A0A087X9U1_POEFO Loading...

3-ketoacyl-CoA reductase

Catalyzes the second of the four reactions of the long-chain fatty acids elongation cycle. This endoplasmic reticulum-bound enzymatic process, allows the addition of two carbons to the chain of long- and very long-chain fatty acids/VLCFAs per cycle. This enzyme has a 3-ketoacyl-CoA reductase activity, reducing 3-ketoacyl-CoA to 3-hydroxyacyl-CoA, within each cycle of fatty acid elongation. Thereby, it may participate in the production of VLCFAs of different chain lengths that are involved in multiple biological processes as precursors of membrane lipids and lipid mediators. May also catalyze the transformation of estrone (E1) into estradiol (E2) and play a role in estrogen formation.

AlphaFold DB , UniProt , Accession A0A087X9U1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 330 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	56.2	Low	71.3	Confident	200 Å²	200	114 Å²	114	99%	0.985	58%	0.58	S	S	*	*				0	117.8	0	-130.4	164.8	81.9	0	0	106.7	V6	M1-V6 HydrophobicContact CE-CG2 3.6Å
2	N	69.1	Low	72	Confident	114 Å²	114	119.3 Å²	119.3	61%	0.61	59%	0.588	S	S	*	*			trans	-77.3	143.4	-173.2	-152.4	14.3	0	0	0	110.2	D4 S5	N2-D4 VanDerWaalsContact C-N 3.27Å; N2-D4 PolarHBondContact O-N 3.06Å; N2-S5 WeakPolarHBondContact O-CB 3.42Å; N2-S5 PolarHBondContact O-N 3.13Å; N2-S5 VanDerWaalsContact O-N 3.08Å
3	R	67.9	Low	72.8	Confident	207 Å²	207	113.1 Å²	113.1	78%	0.781	57%	0.567	S	S	*	*	H	α-helix	trans	-57.7	-40.5	-173.5	-135.7	176.5	-177.1	-178.3	-0.8	112.1	S5 V6 D7	R3-S5 VanDerWaalsContact C-N 3.27Å; R3-S5 PolarHBondContact O-N 2.8Å; R3-V6 WeakPolarHBondContact O-CB 3.27Å; R3-V6 PolarHBondContact O-N 2.89Å; R3-D7 PolarHBondContact O-N 3.47Å
4	D	69.4	Low	73.9	Confident	111 Å²	111	113.8 Å²	113.8	59%	0.594	57%	0.568	S	S	*	*	H	α-helix	trans	-62.5	-31.2	178.9	-51.5	-35.4	0	0	0	113.3	N2 V6 E8	N2-D4 VanDerWaalsContact C-N 3.27Å; N2-D4 PolarHBondContact O-N 3.06Å; D4-V6 VanDerWaalsContact C-N 3.32Å; D4-E8 WeakPolarHBondContact O-CB 3.35Å; D4-E8 PolarHBondContact O-N 2.86Å; D4-E8 VanDerWaalsContact O-N 3.12Å
5	S	71.6	Confident	74.8	Confident	66 Å²	66	112 Å²	112	46%	0.462	57%	0.565	S	S	.	*	H	α-helix	trans	-73.5	-24.7	176.8	171.4	0	0	0	0	112.7	N2 R3 M9	N2-S5 WeakPolarHBondContact O-CB 3.42Å; N2-S5 PolarHBondContact O-N 3.13Å; N2-S5 VanDerWaalsContact O-N 3.08Å; R3-S5 VanDerWaalsContact C-N 3.27Å; R3-S5 PolarHBondContact O-N 2.8Å; S5-M9 WeakPolarHBondContact O-CB 3.46Å; S5-M9 PolarHBondContact O-N 3.34Å
6	V	75.7	Confident	75.8	Confident	49 Å²	49	109.6 Å²	109.6	30%	0.297	56%	0.56	S	S	.	*	H	α-helix	trans	-79.3	-42	176.2	179.5	0	0	0	0	109.9	M1 R3 D4 M9 M10	M1-V6 HydrophobicContact CE-CG2 3.6Å; R3-V6 WeakPolarHBondContact O-CB 3.27Å; R3-V6 PolarHBondContact O-N 2.89Å; D4-V6 VanDerWaalsContact C-N 3.32Å; V6-M9 PolarHBondContact O-N 3.18Å; V6-M10 HydrophobicContact CG1-CG 4.4Å; V6-M10 VanDerWaalsContact O-CG 3.26Å; V6-M10 WeakPolarHBondContact O-CG 3.29Å; V6-M10 PolarHBondContact O-N 3.16Å
7	D	76	Confident	76.8	Confident	102 Å²	102	110.2 Å²	110.2	55%	0.545	56%	0.564	S	S	.	*	H	α-helix	trans	-66.9	-39	179.4	-68.4	-27	0	0	0	112.1	R3 M9 M10 S11	R3-D7 PolarHBondContact O-N 3.47Å; D7-M9 VanDerWaalsContact C-N 3.34Å; D7-M9 PolarHBondContact O-N 3.07Å; D7-M10 PolarHBondContact O-N 2.7Å; D7-S11 WeakPolarHBondContact O-CB 3.44Å; D7-S11 PolarHBondContact O-N 3.24Å
8	E	76.2	Confident	77.8	Confident	111 Å²	111	111.6 Å²	111.6	52%	0.519	57%	0.565	S	S	.	*	H	α-helix	trans	-66.3	-36.8	174.2	-161.1	-175.3	171.6	0	0	112.1	D4 R12	D4-E8 WeakPolarHBondContact O-CB 3.35Å; D4-E8 PolarHBondContact O-N 2.86Å; D4-E8 VanDerWaalsContact O-N 3.12Å; E8-R12 VanDerWaalsContact O-CG 3.3Å; E8-R12 WeakPolarHBondContact O-CG 3.34Å; E8-R12 PolarHBondContact O-N 3.2Å; E8-R12 VanDerWaalsContact O-N 3.12Å; E8-R12 IonicContact OE1-CZ 3.75Å; E8-R12 IonicContact OE1-NE 3.01Å; E8-R12 IonicContact OE1-NH2 3.89Å; E8-R12 PolarHBondContact OE1-NH2 2.9Å
9	M	74.6	Confident	78.7	Confident	116 Å²	116	114.5 Å²	114.5	57%	0.571	57%	0.569	S	S	*	*	H	α-helix	trans	-67.9	-40.4	175.4	-171.1	179.8	73.7	0	0	111.9	S5 V6 D7 R12 A13	S5-M9 WeakPolarHBondContact O-CB 3.46Å; S5-M9 PolarHBondContact O-N 3.34Å; V6-M9 PolarHBondContact O-N 3.18Å; D7-M9 VanDerWaalsContact C-N 3.34Å; D7-M9 PolarHBondContact O-N 3.07Å; M9-R12 PolarHBondContact O-N 2.85Å; M9-A13 PolarHBondContact O-N 3.33Å
