Å; Y284-K310 PolarHBondContact O-N 3.2Å; Y284-K310 VanDerWaalsContact O-N 3.11Å; Y284-E349 PolarHBondContact OH-OE1 2.88Å
285	V	97	Very high	95	Very high	40 Å²	40	60.8 Å²	60.8	24%	0.242	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	137.2	171.1	176.7	0	0	0	0	108.6	Y307 T308 I309 S379	V285-Y307 HydrophobicContact CG1-CD2 4.43Å; V285-Y307 HydrophobicContact CG1-CE2 3.48Å; V285-Y307 VanDerWaalsContact CG1-CE2 3.48Å; V285-Y307 WeakPolarHBondContact CG1-OH 3.41Å; V285-T308 CarbonylContact C-O 3.6Å; V285-T308 WeakPolarHBondContact CA-O 3.46Å; V285-I309 HydrophobicContact CG2-CB 4.42Å; V285-I309 HydrophobicContact CG2-CD1 4.01Å; V285-I309 HydrophobicContact CG2-CG1 3.96Å; V285-S379 WeakPolarHBondContact CG2-OG 3.44Å
286	K	97	Very high	95	Very high	106 Å²	106	61.6 Å²	61.6	46%	0.461	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	138.5	174.3	-66.3	174.6	-176	165.4	0	108.9	Y284 Y307 T308	Y284-K286 HydrophobicContact CD2-CD 4.08Å; Y284-K286 HydrophobicContact CD2-CG 3.92Å; Y284-K286 HydrophobicContact CE2-CD 3.73Å; Y284-K286 VanDerWaalsContact CE2-CE 3.44Å; Y284-K286 HydrophobicContact CE2-CG 4.06Å; Y284-K286 PolarHBondContact OH-NZ 2.53Å; Y284-K286 VanDerWaalsContact OH-NZ 3.13Å; K286-Y307 CarbonylContact O-C 3.54Å; K286-T308 PolarHBondContact N-O 2.63Å; K286-T308 PolarHBondContact O-N 3.03Å
287	H	97.2	Very high	95	Very high	28 Å²	28	65 Å²	65	13%	0.13	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	140.9	172.3	59.1	86.5	0	0	0	109.7	P295 Y299 V306 Y307 F365 T381	H287-P295 VanDerWaalsContact CE1-CB 3.5Å; H287-P295 WeakPolarHBondContact CE1-CB 3.42Å; H287-P295 WeakPolarHBondContact O-CA 3.47Å; H287-P295 VanDerWaalsContact O-CB 3.26Å; H287-P295 WeakPolarHBondContact O-CB 3.38Å; H287-Y299 AromaticContact ND1-CE2 3.87Å; H287-Y299 AromaticContact ND1-CZ 3.84Å; H287-Y299 PolarHBondContact ND1-OH 3.42Å; H287-V306 VanDerWaalsContact CA-O 3.23Å; H287-V306 WeakPolarHBondContact CA-O 3.46Å; H287-Y307 HydrophobicContact CB-CD2 4.02Å; H287-F365 HydrophobicContact CB-CE2 4.18Å; H287-T381 WeakPolarHBondContact NE2-CG2 3.43Å
288	H	97.8	Very high	95	Very high	38 Å²	38	67.6 Å²	67.6	18%	0.176	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	164.9	-179.2	55.6	80.3	0	0	0	110.1	E292 L294 Y299 V305 V306	H288-E292 PolarHBondContact CE1-O 3.33Å; H288-E292 VanDerWaalsContact CE1-O 3.22Å; H288-E292 PolarHBondContact ND1-O 3.06Å; H288-L294 WeakPolarHBondContact CB-O 3.37Å; H288-Y299 WeakPolarHBondContact CA-OH 3.43Å; H288-Y299 PolarHBondContact N-OH 2.87Å; H288-V305 WeakPolarHBondContact O-CA 3.48Å; H288-V305 WeakPolarHBondContact O-CG1 3.27Å; H288-V306 PolarHBondContact N-O 3.41Å; H288-V306 PolarHBondContact O-N 2.74Å
289	R	97.3	Very high	95.1	Very high	56 Å²	56	67.6 Å²	67.6	21%	0.211	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	152.8	170.9	-60.7	-170.6	-172.1	102.1	4.3	110.3	G291 E292 P296 Q298 Y299 D303 D304	R289-G291 PolarHBondContact O-N 3.04Å; R289-E292 HydrophobicContact CB-CB 4.31Å; R289-E292 HydrophobicContact CB-CG 4.13Å; R289-E292 WeakPolarHBondContact CD-OE1 3.39Å; R289-E292 IonicContact CZ-OE1 3.06Å; R289-E292 IonicContact NH1-OE1 2.95Å; R289-E292 PolarHBondContact NH1-OE1 2.73Å; R289-E292 IonicContact NH1-OE2 3.41Å; R289-E292 PolarHBondContact NH1-OE2 3.4Å; R289-E292 PolarHBondContact O-N 2.91Å; R289-P296 HydrophobicContact CG-CG 4.33Å; R289-Q298 PolarHBondContact NH2-O 3.1Å; R289-Y299 HydrophobicContact CG-CD1 4.07Å; R289-Y299 HydrophobicContact CG-CE1 3.91Å; R289-D303 IonicContact CZ-OD2 3.07Å; R289-D303 IonicContact NE-OD2 3.3Å; R289-D303 PolarHBondContact NE-OD2 3.31Å; R289-D303 IonicContact NH2-OD2 3.65Å; R289-D304 WeakPolarHBondContact CA-O 3.43Å
290	V	95.2	Very high	95.2	Very high	83 Å²	83	65.8 Å²	65.8	50%	0.503	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	127.8	170.9	176.1	0	0	0	0	109.2	E292 D304 V306 V353	V290-E292 VanDerWaalsContact C-N 3.34Å; V290-D304 HydrophobicContact CB-CB 4.2Å; V290-D304 HydrophobicContact CG2-CB 3.72Å; V290-D304 PolarHBondContact N-O 2.93Å; V290-V306 HydrophobicContact CG2-CG2 3.7Å; V290-V353 HydrophobicContact CG2-CG1 3.85Å
291	G	93.2	Very high	95.2	Very high	84 Å²	84	65.8 Å²	65.8	87%	0.866	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.7	-14	-176.5	0	0	0	0	0	115.1	R289	R289-G291 PolarHBondContact O-N 3.04Å
292	E	94.3	Very high	95.2	Very high	78 Å²	78	64.4 Å²	64.4	36%	0.364	37%	0.365	S	S	.	.			trans	-97.1	165.8	170.1	-63.4	177.8	-168	0	0	110.3	H288 R289 V290	H288-E292 PolarHBondContact CE1-O 3.33Å; H288-E292 VanDerWaalsContact CE1-O 3.22Å; H288-E292 PolarHBondContact ND1-O 3.06Å; R289-E292 HydrophobicContact CB-CB 4.31Å; R289-E292 HydrophobicContact CB-CG 4.13Å; R289-E292 WeakPolarHBondContact CD-OE1 3.39Å; R289-E292 IonicContact CZ-OE1 3.06Å; R289-E292 IonicContact NH1-OE1 2.95Å; R289-E292 PolarHBondContact NH1-OE1 2.73Å; R289-E292 IonicContact NH1-OE2 3.41Å; R289-E292 PolarHBondContact NH1-OE2 3.4Å; R289-E292 PolarHBondContact O-N 2.91Å; V290-E292 VanDerWaalsContact C-N 3.34Å
293	T	91.3	Very high	95.2	Very high	124 Å²	124	62 Å²	62	76%	0.761	36%	0.355	S	S	*	.	S	Bend	trans	-117.9	-24	176.1	53.3	0	0	0	0	113.6
294	L	93.7	Very high	95.3	Very high	130 Å²	130	62.8 Å²	62.8	68%	0.681	36%	0.356	S	S	*	.	S	Bend	trans	-100.5	147.3	-179.9	-65.6	175.9	0	0	0	110.4	H288	H288-L294 WeakPolarHBondContact CB-O 3.37Å
295	P	94	Very high	95.3	Very high	74 Å²	74	59.4 Å²	59.4	48%	0.481	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-64.1	128.5	171.5	25.2	-32	0	0	0	110	H287	H287-P295 VanDerWaalsContact CE1-CB 3.5Å; H287-P295 WeakPolarHBondContact CE1-CB 3.42Å; H287-P295 WeakPolarHBondContact O-CA 3.47Å; H287-P295 VanDerWaalsContact O-CB 3.26Å; H287-P295 WeakPolarHBondContact O-CB 3.38Å
296	P	93.4	Very high	95.4	Very high	25 Å²	25	58.1 Å²	58.1	16%	0.162	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-69.9	156.4	171.2	31.7	-36.1	0	0	0	110.4	R289 Q298 Y299	R289-P296 HydrophobicContact CG-CG 4.33Å; P296-Q298 PolarHBondContact O-N 3.14Å; P296-Y299 HydrophobicContact CG-CD1 3.8Å; P296-Y299 HydrophobicContact CG-CD2 4.23Å; P296-Y299 HydrophobicContact CG-CE1 3.47Å; P296-Y299 VanDerWaalsContact CG-CE1 3.47Å; P296-Y299 HydrophobicContact CG-CE2 3.92Å; P296-Y299 HydrophobicContact CG-CG 4.18Å
297	S	92.3	Very high	95.4	Very high	110 Å²	110	53.1 Å²	53.1	77%	0.769	31%	0.313	S	S	*	.	S	Bend	trans	-63.4	-27.4	174.4	57.6	0	0	0	0	113.1	P384	S297-P384 WeakPolarHBondContact O-CG 3.24Å
298	Q	93.5	Very high	95.4	Very high	79 Å²	79	52.2 Å²	52.2	37%	0.369	31%	0.31	S	S	.	.	S	Bend	trans	-155.4	145.5	177.9	59	-173.7	-2.8	0	0	110.1	R289 P296 P384 R386	R289-Q298 PolarHBondContact NH2-O 3.1Å; P296-Q298 PolarHBondContact O-N 3.14Å; Q298-P384 HydrophobicContact CB-CB 4.48Å; Q298-P384 HydrophobicContact CB-CG 3.85Å; Q298-R386 VanDerWaalsContact NE2-NE 3.19Å
299	Y	96.7	Very high	95.4	Very high	1 Å²	1	50.4 Å²	50.4	0%	0.004	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	161.5	173.1	-69.3	-85.6	0	0	0	111	H287 H288 R289 P296 D303 V305 L356 F365 V383 P384 V385 R386	H287-Y299 AromaticContact ND1-CE2 3.87Å; H287-Y299 AromaticContact ND1-CZ 3.84Å; H287-Y299 PolarHBondContact ND1-OH 3.42Å; H288-Y299 WeakPolarHBondContact CA-OH 3.43Å; H288-Y299 PolarHBondContact N-OH 2.87Å; R289-Y299 HydrophobicContact CG-CD1 4.07Å; R289-Y299 HydrophobicContact CG-CE1 3.91Å; P296-Y299 HydrophobicContact CG-CD1 3.8Å; P296-Y299 HydrophobicContact CG-CD2 4.23Å; P296-Y299 HydrophobicContact CG-CE1 3.47Å; P296-Y299 VanDerWaalsContact CG-CE1 3.47Å; P296-Y299 HydrophobicContact CG-CE2 3.92Å; P296-Y299 HydrophobicContact CG-CG 4.18Å; Y299-D303 HydrophobicContact CD1-CB 4.47Å; Y299-V305 HydrophobicContact CD1-CG2 3.55Å; Y299-V305 HydrophobicContact CE1-CB 4.33Å; Y299-V305 HydrophobicContact CE1-CG1 3.92Å; Y299-V305 HydrophobicContact CE1-CG2 3.43Å; Y299-V305 VanDerWaalsContact CE1-CG2 3.43Å; Y299-V305 HydrophobicContact CG-CG2 4.48Å; Y299-L356 HydrophobicContact CD1-CD1 4.21Å; Y299-L356 HydrophobicContact CG-CD1 3.97Å; Y299-F365 HydrophobicContact CE2-CE2 4.4Å; Y299-V383 HydrophobicContact CD2-CB 4.07Å; Y299-V383 HydrophobicContact CD2-CG2 4.26Å; Y299-V383 HydrophobicContact CE2-CB 4.16Å; Y299-V383 HydrophobicContact CE2-CG1 4.09Å; Y299-V383 HydrophobicContact CE2-CG2 4.43Å; Y299-P384 PolarHBondContact N-O 2.89Å; Y299-V385 CarbonylContact O-C 3.56Å; Y299-V385 WeakPolarHBondContact O-CA 3.12Å; Y299-R386 WeakPolarHBondContact O-CG 3.38Å; Y299-R386 PolarHBondContact O-N 2.91Å
300	T	95.8	Very high	95.5	Very high	3 Å²	3	50.1 Å²	50.1	2%	0.018	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	153.6	169.9	-37.2	0	0	0	0	109.3	D303 R386 F388	T300-D303 PolarHBondContact N-OD2 3.42Å; T300-D303 WeakPolarHBondContact O-CB 3.49Å; T300-D303 VanDerWaalsContact O-CG 3.27Å; T300-D303 PolarHBondContact O-N 3.08Å; T300-R386 CarbonylContact C-O 3.6Å; T300-R386 WeakPolarHBondContact CA-O 3.48Å; T300-R386 WeakPolarHBondContact CG2-O 3.49Å; T300-F388 HydrophobicContact CG2-CD1 3.33Å; T300-F388 HydrophobicContact CG2-CE1 3.43Å; T300-F388 VanDerWaalsContact CG2-CE1 3.43Å; T300-F388 HydrophobicContact CG2-CG 3.99Å; T300-F388 HydrophobicContact CG2-CZ 4.18Å
301	I	96.2	Very high	95.6	Very high	13 Å²	13	46.1 Å²	46.1	7%	0.067	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	145.2	167.6	52.2	167.5	0	0	0	110.6	D303 D358 V385 R386 F388	I301-D303 PolarHBondContact O-N 3.43Å; I301-D303 VanDerWaalsContact O-N 3.1Å; I301-D358 WeakPolarHBondContact CD1-OD1 3.47Å; I301-V385 HydrophobicContact CG2-CG1 4Å; I301-R386 PolarHBondContact N-O 2.92Å; I301-F388 HydrophobicContact CD1-CD2 3.56Å; I301-F388 HydrophobicContact CD1-CE2 3.62Å; I301-F388 HydrophobicContact CD1-CG 4.45Å; I301-F388 HydrophobicContact CG1-CD2 3.78Å; I301-F388 HydrophobicContact CG1-CE2 3.59Å; I301-F388 HydrophobicContact CG1-CG 4.4Å; I301-F388 HydrophobicContact CG1-CZ 4.05Å; I301-F388 WeakPolarHBondContact O-CZ 3.3Å
302	L	95.6	Very high	95.8	Very high	67 Å²	67	43.1 Å²	43.1	35%	0.351	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.7	7	-179.8	-56.8	174.2	0	0	0	116.5	K355 L356 D358	L302-K355 WeakPolarHBondContact O-CE 3.41Å; L302-L356 WeakPolarHBondContact CA-O 3.36Å; L302-L356 PolarHBondContact N-O 3.47Å; L302-D358 HydrophobicContact CD2-CB 3.91Å; L302-D358 HydrophobicContact CG-CB 4.17Å
303	D	96.1	Very high	95.9	Very high	26 Å²	26	40.3 Å²	40.3	14%	0.139	23%	0.229	C	C	.	.			trans	-60	141.2	172.5	-81.2	-4.1	0	0	0	110.7	R289 Y299 T300 I301 V305 K355 L356	R289-D303 IonicContact CZ-OD2 3.07Å; R289-D303 IonicContact NE-OD2 3.3Å; R289-D303 PolarHBondContact NE-OD2 3.31Å; R289-D303 IonicContact NH2-OD2 3.65Å; Y299-D303 HydrophobicContact CD1-CB 4.47Å; T300-D303 PolarHBondContact N-OD2 3.42Å; T300-D303 WeakPolarHBondContact O-CB 3.49Å; T300-D303 VanDerWaalsContact O-CG 3.27Å; T300-D303 PolarHBondContact O-N 3.08Å; I301-D303 PolarHBondContact O-N 3.43Å; I301-D303 VanDerWaalsContact O-N 3.1Å; D303-V305 HydrophobicContact CB-CG2 4.22Å; D303-K355 WeakPolarHBondContact O-CA 3.45Å; D303-L356 HydrophobicContact CB-CD1 4.18Å; D303-L356 HydrophobicContact CB-CG 4.36Å; D303-L356 WeakPolarHBondContact O-CG 3.44Å; D303-L356 PolarHBondContact O-N 3.05Å
304	D	97.5	Very high	95.9	Very high	83 Å²	83	37.1 Å²	37.1	44%	0.444	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	121.7	167.1	-67.4	-50.9	0	0	0	109.5	R289 V290 K355	R289-D304 WeakPolarHBondContact CA-O 3.43Å; V290-D304 HydrophobicContact CB-CB 4.2Å; V290-D304 HydrophobicContact CG2-CB 3.72Å; V290-D304 PolarHBondContact N-O 2.93Å; D304-K355 WeakPolarHBondContact OD1-CB 3.42Å; D304-K355 WeakPolarHBondContact OD1-CG 3.38Å