10	M	74.3	Confident	79.6	Confident	109 Å²	109	113.3 Å²	113.3	54%	0.537	57%	0.568	S	S	.	*	H	α-helix	trans	-65.2	-46.7	176.3	-72.1	-70.6	-73.5	0	0	111.3	V6 D7 R12 A13 E14	V6-M10 HydrophobicContact CG1-CG 4.4Å; V6-M10 VanDerWaalsContact O-CG 3.26Å; V6-M10 WeakPolarHBondContact O-CG 3.29Å; V6-M10 PolarHBondContact O-N 3.16Å; D7-M10 PolarHBondContact O-N 2.7Å; M10-R12 VanDerWaalsContact C-N 3.31Å; M10-R12 PolarHBondContact O-N 2.91Å; M10-A13 PolarHBondContact O-N 2.93Å; M10-E14 WeakPolarHBondContact O-CG 3.24Å; M10-E14 PolarHBondContact O-N 2.95Å
11	S	73.8	Confident	80.4	Confident	69 Å²	69	109.5 Å²	109.5	48%	0.483	56%	0.557	S	S	.	*	H	α-helix	trans	-58.9	-39.6	176.6	176.7	0	0	0	0	112.7	D7 A13 E14	D7-S11 WeakPolarHBondContact O-CB 3.44Å; D7-S11 PolarHBondContact O-N 3.24Å; S11-A13 VanDerWaalsContact C-N 3.29Å; S11-A13 PolarHBondContact O-N 2.59Å; S11-E14 PolarHBondContact O-N 3.3Å
12	R	79.8	Confident	82.3	Confident	177 Å²	177	101.7 Å²	101.7	67%	0.668	52%	0.524	S	S	*	.	H	α-helix	trans	-68.3	-26	174.9	-71.9	178.6	-172	-161.9	6	113.3	E8 M9 M10 P16	E8-R12 VanDerWaalsContact O-CG 3.3Å; E8-R12 WeakPolarHBondContact O-CG 3.34Å; E8-R12 PolarHBondContact O-N 3.2Å; E8-R12 VanDerWaalsContact O-N 3.12Å; E8-R12 IonicContact OE1-CZ 3.75Å; E8-R12 IonicContact OE1-NE 3.01Å; E8-R12 IonicContact OE1-NH2 3.89Å; E8-R12 PolarHBondContact OE1-NH2 2.9Å; M9-R12 PolarHBondContact O-N 2.85Å; M10-R12 VanDerWaalsContact C-N 3.31Å; M10-R12 PolarHBondContact O-N 2.91Å; R12-P16 WeakPolarHBondContact O-CD 3.38Å
13	A	81.7	Confident	83.6	Confident	39 Å²	39	103.3 Å²	103.3	32%	0.322	53%	0.526	S	S	.	.	H	α-helix	trans	-86.9	-24.8	178.9	0	0	0	0	0	113.6	M9 M10 S11 T15 P16 L17	M9-A13 PolarHBondContact O-N 3.33Å; M10-A13 PolarHBondContact O-N 2.93Å; S11-A13 VanDerWaalsContact C-N 3.29Å; S11-A13 PolarHBondContact O-N 2.59Å; A13-T15 PolarHBondContact O-N 3.05Å; A13-P16 WeakPolarHBondContact O-CD 3.45Å; A13-L17 HydrophobicContact CB-CD1 4.34Å; A13-L17 WeakPolarHBondContact O-CB 3.19Å; A13-L17 WeakPolarHBondContact O-CD1 3.44Å; A13-L17 WeakPolarHBondContact O-CG 3.39Å; A13-L17 PolarHBondContact O-N 3.09Å
14	E	88	Confident	84.9	Confident	123 Å²	123	96.6 Å²	96.6	58%	0.575	51%	0.508	S	S	*	.	H	α-helix	trans	-59.3	-45.5	-179.4	-79.2	172	-175	0	0	113.1	M10 S11 L17 F18	M10-E14 WeakPolarHBondContact O-CG 3.24Å; M10-E14 PolarHBondContact O-N 2.95Å; S11-E14 PolarHBondContact O-N 3.3Å; E14-L17 PolarHBondContact O-N 3.35Å; E14-F18 VanDerWaalsContact O-CB 3.31Å; E14-F18 WeakPolarHBondContact O-CB 3.49Å; E14-F18 PolarHBondContact O-N 3.17Å
15	T	88.3	Confident	86.3	Confident	87 Å²	87	96 Å²	96	53%	0.534	51%	0.509	S	S	.	.	H	α-helix	trans	-66.4	-48.6	-176.9	-58.9	0	0	0	0	112	A13 L17 F18 W19	A13-T15 PolarHBondContact O-N 3.05Å; T15-L17 PolarHBondContact O-N 3.21Å; T15-F18 PolarHBondContact O-N 2.89Å; T15-W19 PolarHBondContact O-N 3.05Å; T15-W19 VanDerWaalsContact O-N 3.12Å
16	P	90.9	Very high	87.4	Confident	74 Å²	74	95.3 Å²	95.3	48%	0.481	51%	0.507	S	S	.	.	H	α-helix	trans	-58.3	-44.4	171.6	-25.1	33.2	0	0	0	113.6	R12 A13 F18 W19 V20	R12-P16 WeakPolarHBondContact O-CD 3.38Å; A13-P16 WeakPolarHBondContact O-CD 3.45Å; P16-F18 VanDerWaalsContact C-N 3.33Å; P16-F18 PolarHBondContact O-N 3.34Å; P16-W19 PolarHBondContact O-N 3.09Å; P16-V20 VanDerWaalsContact O-CG2 3.32Å; P16-V20 WeakPolarHBondContact O-CG2 3.49Å; P16-V20 PolarHBondContact O-N 3.19Å
17	L	92.9	Very high	88.4	Confident	119 Å²	119	96.2 Å²	96.2	62%	0.623	51%	0.512	S	S	*	.	H	α-helix	trans	-63.7	-39	179.3	-74.4	170.4	0	0	0	112	A13 E14 T15 V20 G21	A13-L17 HydrophobicContact CB-CD1 4.34Å; A13-L17 WeakPolarHBondContact O-CB 3.19Å; A13-L17 WeakPolarHBondContact O-CD1 3.44Å; A13-L17 WeakPolarHBondContact O-CG 3.39Å; A13-L17 PolarHBondContact O-N 3.09Å; E14-L17 PolarHBondContact O-N 3.35Å; T15-L17 PolarHBondContact O-N 3.21Å; L17-V20 PolarHBondContact O-N 3.16Å; L17-G21 PolarHBondContact O-N 2.81Å
18	F	94.3	Very high	89.3	Confident	135 Å²	135	96.3 Å²	96.3	59%	0.592	51%	0.513	S	S	*	.	H	α-helix	trans	-59.3	-49.3	173.4	173.4	-93.9	0	0	0	111.3	E14 T15 P16 V20 G21 A22	E14-F18 VanDerWaalsContact O-CB 3.31Å; E14-F18 WeakPolarHBondContact O-CB 3.49Å; E14-F18 PolarHBondContact O-N 3.17Å; T15-F18 PolarHBondContact O-N 2.89Å; P16-F18 VanDerWaalsContact C-N 3.33Å; P16-F18 PolarHBondContact O-N 3.34Å; F18-V20 PolarHBondContact O-N 3.11Å; F18-G21 PolarHBondContact O-N 3.33Å; F18-A22 HydrophobicContact CE1-CB 4.45Å; F18-A22 WeakPolarHBondContact O-CB 3.5Å; F18-A22 PolarHBondContact O-N 3.01Å