305	V	97.5	Very high	95.7	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	136.6	-172.3	-179.8	0	0	0	0	110.4	H288 Y299 D303 V353 M354 L356 F365	H288-V305 WeakPolarHBondContact O-CA 3.48Å; H288-V305 WeakPolarHBondContact O-CG1 3.27Å; Y299-V305 HydrophobicContact CD1-CG2 3.55Å; Y299-V305 HydrophobicContact CE1-CB 4.33Å; Y299-V305 HydrophobicContact CE1-CG1 3.92Å; Y299-V305 HydrophobicContact CE1-CG2 3.43Å; Y299-V305 VanDerWaalsContact CE1-CG2 3.43Å; Y299-V305 HydrophobicContact CG-CG2 4.48Å; D303-V305 HydrophobicContact CB-CG2 4.22Å; V305-V353 WeakPolarHBondContact O-CA 3.25Å; V305-M354 PolarHBondContact N-O 2.85Å; V305-M354 PolarHBondContact O-N 3.22Å; V305-L356 HydrophobicContact CB-CD2 4.3Å; V305-L356 HydrophobicContact CG2-CD1 3.93Å; V305-L356 HydrophobicContact CG2-CD2 3.86Å; V305-L356 HydrophobicContact CG2-CG 3.74Å; V305-F365 HydrophobicContact CG1-CE1 4.4Å; V305-F365 HydrophobicContact CG1-CZ 3.91Å
306	V	97.6	Very high	95.2	Very high	13 Å²	13	33.3 Å²	33.3	8%	0.079	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	124.8	168.1	-171.9	0	0	0	0	107.7	H287 H288 V290 Q351 V353	H287-V306 VanDerWaalsContact CA-O 3.23Å; H287-V306 WeakPolarHBondContact CA-O 3.46Å; H288-V306 PolarHBondContact N-O 3.41Å; H288-V306 PolarHBondContact O-N 2.74Å; V290-V306 HydrophobicContact CG2-CG2 3.7Å; V306-Q351 HydrophobicContact CG1-CG 3.87Å; V306-V353 HydrophobicContact CG1-CG2 4.48Å; V306-V353 HydrophobicContact CG2-CG2 4.16Å
307	Y	97.9	Very high	94.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	139.4	168.8	-178.6	-87.5	0	0	0	108.9	V285 K286 H287 I309 L330 M343 Q351 L352 F365 V367	V285-Y307 HydrophobicContact CG1-CD2 4.43Å; V285-Y307 HydrophobicContact CG1-CE2 3.48Å; V285-Y307 VanDerWaalsContact CG1-CE2 3.48Å; V285-Y307 WeakPolarHBondContact CG1-OH 3.41Å; K286-Y307 CarbonylContact O-C 3.54Å; H287-Y307 HydrophobicContact CB-CD2 4.02Å; Y307-I309 HydrophobicContact CE1-CB 3.89Å; Y307-I309 HydrophobicContact CE1-CG2 3.95Å; Y307-L330 VanDerWaalsContact CB-CD2 3.44Å; Y307-L330 HydrophobicContact CD1-CD1 3.7Å; Y307-L330 HydrophobicContact CD1-CD2 3.55Å; Y307-L330 HydrophobicContact CD1-CG 4.17Å; Y307-L330 HydrophobicContact CD2-CD1 4.19Å; Y307-L330 HydrophobicContact CD2-CD2 4.17Å; Y307-L330 HydrophobicContact CE1-CD1 3.6Å; Y307-L330 HydrophobicContact CE1-CD2 4.33Å; Y307-L330 HydrophobicContact CE2-CD1 4.11Å; Y307-L330 HydrophobicContact CG-CD1 4Å; Y307-L330 HydrophobicContact CG-CD2 3.45Å; Y307-L330 VanDerWaalsContact CG-CD2 3.45Å; Y307-L330 HydrophobicContact CG-CG 4.37Å; Y307-M343 HydrophobicContact CD1-SD 4.08Å; Y307-M343 HydrophobicContact CE1-SD 4.27Å; Y307-Q351 VanDerWaalsContact O-CA 3.29Å; Y307-Q351 WeakPolarHBondContact O-CA 3.42Å; Y307-L352 PolarHBondContact N-O 3.36Å; Y307-L352 PolarHBondContact O-N 3.35Å; Y307-F365 HydrophobicContact CD2-CB 3.88Å; Y307-F365 AromaticContact CD2-CD1 3.65Å; Y307-F365 HydrophobicContact CD2-CD1 3.65Å; Y307-F365 HydrophobicContact CD2-CD2 4.14Å; Y307-F365 HydrophobicContact CD2-CE1 4.19Å; Y307-F365 AromaticContact CD2-CG 3.63Å; Y307-F365 HydrophobicContact CD2-CG 3.63Å; Y307-F365 HydrophobicContact CE2-CB 3.49Å; Y307-F365 VanDerWaalsContact CE2-CB 3.49Å; Y307-F365 HydrophobicContact CE2-CD1 4.18Å; Y307-F365 HydrophobicContact CE2-CD2 4.31Å; Y307-F365 AromaticContact CE2-CG 3.76Å; Y307-F365 HydrophobicContact CE2-CG 3.76Å; Y307-F365 HydrophobicContact CG-CD1 4.31Å; Y307-V367 HydrophobicContact CE1-CG2 3.77Å
308	T	97.5	Very high	94.5	Very high	10 Å²	10	35.2 Å²	35.2	6%	0.061	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	132.1	178.6	-56.8	0	0	0	0	110.5	V285 K286 Y350 Q351	V285-T308 CarbonylContact C-O 3.6Å; V285-T308 WeakPolarHBondContact CA-O 3.46Å; K286-T308 PolarHBondContact N-O 2.63Å; K286-T308 PolarHBondContact O-N 3.03Å; T308-Y350 CarbonylContact C-O 3.54Å; T308-Y350 WeakPolarHBondContact CA-O 3.49Å; T308-Q351 PolarHBondContact OG1-NE2 3.12Å
309	I	98	Very high	94.5	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	133.5	174.5	-175.3	170.1	0	0	0	109.4	H282 V285 Y307 I311 M343 Y350 V367	H282-I309 HydrophobicContact CB-CD1 3.79Å; H282-I309 HydrophobicContact CB-CG1 3.9Å; V285-I309 HydrophobicContact CG2-CB 4.42Å; V285-I309 HydrophobicContact CG2-CD1 4.01Å; V285-I309 HydrophobicContact CG2-CG1 3.96Å; Y307-I309 HydrophobicContact CE1-CB 3.89Å; Y307-I309 HydrophobicContact CE1-CG2 3.95Å; I309-I311 HydrophobicContact CD1-CG1 4.38Å; I309-I311 HydrophobicContact CG1-CG1 4.12Å; I309-I311 HydrophobicContact CG2-CD1 4.3Å; I309-I311 HydrophobicContact CG2-CG1 4.36Å; I309-M343 HydrophobicContact CG2-CE 3.69Å; I309-M343 HydrophobicContact CG2-SD 4.05Å; I309-Y350 PolarHBondContact N-O 3.05Å; I309-Y350 PolarHBondContact O-N 2.92Å; I309-V367 HydrophobicContact CD1-CB 4.18Å; I309-V367 HydrophobicContact CD1-CG1 4.27Å; I309-V367 HydrophobicContact CD1-CG2 4.16Å; I309-V367 HydrophobicContact CG2-CG2 4.3Å
310	K	97.8	Very high	94.4	Very high	49 Å²	49	40 Å²	40	21%	0.213	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	121.1	173.2	-174.2	176.3	-177.9	-165.6	0	109.7	H282 T283 Y284 E312 G348 E349	H282-K310 CarbonylContact C-O 3.46Å; H282-K310 WeakPolarHBondContact CA-O 3.18Å; T283-K310 PolarHBondContact N-O 3.27Å; Y284-K310 HydrophobicContact CD1-CB 4.18Å; Y284-K310 HydrophobicContact CD1-CD 4.43Å; Y284-K310 HydrophobicContact CD2-CB 4.36Å; Y284-K310 HydrophobicContact CE1-CB 3.96Å; Y284-K310 HydrophobicContact CE1-CD 3.81Å; Y284-K310 HydrophobicContact CE2-CB 4.12Å; Y284-K310 HydrophobicContact CG-CB 4.42Å; Y284-K310 PolarHBondContact O-N 3.2Å; Y284-K310 VanDerWaalsContact O-N 3.11Å; K310-E312 WeakPolarHBondContact CE-OE1 3.47Å; K310-E312 IonicContact NZ-OE1 2.89Å; K310-E312 PolarHBondContact NZ-OE1 3.39Å; K310-G348 WeakPolarHBondContact CA-O 3.43Å; K310-E349 HydrophobicContact CB-CG 4.24Å; K310-E349 HydrophobicContact CD-CG 4.32Å; K310-E349 HydrophobicContact CG-CG 4.1Å
311	I	98.1	Very high	94.4	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	134	-179.2	-52.3	175	0	0	0	109.3	R281 I309 F323 V328 G348 Y350 L377	R281-I311 WeakPolarHBondContact O-CA 3.29Å; I309-I311 HydrophobicContact CD1-CG1 4.38Å; I309-I311 HydrophobicContact CG1-CG1 4.12Å; I309-I311 HydrophobicContact CG2-CD1 4.3Å; I309-I311 HydrophobicContact CG2-CG1 4.36Å; I311-F323 HydrophobicContact CB-CB 4.24Å; I311-F323 HydrophobicContact CB-CD1 4.44Å; I311-F323 HydrophobicContact CG2-CB 3.81Å; I311-F323 HydrophobicContact CG2-CD1 3.8Å; I311-F323 HydrophobicContact CG2-CG 4.14Å; I311-F323 PolarHBondContact O-N 2.58Å; I311-V328 HydrophobicContact CD1-CG1 3.84Å; I311-V328 HydrophobicContact CD1-CG2 4.45Å; I311-G348 PolarHBondContact N-O 2.89Å; I311-Y350 HydrophobicContact CB-CD2 4.12Å; I311-Y350 HydrophobicContact CB-CE2 3.88Å; I311-Y350 HydrophobicContact CD1-CD2 3.71Å; I311-Y350 HydrophobicContact CD1-CE2 3.84Å; I311-Y350 HydrophobicContact CD1-CG 4.32Å; I311-Y350 HydrophobicContact CG1-CD2 3.87Å; I311-Y350 HydrophobicContact CG1-CE2 4.07Å; I311-L377 HydrophobicContact CB-CD2 4.43Å; I311-L377 HydrophobicContact CD1-CD2 3.59Å; I311-L377 HydrophobicContact CG1-CD2 3.84Å; I311-L377 HydrophobicContact CG2-CD2 3.73Å
312	E	97	Very high	94.4	Very high	20 Å²	20	43.7 Å²	43.7	9%	0.093	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	147.7	179	-68.6	172.4	-175.6	0	0	110	L280 R281 T283 K310 W320 V321	L280-E312 WeakPolarHBondContact CA-O 3.21Å; R281-E312 HydrophobicContact CG-CB 4.24Å; R281-E312 IonicContact CZ-OE2 3.12Å; R281-E312 PolarHBondContact N-O 3.36Å; R281-E312 IonicContact NE-OE2 2.92Å; R281-E312 PolarHBondContact NE-OE2 3.09Å; R281-E312 IonicContact NH2-OE2 3.33Å; R281-E312 PolarHBondContact NH2-OE2 2.74Å; R281-E312 PolarHBondContact O-N 2.81Å; T283-E312 PolarHBondContact OG1-OE1 2.98Å; T283-E312 PolarHBondContact OG1-OE2 3.47Å; K310-E312 WeakPolarHBondContact CE-OE1 3.47Å; K310-E312 IonicContact NZ-OE1 2.89Å; K310-E312 PolarHBondContact NZ-OE1 3.39Å; E312-W320 HydrophobicContact CB-CB 4.43Å; E312-W320 HydrophobicContact CB-CE3 4.08Å; E312-V321 CarbonylContact C-O 3.53Å; E312-V321 VanDerWaalsContact CA-O 3.27Å; E312-V321 WeakPolarHBondContact CA-O 3.34Å
313	T	96.4	Very high	94.5	Very high	20 Å²	20	40.8 Å²	40.8	12%	0.123	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	155.5	171.2	-175.8	0	0	0	0	110.5	Q279 W320 V321 F323	Q279-T313 WeakPolarHBondContact O-CA 3.38Å; Q279-T313 PolarHBondContact O-OG1 2.95Å; T313-W320 CarbonylContact O-C 3.53Å; T313-W320 WeakPolarHBondContact O-CA 3.5Å; T313-V321 HydrophobicContact CG2-CG2 3.82Å; T313-V321 PolarHBondContact N-O 3.38Å; T313-V321 WeakPolarHBondContact O-CG2 3.46Å; T313-V321 PolarHBondContact O-N 3.09Å; T313-V321 VanDerWaalsContact O-O 3.09Å; T313-F323 HydrophobicContact CG2-CB 4.25Å; T313-F323 HydrophobicContact CG2-CD2 4Å
314	K	92.1	Very high	94.3	Very high	57 Å²	57	44.4 Å²	44.4	25%	0.248	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	138.6	167.9	-70.2	-174.9	-174.1	174.5	0	111.4	G275 E276 Q279 N319 W320	G275-K314 PolarHBondContact O-NZ 3.27Å; E276-K314 WeakPolarHBondContact O-CB 3.22Å; Q279-K314 HydrophobicContact CB-CB 4.41Å; Q279-K314 HydrophobicContact CB-CD 3.99Å; Q279-K314 HydrophobicContact CB-CG 4Å; Q279-K314 HydrophobicContact CG-CD 3.98Å; Q279-K314 PolarHBondContact O-N 2.96Å; K314-N319 CarbonylContact C-O 3.59Å; K314-N319 WeakPolarHBondContact CA-O 3.4Å; K314-W320 HydrophobicContact CD-CH2 4.46Å; K314-W320 HydrophobicContact CD-CZ2 4.26Å; K314-W320 HydrophobicContact CG-CD2 3.93Å; K314-W320 HydrophobicContact CG-CE3 3.92Å; K314-W320 HydrophobicContact CG-CH2 3.93Å; K314-W320 HydrophobicContact CG-CZ2 3.92Å; K314-W320 HydrophobicContact CG-CZ3 3.91Å
315	D	89.3	Confident	94.1	Very high	41 Å²	41	41.1 Å²	41.1	22%	0.219	23%	0.225	C	C	.	.			trans	-82.9	176.6	165.3	76.4	-2.5	0	0	0	111.5	N317 G318 N319 V321	D315-N317 PolarHBondContact O-N 2.77Å; D315-N317 VanDerWaalsContact OD1-C 3.29Å; D315-N317 WeakPolarHBondContact OD1-CA 3.29Å; D315-N317 WeakPolarHBondContact OD1-CB 3.35Å; D315-N317 PolarHBondContact OD1-N 3.28Å; D315-G318 PolarHBondContact O-N 3.31Å; D315-G318 VanDerWaalsContact O-N 3.08Å; D315-G318 PolarHBondContact OD1-N 3.2Å; D315-N319 PolarHBondContact N-O 3.44Å; D315-N319 WeakPolarHBondContact OD1-CA 3.35Å; D315-N319 PolarHBondContact OD1-N 3.09Å; D315-V321 HydrophobicContact CB-CG1 3.99Å; D315-V321 HydrophobicContact CB-CG2 4.05Å
316	D	83.7	Confident	94	Very high	83 Å²	83	46.9 Å²	46.9	44%	0.444	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-13.4	178.2	-79.5	-15.4	0	0	0	113.9	R277	R277-D316 IonicContact CZ-OD1 3.72Å; R277-D316 VanDerWaalsContact CZ-OD1 3.3Å; R277-D316 IonicContact NE-OD1 3.54Å; R277-D316 PolarHBondContact NE-OD1 3.45Å; R277-D316 IonicContact NH2-OD1 2.79Å; R277-D316 PolarHBondContact NH2-OD1 2.87Å; R277-D316 IonicContact NH2-OD2 3.87Å; R277-D316 PolarHBondContact NH2-OD2 3.08Å
317	N	85.1	Confident	93.9	Very high	134 Å²	134	48.3 Å²	48.3	72%	0.717	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	0.7	176.5	-58.3	-47.4	0	0	0	112.2	D315 N319	D315-N317 PolarHBondContact O-N 2.77Å; D315-N317 VanDerWaalsContact OD1-C 3.29Å; D315-N317 WeakPolarHBondContact OD1-CA 3.29Å; D315-N317 WeakPolarHBondContact OD1-CB 3.35Å; D315-N317 PolarHBondContact OD1-N 3.28Å; N317-N319 VanDerWaalsContact C-N 3.34Å
318	G	85.9	Confident	93.9	Very high	41 Å²	41	48.3 Å²	48.3	42%	0.423	26%	0.263	S	S	.	.	S	Bend	trans	82	4.4	-177.3	0	0	0	0	0	115.1	D315	D315-G318 PolarHBondContact O-N 3.31Å; D315-G318 VanDerWaalsContact O-N 3.08Å; D315-G318 PolarHBondContact OD1-N 3.2Å
319	N	92.6	Very high	93.9	Very high	95 Å²	95	50.9 Å²	50.9	51%	0.508	27%	0.274	S	S	.	.			trans	-81	142.1	175.9	-58.2	-56.4	0	0	0	111	K314 D315 N317 V321	K314-N319 CarbonylContact C-O 3.59Å; K314-N319 WeakPolarHBondContact CA-O 3.4Å; D315-N319 PolarHBondContact N-O 3.44Å; D315-N319 WeakPolarHBondContact OD1-CA 3.35Å; D315-N319 PolarHBondContact OD1-N 3.09Å; N317-N319 VanDerWaalsContact C-N 3.34Å; N319-V321 PolarHBondContact O-N 3Å
320	W	94.9	Very high	93.9	Very high	86 Å²	86	50.9 Å²	50.9	33%	0.326	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	115.1	173.1	-66.8	96.9	0	0	0	110.3	Q279 R281 E312 T313 K314	Q279-W320 HydrophobicContact CB-CH2 3.86Å; Q279-W320 HydrophobicContact CB-CZ3 4.17Å; R281-W320 HydrophobicContact CB-CH2 4.22Å; R281-W320 HydrophobicContact CB-CZ3 4.12Å; R281-W320 HydrophobicContact CG-CD2 4.46Å; R281-W320 HydrophobicContact CG-CE3 3.83Å; R281-W320 HydrophobicContact CG-CH2 3.93Å; R281-W320 HydrophobicContact CG-CZ3 3.54Å; R281-W320 VanDerWaalsContact CZ-CD1 3.48Å; R281-W320 VanDerWaalsContact CZ-CE2 3.46Å; R281-W320 VanDerWaalsContact NE-CD2 3.33Å; R281-W320 VanDerWaalsContact NH2-CD1 3.33Å; E312-W320 HydrophobicContact CB-CB 4.43Å; E312-W320 HydrophobicContact CB-CE3 4.08Å; T313-W320 CarbonylContact O-C 3.53Å; T313-W320 WeakPolarHBondContact O-CA 3.5Å; K314-W320 HydrophobicContact CD-CH2 4.46Å; K314-W320 HydrophobicContact CD-CZ2 4.26Å; K314-W320 HydrophobicContact CG-CD2 3.93Å; K314-W320 HydrophobicContact CG-CE3 3.92Å; K314-W320 HydrophobicContact CG-CH2 3.93Å; K314-W320 HydrophobicContact CG-CZ2 3.92Å; K314-W320 HydrophobicContact CG-CZ3 3.91Å
321	V	95.8	Very high	93.9	Very high	49 Å²	49	50.2 Å²	50.2	30%	0.297	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	156	178.5	-62.2	0	0	0	0	110.6	E312 T313 D315 N319 F323	E312-V321 CarbonylContact C-O 3.53Å; E312-V321 VanDerWaalsContact CA-O 3.27Å; E312-V321 WeakPolarHBondContact CA-O 3.34Å; T313-V321 HydrophobicContact CG2-CG2 3.82Å; T313-V321 PolarHBondContact N-O 3.38Å; T313-V321 WeakPolarHBondContact O-CG2 3.46Å; T313-V321 PolarHBondContact O-N 3.09Å; T313-V321 VanDerWaalsContact O-O 3.09Å; D315-V321 HydrophobicContact CB-CG1 3.99Å; D315-V321 HydrophobicContact CB-CG2 4.05Å; N319-V321 PolarHBondContact O-N 3Å; V321-F323 PolarHBondContact O-N 3.16Å
322	P	96.7	Very high	93.9	Very high	43 Å²	43	50.2 Å²	50.2	28%	0.279	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	131	177.1	-24.3	34.5	0	0	0	112.7	N347	P322-N347 VanDerWaalsContact CB-C 3.48Å; P322-N347 WeakPolarHBondContact CB-O 3.31Å; P322-N347 WeakPolarHBondContact CG-OD1 3.27Å
323	F	96.1	Very high	93.9	Very high	6 Å²	6	50.4 Å²	50.4	3%	0.026	27%	0.274	C	S	.	.			trans	-82.5	132.3	175.5	-178.1	-117.8	0	0	0	110.3	L280 I311 T313 V321 A325 V328 G348 Y350 Y369 Y374	L280-F323 HydrophobicContact CD1-CE1 4.32Å; L280-F323 HydrophobicContact CD1-CZ 4.29Å; L280-F323 HydrophobicContact CD2-CB 4.33Å; L280-F323 HydrophobicContact CD2-CD1 4.08Å; L280-F323 HydrophobicContact CD2-CD2 3.56Å; L280-F323 HydrophobicContact CD2-CE1 4.24Å; L280-F323 HydrophobicContact CD2-CE2 3.78Å; L280-F323 HydrophobicContact CD2-CG 3.73Å; L280-F323 HydrophobicContact CD2-CZ 4.1Å; I311-F323 HydrophobicContact CB-CB 4.24Å; I311-F323 HydrophobicContact CB-CD1 4.44Å; I311-F323 HydrophobicContact CG2-CB 3.81Å; I311-F323 HydrophobicContact CG2-CD1 3.8Å; I311-F323 HydrophobicContact CG2-CG 4.14Å; I311-F323 PolarHBondContact O-N 2.58Å; T313-F323 HydrophobicContact CG2-CB 4.25Å; T313-F323 HydrophobicContact CG2-CD2 4Å; V321-F323 PolarHBondContact O-N 3.16Å; F323-A325 HydrophobicContact CD1-CB 4.21Å; F323-A325 HydrophobicContact CE1-CB 3.45Å; F323-A325 VanDerWaalsContact CE1-CB 3.45Å; F323-A325 HydrophobicContact CE2-CB 4.45Å; F323-A325 HydrophobicContact CZ-CB 3.59Å; F323-V328 HydrophobicContact CE1-CG2 4.28Å; F323-G348 VanDerWaalsContact O-CA 3.3Å; F323-G348 WeakPolarHBondContact O-CA 3.45Å; F323-Y350 HydrophobicContact CD1-CE2 4.45Å; F323-Y350 WeakPolarHBondContact CD1-OH 3.39Å; F323-Y350 WeakPolarHBondContact O-CE2 3.48Å; F323-Y350 PolarHBondContact O-OH 3.14Å; F323-Y350 VanDerWaalsContact O-OH 3.05Å; F323-Y369 HydrophobicContact CE1-CD1 4.44Å; F323-Y369 AromaticContact CE1-CE1 3.73Å; F323-Y369 HydrophobicContact CE1-CE1 3.73Å; F323-Y369 AromaticContact CE1-CZ 3.94Å; F323-Y369 AromaticContact CZ-CE1 3.8Å; F323-Y369 HydrophobicContact CZ-CE1 3.8Å; F323-Y374 HydrophobicContact CE2-CD1 4.37Å; F323-Y374 AromaticContact CE2-CE1 3.75Å; F323-Y374 HydrophobicContact CE2-CE1 3.75Å; F323-Y374 HydrophobicContact CE2-CE2 4.41Å; F323-Y374 AromaticContact CE2-CZ 3.77Å; F323-Y374 HydrophobicContact CZ-CE1 4.45Å
324	N	93	Very high	93.8	Very high	102 Å²	102	53.6 Å²	53.6	55%	0.545	28%	0.284	S	S	.	.			trans	-123.3	116.4	-179.4	-61.8	-43.7	0	0	0	109.6
325	A	94	Very high	93.8	Very high	14 Å²	14	58.6 Å²	58.6	12%	0.116	31%	0.312	C	S	.	.			trans	-156.7	129.3	-177.7	0	0	0	0	0	110.3	F323 D327 V328 Y350	F323-A325 HydrophobicContact CD1-CB 4.21Å; F323-A325 HydrophobicContact CE1-CB 3.45Å; F323-A325 VanDerWaalsContact CE1-CB 3.45Å; F323-A325 HydrophobicContact CE2-CB 4.45Å; F323-A325 HydrophobicContact CZ-CB 3.59Å; A325-D327 PolarHBondContact O-N 3.29Å; A325-V328 HydrophobicContact CB-CG2 4.1Å; A325-Y350 PolarHBondContact N-OH 3.15Å; A325-Y350 VanDerWaalsContact O-CE1 3.25Å; A325-Y350 WeakPolarHBondContact O-CE1 3.45Å; A325-Y350 PolarHBondContact O-OH 3.35Å
326	D	94.9	Very high	94.1	Very high	122 Å²	122	62 Å²	62	65%	0.652	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	2.1	-175	-62	-48	0	0	0	114.3	K342 H345	D326-K342 WeakPolarHBondContact O-CD 3.2Å; D326-H345 IonicContact OD1-CE1 2.69Å; D326-H345 PolarHBondContact OD1-CE1 2.92Å; D326-H345 IonicContact OD1-ND1 3.51Å
327	D	96.2	Very high	94.7	Very high	42 Å²	42	60.7 Å²	60.7	23%	0.225	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.3	7.3	-167.9	74.6	-31.5	0	0	0	114	A325 Q329 Y369 R371	A325-D327 PolarHBondContact O-N 3.29Å; D327-Q329 PolarHBondContact O-N 2.9Å; D327-Y369 VanDerWaalsContact OD1-CE2 3.3Å; D327-Y369 WeakPolarHBondContact OD1-CE2 3.36Å; D327-Y369 PolarHBondContact OD1-OH 3.07Å; D327-R371 IonicContact OD2-CZ 3.85Å; D327-R371 IonicContact OD2-NE 2.68Å; D327-R371 PolarHBondContact OD2-NE 3.5Å; D327-R371 IonicContact OD2-NH2 3.06Å; D327-R371 PolarHBondContact OD2-NH2 2.94Å
328	V	97.5	Very high	95.1	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.31	C	S	.	.			trans	-68.9	128.8	172.2	-169.1	0	0	0	0	109.3	I311 F323 A325 K342 M343 Y350 V367 Y369	I311-V328 HydrophobicContact CD1-CG1 3.84Å; I311-V328 HydrophobicContact CD1-CG2 4.45Å; F323-V328 HydrophobicContact CE1-CG2 4.28Å; A325-V328 HydrophobicContact CB-CG2 4.1Å; V328-K342 WeakPolarHBondContact O-CA 3.47Å; V328-M343 HydrophobicContact CB-CE 4.12Å; V328-M343 HydrophobicContact CG1-CE 3.32Å; V328-M343 PolarHBondContact O-N 3.31Å; V328-Y350 HydrophobicContact CB-CD1 3.69Å; V328-Y350 HydrophobicContact CB-CE1 3.59Å; V328-Y350 HydrophobicContact CB-CG 4.46Å; V328-Y350 HydrophobicContact CG1-CD1 4.18Å; V328-Y350 HydrophobicContact CG1-CE1 4.38Å; V328-Y350 HydrophobicContact CG2-CD1 3.91Å; V328-Y350 HydrophobicContact CG2-CE1 3.29Å; V328-Y350 HydrophobicContact CG2-CE2 4.42Å; V328-V367 HydrophobicContact CG1-CG1 4.01Å; V328-Y369 HydrophobicContact CB-CD2 4.3Å; V328-Y369 HydrophobicContact CB-CE2 4.39Å; V328-Y369 HydrophobicContact CG1-CD2 4.29Å; V328-Y369 HydrophobicContact CG2-CD2 3.95Å; V328-Y369 HydrophobicContact CG2-CE2 3.74Å
329	Q	97.1	Very high	95.6	Very high	65 Å²	65	57.5 Å²	57.5	30%	0.304	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	146.7	-175.2	-66.2	176.4	10.5	0	0	111.2	D327 K341 K342	D327-Q329 PolarHBondContact O-N 2.9Å; Q329-K341 CarbonylContact C-O 3.55Å; Q329-K341 VanDerWaalsContact CA-O 3.27Å; Q329-K341 WeakPolarHBondContact CA-O 3.49Å; Q329-K342 HydrophobicContact CG-CG 3.82Å
330	L	98	Very high	95.9	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	133.1	165	179.9	65.2	0	0	0	109.1	Y307 R340 K341 M343 L352 M354 F365 V367	Y307-L330 VanDerWaalsContact CB-CD2 3.44Å; Y307-L330 HydrophobicContact CD1-CD1 3.7Å; Y307-L330 HydrophobicContact CD1-CD2 3.55Å; Y307-L330 HydrophobicContact CD1-CG 4.17Å; Y307-L330 HydrophobicContact CD2-CD1 4.19Å; Y307-L330 HydrophobicContact CD2-CD2 4.17Å; Y307-L330 HydrophobicContact CE1-CD1 3.6Å; Y307-L330 HydrophobicContact CE1-CD2 4.33Å; Y307-L330 HydrophobicContact CE2-CD1 4.11Å; Y307-L330 HydrophobicContact CG-CD1 4Å; Y307-L330 HydrophobicContact CG-CD2 3.45Å; Y307-L330 VanDerWaalsContact CG-CD2 3.45Å; Y307-L330 HydrophobicContact CG-CG 4.37Å; L330-R340 WeakPolarHBondContact O-CA 3.42Å; L330-K341 PolarHBondContact N-O 2.92Å; L330-K341 PolarHBondContact O-N 3.36Å; L330-K341 VanDerWaalsContact O-N 3.07Å; L330-M343 HydrophobicContact CB-CG 4.01Å; L330-M343 HydrophobicContact CB-SD 3.92Å; L330-L352 HydrophobicContact CB-CD2 4Å; L330-L352 HydrophobicContact CD2-CB 4.43Å; L330-L352 HydrophobicContact CD2-CD2 4.01Å; L330-M354 HydrophobicContact CD2-SD 3.87Å; L330-F365 HydrophobicContact CD1-CB 4.11Å; L330-F365 HydrophobicContact CD1-CD1 4.21Å; L330-F365 HydrophobicContact CD2-CD1 4.07Å; L330-F365 HydrophobicContact CG-CD1 4.49Å; L330-V367 HydrophobicContact CD1-CG2 3.77Å
331	E	98	Very high	96	Very high	35 Å²	35	60.9 Å²	60.9	16%	0.164	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	139.5	169.1	-53.9	-171.1	178.2	0	0	110.9	V333 I339 R340 F365 V366	E331-V333 HydrophobicContact CB-CG2 3.63Å; E331-I339 CarbonylContact C-O 3.49Å; E331-I339 WeakPolarHBondContact CA-O 3.41Å; E331-R340 VanDerWaalsContact CD-NE 3.32Å; E331-R340 VanDerWaalsContact CD-NH2 3.26Å; E331-R340 HydrophobicContact CG-CB 4.33Å; E331-R340 HydrophobicContact CG-CG 4.13Å; E331-R340 IonicContact OE1-CZ 2.85Å; E331-R340 IonicContact OE1-NE 3.95Å; E331-R340 PolarHBondContact OE1-NE 2.96Å; E331-R340 IonicContact OE1-NH2 3.77Å; E331-R340 PolarHBondContact OE1-NH2 3.4Å; E331-R340 IonicContact OE2-CZ 2.72Å; E331-R340 IonicContact OE2-NE 3.47Å; E331-R340 IonicContact OE2-NH2 3.76Å; E331-R340 PolarHBondContact OE2-NH2 2.72Å; E331-R340 VanDerWaalsContact OE2-NH2 3.12Å; E331-F365 CarbonylContact O-C 3.57Å; E331-F365 WeakPolarHBondContact O-CA 3.38Å; E331-V366 HydrophobicContact CB-CB 4.25Å; E331-V366 PolarHBondContact N-O 3.26Å; E331-V366 PolarHBondContact O-N 3.11Å
332	F	97.9	Very high	96.1	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	105.3	169.3	-163.8	-114.9	0	0	0	109	F338 I339 M354 L356 P357 F363 K364 F365 V383 V385	F332-F338 PolarHBondContact O-N 3.01Å; F332-I339 HydrophobicContact CB-CB 3.96Å; F332-I339 HydrophobicContact CB-CD1 4.31Å; F332-I339 HydrophobicContact CB-CG1 4.41Å; F332-I339 PolarHBondContact N-O 3.37Å; F332-I339 PolarHBondContact O-N 3.04Å; F332-M354 HydrophobicContact CB-CE 3.67Å; F332-M354 HydrophobicContact CB-SD 4.41Å; F332-M354 HydrophobicContact CD1-CE 4.13Å; F332-M354 HydrophobicContact CD2-CE 3.65Å; F332-M354 HydrophobicContact CE2-CE 4.26Å; F332-M354 HydrophobicContact CG-CE 3.55Å; F332-L356 HydrophobicContact CD1-CD2 4.21Å; F332-L356 HydrophobicContact CE1-CD2 3.74Å; F332-L356 HydrophobicContact CE2-CD2 4.17Å; F332-L356 HydrophobicContact CZ-CD1 4.31Å; F332-L356 HydrophobicContact CZ-CD2 3.7Å; F332-P357 HydrophobicContact CD1-CG 4.33Å; F332-P357 HydrophobicContact CE1-CG 4.31Å; F332-F363 HydrophobicContact CD1-CB 4.23Å; F332-F363 AromaticContact CD1-CD1 3.37Å; F332-F363 HydrophobicContact CD1-CD1 3.37Å; F332-F363 AromaticContact CD1-CE1 3.88Å; F332-F363 HydrophobicContact CD1-CE1 3.88Å; F332-F363 AromaticContact CD1-CG 3.95Å; F332-F363 HydrophobicContact CD1-CG 3.95Å; F332-F363 HydrophobicContact CD2-CB 4.26Å; F332-F363 HydrophobicContact CE1-CB 3.56Å; F332-F363 AromaticContact CE1-CD1 3.19Å; F332-F363 HydrophobicContact CE1-CD1 3.19Å; F332-F363 AromaticContact CE1-CD2 3.96Å; F332-F363 HydrophobicContact CE1-CD2 3.96Å; F332-F363 AromaticContact CE1-CE1 3.78Å; F332-F363 HydrophobicContact CE1-CE1 3.78Å; F332-F363 HydrophobicContact CE1-CE2 4.45Å; F332-F363 AromaticContact CE1-CG 3.29Å; F332-F363 HydrophobicContact CE1-CG 3.29Å; F332-F363 HydrophobicContact CE1-CZ 4.38Å; F332-F363 HydrophobicContact CE2-CB 3.61Å; F332-F363 HydrophobicContact CE2-CG 4.3Å; F332-F363 HydrophobicContact CG-CD1 4.15Å; F332-F363 HydrophobicContact CZ-CB 3.22Å; F332-F363 AromaticContact CZ-CD1 3.86Å; F332-F363 HydrophobicContact CZ-CD1 3.86Å; F332-F363 HydrophobicContact CZ-CD2 4.2Å; F332-F363 AromaticContact CZ-CG 3.52Å; F332-F363 HydrophobicContact CZ-CG 3.52Å; F332-K364 WeakPolarHBondContact CA-O 3.36Å; F332-F365 AromaticContact CD2-CD1 3.59Å; F332-F365 HydrophobicContact CD2-CD1 3.59Å; F332-F365 AromaticContact CD2-CE1 3.5Å; F332-F365 HydrophobicContact CD2-CE1 3.5Å; F332-F365 VanDerWaalsContact CD2-CE1 3.5Å; F332-F365 HydrophobicContact CD2-CG 4.2Å; F332-F365 HydrophobicContact CD2-CZ 4.02Å; F332-F365 HydrophobicContact CE2-CD1 4.01Å; F332-F365 HydrophobicContact CE2-CD2 4.43Å; F332-F365 AromaticContact CE2-CE1 3.63Å; F332-F365 HydrophobicContact CE2-CE1 3.63Å; F332-F365 HydrophobicContact CE2-CE2 4.08Å; F332-F365 HydrophobicContact CE2-CG 4.38Å; F332-F365 AromaticContact CE2-CZ 3.63Å; F332-F365 HydrophobicContact CE2-CZ 3.63Å; F332-V383 HydrophobicContact CE2-CG2 3.75Å; F332-V383 HydrophobicContact CZ-CG2 4.14Å; F332-V385 HydrophobicContact CE1-CG2 4.15Å; F332-V385 HydrophobicContact CZ-CG2 3.71Å