19	W	95.6	Very high	90.2	Very high	168 Å²	168	93.7 Å²	93.7	64%	0.636	51%	0.51	S	S	*	.	H	α-helix	trans	-66.3	-37	179.8	-74.8	114.4	0	0	0	112.8	T15 P16 A22 F23	T15-W19 PolarHBondContact O-N 3.05Å; T15-W19 VanDerWaalsContact O-N 3.12Å; P16-W19 PolarHBondContact O-N 3.09Å; W19-A22 PolarHBondContact O-N 3.42Å; W19-F23 WeakPolarHBondContact O-CB 3.27Å; W19-F23 PolarHBondContact O-N 2.99Å
20	V	96	Very high	91.2	Very high	90 Å²	90	93.9 Å²	93.9	55%	0.545	51%	0.512	S	S	.	.	H	α-helix	trans	-62.1	-44.7	171.7	171.2	0	0	0	0	110.7	P16 L17 F18 T24	P16-V20 VanDerWaalsContact O-CG2 3.32Å; P16-V20 WeakPolarHBondContact O-CG2 3.49Å; P16-V20 PolarHBondContact O-N 3.19Å; L17-V20 PolarHBondContact O-N 3.16Å; F18-V20 PolarHBondContact O-N 3.11Å; V20-T24 WeakPolarHBondContact O-CB 3.4Å; V20-T24 PolarHBondContact O-N 2.82Å; V20-T24 PolarHBondContact O-OG1 3.22Å
21	G	96.1	Very high	92.1	Very high	33 Å²	33	94.6 Å²	94.6	34%	0.34	51%	0.509	S	S	.	.	H	α-helix	trans	-61.8	-49.6	175.9	0	0	0	0	0	112.4	L17 F18 F23 T24 V25	L17-G21 PolarHBondContact O-N 2.81Å; F18-G21 PolarHBondContact O-N 3.33Å; G21-F23 PolarHBondContact O-N 3.37Å; G21-T24 WeakPolarHBondContact O-CB 3.37Å; G21-T24 PolarHBondContact O-N 3.01Å; G21-V25 WeakPolarHBondContact O-CG2 3.36Å; G21-V25 PolarHBondContact O-N 3.07Å
22	A	96.2	Very high	93	Very high	36 Å²	36	95.8 Å²	95.8	30%	0.298	51%	0.51	S	S	.	.	H	α-helix	trans	-60.9	-45.4	178.5	0	0	0	0	0	111.8	F18 W19 T24 V25 A26	F18-A22 HydrophobicContact CE1-CB 4.45Å; F18-A22 WeakPolarHBondContact O-CB 3.5Å; F18-A22 PolarHBondContact O-N 3.01Å; W19-A22 PolarHBondContact O-N 3.42Å; A22-T24 VanDerWaalsContact C-N 3.33Å; A22-T24 PolarHBondContact O-N 2.81Å; A22-V25 PolarHBondContact O-N 3.13Å; A22-A26 WeakPolarHBondContact O-CB 3.34Å; A22-A26 PolarHBondContact O-N 2.96Å
23	F	97.1	Very high	93.7	Very high	148 Å²	148	91.8 Å²	91.8	65%	0.649	50%	0.501	S	S	*	.	H	α-helix	trans	-62.3	-40.5	175.5	-178.5	-98.9	0	0	0	111.9	W19 G21 A26 T27	W19-F23 WeakPolarHBondContact O-CB 3.27Å; W19-F23 PolarHBondContact O-N 2.99Å; G21-F23 PolarHBondContact O-N 3.37Å; F23-A26 PolarHBondContact O-N 2.77Å; F23-T27 VanDerWaalsContact O-CB 3.31Å; F23-T27 WeakPolarHBondContact O-CB 3.49Å; F23-T27 PolarHBondContact O-N 3.44Å; F23-T27 PolarHBondContact O-OG1 3.5Å
24	T	95.6	Very high	94.2	Very high	66 Å²	66	97 Å²	97	41%	0.405	51%	0.514	S	S	.	.	H	α-helix	trans	-63.3	-48.6	176.8	-59.1	0	0	0	0	111.1	V20 G21 A22 A26 T27 L28	V20-T24 WeakPolarHBondContact O-CB 3.4Å; V20-T24 PolarHBondContact O-N 2.82Å; V20-T24 PolarHBondContact O-OG1 3.22Å; G21-T24 WeakPolarHBondContact O-CB 3.37Å; G21-T24 PolarHBondContact O-N 3.01Å; A22-T24 VanDerWaalsContact C-N 3.33Å; A22-T24 PolarHBondContact O-N 2.81Å; T24-A26 PolarHBondContact O-N 2.97Å; T24-T27 PolarHBondContact O-N 2.89Å; T24-L28 HydrophobicContact CG2-CD1 4.11Å; T24-L28 HydrophobicContact CG2-CG 4.49Å; T24-L28 WeakPolarHBondContact O-CB 3.31Å; T24-L28 WeakPolarHBondContact O-CG 3.46Å; T24-L28 PolarHBondContact O-N 2.94Å
25	V	96.9	Very high	94.2	Very high	100 Å²	100	96.6 Å²	96.6	61%	0.606	51%	0.506	S	S	*	.	H	α-helix	trans	-61.5	-45.5	177.8	172.3	0	0	0	0	111	G21 A22 T27 L28 A29	G21-V25 WeakPolarHBondContact O-CG2 3.36Å; G21-V25 PolarHBondContact O-N 3.07Å; A22-V25 PolarHBondContact O-N 3.13Å; V25-T27 VanDerWaalsContact C-N 3.34Å; V25-T27 PolarHBondContact O-N 2.9Å; V25-L28 PolarHBondContact O-N 2.92Å; V25-A29 VanDerWaalsContact O-CB 3.32Å; V25-A29 WeakPolarHBondContact O-CB 3.3Å; V25-A29 PolarHBondContact O-N 3.47Å
26	A	96.6	Very high	94.3	Very high	51 Å²	51	97.7 Å²	97.7	42%	0.421	51%	0.509	S	S	.	.	H	α-helix	trans	-60.1	-44	177	0	0	0	0	0	111.7	A22 F23 T24 A29 L30	A22-A26 WeakPolarHBondContact O-CB 3.34Å; A22-A26 PolarHBondContact O-N 2.96Å; F23-A26 PolarHBondContact O-N 2.77Å; T24-A26 PolarHBondContact O-N 2.97Å; A26-A29 PolarHBondContact O-N 3.45Å; A26-L30 WeakPolarHBondContact O-CB 3.41Å; A26-L30 WeakPolarHBondContact O-CG 3.31Å; A26-L30 PolarHBondContact O-N 2.91Å
27	T	95.7	Very high	94.4	Very high	67 Å²	67	99.2 Å²	99.2	41%	0.411	51%	0.512	S	S	.	.	H	α-helix	trans	-63.5	-44.2	177.8	-58.4	0	0	0	0	111.5	F23 T24 V25 L30 W31	F23-T27 VanDerWaalsContact O-CB 3.31Å; F23-T27 WeakPolarHBondContact O-CB 3.49Å; F23-T27 PolarHBondContact O-N 3.44Å; F23-T27 PolarHBondContact O-OG1 3.5Å; T24-T27 PolarHBondContact O-N 2.89Å; V25-T27 VanDerWaalsContact C-N 3.34Å; V25-T27 PolarHBondContact O-N 2.9Å; T27-L30 PolarHBondContact O-N 3.44Å; T27-W31 VanDerWaalsContact O-CB 3.25Å; T27-W31 WeakPolarHBondContact O-CB 3.23Å; T27-W31 PolarHBondContact O-N 3.5Å