333	V	97	Very high	96.1	Very high	23 Å²	23	62.7 Å²	62.7	14%	0.139	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	137.4	-160.8	-174.6	0	0	0	0	111.1	E331 P337 F363 K364 V366	E331-V333 HydrophobicContact CB-CG2 3.63Å; V333-P337 HydrophobicContact CG2-CB 4.17Å; V333-F363 CarbonylContact O-C 3.52Å; V333-F363 VanDerWaalsContact O-CA 3.25Å; V333-F363 WeakPolarHBondContact O-CA 3.48Å; V333-K364 PolarHBondContact N-O 3.01Å; V333-K364 PolarHBondContact O-N 3.21Å; V333-V366 HydrophobicContact CG2-CB 4.45Å; V333-V366 HydrophobicContact CG2-CG2 4.15Å
334	R	94.7	Very high	96.1	Very high	87 Å²	87	70.4 Å²	70.4	33%	0.328	34%	0.339	S	S	.	.	S	Bend	trans	-139.2	90.3	163	-178.8	-168.4	72.6	159.5	7.9	107.4	D336 F338 V359 Y360 F363	R334-D336 PolarHBondContact N-O 2.9Å; R334-D336 PolarHBondContact O-N 3.2Å; R334-F338 HydrophobicContact CB-CD2 4.46Å; R334-F338 HydrophobicContact CB-CE2 4.2Å; R334-V359 VanDerWaalsContact NH2-CG1 3.34Å; R334-Y360 PolarHBondContact NH1-O 3.25Å; R334-F363 HydrophobicContact CB-CD1 3.56Å; R334-F363 HydrophobicContact CB-CD2 4.3Å; R334-F363 HydrophobicContact CB-CE1 3.48Å; R334-F363 VanDerWaalsContact CB-CE1 3.48Å; R334-F363 HydrophobicContact CB-CE2 4.23Å; R334-F363 HydrophobicContact CB-CG 3.99Å; R334-F363 HydrophobicContact CB-CZ 3.84Å; R334-F363 HydrophobicContact CG-CZ 4.49Å
335	I	92.2	Very high	96.2	Very high	163 Å²	163	68.2 Å²	68.2	84%	0.836	33%	0.326	S	S	*	.	S	Bend	trans	67.6	-63.3	-164.7	-55.7	171.7	0	0	0	110.7
336	D	94.3	Very high	96.2	Very high	111 Å²	111	75.8 Å²	75.8	59%	0.594	36%	0.356	S	S	*	.	S	Bend	trans	-102.6	151.8	173.8	-62.8	-48.3	0	0	0	111.4	R334 F338	R334-D336 PolarHBondContact N-O 2.9Å; R334-D336 PolarHBondContact O-N 3.2Å; D336-F338 WeakPolarHBondContact O-CD2 3.3Å; D336-F338 PolarHBondContact O-N 2.8Å
337	P	96	Very high	96.2	Very high	57 Å²	57	75.6 Å²	75.6	37%	0.37	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	116	174.8	28.8	-33.5	0	0	0	110.5	V333	V333-P337 HydrophobicContact CG2-CB 4.17Å
338	F	95.5	Very high	96.1	Very high	85 Å²	85	73.6 Å²	73.6	37%	0.373	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	-32.8	172.9	-82.6	-104	0	0	0	111.8	F332 R334 D336 P357 V359 F363	F332-F338 PolarHBondContact O-N 3.01Å; R334-F338 HydrophobicContact CB-CD2 4.46Å; R334-F338 HydrophobicContact CB-CE2 4.2Å; D336-F338 WeakPolarHBondContact O-CD2 3.3Å; D336-F338 PolarHBondContact O-N 2.8Å; F338-P357 HydrophobicContact CB-CB 4.44Å; F338-P357 HydrophobicContact CB-CG 4.12Å; F338-P357 HydrophobicContact CD1-CB 3.76Å; F338-P357 HydrophobicContact CD1-CG 3.97Å; F338-P357 HydrophobicContact CE1-CB 4.49Å; F338-P357 HydrophobicContact CG-CB 4.41Å; F338-P357 HydrophobicContact CG-CG 4.18Å; F338-V359 HydrophobicContact CE1-CB 4.17Å; F338-V359 HydrophobicContact CE1-CG1 4.46Å; F338-V359 HydrophobicContact CE1-CG2 3.87Å; F338-V359 HydrophobicContact CZ-CG1 4.42Å; F338-F363 HydrophobicContact CB-CE1 4.31Å; F338-F363 AromaticContact CD2-CE1 3.63Å; F338-F363 HydrophobicContact CD2-CE1 3.63Å; F338-F363 HydrophobicContact CD2-CZ 4.3Å; F338-F363 HydrophobicContact CE2-CE1 4.1Å; F338-F363 HydrophobicContact CE2-CZ 4.39Å; F338-F363 AromaticContact CG-CE1 3.92Å; F338-F363 HydrophobicContact CG-CE1 3.92Å
339	I	96.3	Very high	96	Very high	22 Å²	22	77.1 Å²	77.1	11%	0.113	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	132.3	177.2	-57.8	170	0	0	0	106.8	E331 F332 K341 M354 K355	E331-I339 CarbonylContact C-O 3.49Å; E331-I339 WeakPolarHBondContact CA-O 3.41Å; F332-I339 HydrophobicContact CB-CB 3.96Å; F332-I339 HydrophobicContact CB-CD1 4.31Å; F332-I339 HydrophobicContact CB-CG1 4.41Å; F332-I339 PolarHBondContact N-O 3.37Å; F332-I339 PolarHBondContact O-N 3.04Å; I339-K341 HydrophobicContact CG2-CD 4.16Å; I339-K341 HydrophobicContact CG2-CG 4.01Å; I339-M354 HydrophobicContact CD1-CB 4.43Å; I339-M354 HydrophobicContact CD1-CE 3.89Å; I339-M354 HydrophobicContact CD1-SD 4.1Å; I339-M354 HydrophobicContact CG2-SD 4.22Å; I339-K355 VanDerWaalsContact CD1-O 3.24Å; I339-K355 WeakPolarHBondContact CD1-O 3.34Å
340	R	97.4	Very high	96.1	Very high	141 Å²	141	74 Å²	74	53%	0.532	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	111.1	167.7	176.5	178.5	-71.5	165.1	-1	107.3	L330 E331	L330-R340 WeakPolarHBondContact O-CA 3.42Å; E331-R340 VanDerWaalsContact CD-NE 3.32Å; E331-R340 VanDerWaalsContact CD-NH2 3.26Å; E331-R340 HydrophobicContact CG-CB 4.33Å; E331-R340 HydrophobicContact CG-CG 4.13Å; E331-R340 IonicContact OE1-CZ 2.85Å; E331-R340 IonicContact OE1-NE 3.95Å; E331-R340 PolarHBondContact OE1-NE 2.96Å; E331-R340 IonicContact OE1-NH2 3.77Å; E331-R340 PolarHBondContact OE1-NH2 3.4Å; E331-R340 IonicContact OE2-CZ 2.72Å; E331-R340 IonicContact OE2-NE 3.47Å; E331-R340 IonicContact OE2-NH2 3.76Å; E331-R340 PolarHBondContact OE2-NH2 2.72Å; E331-R340 VanDerWaalsContact OE2-NH2 3.12Å
341	K	97.3	Very high	96.1	Very high	111 Å²	111	78.4 Å²	78.4	48%	0.483	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	146.6	-177.8	-69.3	-175.4	-179.5	-177.6	0	110.8	Q329 L330 I339 L352	Q329-K341 CarbonylContact C-O 3.55Å; Q329-K341 VanDerWaalsContact CA-O 3.27Å; Q329-K341 WeakPolarHBondContact CA-O 3.49Å; L330-K341 PolarHBondContact N-O 2.92Å; L330-K341 PolarHBondContact O-N 3.36Å; L330-K341 VanDerWaalsContact O-N 3.07Å; I339-K341 HydrophobicContact CG2-CD 4.16Å; I339-K341 HydrophobicContact CG2-CG 4.01Å; K341-L352 HydrophobicContact CB-CD1 4.21Å; K341-L352 HydrophobicContact CB-CD2 3.71Å; K341-L352 HydrophobicContact CD-CD1 4.34Å; K341-L352 HydrophobicContact CD-CD2 4.46Å
342	K	97.6	Very high	96	Very high	123 Å²	123	77.7 Å²	77.7	54%	0.535	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	143.4	168.9	-68.8	179.3	168.8	-161	0	109.8	D326 V328 Q329	D326-K342 WeakPolarHBondContact O-CD 3.2Å; V328-K342 WeakPolarHBondContact O-CA 3.47Å; Q329-K342 HydrophobicContact CG-CG 3.82Å
343	M	97.3	Very high	96	Very high	7 Å²	7	81.6 Å²	81.6	3%	0.034	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-93	145.1	176.3	-60.1	-171.2	-81.6	0	0	110.1	Y307 I309 V328 L330 Y350 L352 V367	Y307-M343 HydrophobicContact CD1-SD 4.08Å; Y307-M343 HydrophobicContact CE1-SD 4.27Å; I309-M343 HydrophobicContact CG2-CE 3.69Å; I309-M343 HydrophobicContact CG2-SD 4.05Å; V328-M343 HydrophobicContact CB-CE 4.12Å; V328-M343 HydrophobicContact CG1-CE 3.32Å; V328-M343 PolarHBondContact O-N 3.31Å; L330-M343 HydrophobicContact CB-CG 4.01Å; L330-M343 HydrophobicContact CB-SD 3.92Å; M343-Y350 HydrophobicContact CB-CD1 4.25Å; M343-Y350 HydrophobicContact CE-CD1 4.46Å; M343-Y350 HydrophobicContact CE-CG 4.31Å; M343-L352 HydrophobicContact CB-CB 4.49Å; M343-L352 HydrophobicContact CG-CB 3.92Å; M343-V367 HydrophobicContact CE-CG1 4.3Å; M343-V367 HydrophobicContact CE-CG2 4.04Å
344	E	96.9	Very high	96	Very high	168 Å²	168	80.7 Å²	80.7	79%	0.785	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.2	146.1	166.5	-65.4	-176.7	174.6	0	0	108.6	Y350 Q351	E344-Y350 CarbonylContact O-C 3.59Å; E344-Y350 WeakPolarHBondContact O-CA 3.38Å; E344-Q351 PolarHBondContact N-O 3.04Å; E344-Q351 PolarHBondContact O-N 2.78Å
345	H	94.7	Very high	96.1	Very high	57 Å²	57	82 Å²	82	26%	0.264	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	144.7	-175.5	75.6	-72.3	0	0	0	113.1	D326 E349 Y350	D326-H345 IonicContact OD1-CE1 2.69Å; D326-H345 PolarHBondContact OD1-CE1 2.92Å; D326-H345 IonicContact OD1-ND1 3.51Å; H345-E349 CarbonylContact C-O 3.6Å; H345-E349 WeakPolarHBondContact CA-O 3.48Å; H345-Y350 HydrophobicContact CB-CD1 3.43Å; H345-Y350 VanDerWaalsContact CB-CD1 3.43Å; H345-Y350 HydrophobicContact CB-CD2 4.39Å; H345-Y350 HydrophobicContact CB-CE1 3.47Å; H345-Y350 VanDerWaalsContact CB-CE1 3.47Å; H345-Y350 HydrophobicContact CB-CE2 4.41Å; H345-Y350 HydrophobicContact CB-CG 3.93Å; H345-Y350 AromaticContact CG-CE1 3.82Å
346	K	94.3	Very high	96.3	Very high	173 Å²	173	74.4 Å²	74.4	75%	0.752	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.5	119.7	172.9	-173.9	179.2	-178.6	-179.7	0	109.1	G348 E349	K346-G348 VanDerWaalsContact C-N 3.31Å; K346-G348 PolarHBondContact O-N 2.85Å; K346-E349 PolarHBondContact N-O 2.88Å; K346-E349 WeakPolarHBondContact O-CB 3.38Å; K346-E349 PolarHBondContact O-N 2.95Å
347	N	93.8	Very high	96.4	Very high	117 Å²	117	70.1 Å²	70.1	63%	0.626	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	45.9	175.5	-163.8	37.7	0	0	0	113	P322 E349	P322-N347 VanDerWaalsContact CB-C 3.48Å; P322-N347 WeakPolarHBondContact CB-O 3.31Å; P322-N347 WeakPolarHBondContact CG-OD1 3.27Å; N347-E349 PolarHBondContact O-N 2.96Å
348	G	93.7	Very high	96.4	Very high	0 Å²	0	72.6 Å²	72.6	0%	0	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.2	-1.4	-177.5	0	0	0	0	0	116.3	K310 I311 F323 K346 Y350	K310-G348 WeakPolarHBondContact CA-O 3.43Å; I311-G348 PolarHBondContact N-O 2.89Å; F323-G348 VanDerWaalsContact O-CA 3.3Å; F323-G348 WeakPolarHBondContact O-CA 3.45Å; K346-G348 VanDerWaalsContact C-N 3.31Å; K346-G348 PolarHBondContact O-N 2.85Å; G348-Y350 WeakPolarHBondContact O-CD2 3.46Å
349	E	97.1	Very high	96.4	Very high	74 Å²	74	70.8 Å²	70.8	35%	0.346	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	120.5	167.1	-62.4	-165.3	149.3	0	0	109.8	Y284 K310 H345 K346 N347	Y284-E349 PolarHBondContact OH-OE1 2.88Å; K310-E349 HydrophobicContact CB-CG 4.24Å; K310-E349 HydrophobicContact CD-CG 4.32Å; K310-E349 HydrophobicContact CG-CG 4.1Å; H345-E349 CarbonylContact C-O 3.6Å; H345-E349 WeakPolarHBondContact CA-O 3.48Å; K346-E349 PolarHBondContact N-O 2.88Å; K346-E349 WeakPolarHBondContact O-CB 3.38Å; K346-E349 PolarHBondContact O-N 2.95Å; N347-E349 PolarHBondContact O-N 2.96Å
350	Y	98.1	Very high	96.3	Very high	0 Å²	0	76.8 Å²	76.8	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	126.7	177.1	-68	-96.2	0	0	0	108.9	T308 I309 I311 F323 A325 V328 M343 E344 H345 G348	T308-Y350 CarbonylContact C-O 3.54Å; T308-Y350 WeakPolarHBondContact CA-O 3.49Å; I309-Y350 PolarHBondContact N-O 3.05Å; I309-Y350 PolarHBondContact O-N 2.92Å; I311-Y350 HydrophobicContact CB-CD2 4.12Å; I311-Y350 HydrophobicContact CB-CE2 3.88Å; I311-Y350 HydrophobicContact CD1-CD2 3.71Å; I311-Y350 HydrophobicContact CD1-CE2 3.84Å; I311-Y350 HydrophobicContact CD1-CG 4.32Å; I311-Y350 HydrophobicContact CG1-CD2 3.87Å; I311-Y350 HydrophobicContact CG1-CE2 4.07Å; F323-Y350 HydrophobicContact CD1-CE2 4.45Å; F323-Y350 WeakPolarHBondContact CD1-OH 3.39Å; F323-Y350 WeakPolarHBondContact O-CE2 3.48Å; F323-Y350 PolarHBondContact O-OH 3.14Å; F323-Y350 VanDerWaalsContact O-OH 3.05Å; A325-Y350 PolarHBondContact N-OH 3.15Å; A325-Y350 VanDerWaalsContact O-CE1 3.25Å; A325-Y350 WeakPolarHBondContact O-CE1 3.45Å; A325-Y350 PolarHBondContact O-OH 3.35Å; V328-Y350 HydrophobicContact CB-CD1 3.69Å; V328-Y350 HydrophobicContact CB-CE1 3.59Å; V328-Y350 HydrophobicContact CB-CG 4.46Å; V328-Y350 HydrophobicContact CG1-CD1 4.18Å; V328-Y350 HydrophobicContact CG1-CE1 4.38Å; V328-Y350 HydrophobicContact CG2-CD1 3.91Å; V328-Y350 HydrophobicContact CG2-CE1 3.29Å; V328-Y350 HydrophobicContact CG2-CE2 4.42Å; M343-Y350 HydrophobicContact CB-CD1 4.25Å; M343-Y350 HydrophobicContact CE-CD1 4.46Å; M343-Y350 HydrophobicContact CE-CG 4.31Å; E344-Y350 CarbonylContact O-C 3.59Å; E344-Y350 WeakPolarHBondContact O-CA 3.38Å; H345-Y350 HydrophobicContact CB-CD1 3.43Å; H345-Y350 VanDerWaalsContact CB-CD1 3.43Å; H345-Y350 HydrophobicContact CB-CD2 4.39Å; H345-Y350 HydrophobicContact CB-CE1 3.47Å; H345-Y350 VanDerWaalsContact CB-CE1 3.47Å; H345-Y350 HydrophobicContact CB-CE2 4.41Å; H345-Y350 HydrophobicContact CB-CG 3.93Å; H345-Y350 AromaticContact CG-CE1 3.82Å; G348-Y350 WeakPolarHBondContact O-CD2 3.46Å