28	L	94.7	Very high	94.2	Very high	105 Å²	105	95.5 Å²	95.5	55%	0.55	49%	0.494	S	S	.	.	H	α-helix	trans	-65.2	-40.2	176.6	-70.8	175.3	0	0	0	112.1	T24 V25 W31 L32	T24-L28 HydrophobicContact CG2-CD1 4.11Å; T24-L28 HydrophobicContact CG2-CG 4.49Å; T24-L28 WeakPolarHBondContact O-CB 3.31Å; T24-L28 WeakPolarHBondContact O-CG 3.46Å; T24-L28 PolarHBondContact O-N 2.94Å; V25-L28 PolarHBondContact O-N 2.92Å; L28-W31 PolarHBondContact O-N 2.93Å; L28-L32 WeakPolarHBondContact O-CB 3.34Å; L28-L32 PolarHBondContact O-N 2.8Å
29	A	95.6	Very high	93.9	Very high	55 Å²	55	90.2 Å²	90.2	46%	0.455	48%	0.478	S	S	.	.	H	α-helix	trans	-64.9	-46.2	176.8	0	0	0	0	0	111.7	V25 A26 W31 L32 L33	V25-A29 VanDerWaalsContact O-CB 3.32Å; V25-A29 WeakPolarHBondContact O-CB 3.3Å; V25-A29 PolarHBondContact O-N 3.47Å; A26-A29 PolarHBondContact O-N 3.45Å; A29-W31 VanDerWaalsContact C-N 3.35Å; A29-W31 PolarHBondContact O-N 3.44Å; A29-L32 PolarHBondContact O-N 2.83Å; A29-L33 WeakPolarHBondContact O-CB 3.48Å; A29-L33 PolarHBondContact O-N 2.6Å
30	L	95.7	Very high	93.6	Very high	120 Å²	120	87 Å²	87	63%	0.628	47%	0.469	S	S	*	.	H	α-helix	trans	-62.3	-42.2	175.1	-74.5	173.5	0	0	0	111.7	A26 T27 L33 Y34	A26-L30 WeakPolarHBondContact O-CB 3.41Å; A26-L30 WeakPolarHBondContact O-CG 3.31Å; A26-L30 PolarHBondContact O-N 2.91Å; T27-L30 PolarHBondContact O-N 3.44Å; L30-L33 PolarHBondContact O-N 2.94Å; L30-Y34 WeakPolarHBondContact O-CB 3.35Å; L30-Y34 PolarHBondContact O-N 3.49Å
31	W	93.4	Very high	93.3	Very high	125 Å²	125	89.6 Å²	89.6	47%	0.473	47%	0.469	S	S	.	.	H	α-helix	trans	-61.9	-44.6	175.7	178.4	87.2	0	0	0	111.8	T27 L28 A29 Y34 R35	T27-W31 VanDerWaalsContact O-CB 3.25Å; T27-W31 WeakPolarHBondContact O-CB 3.23Å; T27-W31 PolarHBondContact O-N 3.5Å; L28-W31 PolarHBondContact O-N 2.93Å; A29-W31 VanDerWaalsContact C-N 3.35Å; A29-W31 PolarHBondContact O-N 3.44Å; W31-Y34 PolarHBondContact O-N 2.73Å; W31-R35 HydrophobicContact CD2-CG 4.2Å; W31-R35 HydrophobicContact CE3-CG 4.47Å; W31-R35 HydrophobicContact CH2-CG 4.45Å; W31-R35 HydrophobicContact CZ2-CG 4.17Å; W31-R35 VanDerWaalsContact O-CG 3.22Å; W31-R35 WeakPolarHBondContact O-CG 3.38Å; W31-R35 PolarHBondContact O-N 2.93Å
32	L	92.6	Very high	93.1	Very high	93 Å²	93	88.5 Å²	88.5	49%	0.487	46%	0.455	S	S	.	.	H	α-helix	trans	-63.6	-46.1	176.7	179.7	62.3	0	0	0	111.3	L28 A29 Y34 R35 L36	L28-L32 WeakPolarHBondContact O-CB 3.34Å; L28-L32 PolarHBondContact O-N 2.8Å; A29-L32 PolarHBondContact O-N 2.83Å; L32-Y34 PolarHBondContact O-N 2.91Å; L32-R35 WeakPolarHBondContact O-CB 3.49Å; L32-R35 PolarHBondContact O-N 3.49Å; L32-R35 VanDerWaalsContact O-N 3.17Å; L32-L36 HydrophobicContact CD1-CD1 4.47Å; L32-L36 HydrophobicContact CD1-CG 4.38Å; L32-L36 HydrophobicContact CG-CD1 4.18Å; L32-L36 WeakPolarHBondContact O-CG 3.14Å; L32-L36 PolarHBondContact O-N 3.27Å
33	L	93.9	Very high	92.8	Very high	93 Å²	93	90.3 Å²	90.3	49%	0.487	45%	0.454	S	S	.	.	H	α-helix	trans	-59.1	-47.4	176.7	179.3	61.6	0	0	0	111.2	A29 L30 R35 L36 L37	A29-L33 WeakPolarHBondContact O-CB 3.48Å; A29-L33 PolarHBondContact O-N 2.6Å; L30-L33 PolarHBondContact O-N 2.94Å; L33-R35 VanDerWaalsContact C-N 3.29Å; L33-R35 PolarHBondContact O-N 3.23Å; L33-L36 PolarHBondContact O-N 3.47Å; L33-L37 HydrophobicContact CD1-CD1 4.14Å; L33-L37 HydrophobicContact CD1-CG 4.14Å; L33-L37 HydrophobicContact CG-CD1 4.01Å; L33-L37 HydrophobicContact CG-CG 4.42Å; L33-L37 WeakPolarHBondContact O-CB 3.47Å; L33-L37 WeakPolarHBondContact O-CG 3.5Å; L33-L37 PolarHBondContact O-N 3.02Å
34	Y	92.4	Very high	92.3	Very high	150 Å²	150	88.6 Å²	88.6	59%	0.588	45%	0.451	S	S	*	.	H	α-helix	trans	-57.4	-42.5	175.5	175.3	-100.2	0	0	0	111.8	L30 W31 L32 T38	L30-Y34 WeakPolarHBondContact O-CB 3.35Å; L30-Y34 PolarHBondContact O-N 3.49Å; W31-Y34 PolarHBondContact O-N 2.73Å; L32-Y34 PolarHBondContact O-N 2.91Å; Y34-T38 VanDerWaalsContact O-CB 3.26Å; Y34-T38 WeakPolarHBondContact O-CB 3.33Å; Y34-T38 PolarHBondContact O-N 3.1Å; Y34-T38 PolarHBondContact O-OG1 3.01Å
35	R	88.6	Confident	91.8	Very high	113 Å²	113	90.5 Å²	90.5	43%	0.426	46%	0.458	S	S	.	.	H	α-helix	trans	-64	-43.1	176.4	-72	-72.1	-174.9	-174.7	-2.1	112.4	W31 L32 L33 T38 G39	W31-R35 HydrophobicContact CD2-CG 4.2Å; W31-R35 HydrophobicContact CE3-CG 4.47Å; W31-R35 HydrophobicContact CH2-CG 4.45Å; W31-R35 HydrophobicContact CZ2-CG 4.17Å; W31-R35 VanDerWaalsContact O-CG 3.22Å; W31-R35 WeakPolarHBondContact O-CG 3.38Å; W31-R35 PolarHBondContact O-N 2.93Å; L32-R35 WeakPolarHBondContact O-CB 3.49Å; L32-R35 PolarHBondContact O-N 3.49Å; L32-R35 VanDerWaalsContact O-N 3.17Å; L33-R35 VanDerWaalsContact C-N 3.29Å; L33-R35 PolarHBondContact O-N 3.23Å; R35-T38 PolarHBondContact O-N 3.16Å; R35-G39 PolarHBondContact O-N 3.22Å
36	L	90.5	Very high	91.2	Very high	111 Å²	111	86.4 Å²	86.4	58%	0.581	44%	0.435	S	S	*	.	H	α-helix	trans	-64.7	-46.7	177.7	-70.7	173.5	0	0	0	111.5	L32 L33 T38 G39 F40	L32-L36 HydrophobicContact CD1-CD1 4.47Å; L32-L36 HydrophobicContact CD1-CG 4.38Å; L32-L36 HydrophobicContact CG-CD1 4.18Å; L32-L36 WeakPolarHBondContact O-CG 3.14Å; L32-L36 PolarHBondContact O-N 3.27Å; L33-L36 PolarHBondContact O-N 3.47Å; L36-T38 PolarHBondContact O-N 3.49Å; L36-G39 PolarHBondContact O-N 3.35Å; L36-F40 WeakPolarHBondContact O-CB 3.48Å; L36-F40 PolarHBondContact O-N 2.96Å
37	L	91.9	Very high	90.6	Very high	105 Å²	105	88.1 Å²	88.1	55%	0.55	44%	0.438	S	S	.	.	H	α-helix	trans	-63	-41.7	176.9	-68.9	175.1	0	0	0	111.9	L33 F40 R41	L33-L37 HydrophobicContact CD1-CD1 4.14Å; L33-L37 HydrophobicContact CD1-CG 4.14Å; L33-L37 HydrophobicContact CG-CD1 4.01Å; L33-L37 HydrophobicContact CG-CG 4.42Å; L33-L37 WeakPolarHBondContact O-CB 3.47Å; L33-L37 WeakPolarHBondContact O-CG 3.5Å; L33-L37 PolarHBondContact O-N 3.02Å; L37-F40 PolarHBondContact O-N 3.11Å; L37-R41 WeakPolarHBondContact O-CB 3.37Å; L37-R41 PolarHBondContact O-N 2.73Å
38	T	88.3	Confident	89.9	Confident	41 Å²	41	85.1 Å²	85.1	25%	0.252	42%	0.42	S	S	.	.	H	α-helix	trans	-63.7	-44.4	175.5	-58.3	0	0	0	0	110.9	Y34 R35 L36 R41 I42	Y34-T38 VanDerWaalsContact O-CB 3.26Å; Y34-T38 WeakPolarHBondContact O-CB 3.33Å; Y34-T38 PolarHBondContact O-N 3.1Å; Y34-T38 PolarHBondContact O-OG1 3.01Å; R35-T38 PolarHBondContact O-N 3.16Å; L36-T38 PolarHBondContact O-N 3.49Å; T38-R41 PolarHBondContact O-N 2.81Å; T38-I42 HydrophobicContact CG2-CD1 3.7Å; T38-I42 WeakPolarHBondContact O-CD1 3.43Å; T38-I42 VanDerWaalsContact O-CG1 3.28Å; T38-I42 WeakPolarHBondContact O-CG1 3.49Å; T38-I42 PolarHBondContact O-N 3.15Å
39	G	88.5	Confident	89.5	Confident	24 Å²	24	87 Å²	87	25%	0.247	43%	0.426	C	S	.	.	H	α-helix	trans	-60.4	-46.2	175.4	0	0	0	0	0	112.3	R35 L36 R41 I42 W43	R35-G39 PolarHBondContact O-N 3.22Å; L36-G39 PolarHBondContact O-N 3.35Å; G39-R41 PolarHBondContact O-N 3.18Å; G39-I42 PolarHBondContact O-N 3.28Å; G39-W43 WeakPolarHBondContact O-CB 3.39Å; G39-W43 PolarHBondContact O-N 3.12Å
40	F	90	Very high	89.3	Confident	100 Å²	100	87.6 Å²	87.6	44%	0.439	42%	0.421	S	S	.	.	H	α-helix	trans	-58.6	-47.8	175.2	-176.2	-88.8	0	0	0	111.5	L36 L37 I42 I44 L45	L36-F40 WeakPolarHBondContact O-CB 3.48Å; L36-F40 PolarHBondContact O-N 2.96Å; L37-F40 PolarHBondContact O-N 3.11Å; F40-I42 VanDerWaalsContact C-N 3.31Å; F40-I42 PolarHBondContact O-N 3.36Å; F40-I44 HydrophobicContact CD2-CB 4.14Å; F40-I44 HydrophobicContact CD2-CD1 3.24Å; F40-I44 HydrophobicContact CD2-CG1 4.23Å; F40-I44 HydrophobicContact CD2-CG2 4.36Å; F40-I44 HydrophobicContact CE1-CG2 4.39Å; F40-I44 HydrophobicContact CE2-CB 4.09Å; F40-I44 HydrophobicContact CE2-CD1 3.5Å; F40-I44 VanDerWaalsContact CE2-CD1 3.5Å; F40-I44 HydrophobicContact CE2-CG1 4.37Å; F40-I44 HydrophobicContact CE2-CG2 3.79Å; F40-I44 HydrophobicContact CG-CB 4.4Å; F40-I44 HydrophobicContact CG-CD1 4.1Å; F40-I44 HydrophobicContact CZ-CB 4.33Å; F40-I44 HydrophobicContact CZ-CG2 3.8Å; F40-I44 WeakPolarHBondContact O-CA 3.32Å; F40-I44 VanDerWaalsContact O-CB 3.3Å; F40-I44 WeakPolarHBondContact O-CB 3.31Å; F40-I44 PolarHBondContact O-N 3.17Å; F40-L45 HydrophobicContact CD1-CD1 4.03Å; F40-L45 HydrophobicContact CD1-CG 4.02Å; F40-L45 HydrophobicContact CE1-CD1 3.8Å; F40-L45 HydrophobicContact CE1-CD2 3.92Å; F40-L45 HydrophobicContact CE1-CG 3.67Å; F40-L45 HydrophobicContact CZ-CD2 4.48Å; F40-L45 PolarHBondContact O-N 3.1Å
41	R	89.8	Confident	89.2	Confident	146 Å²	146	82 Å²	82	55%	0.551	39%	0.392	S	S	*	.	H	α-helix	trans	-57.4	-42.4	177.4	177.8	-176.6	163.7	103	1.6	112.4	L37 T38 G39 L45 G46	L37-R41 WeakPolarHBondContact O-CB 3.37Å; L37-R41 PolarHBondContact O-N 2.73Å; T38-R41 PolarHBondContact O-N 2.81Å; G39-R41 PolarHBondContact O-N 3.18Å; R41-L45 CarbonylContact O-C 3.51Å; R41-L45 WeakPolarHBondContact O-CB 3.48Å; R41-G46 PolarHBondContact O-N 2.67Å; R41-G46 VanDerWaalsContact O-N 3.1Å