351	Q	97.5	Very high	96.2	Very high	93 Å²	93	71 Å²	71	44%	0.435	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	143	-176.9	-179	170.5	87.4	0	0	111.2	V306 Y307 T308 E344	V306-Q351 HydrophobicContact CG1-CG 3.87Å; Y307-Q351 VanDerWaalsContact O-CA 3.29Å; Y307-Q351 WeakPolarHBondContact O-CA 3.42Å; T308-Q351 PolarHBondContact OG1-NE2 3.12Å; E344-Q351 PolarHBondContact N-O 3.04Å; E344-Q351 PolarHBondContact O-N 2.78Å
352	L	97.6	Very high	96.1	Very high	20 Å²	20	69.5 Å²	69.5	11%	0.105	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	131.9	169.6	176.8	68.5	0	0	0	109.7	Y307 L330 K341 M343 M354	Y307-L352 PolarHBondContact N-O 3.36Å; Y307-L352 PolarHBondContact O-N 3.35Å; L330-L352 HydrophobicContact CB-CD2 4Å; L330-L352 HydrophobicContact CD2-CB 4.43Å; L330-L352 HydrophobicContact CD2-CD2 4.01Å; K341-L352 HydrophobicContact CB-CD1 4.21Å; K341-L352 HydrophobicContact CB-CD2 3.71Å; K341-L352 HydrophobicContact CD-CD1 4.34Å; K341-L352 HydrophobicContact CD-CD2 4.46Å; M343-L352 HydrophobicContact CB-CB 4.49Å; M343-L352 HydrophobicContact CG-CB 3.92Å; L352-M354 HydrophobicContact CD2-CB 4.38Å; L352-M354 HydrophobicContact CD2-SD 4.28Å; L352-M354 HydrophobicContact CG-CB 4.36Å
353	V	97.4	Very high	96.1	Very high	81 Å²	81	63.7 Å²	63.7	49%	0.491	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	124.7	166.3	-172.7	0	0	0	0	108	V290 V305 V306	V290-V353 HydrophobicContact CG2-CG1 3.85Å; V305-V353 WeakPolarHBondContact O-CA 3.25Å; V306-V353 HydrophobicContact CG1-CG2 4.48Å; V306-V353 HydrophobicContact CG2-CG2 4.16Å
354	M	96.5	Very high	96.2	Very high	4 Å²	4	67.7 Å²	67.7	2%	0.02	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	145.9	-177.3	56.3	173.7	-122.1	0	0	111.4	V305 L330 F332 I339 L352 L356 F365	V305-M354 PolarHBondContact N-O 2.85Å; V305-M354 PolarHBondContact O-N 3.22Å; L330-M354 HydrophobicContact CD2-SD 3.87Å; F332-M354 HydrophobicContact CB-CE 3.67Å; F332-M354 HydrophobicContact CB-SD 4.41Å; F332-M354 HydrophobicContact CD1-CE 4.13Å; F332-M354 HydrophobicContact CD2-CE 3.65Å; F332-M354 HydrophobicContact CE2-CE 4.26Å; F332-M354 HydrophobicContact CG-CE 3.55Å; I339-M354 HydrophobicContact CD1-CB 4.43Å; I339-M354 HydrophobicContact CD1-CE 3.89Å; I339-M354 HydrophobicContact CD1-SD 4.1Å; I339-M354 HydrophobicContact CG2-SD 4.22Å; L352-M354 HydrophobicContact CD2-CB 4.38Å; L352-M354 HydrophobicContact CD2-SD 4.28Å; L352-M354 HydrophobicContact CG-CB 4.36Å; M354-L356 HydrophobicContact CE-CD2 3.42Å; M354-L356 VanDerWaalsContact CE-CD2 3.42Å; M354-F365 HydrophobicContact CE-CD1 4.29Å; M354-F365 HydrophobicContact CE-CE1 3.53Å; M354-F365 HydrophobicContact CE-CZ 4.41Å; M354-F365 HydrophobicContact SD-CE1 4.39Å
355	K	97.4	Very high	96.2	Very high	116 Å²	116	59.7 Å²	59.7	50%	0.504	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	128.4	172	-167.9	171.3	-170.4	178.9	0	109.9	L302 D303 D304 I339	L302-K355 WeakPolarHBondContact O-CE 3.41Å; D303-K355 WeakPolarHBondContact O-CA 3.45Å; D304-K355 WeakPolarHBondContact OD1-CB 3.42Å; D304-K355 WeakPolarHBondContact OD1-CG 3.38Å; I339-K355 VanDerWaalsContact CD1-O 3.24Å; I339-K355 WeakPolarHBondContact CD1-O 3.34Å
356	L	96.7	Very high	96.4	Very high	3 Å²	3	57.9 Å²	57.9	2%	0.016	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-66.1	149.7	178.9	-60.8	-166.9	0	0	0	111.4	Y299 L302 D303 V305 F332 M354 V385	Y299-L356 HydrophobicContact CD1-CD1 4.21Å; Y299-L356 HydrophobicContact CG-CD1 3.97Å; L302-L356 WeakPolarHBondContact CA-O 3.36Å; L302-L356 PolarHBondContact N-O 3.47Å; D303-L356 HydrophobicContact CB-CD1 4.18Å; D303-L356 HydrophobicContact CB-CG 4.36Å; D303-L356 WeakPolarHBondContact O-CG 3.44Å; D303-L356 PolarHBondContact O-N 3.05Å; V305-L356 HydrophobicContact CB-CD2 4.3Å; V305-L356 HydrophobicContact CG2-CD1 3.93Å; V305-L356 HydrophobicContact CG2-CD2 3.86Å; V305-L356 HydrophobicContact CG2-CG 3.74Å; F332-L356 HydrophobicContact CD1-CD2 4.21Å; F332-L356 HydrophobicContact CE1-CD2 3.74Å; F332-L356 HydrophobicContact CE2-CD2 4.17Å; F332-L356 HydrophobicContact CZ-CD1 4.31Å; F332-L356 HydrophobicContact CZ-CD2 3.7Å; M354-L356 HydrophobicContact CE-CD2 3.42Å; M354-L356 VanDerWaalsContact CE-CD2 3.42Å; L356-V385 HydrophobicContact CD1-CG1 4.28Å; L356-V385 HydrophobicContact CD1-CG2 3.98Å
357	P	96.1	Very high	96.6	Very high	21 Å²	21	49.6 Å²	49.6	14%	0.136	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-64.8	157.1	177.3	28.4	-35.5	0	0	0	111.8	F332 F338 V359 F363	F332-P357 HydrophobicContact CD1-CG 4.33Å; F332-P357 HydrophobicContact CE1-CG 4.31Å; F338-P357 HydrophobicContact CB-CB 4.44Å; F338-P357 HydrophobicContact CB-CG 4.12Å; F338-P357 HydrophobicContact CD1-CB 3.76Å; F338-P357 HydrophobicContact CD1-CG 3.97Å; F338-P357 HydrophobicContact CE1-CB 4.49Å; F338-P357 HydrophobicContact CG-CB 4.41Å; F338-P357 HydrophobicContact CG-CG 4.18Å; P357-V359 PolarHBondContact O-N 3.45Å; P357-F363 HydrophobicContact CG-CE1 3.92Å; P357-F363 HydrophobicContact CG-CZ 3.83Å
358	D	95.2	Very high	96.7	Very high	108 Å²	108	48 Å²	48	58%	0.578	25%	0.245	S	C	*	.	S	Bend	trans	-77.3	47.3	171.5	-166.6	15.3	0	0	0	111.9	I301 L302	I301-D358 WeakPolarHBondContact CD1-OD1 3.47Å; L302-D358 HydrophobicContact CD2-CB 3.91Å; L302-D358 HydrophobicContact CG-CB 4.17Å
359	V	94.8	Very high	96.9	Very high	47 Å²	47	48.5 Å²	48.5	29%	0.285	25%	0.247	S	C	.	.			trans	-143	120.9	-177.1	-174.6	0	0	0	0	107.9	R334 F338 P357 F363	R334-V359 VanDerWaalsContact NH2-CG1 3.34Å; F338-V359 HydrophobicContact CE1-CB 4.17Å; F338-V359 HydrophobicContact CE1-CG1 4.46Å; F338-V359 HydrophobicContact CE1-CG2 3.87Å; F338-V359 HydrophobicContact CZ-CG1 4.42Å; P357-V359 PolarHBondContact O-N 3.45Å; V359-F363 VanDerWaalsContact O-CE2 3.26Å; V359-F363 WeakPolarHBondContact O-CE2 3.4Å
360	Y	94.3	Very high	96.7	Very high	148 Å²	148	49.8 Å²	49.8	58%	0.58	25%	0.249	S	C	*	.			trans	-84.4	157.4	178.9	65.2	-90.1	0	0	0	111.6	R334 V385 P387	R334-Y360 PolarHBondContact NH1-O 3.25Å; Y360-V385 CarbonylContact C-O 3.54Å; Y360-V385 WeakPolarHBondContact CA-O 3.39Å; Y360-V385 WeakPolarHBondContact CB-O 3.29Å; Y360-P387 HydrophobicContact CD1-CB 4.33Å; Y360-P387 HydrophobicContact CG-CG 4.41Å
361	G	95.4	Very high	96.6	Very high	21 Å²	21	54.2 Å²	54.2	22%	0.216	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	149.6	-174.1	179.3	0	0	0	0	0	111.9	V385	G361-V385 PolarHBondContact N-O 3.39Å; G361-V385 PolarHBondContact O-N 3.22Å
362	V	96.7	Very high	96.4	Very high	79 Å²	79	53.8 Å²	53.8	48%	0.479	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	112.1	175.4	-179.4	0	0	0	0	108.4	Q382	V362-Q382 HydrophobicContact CG1-CG 3.62Å
363	F	97.6	Very high	96.2	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	167.7	-179.8	-76.8	-100.1	0	0	0	111.2	F332 V333 R334 F338 P357 V359 Q382 V383 V385	F332-F363 HydrophobicContact CD1-CB 4.23Å; F332-F363 AromaticContact CD1-CD1 3.37Å; F332-F363 HydrophobicContact CD1-CD1 3.37Å; F332-F363 AromaticContact CD1-CE1 3.88Å; F332-F363 HydrophobicContact CD1-CE1 3.88Å; F332-F363 AromaticContact CD1-CG 3.95Å; F332-F363 HydrophobicContact CD1-CG 3.95Å; F332-F363 HydrophobicContact CD2-CB 4.26Å; F332-F363 HydrophobicContact CE1-CB 3.56Å; F332-F363 AromaticContact CE1-CD1 3.19Å; F332-F363 HydrophobicContact CE1-CD1 3.19Å; F332-F363 AromaticContact CE1-CD2 3.96Å; F332-F363 HydrophobicContact CE1-CD2 3.96Å; F332-F363 AromaticContact CE1-CE1 3.78Å; F332-F363 HydrophobicContact CE1-CE1 3.78Å; F332-F363 HydrophobicContact CE1-CE2 4.45Å; F332-F363 AromaticContact CE1-CG 3.29Å; F332-F363 HydrophobicContact CE1-CG 3.29Å; F332-F363 HydrophobicContact CE1-CZ 4.38Å; F332-F363 HydrophobicContact CE2-CB 3.61Å; F332-F363 HydrophobicContact CE2-CG 4.3Å; F332-F363 HydrophobicContact CG-CD1 4.15Å; F332-F363 HydrophobicContact CZ-CB 3.22Å; F332-F363 AromaticContact CZ-CD1 3.86Å; F332-F363 HydrophobicContact CZ-CD1 3.86Å; F332-F363 HydrophobicContact CZ-CD2 4.2Å; F332-F363 AromaticContact CZ-CG 3.52Å; F332-F363 HydrophobicContact CZ-CG 3.52Å; V333-F363 CarbonylContact O-C 3.52Å; V333-F363 VanDerWaalsContact O-CA 3.25Å; V333-F363 WeakPolarHBondContact O-CA 3.48Å; R334-F363 HydrophobicContact CB-CD1 3.56Å; R334-F363 HydrophobicContact CB-CD2 4.3Å; R334-F363 HydrophobicContact CB-CE1 3.48Å; R334-F363 VanDerWaalsContact CB-CE1 3.48Å; R334-F363 HydrophobicContact CB-CE2 4.23Å; R334-F363 HydrophobicContact CB-CG 3.99Å; R334-F363 HydrophobicContact CB-CZ 3.84Å; R334-F363 HydrophobicContact CG-CZ 4.49Å; F338-F363 HydrophobicContact CB-CE1 4.31Å; F338-F363 AromaticContact CD2-CE1 3.63Å; F338-F363 HydrophobicContact CD2-CE1 3.63Å; F338-F363 HydrophobicContact CD2-CZ 4.3Å; F338-F363 HydrophobicContact CE2-CE1 4.1Å; F338-F363 HydrophobicContact CE2-CZ 4.39Å; F338-F363 AromaticContact CG-CE1 3.92Å; F338-F363 HydrophobicContact CG-CE1 3.92Å; P357-F363 HydrophobicContact CG-CE1 3.92Å; P357-F363 HydrophobicContact CG-CZ 3.83Å; V359-F363 VanDerWaalsContact O-CE2 3.26Å; V359-F363 WeakPolarHBondContact O-CE2 3.4Å; F363-Q382 WeakPolarHBondContact O-CA 3.36Å; F363-V383 HydrophobicContact CB-CG2 4.46Å; F363-V383 PolarHBondContact N-O 3.1Å; F363-V383 PolarHBondContact O-N 3.35Å; F363-V383 VanDerWaalsContact O-O 3.1Å; F363-V385 HydrophobicContact CB-CG2 4.29Å; F363-V385 HydrophobicContact CD2-CB 3.9Å; F363-V385 HydrophobicContact CD2-CG2 3.56Å; F363-V385 HydrophobicContact CE2-CB 4.19Å; F363-V385 HydrophobicContact CE2-CG2 4.21Å; F363-V385 HydrophobicContact CG-CG2 4.18Å
364	K	97.8	Very high	96.2	Very high	92 Å²	92	51.9 Å²	51.9	40%	0.4	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	131.3	172.6	-61	174.6	-176.8	-179.2	0	109.4	F332 V333 V366 V380 T381 Q382	F332-K364 WeakPolarHBondContact CA-O 3.36Å; V333-K364 PolarHBondContact N-O 3.01Å; V333-K364 PolarHBondContact O-N 3.21Å; K364-V366 HydrophobicContact CB-CG2 3.76Å; K364-V380 HydrophobicContact CB-CG1 4.21Å; K364-V380 HydrophobicContact CD-CG1 3.83Å; K364-V380 HydrophobicContact CG-CG1 4.24Å; K364-T381 CarbonylContact C-O 3.48Å; K364-T381 WeakPolarHBondContact CA-O 3.32Å; K364-Q382 HydrophobicContact CG-CB 4.35Å; K364-Q382 HydrophobicContact CG-CG 4.43Å
365	F	97.9	Very high	96.2	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	121.6	155.2	-64.6	-71.2	0	0	0	107.7	H287 Y299 V305 Y307 L330 E331 F332 M354 V380 T381 V383	H287-F365 HydrophobicContact CB-CE2 4.18Å; Y299-F365 HydrophobicContact CE2-CE2 4.4Å; V305-F365 HydrophobicContact CG1-CE1 4.4Å; V305-F365 HydrophobicContact CG1-CZ 3.91Å; Y307-F365 HydrophobicContact CD2-CB 3.88Å; Y307-F365 AromaticContact CD2-CD1 3.65Å; Y307-F365 HydrophobicContact CD2-CD1 3.65Å; Y307-F365 HydrophobicContact CD2-CD2 4.14Å; Y307-F365 HydrophobicContact CD2-CE1 4.19Å; Y307-F365 AromaticContact CD2-CG 3.63Å; Y307-F365 HydrophobicContact CD2-CG 3.63Å; Y307-F365 HydrophobicContact CE2-CB 3.49Å; Y307-F365 VanDerWaalsContact CE2-CB 3.49Å; Y307-F365 HydrophobicContact CE2-CD1 4.18Å; Y307-F365 HydrophobicContact CE2-CD2 4.31Å; Y307-F365 AromaticContact CE2-CG 3.76Å; Y307-F365 HydrophobicContact CE2-CG 3.76Å; Y307-F365 HydrophobicContact CG-CD1 4.31Å; L330-F365 HydrophobicContact CD1-CB 4.11Å; L330-F365 HydrophobicContact CD1-CD1 4.21Å; L330-F365 HydrophobicContact CD2-CD1 4.07Å; L330-F365 HydrophobicContact CG-CD1 4.49Å; E331-F365 CarbonylContact O-C 3.57Å; E331-F365 WeakPolarHBondContact O-CA 3.38Å; F332-F365 AromaticContact CD2-CD1 3.59Å; F332-F365 HydrophobicContact CD2-CD1 3.59Å; F332-F365 AromaticContact CD2-CE1 3.5Å; F332-F365 HydrophobicContact CD2-CE1 3.5Å; F332-F365 VanDerWaalsContact CD2-CE1 3.5Å; F332-F365 HydrophobicContact CD2-CG 4.2Å; F332-F365 HydrophobicContact CD2-CZ 4.02Å; F332-F365 HydrophobicContact CE2-CD1 4.01Å; F332-F365 HydrophobicContact CE2-CD2 4.43Å; F332-F365 AromaticContact CE2-CE1 3.63Å; F332-F365 HydrophobicContact CE2-CE1 3.63Å; F332-F365 HydrophobicContact CE2-CE2 4.08Å; F332-F365 HydrophobicContact CE2-CG 4.38Å; F332-F365 AromaticContact CE2-CZ 3.63Å; F332-F365 HydrophobicContact CE2-CZ 3.63Å; M354-F365 HydrophobicContact CE-CD1 4.29Å; M354-F365 HydrophobicContact CE-CE1 3.53Å; M354-F365 HydrophobicContact CE-CZ 4.41Å; M354-F365 HydrophobicContact SD-CE1 4.39Å; F365-V380 CarbonylContact O-C 3.58Å; F365-V380 WeakPolarHBondContact O-CA 3.31Å; F365-T381 PolarHBondContact N-O 2.96Å; F365-T381 PolarHBondContact O-N 3.07Å; F365-V383 HydrophobicContact CD2-CG1 3.96Å; F365-V383 HydrophobicContact CD2-CG2 3.9Å; F365-V383 HydrophobicContact CE2-CB 4.23Å; F365-V383 HydrophobicContact CE2-CG1 3.74Å; F365-V383 HydrophobicContact CE2-CG2 3.49Å; F365-V383 VanDerWaalsContact CE2-CG2 3.49Å; F365-V383 HydrophobicContact CZ-CG2 4.21Å