42	I	90.3	Very high	89.4	Confident	10 Å²	10	78.4 Å²	78.4	5%	0.051	38%	0.384	C	S	.	.	H	α-helix	trans	-75.9	-50.2	-176.7	-64.6	158.3	0	0	0	111.2	T38 G39 F40 G46 T268 L271 Q272	T38-I42 HydrophobicContact CG2-CD1 3.7Å; T38-I42 WeakPolarHBondContact O-CD1 3.43Å; T38-I42 VanDerWaalsContact O-CG1 3.28Å; T38-I42 WeakPolarHBondContact O-CG1 3.49Å; T38-I42 PolarHBondContact O-N 3.15Å; G39-I42 PolarHBondContact O-N 3.28Å; F40-I42 VanDerWaalsContact C-N 3.31Å; F40-I42 PolarHBondContact O-N 3.36Å; I42-G46 WeakPolarHBondContact O-CA 3.3Å; I42-G46 PolarHBondContact O-N 3.49Å; I42-T268 HydrophobicContact CG2-CG2 4.27Å; I42-L271 HydrophobicContact CG1-CB 4.24Å; I42-Q272 HydrophobicContact CD1-CG 3.61Å; I42-Q272 HydrophobicContact CG1-CG 4.02Å; I42-Q272 HydrophobicContact CG2-CG 4.32Å
43	W	89.9	Confident	89.5	Confident	73 Å²	73	76.3 Å²	76.3	28%	0.277	38%	0.376	S	S	.	.	H	α-helix	trans	-94.3	-17.4	-166.3	-59.2	111.4	0	0	0	114.4	G39 T268 F279 A282	G39-W43 WeakPolarHBondContact O-CB 3.39Å; G39-W43 PolarHBondContact O-N 3.12Å; W43-T268 HydrophobicContact CH2-CG2 4.29Å; W43-T268 HydrophobicContact CZ3-CG2 4.19Å; W43-F279 HydrophobicContact CB-CD2 4.34Å; W43-F279 AromaticContact CD1-CD2 3.9Å; W43-F279 HydrophobicContact CD2-CB 4.03Å; W43-F279 AromaticContact CD2-CD2 3.77Å; W43-F279 HydrophobicContact CD2-CD2 3.77Å; W43-F279 HydrophobicContact CD2-CG 4.4Å; W43-F279 HydrophobicContact CE3-CB 3.69Å; W43-F279 HydrophobicContact CE3-CD2 4.32Å; W43-F279 AromaticContact CG-CD2 3.75Å; W43-F279 HydrophobicContact CG-CD2 3.75Å; W43-F279 HydrophobicContact CG-CE2 4.44Å; W43-F279 HydrophobicContact CH2-CB 4.49Å; W43-F279 HydrophobicContact CZ3-CB 3.94Å; W43-F279 VanDerWaalsContact CZ3-N 3.3Å; W43-A282 HydrophobicContact CH2-CB 3.82Å; W43-A282 HydrophobicContact CZ2-CB 3.29Å
44	I	87.3	Confident	89.6	Confident	113 Å²	113	80.3 Å²	80.3	58%	0.579	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.2	-44.9	-179.9	-63.8	166.7	0	0	0	110.8	F40	F40-I44 HydrophobicContact CD2-CB 4.14Å; F40-I44 HydrophobicContact CD2-CD1 3.24Å; F40-I44 HydrophobicContact CD2-CG1 4.23Å; F40-I44 HydrophobicContact CD2-CG2 4.36Å; F40-I44 HydrophobicContact CE1-CG2 4.39Å; F40-I44 HydrophobicContact CE2-CB 4.09Å; F40-I44 HydrophobicContact CE2-CD1 3.5Å; F40-I44 VanDerWaalsContact CE2-CD1 3.5Å; F40-I44 HydrophobicContact CE2-CG1 4.37Å; F40-I44 HydrophobicContact CE2-CG2 3.79Å; F40-I44 HydrophobicContact CG-CB 4.4Å; F40-I44 HydrophobicContact CG-CD1 4.1Å; F40-I44 HydrophobicContact CZ-CB 4.33Å; F40-I44 HydrophobicContact CZ-CG2 3.8Å; F40-I44 WeakPolarHBondContact O-CA 3.32Å; F40-I44 VanDerWaalsContact O-CB 3.3Å; F40-I44 WeakPolarHBondContact O-CB 3.31Å; F40-I44 PolarHBondContact O-N 3.17Å
45	L	86	Confident	89.8	Confident	106 Å²	106	74.4 Å²	74.4	56%	0.555	37%	0.368	S	S	*	.	S	Bend	trans	-90.3	-13.8	179.5	-57.5	-179.3	0	0	0	114	F40 R41 N47	F40-L45 HydrophobicContact CD1-CD1 4.03Å; F40-L45 HydrophobicContact CD1-CG 4.02Å; F40-L45 HydrophobicContact CE1-CD1 3.8Å; F40-L45 HydrophobicContact CE1-CD2 3.92Å; F40-L45 HydrophobicContact CE1-CG 3.67Å; F40-L45 HydrophobicContact CZ-CD2 4.48Å; F40-L45 PolarHBondContact O-N 3.1Å; R41-L45 CarbonylContact O-C 3.51Å; R41-L45 WeakPolarHBondContact O-CB 3.48Å; L45-N47 PolarHBondContact O-N 3.34Å
46	G	84.4	Confident	90.2	Very high	13 Å²	13	69 Å²	69	13%	0.134	35%	0.347	C	S	.	.			trans	-64.3	117.6	177.6	0	0	0	0	0	111.3	R41 I42	R41-G46 PolarHBondContact O-N 2.67Å; R41-G46 VanDerWaalsContact O-N 3.1Å; I42-G46 WeakPolarHBondContact O-CA 3.3Å; I42-G46 PolarHBondContact O-N 3.49Å
47	N	82.9	Confident	90.6	Very high	88 Å²	88	68.7 Å²	68.7	47%	0.471	34%	0.341	S	S	.	.			trans	-126.6	0.7	-172.6	66.3	12.6	0	0	0	113.6	L45 Q49	L45-N47 PolarHBondContact O-N 3.34Å; N47-Q49 HydrophobicContact CB-CG 4.39Å; N47-Q49 PolarHBondContact ND2-NE2 3.01Å; N47-Q49 PolarHBondContact ND2-OE1 3.22Å; N47-Q49 VanDerWaalsContact ND2-OE1 3.16Å; N47-Q49 PolarHBondContact O-N 3.44Å; N47-Q49 WeakPolarHBondContact OD1-CB 3.27Å; N47-Q49 WeakPolarHBondContact OD1-CG 3.32Å; N47-Q49 PolarHBondContact OD1-N 2.9Å; N47-Q49 VanDerWaalsContact OD1-N 3.11Å
48	G	82.2	Confident	90.9	Very high	4 Å²	4	64.2 Å²	64.2	4%	0.041	32%	0.317	C	S	.	.			trans	64.6	11.2	176.2	0	0	0	0	0	115.4	L50 L51 R79 L266 N267	G48-L50 PolarHBondContact O-N 3.18Å; G48-L51 PolarHBondContact O-N 3.32Å; G48-L51 VanDerWaalsContact O-N 3.13Å; G48-R79 PolarHBondContact O-NH1 2.83Å; G48-L266 WeakPolarHBondContact CA-O 3.42Å; G48-N267 PolarHBondContact N-OD1 2.93Å
49	Q	85.4	Confident	91.4	Very high	144 Å²	144	62.3 Å²	62.3	67%	0.673	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-14.4	-175.2	-76.8	179.1	-11.6	0	0	114.4	N47 L51 T52	N47-Q49 HydrophobicContact CB-CG 4.39Å; N47-Q49 PolarHBondContact ND2-NE2 3.01Å; N47-Q49 PolarHBondContact ND2-OE1 3.22Å; N47-Q49 VanDerWaalsContact ND2-OE1 3.16Å; N47-Q49 PolarHBondContact O-N 3.44Å; N47-Q49 WeakPolarHBondContact OD1-CB 3.27Å; N47-Q49 WeakPolarHBondContact OD1-CG 3.32Å; N47-Q49 PolarHBondContact OD1-N 2.9Å; N47-Q49 VanDerWaalsContact OD1-N 3.11Å; Q49-L51 PolarHBondContact O-N 2.92Å; Q49-T52 WeakPolarHBondContact O-CG2 3.27Å
50	L	91.1	Very high	91.9	Very high	67 Å²	67	61.1 Å²	61.1	35%	0.351	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-32.5	175.5	-172.2	137	0	0	0	112.2	G48 T52 L55 V189 I232 V269	G48-L50 PolarHBondContact O-N 3.18Å; L50-T52 PolarHBondContact O-N 2.93Å; L50-L55 HydrophobicContact CD2-CD1 4.13Å; L50-L55 WeakPolarHBondContact O-CD1 3.31Å; L50-V189 HydrophobicContact CD2-CG2 3.6Å; L50-I232 HydrophobicContact CD1-CD1 3.39Å; L50-I232 HydrophobicContact CD2-CD1 3.68Å; L50-I232 HydrophobicContact CG-CD1 4.17Å; L50-V269 HydrophobicContact CD2-CG1 4.08Å
51	L	94.9	Very high	92.3	Very high	3 Å²	3	56.4 Å²	56.4	2%	0.016	27%	0.272	C	S	.	.			trans	-86.5	92.7	-175.6	-68.9	172	0	0	0	111.1	G48 Q49 L55 L76 F81 V135 V189 L266 V269	G48-L51 PolarHBondContact O-N 3.32Å; G48-L51 VanDerWaalsContact O-N 3.13Å; Q49-L51 PolarHBondContact O-N 2.92Å; L51-L55 HydrophobicContact CD2-CD1 4.14Å; L51-L76 HydrophobicContact CD1-CD2 4.44Å; L51-F81 HydrophobicContact CB-CE2 4.4Å; L51-V135 HydrophobicContact CD2-CG2 3.76Å; L51-V189 HydrophobicContact CD2-CB 4.16Å; L51-V189 HydrophobicContact CD2-CG1 4.17Å; L51-V189 HydrophobicContact CD2-CG2 3.95Å; L51-L266 HydrophobicContact CD1-CB 4.05Å; L51-L266 HydrophobicContact CD1-CD1 4.12Å; L51-L266 HydrophobicContact CD1-CD2 3.54Å; L51-L266 HydrophobicContact CD1-CG 4.13Å; L51-V269 HydrophobicContact CD1-CB 4.25Å; L51-V269 HydrophobicContact CD1-CG1 4.33Å; L51-V269 HydrophobicContact CD1-CG2 4.06Å; L51-V269 HydrophobicContact CD2-CG1 4.25Å; L51-V269 HydrophobicContact CG-CG1 4.23Å
52	T	95.9	Very high	92.8	Very high	50 Å²	50	49.4 Å²	49.4	31%	0.307	25%	0.246	S	C	.	.	S	Bend	trans	-135.4	158.8	173.8	67.3	0	0	0	0	110.6	Q49 L50 K54 L55 F81	Q49-T52 WeakPolarHBondContact O-CG2 3.27Å; L50-T52 PolarHBondContact O-N 2.93Å; T52-K54 PolarHBondContact O-N 3.39Å; T52-L55 PolarHBondContact O-N 2.88Å; T52-F81 WeakPolarHBondContact O-CE1 3.3Å; T52-F81 WeakPolarHBondContact O-CZ 3.16Å
53	P	95.5	Very high	93.1	Very high	49 Å²	49	49.6 Å²	49.6	32%	0.318	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-57.6	-9.5	175.6	-27.7	36.6	0	0	0	114.8	L55 G56 R79 G80 F81	P53-L55 PolarHBondContact O-N 3.1Å; P53-G56 CarbonylContact O-C 3.51Å; P53-G56 WeakPolarHBondContact O-CA 3.21Å; P53-G56 PolarHBondContact O-N 3.44Å; P53-R79 WeakPolarHBondContact CD-O 3.46Å; P53-G80 VanDerWaalsContact CG-C 3.46Å; P53-G80 VanDerWaalsContact CG-O 3.24Å; P53-G80 WeakPolarHBondContact CG-O 2.93Å; P53-F81 HydrophobicContact CG-CD1 4.42Å; P53-F81 HydrophobicContact CG-CG 4.39Å
54	K	95.4	Very high	93.5	Very high	177 Å²	177	46.1 Å²	46.1	77%	0.77	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-64.7	-22.8	171.8	-62	-177.1	178.5	179.8	0	113.1	T52 G56 K187	T52-K54 PolarHBondContact O-N 3.39Å; K54-G56 VanDerWaalsContact C-N 3.25Å; K54-K187 PolarHBondContact O-NZ 2.9Å
55	L	96.8	Very high	93.9	Very high	25 Å²	25	42.1 Å²	42.1	13%	0.131	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-69.4	-27.4	171.7	-67.1	173.2	0	0	0	112.2	L50 L51 T52 P53 G134 V135 K187 V189	L50-L55 HydrophobicContact CD2-CD1 4.13Å; L50-L55 WeakPolarHBondContact O-CD1 3.31Å; L51-L55 HydrophobicContact CD2-CD1 4.14Å; T52-L55 PolarHBondContact O-N 2.88Å; P53-L55 PolarHBondContact O-N 3.1Å; L55-G134 WeakPolarHBondContact O-CA 3.4Å; L55-V135 HydrophobicContact CD1-CG2 4.46Å; L55-K187 HydrophobicContact CD2-CB 4.37Å; L55-V189 HydrophobicContact CD1-CG2 3.72Å