366	V	98.2	Very high	96.1	Very high	18 Å²	18	49 Å²	49	11%	0.109	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	120.7	-179.5	-178.5	0	0	0	0	108.4	E331 V333 K364 D368 L378 S379 V380	E331-V366 HydrophobicContact CB-CB 4.25Å; E331-V366 PolarHBondContact N-O 3.26Å; E331-V366 PolarHBondContact O-N 3.11Å; V333-V366 HydrophobicContact CG2-CB 4.45Å; V333-V366 HydrophobicContact CG2-CG2 4.15Å; K364-V366 HydrophobicContact CB-CG2 3.76Å; V366-D368 HydrophobicContact CG1-CB 4.07Å; V366-L378 HydrophobicContact CG1-CD1 4.24Å; V366-S379 WeakPolarHBondContact CA-O 3.41Å; V366-V380 HydrophobicContact CG1-CG2 4.34Å; V366-V380 HydrophobicContact CG2-CG1 4.36Å; V366-V380 HydrophobicContact CG2-CG2 4.35Å
367	V	98	Very high	96.1	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	104.7	163.5	178.8	0	0	0	0	105.7	Y307 I309 V328 L330 M343 L378 S379	Y307-V367 HydrophobicContact CE1-CG2 3.77Å; I309-V367 HydrophobicContact CD1-CB 4.18Å; I309-V367 HydrophobicContact CD1-CG1 4.27Å; I309-V367 HydrophobicContact CD1-CG2 4.16Å; I309-V367 HydrophobicContact CG2-CG2 4.3Å; V328-V367 HydrophobicContact CG1-CG1 4.01Å; L330-V367 HydrophobicContact CD1-CG2 3.77Å; M343-V367 HydrophobicContact CE-CG1 4.3Å; M343-V367 HydrophobicContact CE-CG2 4.04Å; V367-L378 WeakPolarHBondContact O-CA 3.47Å; V367-S379 PolarHBondContact N-O 3.23Å; V367-S379 PolarHBondContact O-N 3.33Å
368	D	96.9	Very high	96.1	Very high	82 Å²	82	52.3 Å²	52.3	44%	0.439	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	98.5	176.7	-174.7	-6.1	0	0	0	108	V366 H376 L378	V366-D368 HydrophobicContact CG1-CB 4.07Å; D368-H376 IonicContact OD1-CD2 3.94Å; D368-H376 PolarHBondContact OD1-CD2 2.89Å; D368-H376 IonicContact OD1-CE1 2.78Å; D368-H376 IonicContact OD1-NE2 3.12Å; D368-H376 PolarHBondContact OD1-NE2 3.39Å; D368-L378 HydrophobicContact CB-CD1 4.02Å
369	Y	97	Very high	96.2	Very high	11 Å²	11	47.4 Å²	47.4	4%	0.043	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	102.3	-178.3	-166.9	-99.9	0	0	0	110.4	L280 F323 D327 V328 R371 L377	L280-Y369 HydrophobicContact CD1-CD1 3.62Å; L280-Y369 HydrophobicContact CD1-CE1 3.83Å; F323-Y369 HydrophobicContact CE1-CD1 4.44Å; F323-Y369 AromaticContact CE1-CE1 3.73Å; F323-Y369 HydrophobicContact CE1-CE1 3.73Å; F323-Y369 AromaticContact CE1-CZ 3.94Å; F323-Y369 AromaticContact CZ-CE1 3.8Å; F323-Y369 HydrophobicContact CZ-CE1 3.8Å; D327-Y369 VanDerWaalsContact OD1-CE2 3.3Å; D327-Y369 WeakPolarHBondContact OD1-CE2 3.36Å; D327-Y369 PolarHBondContact OD1-OH 3.07Å; V328-Y369 HydrophobicContact CB-CD2 4.3Å; V328-Y369 HydrophobicContact CB-CE2 4.39Å; V328-Y369 HydrophobicContact CG1-CD2 4.29Å; V328-Y369 HydrophobicContact CG2-CD2 3.95Å; V328-Y369 HydrophobicContact CG2-CE2 3.74Å; Y369-R371 HydrophobicContact CD1-CG 4.3Å; Y369-R371 HydrophobicContact CE1-CB 4.2Å; Y369-R371 HydrophobicContact CE1-CG 3.63Å; Y369-R371 HydrophobicContact CE2-CG 4.03Å; Y369-R371 VanDerWaalsContact CZ-CG 3.49Å; Y369-L377 PolarHBondContact N-O 3.34Å; Y369-L377 PolarHBondContact O-N 3.44Å
370	Y	94.5	Very high	96.3	Very high	101 Å²	101	48.7 Å²	48.7	40%	0.396	24%	0.239	S	C	.	.			trans	-119.7	113.5	178.3	-176.2	-114.4	0	0	0	110.1	P186 H376	P186-Y370 PolarHBondContact O-OH 3.46Å; Y370-H376 HydrophobicContact CD2-CB 4.1Å
371	R	95	Very high	96.4	Very high	94 Å²	94	43.2 Å²	43.2	36%	0.355	22%	0.221	S	C	.	.			trans	-139.9	142.5	179.6	-68.1	-62.3	180	-88.3	-4.9	110.7	D327 Y369 G373 Y374	D327-R371 IonicContact OD2-CZ 3.85Å; D327-R371 IonicContact OD2-NE 2.68Å; D327-R371 PolarHBondContact OD2-NE 3.5Å; D327-R371 IonicContact OD2-NH2 3.06Å; D327-R371 PolarHBondContact OD2-NH2 2.94Å; Y369-R371 HydrophobicContact CD1-CG 4.3Å; Y369-R371 HydrophobicContact CE1-CB 4.2Å; Y369-R371 HydrophobicContact CE1-CG 3.63Å; Y369-R371 HydrophobicContact CE2-CG 4.03Å; Y369-R371 VanDerWaalsContact CZ-CG 3.49Å; R371-G373 PolarHBondContact O-N 3.26Å; R371-Y374 HydrophobicContact CB-CD2 4.02Å; R371-Y374 PolarHBondContact O-N 2.96Å
372	V	94.1	Very high	96.5	Very high	84 Å²	84	48.3 Å²	48.3	51%	0.509	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	120.9	-177.7	179.8	0	0	0	0	111	V158 S160 I163 I189	V158-V372 HydrophobicContact CG2-CG1 4.48Å; S160-V372 PolarHBondContact OG-O 2.96Å; I163-V372 HydrophobicContact CD1-CG1 4.04Å; I189-V372 HydrophobicContact CD1-CG1 4.21Å; I189-V372 HydrophobicContact CG1-CG1 4.45Å; I189-V372 HydrophobicContact CG2-CG1 4.22Å
373	G	93.7	Very high	96.5	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.8	-15.7	179.9	0	0	0	0	0	115	V162 R231 W272 R371	V162-G373 WeakPolarHBondContact CG1-O 3.15Å; R231-G373 PolarHBondContact NH2-O 3.09Å; W272-G373 PolarHBondContact NE1-O 3.16Å; R371-G373 PolarHBondContact O-N 3.26Å
374	Y	95.9	Very high	96.4	Very high	60 Å²	60	47.5 Å²	47.5	24%	0.235	24%	0.235	C	C	.	.	S	Bend	trans	-95.8	148.5	172.9	-70.8	-74.3	0	0	0	111.1	V162 Q225 G278 L280 F323 R371	V162-Y374 HydrophobicContact CG1-CD1 4.41Å; V162-Y374 HydrophobicContact CG1-CE1 4.26Å; V162-Y374 HydrophobicContact CG2-CD2 4.16Å; V162-Y374 HydrophobicContact CG2-CE1 3.9Å; V162-Y374 HydrophobicContact CG2-CE2 3.49Å; V162-Y374 VanDerWaalsContact CG2-CE2 3.49Å; V162-Y374 WeakPolarHBondContact CG2-OH 3.46Å; Q225-Y374 PolarHBondContact NE2-O 2.83Å; Q225-Y374 PolarHBondContact OE1-O 2.82Å; G278-Y374 CarbonylContact O-C 3.58Å; G278-Y374 WeakPolarHBondContact O-CA 3.49Å; L280-Y374 HydrophobicContact CD1-CD1 4Å; L280-Y374 HydrophobicContact CD1-CG 3.99Å; L280-Y374 HydrophobicContact CD2-CD1 3.87Å; L280-Y374 HydrophobicContact CD2-CE1 4.28Å; L280-Y374 HydrophobicContact CG-CD1 3.79Å; L280-Y374 HydrophobicContact CG-CG 4.25Å; F323-Y374 HydrophobicContact CE2-CD1 4.37Å; F323-Y374 AromaticContact CE2-CE1 3.75Å; F323-Y374 HydrophobicContact CE2-CE1 3.75Å; F323-Y374 HydrophobicContact CE2-CE2 4.41Å; F323-Y374 AromaticContact CE2-CZ 3.77Å; F323-Y374 HydrophobicContact CZ-CE1 4.45Å; R371-Y374 HydrophobicContact CB-CD2 4.02Å; R371-Y374 PolarHBondContact O-N 2.96Å
375	T	96.1	Very high	96.4	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.018	22%	0.218	C	C	.	.			trans	-62.1	142.4	169.2	57.2	0	0	0	0	110.3	N229 G278 L280 L377	N229-T375 HydrophobicContact CB-CG2 3.93Å; N229-T375 WeakPolarHBondContact OD1-CA 3.27Å; G278-T375 PolarHBondContact O-N 3.11Å; L280-T375 WeakPolarHBondContact CA-OG1 3.31Å; L280-T375 PolarHBondContact N-OG1 3.27Å; L280-T375 PolarHBondContact O-OG1 2.78Å; T375-L377 PolarHBondContact O-N 3.1Å
376	H	96.2	Very high	96.3	Very high	56 Å²	56	45.8 Å²	45.8	26%	0.259	23%	0.227	S	C	.	.			trans	-63.3	115.7	174.8	-178.1	-148.6	0	0	0	109.5	N229 D368 Y370	N229-H376 PolarHBondContact ND2-O 2.84Å; N229-H376 WeakPolarHBondContact OD1-CB 3.23Å; N229-H376 PolarHBondContact OD1-N 2.93Å; D368-H376 IonicContact OD1-CD2 3.94Å; D368-H376 PolarHBondContact OD1-CD2 2.89Å; D368-H376 IonicContact OD1-CE1 2.78Å; D368-H376 IonicContact OD1-NE2 3.12Å; D368-H376 PolarHBondContact OD1-NE2 3.39Å; Y370-H376 HydrophobicContact CD2-CB 4.1Å
377	L	95.9	Very high	96.2	Very high	6 Å²	6	47.6 Å²	47.6	3%	0.031	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	106.4	176.8	179.4	76.6	0	0	0	108.9	L280 H282 I311 Y369 T375	L280-L377 HydrophobicContact CB-CB 4.33Å; H282-L377 HydrophobicContact CB-CD1 4.09Å; I311-L377 HydrophobicContact CB-CD2 4.43Å; I311-L377 HydrophobicContact CD1-CD2 3.59Å; I311-L377 HydrophobicContact CG1-CD2 3.84Å; I311-L377 HydrophobicContact CG2-CD2 3.73Å; Y369-L377 PolarHBondContact N-O 3.34Å; Y369-L377 PolarHBondContact O-N 3.44Å; T375-L377 PolarHBondContact O-N 3.1Å
378	L	96.6	Very high	95.9	Very high	88 Å²	88	50.6 Å²	50.6	46%	0.461	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	121.4	175	-177.5	63.7	0	0	0	110.1	V366 V367 D368 V380	V366-L378 HydrophobicContact CG1-CD1 4.24Å; V367-L378 WeakPolarHBondContact O-CA 3.47Å; D368-L378 HydrophobicContact CB-CD1 4.02Å; L378-V380 HydrophobicContact CD1-CG2 3.86Å; L378-V380 HydrophobicContact CD2-CG2 4.49Å; L378-V380 HydrophobicContact CG-CG2 4.03Å
379	S	97.3	Very high	95.6	Very high	6 Å²	6	49.4 Å²	49.4	4%	0.042	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	120.4	171.9	167.8	0	0	0	0	109.4	V285 V366 V367	V285-S379 WeakPolarHBondContact CG2-OG 3.44Å; V366-S379 WeakPolarHBondContact CA-O 3.41Å; V367-S379 PolarHBondContact N-O 3.23Å; V367-S379 PolarHBondContact O-N 3.33Å
380	V	97.6	Very high	95.1	Very high	74 Å²	74	56.6 Å²	56.6	45%	0.448	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	116.6	-177.8	-179.4	0	0	0	0	109.1	K364 F365 V366 L378	K364-V380 HydrophobicContact CB-CG1 4.21Å; K364-V380 HydrophobicContact CD-CG1 3.83Å; K364-V380 HydrophobicContact CG-CG1 4.24Å; F365-V380 CarbonylContact O-C 3.58Å; F365-V380 WeakPolarHBondContact O-CA 3.31Å; V366-V380 HydrophobicContact CG1-CG2 4.34Å; V366-V380 HydrophobicContact CG2-CG1 4.36Å; V366-V380 HydrophobicContact CG2-CG2 4.35Å; L378-V380 HydrophobicContact CD1-CG2 3.86Å; L378-V380 HydrophobicContact CD2-CG2 4.49Å; L378-V380 HydrophobicContact CG-CG2 4.03Å
381	T	96.6	Very high	94.7	Very high	33 Å²	33	56.6 Å²	56.6	20%	0.202	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	114.7	175.2	-56.2	0	0	0	0	109.9	H287 K364 F365 V383	H287-T381 WeakPolarHBondContact NE2-CG2 3.43Å; K364-T381 CarbonylContact C-O 3.48Å; K364-T381 WeakPolarHBondContact CA-O 3.32Å; F365-T381 PolarHBondContact N-O 2.96Å; F365-T381 PolarHBondContact O-N 3.07Å; T381-V383 HydrophobicContact CG2-CG1 4.4Å
382	Q	96.7	Very high	94.4	Very high	127 Å²	127	56 Å²	56	59%	0.593	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.7	131.7	-178.4	-176.5	174.9	-29.7	0	0	111.2	V362 F363 K364	V362-Q382 HydrophobicContact CG1-CG 3.62Å; F363-Q382 WeakPolarHBondContact O-CA 3.36Å; K364-Q382 HydrophobicContact CG-CB 4.35Å; K364-Q382 HydrophobicContact CG-CG 4.43Å
383	V	96.1	Very high	94	Very high	7 Å²	7	58.5 Å²	58.5	4%	0.042	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	136.1	179.6	-63.8	0	0	0	0	112	Y299 F332 F363 F365 T381	Y299-V383 HydrophobicContact CD2-CB 4.07Å; Y299-V383 HydrophobicContact CD2-CG2 4.26Å; Y299-V383 HydrophobicContact CE2-CB 4.16Å; Y299-V383 HydrophobicContact CE2-CG1 4.09Å; Y299-V383 HydrophobicContact CE2-CG2 4.43Å; F332-V383 HydrophobicContact CE2-CG2 3.75Å; F332-V383 HydrophobicContact CZ-CG2 4.14Å; F363-V383 HydrophobicContact CB-CG2 4.46Å; F363-V383 PolarHBondContact N-O 3.1Å; F363-V383 PolarHBondContact O-N 3.35Å; F363-V383 VanDerWaalsContact O-O 3.1Å; F365-V383 HydrophobicContact CD2-CG1 3.96Å; F365-V383 HydrophobicContact CD2-CG2 3.9Å; F365-V383 HydrophobicContact CE2-CB 4.23Å; F365-V383 HydrophobicContact CE2-CG1 3.74Å; F365-V383 HydrophobicContact CE2-CG2 3.49Å; F365-V383 VanDerWaalsContact CE2-CG2 3.49Å; F365-V383 HydrophobicContact CZ-CG2 4.21Å; T381-V383 HydrophobicContact CG2-CG1 4.4Å
384	P	96.8	Very high	93.6	Very high	55 Å²	55	65.8 Å²	65.8	36%	0.357	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	134.1	172.9	30.1	-29.8	0	0	0	111	S297 Q298 Y299	S297-P384 WeakPolarHBondContact O-CG 3.24Å; Q298-P384 HydrophobicContact CB-CB 4.48Å; Q298-P384 HydrophobicContact CB-CG 3.85Å; Y299-P384 PolarHBondContact N-O 2.89Å
385	V	97.1	Very high	93.1	Very high	5 Å²	5	70.9 Å²	70.9	3%	0.03	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	116.7	171.4	-175.4	0	0	0	0	108	Y299 I301 F332 L356 Y360 G361 F363	Y299-V385 CarbonylContact O-C 3.56Å; Y299-V385 WeakPolarHBondContact O-CA 3.12Å; I301-V385 HydrophobicContact CG2-CG1 4Å; F332-V385 HydrophobicContact CE1-CG2 4.15Å; F332-V385 HydrophobicContact CZ-CG2 3.71Å; L356-V385 HydrophobicContact CD1-CG1 4.28Å; L356-V385 HydrophobicContact CD1-CG2 3.98Å; Y360-V385 CarbonylContact C-O 3.54Å; Y360-V385 WeakPolarHBondContact CA-O 3.39Å; Y360-V385 WeakPolarHBondContact CB-O 3.29Å; G361-V385 PolarHBondContact N-O 3.39Å; G361-V385 PolarHBondContact O-N 3.22Å; F363-V385 HydrophobicContact CB-CG2 4.29Å; F363-V385 HydrophobicContact CD2-CB 3.9Å; F363-V385 HydrophobicContact CD2-CG2 3.56Å; F363-V385 HydrophobicContact CE2-CB 4.19Å; F363-V385 HydrophobicContact CE2-CG2 4.21Å; F363-V385 HydrophobicContact CG-CG2 4.18Å
386	R	95.4	Very high	92.5	Very high	51 Å²	51	77.4 Å²	77.4	19%	0.192	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	157.8	-179.8	64	163.5	-177.4	81.4	-2.3	111.9	Q298 Y299 T300 I301	Q298-R386 VanDerWaalsContact NE2-NE 3.19Å; Y299-R386 WeakPolarHBondContact O-CG 3.38Å; Y299-R386 PolarHBondContact O-N 2.91Å; T300-R386 CarbonylContact C-O 3.6Å; T300-R386 WeakPolarHBondContact CA-O 3.48Å; T300-R386 WeakPolarHBondContact CG2-O 3.49Å; I301-R386 PolarHBondContact N-O 2.92Å
387	P	95.8	Very high	92	Very high	57 Å²	57	79 Å²	79	37%	0.37	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-67.5	167.9	167.3	31.3	-35.6	0	0	0	111	Y360	Y360-P387 HydrophobicContact CD1-CB 4.33Å; Y360-P387 HydrophobicContact CG-CG 4.41Å
388	F	93.4	Very high	91.7	Very high	63 Å²	63	84.4 Å²	84.4	28%	0.276	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-60	137	169.8	-66.2	-64.8	0	0	0	110.8	T300 I301 Q392 Y393	T300-F388 HydrophobicContact CG2-CD1 3.33Å; T300-F388 HydrophobicContact CG2-CE1 3.43Å; T300-F388 VanDerWaalsContact CG2-CE1 3.43Å; T300-F388 HydrophobicContact CG2-CG 3.99Å; T300-F388 HydrophobicContact CG2-CZ 4.18Å; I301-F388 HydrophobicContact CD1-CD2 3.56Å; I301-F388 HydrophobicContact CD1-CE2 3.62Å; I301-F388 HydrophobicContact CD1-CG 4.45Å; I301-F388 HydrophobicContact CG1-CD2 3.78Å; I301-F388 HydrophobicContact CG1-CE2 3.59Å; I301-F388 HydrophobicContact CG1-CG 4.4Å; I301-F388 HydrophobicContact CG1-CZ 4.05Å; I301-F388 WeakPolarHBondContact O-CZ 3.3Å; F388-Q392 HydrophobicContact CB-CB 4.19Å; F388-Q392 HydrophobicContact CD1-CB 4.05Å; F388-Y393 HydrophobicContact CB-CE1 4.27Å; F388-Y393 HydrophobicContact CB-CE2 4.12Å
389	T	90.4	Very high	91.4	Very high	56 Å²	56	84.2 Å²	84.2	34%	0.344	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-73.3	158.8	168.4	53.9	0	0	0	0	109.7	T391 Q392 Y393	T389-T391 PolarHBondContact O-N 3.26Å; T389-T391 PolarHBondContact OG1-OG1 3.4Å; T389-Q392 PolarHBondContact O-N 2.69Å; T389-Q392 VanDerWaalsContact OG1-CG 3.32Å; T389-Q392 WeakPolarHBondContact OG1-CG 3.32Å; T389-Q392 PolarHBondContact OG1-OE1 3.48Å; T389-Y393 WeakPolarHBondContact O-CD2 3.11Å
390	H	86.4	Confident	91.1	Very high	162 Å²	162	84.7 Å²	84.7	75%	0.75	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-28.4	176.2	-173.9	-81.8	0	0	0	113.1
391	T	86.6	Confident	90.8	Very high	102 Å²	102	87.3 Å²	87.3	63%	0.626	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-16	177.1	51.4	0	0	0	0	114.9	T389	T389-T391 PolarHBondContact O-N 3.26Å; T389-T391 PolarHBondContact OG1-OG1 3.4Å
392	Q	87.3	Confident	90.7	Very high	82 Å²	82	89.7 Å²	89.7	38%	0.383	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-11.7	-177.2	-73.4	176.9	-46.5	0	0	113.7	F388 T389	F388-Q392 HydrophobicContact CB-CB 4.19Å; F388-Q392 HydrophobicContact CD1-CB 4.05Å; T389-Q392 PolarHBondContact O-N 2.69Å; T389-Q392 VanDerWaalsContact OG1-CG 3.32Å; T389-Q392 WeakPolarHBondContact OG1-CG 3.32Å; T389-Q392 PolarHBondContact OG1-OE1 3.48Å
393	Y	86.6	Confident	90.6	Very high	135 Å²	135	92 Å²	92	53%	0.529	46%	0.458	S	S	.	.	S	Bend	trans	-68.2	144.1	172.4	-69.8	-77.9	0	0	0	110.9	F388 T389 R395	F388-Y393 HydrophobicContact CB-CE1 4.27Å; F388-Y393 HydrophobicContact CB-CE2 4.12Å; T389-Y393 WeakPolarHBondContact O-CD2 3.11Å; Y393-R395 PolarHBondContact O-N 3.15Å
394	E	84.6	Confident	90.5	Very high	154 Å²	154	95.8 Å²	95.8	72%	0.72	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-57.2	131.5	173.5	-170.5	177.7	-172.3	0	0	110.3	L397	E394-L397 HydrophobicContact CB-CD2 4.48Å
395	R	85.7	Confident	90.4	Very high	166 Å²	166	96.5 Å²	96.5	63%	0.626	48%	0.478	S	S	*	.	S	Bend	trans	-100.5	148.2	177.3	-64.6	-175	178.7	-165.8	-1.2	109.5	Y393	Y393-R395 PolarHBondContact O-N 3.15Å
396	F	83.7	Confident	90.3	Very high	141 Å²	141	99.5 Å²	99.5	62%	0.618	50%	0.5	S	S	*	.	S	Bend	trans	64.6	52.1	-179	-48.9	-76.4	0	0	0	113.5	V398 Y404	F396-V398 PolarHBondContact O-N 3.1Å; F396-Y404 HydrophobicContact CB-CE2 4.45Å; F396-Y404 HydrophobicContact CD1-CE2 4.19Å
397	L	85.9	Confident	90.3	Very high	90 Å²	90	99.7 Å²	99.7	47%	0.471	51%	0.512	S	S	.	.			trans	-51.9	134.8	173.1	-67	165.6	0	0	0	110.3	E394 A399 A400	E394-L397 HydrophobicContact CB-CD2 4.48Å; L397-A399 PolarHBondContact O-N 3.01Å; L397-A399 VanDerWaalsContact O-N 3.17Å; L397-A400 HydrophobicContact CB-CB 4.16Å; L397-A400 WeakPolarHBondContact O-CA 3.22Å; L397-A400 WeakPolarHBondContact O-CB 3.37Å; L397-A400 PolarHBondContact O-N 2.82Å
398	V	88.6	Confident	90.3	Very high	118 Å²	118	101.6 Å²	101.6	72%	0.715	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-58.1	-34.9	179.5	-179.4	0	0	0	0	111.3	F396 A400 Y401	F396-V398 PolarHBondContact O-N 3.1Å; V398-A400 PolarHBondContact O-N 2.87Å; V398-Y401 HydrophobicContact CB-CD2 4.38Å; V398-Y401 HydrophobicContact CB-CE2 4.47Å; V398-Y401 HydrophobicContact CG1-CD2 4.25Å; V398-Y401 HydrophobicContact CG2-CE2 4.38Å; V398-Y401 VanDerWaalsContact O-CD2 3.31Å; V398-Y401 WeakPolarHBondContact O-CD2 3.25Å; V398-Y401 PolarHBondContact O-N 3.29Å
399	A	90.6	Very high	90.4	Very high	84 Å²	84	102.4 Å²	102.4	69%	0.694	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-66.2	-19.7	175.6	0	0	0	0	0	114.2	L397 P402	L397-A399 PolarHBondContact O-N 3.01Å; L397-A399 VanDerWaalsContact O-N 3.17Å; A399-P402 WeakPolarHBondContact O-CD 3.3Å
400	A	90.3	Very high	90.6	Very high	17 Å²	17	106.2 Å²	106.2	14%	0.14	55%	0.547	C	S	.	.	G	3₁₀ helix	trans	-89.7	-7.6	-179.2	0	0	0	0	0	113.5	L397 V398 P402 Y403 Y404	L397-A400 HydrophobicContact CB-CB 4.16Å; L397-A400 WeakPolarHBondContact O-CA 3.22Å; L397-A400 WeakPolarHBondContact O-CB 3.37Å; L397-A400 PolarHBondContact O-N 2.82Å; V398-A400 PolarHBondContact O-N 2.87Å; A400-P402 VanDerWaalsContact C-CD 3.48Å; A400-Y403 WeakPolarHBondContact O-CB 3.19Å; A400-Y403 PolarHBondContact O-N 2.89Å; A400-Y404 HydrophobicContact CB-CD2 4.23Å; A400-Y404 HydrophobicContact CB-CE1 4.2Å; A400-Y404 HydrophobicContact CB-CE2 3.48Å; A400-Y404 VanDerWaalsContact CB-CE2 3.48Å; A400-Y404 VanDerWaalsContact CB-CZ 3.47Å; A400-Y404 WeakPolarHBondContact O-CD2 3.42Å; A400-Y404 PolarHBondContact O-N 2.91Å
401	Y	92.2	Very high	91.1	Very high	129 Å²	129	104.5 Å²	104.5	51%	0.506	54%	0.541	S	S	.	.	H	α-helix	trans	-54.2	-39.5	179.2	-84.8	-72.2	0	0	0	115	V398 Y403 Y404 S405	V398-Y401 HydrophobicContact CB-CD2 4.38Å; V398-Y401 HydrophobicContact CB-CE2 4.47Å; V398-Y401 HydrophobicContact CG1-CD2 4.25Å; V398-Y401 HydrophobicContact CG2-CE2 4.38Å; V398-Y401 VanDerWaalsContact O-CD2 3.31Å; V398-Y401 WeakPolarHBondContact O-CD2 3.25Å; V398-Y401 PolarHBondContact O-N 3.29Å; Y401-Y403 PolarHBondContact O-N 3.02Å; Y401-Y404 HydrophobicContact CD1-CD2 4.22Å; Y401-Y404 HydrophobicContact CG-CD2 4.47Å; Y401-Y404 PolarHBondContact O-N 2.92Å; Y401-S405 WeakPolarHBondContact O-CB 3.39Å; Y401-S405 PolarHBondContact O-N 3.27Å; Y401-S405 PolarHBondContact O-OG 2.84Å
402	P	95.1	Very high	91.6	Very high	82 Å²	82	104.2 Å²	104.2	53%	0.532	53%	0.534	S	S	.	.	H	α-helix	trans	-60.5	-31.8	175.1	-25.8	35.9	0	0	0	113.9	A399 A400 S405 S406	A399-P402 WeakPolarHBondContact O-CD 3.3Å; A400-P402 VanDerWaalsContact C-CD 3.48Å; P402-S405 WeakPolarHBondContact CA-OG 3.28Å; P402-S405 PolarHBondContact O-OG 3.37Å; P402-S406 VanDerWaalsContact O-CB 3.26Å; P402-S406 WeakPolarHBondContact O-CB 3.44Å; P402-S406 PolarHBondContact O-N 3.35Å
403	Y	94	Very high	92	Very high	177 Å²	177	102.1 Å²	102.1	69%	0.694	54%	0.535	S	S	*	.	H	α-helix	trans	-77.2	-41.3	176.2	-61.5	-80.5	0	0	0	111.2	A400 Y401 S405 S406 A407	A400-Y403 WeakPolarHBondContact O-CB 3.19Å; A400-Y403 PolarHBondContact O-N 2.89Å; Y401-Y403 PolarHBondContact O-N 3.02Å; Y403-S405 VanDerWaalsContact C-N 3.33Å; Y403-S405 PolarHBondContact O-N 2.97Å; Y403-S406 PolarHBondContact O-N 2.8Å; Y403-A407 WeakPolarHBondContact O-CB 3.13Å; Y403-A407 PolarHBondContact O-N 2.87Å
404	Y	93.7	Very high	92.4	Very high	86 Å²	86	101.1 Å²	101.1	34%	0.337	54%	0.538	S	S	.	.	H	α-helix	trans	-60.6	-43.6	173.9	-56.6	-37.2	0	0	0	111.3	F396 A400 Y401 A407 I408	F396-Y404 HydrophobicContact CB-CE2 4.45Å; F396-Y404 HydrophobicContact CD1-CE2 4.19Å; A400-Y404 HydrophobicContact CB-CD2 4.23Å; A400-Y404 HydrophobicContact CB-CE1 4.2Å; A400-Y404 HydrophobicContact CB-CE2 3.48Å; A400-Y404 VanDerWaalsContact CB-CE2 3.48Å; A400-Y404 VanDerWaalsContact CB-CZ 3.47Å; A400-Y404 WeakPolarHBondContact O-CD2 3.42Å; A400-Y404 PolarHBondContact O-N 2.91Å; Y401-Y404 HydrophobicContact CD1-CD2 4.22Å; Y401-Y404 HydrophobicContact CG-CD2 4.47Å; Y401-Y404 PolarHBondContact O-N 2.92Å; Y404-A407 PolarHBondContact O-N 2.83Å; Y404-I408 WeakPolarHBondContact O-CD1 2.99Å; Y404-I408 VanDerWaalsContact O-CG1 3.23Å; Y404-I408 WeakPolarHBondContact O-CG1 3.49Å; Y404-I408 PolarHBondContact O-N 2.72Å
405	S	94.4	Very high	92.8	Very high	70 Å²	70	99.2 Å²	99.2	49%	0.49	53%	0.532	S	S	.	.	H	α-helix	trans	-67.9	-39.6	177.7	66	0	0	0	0	112.6	Y401 P402 Y403 I408 S409	Y401-S405 WeakPolarHBondContact O-CB 3.39Å; Y401-S405 PolarHBondContact O-N 3.27Å; Y401-S405 PolarHBondContact O-OG 2.84Å; P402-S405 WeakPolarHBondContact CA-OG 3.28Å; P402-S405 PolarHBondContact O-OG 3.37Å; Y403-S405 VanDerWaalsContact C-N 3.33Å; Y403-S405 PolarHBondContact O-N 2.97Å; S405-I408 PolarHBondContact O-N 3.18Å; S405-S409 VanDerWaalsContact O-CB 3.3Å; S405-S409 WeakPolarHBondContact O-CB 3.49Å; S405-S409 PolarHBondContact O-N 2.92Å
406	S	95.2	Very high	93.2	Very high	68 Å²	68	94.3 Å²	94.3	48%	0.476	52%	0.523	S	S	.	.	H	α-helix	trans	-61.2	-45.9	173.7	179.9	0	0	0	0	112.2	P402 Y403 I408 S409 M410	P402-S406 VanDerWaalsContact O-CB 3.26Å; P402-S406 WeakPolarHBondContact O-CB 3.44Å; P402-S406 PolarHBondContact O-N 3.35Å; Y403-S406 PolarHBondContact O-N 2.8Å; S406-I408 PolarHBondContact O-N 3.26Å; S406-S409 WeakPolarHBondContact O-CB 3.5Å; S406-S409 PolarHBondContact O-N 2.88Å; S406-M410 WeakPolarHBondContact O-CG 3.26Å; S406-M410 PolarHBondContact O-N 2.94Å
407	A	94.8	Very high	93.6	Very high	54 Å²	54	93.7 Å²	93.7	45%	0.446	52%	0.52	S	S	.	.	H	α-helix	trans	-62.2	-44.1	177.1	0	0	0	0	0	112	Y403 Y404 M410 M411	Y403-A407 WeakPolarHBondContact O-CB 3.13Å; Y403-A407 PolarHBondContact O-N 2.87Å; Y404-A407 PolarHBondContact O-N 2.83Å; A407-M410 PolarHBondContact O-N 3.03Å; A407-M411 WeakPolarHBondContact O-CG 3.5Å; A407-M411 PolarHBondContact O-N 2.79Å
408	I	95.8	Very high	93.8	Very high	98 Å²	98	91.8 Å²	91.8	50%	0.503	51%	0.514	S	S	.	.	H	α-helix	trans	-62.7	-42.6	175.2	-68	165.6	0	0	0	110.7	Y404 S405 S406 M410 M411 I412	Y404-I408 WeakPolarHBondContact O-CD1 2.99Å; Y404-I408 VanDerWaalsContact O-CG1 3.23Å; Y404-I408 WeakPolarHBondContact O-CG1 3.49Å; Y404-I408 PolarHBondContact O-N 2.72Å; S405-I408 PolarHBondContact O-N 3.18Å; S406-I408 PolarHBondContact O-N 3.26Å; I408-M410 PolarHBondContact O-N 3.13Å; I408-M411 PolarHBondContact O-N 2.88Å; I408-I412 HydrophobicContact CG2-CD1 3.82Å; I408-I412 HydrophobicContact CG2-CG1 4.47Å; I408-I412 WeakPolarHBondContact O-CG1 3.39Å; I408-I412 PolarHBondContact O-N 2.97Å
409	S	96.2	Very high	93.9	Very high	79 Å²	79	92.2 Å²	92.2	55%	0.552	51%	0.506	S	S	*	.	H	α-helix	trans	-59.8	-44.2	175.9	-176.7	0	0	0	0	111.9	S405 S406 M411 I412 G413	S405-S409 VanDerWaalsContact O-CB 3.3Å; S405-S409 WeakPolarHBondContact O-CB 3.49Å; S405-S409 PolarHBondContact O-N 2.92Å; S406-S409 WeakPolarHBondContact O-CB 3.5Å; S406-S409 PolarHBondContact O-N 2.88Å; S409-M411 PolarHBondContact O-N 3.43Å; S409-I412 PolarHBondContact O-N 3.23Å; S409-G413 PolarHBondContact O-N 3.22Å
410	M	95.7	Very high	93.8	Very high	136 Å²	136	91.6 Å²	91.6	67%	0.67	49%	0.494	S	S	*	.	H	α-helix	trans	-62.1	-41.1	175.4	-74.6	-60	-59.4	0	0	112.6	S406 A407 I408 G413 L414	S406-M410 WeakPolarHBondContact O-CG 3.26Å; S406-M410 PolarHBondContact O-N 2.94Å; A407-M410 PolarHBondContact O-N 3.03Å; I408-M410 PolarHBondContact O-N 3.13Å; M410-G413 PolarHBondContact O-N 3.4Å; M410-L414 WeakPolarHBondContact O-CB 3.21Å; M410-L414 PolarHBondContact O-N 3.38Å
411	M	96	Very high	93.6	Very high	126 Å²	126	98 Å²	98	62%	0.621	52%	0.519	S	S	*	.	H	α-helix	trans	-62.9	-46.3	175.5	-71.4	175.2	57.7	0	0	111.8	A407 I408 S409 G413 L414 I415	A407-M411 WeakPolarHBondContact O-CG 3.5Å; A407-M411 PolarHBondContact O-N 2.79Å; I408-M411 PolarHBondContact O-N 2.88Å; S409-M411 PolarHBondContact O-N 3.43Å; M411-G413 VanDerWaalsContact C-N 3.34Å; M411-L414 PolarHBondContact O-N 2.68Å; M411-I415 VanDerWaalsContact O-CG1 3.26Å; M411-I415 WeakPolarHBondContact O-CG1 3.49Å; M411-I415 PolarHBondContact O-N 3.03Å
412	I	96.5	Very high	93.3	Very high	97 Å²	97	98.1 Å²	98.1	50%	0.497	53%	0.528	S	S	.	.	H	α-helix	trans	-64.1	-41.3	177.3	-66.8	168.2	0	0	0	110.8	I408 S409 I415 S416	I408-I412 HydrophobicContact CG2-CD1 3.82Å; I408-I412 HydrophobicContact CG2-CG1 4.47Å; I408-I412 WeakPolarHBondContact O-CG1 3.39Å; I408-I412 PolarHBondContact O-N 2.97Å; S409-I412 PolarHBondContact O-N 3.23Å; I412-I415 PolarHBondContact O-N 2.96Å; I412-S416 VanDerWaalsContact O-CB 3.32Å; I412-S416 WeakPolarHBondContact O-CB 3.43Å; I412-S416 PolarHBondContact O-N 2.98Å; I412-S416 PolarHBondContact O-OG 2.99Å
413	G	95.5	Very high	92.7	Very high	38 Å²	38	102.4 Å²	102.4	39%	0.392	54%	0.535	S	S	.	.	H	α-helix	trans	-61.5	-45.3	176.7	0	0	0	0	0	112	S409 M410 M411 S416 F417	S409-G413 PolarHBondContact O-N 3.22Å; M410-G413 PolarHBondContact O-N 3.4Å; M411-G413 VanDerWaalsContact C-N 3.34Å; G413-S416 PolarHBondContact O-N 3.4Å; G413-F417 VanDerWaalsContact O-CB 3.24Å; G413-F417 WeakPolarHBondContact O-CB 3.39Å; G413-F417 PolarHBondContact O-N 3.46Å
414	L	95.4	Very high	91.7	Very high	113 Å²	113	99.8 Å²	99.8	59%	0.592	53%	0.532	S	S	*	.	H	α-helix	trans	-64.9	-42.7	176.3	-177.3	69.6	0	0	0	112	M410 M411 F417 S418	M410-L414 WeakPolarHBondContact O-CB 3.21Å; M410-L414 PolarHBondContact O-N 3.38Å; M411-L414 PolarHBondContact O-N 2.68Å; L414-F417 PolarHBondContact O-N 3.38Å; L414-S418 VanDerWaalsContact O-CB 3.25Å; L414-S418 WeakPolarHBondContact O-CB 3.46Å; L414-S418 PolarHBondContact O-N 2.87Å; L414-S418 PolarHBondContact O-OG 3.45Å
415	I	94.3	Very high	90.4	Very high	115 Å²	115	103.6 Å²	103.6	59%	0.59	55%	0.55	S	S	*	.	H	α-helix	trans	-62.2	-46.9	176.5	-69	166.1	0	0	0	110	M411 I412 S418 F419	M411-I415 VanDerWaalsContact O-CG1 3.26Å; M411-I415 WeakPolarHBondContact O-CG1 3.49Å; M411-I415 PolarHBondContact O-N 3.03Å; I412-I415 PolarHBondContact O-N 2.96Å; I415-S418 PolarHBondContact O-N 3.19Å; I415-F419 WeakPolarHBondContact O-CB 3.15Å; I415-F419 PolarHBondContact O-N 2.93Å
416	S	92.7	Very high	88.9	Confident	63 Å²	63	107.3 Å²	107.3	44%	0.441	57%	0.565	S	S	.	*	H	α-helix	trans	-62.5	-45.9	177.7	-58.1	0	0	0	0	112	I412 G413 F419 V420	I412-S416 VanDerWaalsContact O-CB 3.32Å; I412-S416 WeakPolarHBondContact O-CB 3.43Å; I412-S416 PolarHBondContact O-N 2.98Å; I412-S416 PolarHBondContact O-OG 2.99Å; G413-S416 PolarHBondContact O-N 3.4Å; S416-F419 PolarHBondContact O-N 2.91Å; S416-V420 WeakPolarHBondContact O-CG2 3.38Å; S416-V420 PolarHBondContact O-N 3.09Å
417	F	92.1	Very high	87.3	Confident	128 Å²	128	110.4 Å²	110.4	56%	0.561	58%	0.576	S	S	*	*	H	α-helix	trans	-63.3	-44.6	176.5	174.6	-98.1	0	0	0	111.8	G413 L414 F419 V420 F421	G413-F417 VanDerWaalsContact O-CB 3.24Å; G413-F417 WeakPolarHBondContact O-CB 3.39Å; G413-F417 PolarHBondContact O-N 3.46Å; L414-F417 PolarHBondContact O-N 3.38Å; F417-F419 VanDerWaalsContact C-N 3.3Å; F417-F419 PolarHBondContact O-N 3.02Å; F417-V420 PolarHBondContact O-N 2.98Å; F417-F421 HydrophobicContact CE1-CB 4.35Å; F417-F421 HydrophobicContact CZ-CB 4.42Å; F417-F421 HydrophobicContact CZ-CD2 4.35Å; F417-F421 VanDerWaalsContact O-CB 3.29Å; F417-F421 WeakPolarHBondContact O-CB 3.43Å; F417-F421 PolarHBondContact O-N 3.36Å
418	S	90.1	Very high	85.4	Confident	49 Å²	49	116.8 Å²	116.8	34%	0.343	59%	0.593	S	S	.	*	H	α-helix	trans	-63.2	-39.5	177.6	-57.1	0	0	0	0	111.1	L414 I415 L422	L414-S418 VanDerWaalsContact O-CB 3.25Å; L414-S418 WeakPolarHBondContact O-CB 3.46Å; L414-S418 PolarHBondContact O-N 2.87Å; L414-S418 PolarHBondContact O-OG 3.45Å; I415-S418 PolarHBondContact O-N 3.19Å; S418-L422 VanDerWaalsContact O-CB 3.3Å; S418-L422 WeakPolarHBondContact O-CB 3.27Å; S418-L422 VanDerWaalsContact O-CG 3.3Å; S418-L422 WeakPolarHBondContact O-CG 3.36Å; S418-L422 PolarHBondContact O-N 3.35Å
419	F	90.7	Very high	83.4	Confident	127 Å²	127	121 Å²	121	56%	0.557	61%	0.611	S	S	*	*	H	α-helix	trans	-63.1	-47.9	174.4	-168.9	-91.5	0	0	0	111.1	I415 S416 F417 Y423	I415-F419 WeakPolarHBondContact O-CB 3.15Å; I415-F419 PolarHBondContact O-N 2.93Å; S416-F419 PolarHBondContact O-N 2.91Å; F417-F419 VanDerWaalsContact C-N 3.3Å; F417-F419 PolarHBondContact O-N 3.02Å; F419-Y423 HydrophobicContact CD1-CD2 4.34Å; F419-Y423 AromaticContact CD2-CD2 3.78Å; F419-Y423 HydrophobicContact CD2-CD2 3.78Å; F419-Y423 AromaticContact CD2-CE2 3.81Å; F419-Y423 HydrophobicContact CD2-CE2 3.81Å; F419-Y423 HydrophobicContact CE1-CD2 4.3Å; F419-Y423 AromaticContact CE2-CD2 3.74Å; F419-Y423 HydrophobicContact CE2-CD2 3.74Å; F419-Y423 AromaticContact CE2-CE2 3.66Å; F419-Y423 HydrophobicContact CE2-CE2 3.66Å; F419-Y423 HydrophobicContact CG-CD2 4.08Å; F419-Y423 HydrophobicContact CZ-CD2 4.02Å; F419-Y423 HydrophobicContact CZ-CE2 4.29Å; F419-Y423 HydrophobicContact CZ-CG 4.46Å; F419-Y423 WeakPolarHBondContact O-CB 3.28Å; F419-Y423 VanDerWaalsContact O-CD2 3.32Å; F419-Y423 WeakPolarHBondContact O-CD2 3.44Å; F419-Y423 PolarHBondContact O-N 3.3Å
420	V	88.8	Confident	81	Confident	72 Å²	72	127.1 Å²	127.1	44%	0.436	63%	0.627	S	S	.	*	H	α-helix	trans	-59.9	-51.9	174.6	165	0	0	0	0	110.9	S416 F417 L422 Y423 L424	S416-V420 WeakPolarHBondContact O-CG2 3.38Å; S416-V420 PolarHBondContact O-N 3.09Å; F417-V420 PolarHBondContact O-N 2.98Å; V420-L422 VanDerWaalsContact C-N 3.33Å; V420-L422 PolarHBondContact O-N 3.09Å; V420-Y423 PolarHBondContact O-N 2.84Å; V420-L424 HydrophobicContact CB-CD1 4.25Å; V420-L424 HydrophobicContact CG1-CB 4.37Å; V420-L424 HydrophobicContact CG1-CD1 3.53Å; V420-L424 HydrophobicContact CG1-CG 4.49Å; V420-L424 HydrophobicContact CG2-CD1 4.31Å; V420-L424 WeakPolarHBondContact O-CA 3.16Å; V420-L424 VanDerWaalsContact O-CB 3.23Å; V420-L424 WeakPolarHBondContact O-CB 3.4Å; V420-L424 PolarHBondContact O-N 2.79Å
421	F	85.8	Confident	78.9	Confident	150 Å²	150	123.8 Å²	123.8	66%	0.658	63%	0.628	S	S	*	*	H	α-helix	trans	-60.9	-37.1	-178.1	-176.4	-97.5	0	0	0	113.6	F417	F417-F421 HydrophobicContact CE1-CB 4.35Å; F417-F421 HydrophobicContact CZ-CB 4.42Å; F417-F421 HydrophobicContact CZ-CD2 4.35Å; F417-F421 VanDerWaalsContact O-CB 3.29Å; F417-F421 WeakPolarHBondContact O-CB 3.43Å; F417-F421 PolarHBondContact O-N 3.36Å
422	L	86	Confident	76.3	Confident	133 Å²	133	130.8 Å²	130.8	70%	0.696	66%	0.659	S	S	*	*	H	α-helix	trans	-77.8	-32.5	178.4	-73.3	174.9	0	0	0	113.6	S418 V420	S418-L422 VanDerWaalsContact O-CB 3.3Å; S418-L422 WeakPolarHBondContact O-CB 3.27Å; S418-L422 VanDerWaalsContact O-CG 3.3Å; S418-L422 WeakPolarHBondContact O-CG 3.36Å; S418-L422 PolarHBondContact O-N 3.35Å; V420-L422 VanDerWaalsContact C-N 3.33Å; V420-L422 PolarHBondContact O-N 3.09Å
423	Y	82.2	Confident	75.3	Confident	172 Å²	172	132.5 Å²	132.5	68%	0.675	67%	0.668	S	S	*	*	H	α-helix	trans	-108.9	-18.4	-172.4	-70.6	-81.8	0	0	0	114.6	F419 V420 K425	F419-Y423 HydrophobicContact CD1-CD2 4.34Å; F419-Y423 AromaticContact CD2-CD2 3.78Å; F419-Y423 HydrophobicContact CD2-CD2 3.78Å; F419-Y423 AromaticContact CD2-CE2 3.81Å; F419-Y423 HydrophobicContact CD2-CE2 3.81Å; F419-Y423 HydrophobicContact CE1-CD2 4.3Å; F419-Y423 AromaticContact CE2-CD2 3.74Å; F419-Y423 HydrophobicContact CE2-CD2 3.74Å; F419-Y423 AromaticContact CE2-CE2 3.66Å; F419-Y423 HydrophobicContact CE2-CE2 3.66Å; F419-Y423 HydrophobicContact CG-CD2 4.08Å; F419-Y423 HydrophobicContact CZ-CD2 4.02Å; F419-Y423 HydrophobicContact CZ-CE2 4.29Å; F419-Y423 HydrophobicContact CZ-CG 4.46Å; F419-Y423 WeakPolarHBondContact O-CB 3.28Å; F419-Y423 VanDerWaalsContact O-CD2 3.32Å; F419-Y423 WeakPolarHBondContact O-CD2 3.44Å; F419-Y423 PolarHBondContact O-N 3.3Å; V420-Y423 PolarHBondContact O-N 2.84Å; Y423-K425 PolarHBondContact O-N 3.34Å; Y423-K425 VanDerWaalsContact O-N 3.16Å
424	L	73.3	Confident	74.2	Confident	121 Å²	121	137.4 Å²	137.4	63%	0.634	68%	0.682	S	S	*	*	S	Bend	trans	-78.9	97.9	164.2	-102.1	113.3	0	0	0	108.2	V420 D426	V420-L424 HydrophobicContact CB-CD1 4.25Å; V420-L424 HydrophobicContact CG1-CB 4.37Å; V420-L424 HydrophobicContact CG1-CD1 3.53Å; V420-L424 HydrophobicContact CG1-CG 4.49Å; V420-L424 HydrophobicContact CG2-CD1 4.31Å; V420-L424 WeakPolarHBondContact O-CA 3.16Å; V420-L424 VanDerWaalsContact O-CB 3.23Å; V420-L424 WeakPolarHBondContact O-CB 3.4Å; V420-L424 PolarHBondContact O-N 2.79Å; L424-D426 PolarHBondContact O-N 2.78Å
425	K	66.1	Low	73	Confident	166 Å²	166	138.8 Å²	138.8	72%	0.722	69%	0.687	S	S	*	*			trans	-61.2	125.3	164.4	-167.2	179.8	177.4	-165.7	0	108.4	Y423 D427	Y423-K425 PolarHBondContact O-N 3.34Å; Y423-K425 VanDerWaalsContact O-N 3.16Å; K425-D427 VanDerWaalsContact C-N 3.34Å; K425-D427 PolarHBondContact O-N 3Å
426	D	63.3	Low	71.8	Confident	149 Å²	149	140.2 Å²	140.2	80%	0.797	69%	0.693	S	S	*	*			trans	-63.8	100.2	161.8	-84.7	-30	0	0	0	107.1	L424 K428	L424-D426 PolarHBondContact O-N 2.78Å; D426-K428 PolarHBondContact O-N 3.02Å
427	D	62.5	Low	70.5	Confident	132 Å²	132	145 Å²	145	71%	0.706	71%	0.709	S	S	*	*			trans	-70.3	10.5	170.9	-78.9	-22.3	0	0	0	112.3	K425 E429	K425-D427 VanDerWaalsContact C-N 3.34Å; K425-D427 PolarHBondContact O-N 3Å; D427-E429 VanDerWaalsContact C-N 3.26Å; D427-E429 PolarHBondContact O-N 2.86Å; D427-E429 VanDerWaalsContact O-N 3.07Å
428	K	55	Low	69.1	Low	189 Å²	189	146.1 Å²	146.1	82%	0.822	72%	0.718	S	S	*	*			trans	-86.9	78.5	169.5	-68.8	-169.7	178.7	-178.5	0	109.2	D426 K430	D426-K428 PolarHBondContact O-N 3.02Å; K428-K430 PolarHBondContact O-N 2.76Å
429	E	53.2	Low	67.6	Low	185 Å²	185	153.1 Å²	153.1	86%	0.864	75%	0.745	S	S	*	*			trans	-38.3	112.7	146	-73.4	-177.9	155.6	0	0	108.3	D427 G431	D427-E429 VanDerWaalsContact C-N 3.26Å; D427-E429 PolarHBondContact O-N 2.86Å; D427-E429 VanDerWaalsContact O-N 3.07Å; E429-G431 PolarHBondContact O-N 3.39Å
430	K	46.5	Very low	65.8	Low	208 Å²	208	155.1 Å²	155.1	90%	0.904	76%	0.76	S	S	*	*	S	Bend	trans	-58.8	120.6	160	-78.1	176.1	172.7	175.9	0	106.9	K428	K428-K430 PolarHBondContact O-N 2.76Å
431	G	50.9	Low	63.9	Low	67 Å²	67	162 Å²	162	69%	0.691	79%	0.787	S	S	*	*			trans	101.5	99.2	155.4	0	0	0	0	0	114	E429	E429-G431 PolarHBondContact O-N 3.39Å
432	E	41.5	Very low	61.9	Low	272 Å²	272	163.1 Å²	163.1	100%	1.271	80%	0.798	S	S	*	*				-55	0	119.4	-71.2	-178	151.7	0	0	110.8

Retrieved 432 of 432 residues in 1453.6 ms (Link to these results)

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