56	G	97.5	Very high	94.3	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.207	C	C	.	.			trans	155.4	140.4	-176.6	0	0	0	0	0	108.5	P53 K54 W58 F81 E132	P53-G56 CarbonylContact O-C 3.51Å; P53-G56 WeakPolarHBondContact O-CA 3.21Å; P53-G56 PolarHBondContact O-N 3.44Å; K54-G56 VanDerWaalsContact C-N 3.25Å; G56-W58 PolarHBondContact O-N 3.32Å; G56-W58 VanDerWaalsContact O-N 3.16Å; G56-F81 WeakPolarHBondContact O-CD1 3.18Å; G56-F81 WeakPolarHBondContact O-CE1 3.46Å; G56-E132 CarbonylContact C-O 3.16Å; G56-E132 VanDerWaalsContact C-O 3.32Å; G56-E132 WeakPolarHBondContact CA-O 3.47Å; G56-E132 WeakPolarHBondContact CA-OE1 3.14Å
57	K	98.3	Very high	94.9	Very high	105 Å²	105	39.9 Å²	39.9	46%	0.457	21%	0.206	S	C	.	.	S	Bend	trans	-56	-34.5	-173.6	179	-178.7	169.3	-169.2	0	112.7	A82 E107 E132	K57-A82 HydrophobicContact CG-CB 4.13Å; K57-A82 PolarHBondContact O-N 2.94Å; K57-E107 WeakPolarHBondContact CE-OE2 3.37Å; K57-E107 IonicContact NZ-OE2 3.34Å; K57-E107 PolarHBondContact NZ-OE2 3.4Å; K57-E132 PolarHBondContact N-O 3.47Å; K57-E132 VanDerWaalsContact N-O 3.09Å
58	W	98.8	Very high	95.6	Very high	11 Å²	11	36.8 Å²	36.8	4%	0.042	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	140	-170.6	-68.9	85	0	0	0	113.7	G56 A82 M83 M84 E107 R109 L131 E132 I133 G134 V135	G56-W58 PolarHBondContact O-N 3.32Å; G56-W58 VanDerWaalsContact O-N 3.16Å; W58-A82 CarbonylContact C-O 3.56Å; W58-A82 VanDerWaalsContact CA-O 3.32Å; W58-A82 WeakPolarHBondContact CA-O 3.5Å; W58-A82 HydrophobicContact CD2-CB 3.52Å; W58-A82 HydrophobicContact CE3-CB 3.61Å; W58-A82 HydrophobicContact CG-CB 4.11Å; W58-A82 HydrophobicContact CH2-CB 4.01Å; W58-A82 HydrophobicContact CZ2-CB 3.95Å; W58-A82 HydrophobicContact CZ3-CB 3.85Å; W58-M83 WeakPolarHBondContact CZ3-O 3.27Å; W58-M84 HydrophobicContact CE3-CB 4.25Å; W58-E107 HydrophobicContact CH2-CB 4.21Å; W58-E107 VanDerWaalsContact CH2-CD 3.46Å; W58-E107 HydrophobicContact CH2-CG 3.66Å; W58-E107 WeakPolarHBondContact CH2-OE1 3.45Å; W58-E107 HydrophobicContact CZ2-CG 4.01Å; W58-E107 WeakPolarHBondContact CZ2-OE1 3.28Å; W58-E107 WeakPolarHBondContact CZ2-OE2 3.45Å; W58-R109 HydrophobicContact CH2-CB 4.21Å; W58-R109 HydrophobicContact CH2-CG 3.63Å; W58-R109 HydrophobicContact CZ3-CB 4.02Å; W58-R109 HydrophobicContact CZ3-CG 3.98Å; W58-L131 HydrophobicContact CB-CB 4.42Å; W58-L131 HydrophobicContact CD2-CD1 4.09Å; W58-L131 HydrophobicContact CD2-CD2 3.96Å; W58-L131 HydrophobicContact CD2-CG 4.46Å; W58-L131 HydrophobicContact CE3-CD1 4.18Å; W58-L131 HydrophobicContact CG-CB 4.13Å; W58-L131 HydrophobicContact CG-CD1 4.3Å; W58-L131 HydrophobicContact CG-CD2 4.23Å; W58-L131 HydrophobicContact CG-CG 4.46Å; W58-L131 HydrophobicContact CZ2-CD2 3.92Å; W58-E132 PolarHBondContact N-O 3.26Å; W58-I133 CarbonylContact O-C 3.52Å; W58-I133 WeakPolarHBondContact O-CA 3.05Å; W58-G134 PolarHBondContact O-N 3.31Å; W58-V135 PolarHBondContact O-N 2.95Å
59	A	98.9	Very high	96.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	130.1	163.4	0	0	0	0	0	110.2	L76 F81 A82 M83 M84 V135	A59-L76 HydrophobicContact CB-CB 4.27Å; A59-L76 HydrophobicContact CB-CD1 3.95Å; A59-F81 HydrophobicContact CB-CB 3.85Å; A59-F81 HydrophobicContact CB-CD1 4.08Å; A59-F81 HydrophobicContact CB-CG 4Å; A59-A82 PolarHBondContact N-O 2.95Å; A59-M83 HydrophobicContact CB-CE 3.88Å; A59-M83 HydrophobicContact CB-SD 3.92Å; A59-M84 PolarHBondContact O-N 2.85Å; A59-V135 CarbonylContact C-O 3.53Å; A59-V135 WeakPolarHBondContact CA-O 3.36Å; A59-V135 HydrophobicContact CB-CB 4.02Å
60	V	98.9	Very high	97	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	127.9	175.7	-179.4	0	0	0	0	108.9	M84 I86 L128 I133 V135 L136 V137 M174	V60-M84 WeakPolarHBondContact CA-O 3.49Å; V60-M84 HydrophobicContact CB-CB 4.41Å; V60-M84 HydrophobicContact CG1-CG 4.17Å; V60-M84 HydrophobicContact CG2-CB 3.9Å; V60-M84 HydrophobicContact CG2-CG 4.08Å; V60-I86 HydrophobicContact CG1-CD1 3.87Å; V60-I86 HydrophobicContact CG1-CG1 4.38Å; V60-L128 HydrophobicContact CG2-CD2 3.8Å; V60-I133 HydrophobicContact CB-CG2 4.47Å; V60-I133 HydrophobicContact CG2-CB 4.47Å; V60-I133 HydrophobicContact CG2-CD1 3.87Å; V60-I133 HydrophobicContact CG2-CG1 3.92Å; V60-I133 HydrophobicContact CG2-CG2 3.71Å; V60-V135 PolarHBondContact N-O 2.93Å; V60-L136 HydrophobicContact CB-CD1 3.85Å; V60-L136 HydrophobicContact CG1-CD1 3.77Å; V60-L136 CarbonylContact O-C 3.46Å; V60-L136 WeakPolarHBondContact O-CA 3.12Å; V60-V137 PolarHBondContact O-N 3.18Å; V60-M174 HydrophobicContact CG1-CE 4.03Å
61	V	98.9	Very high	97.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	121.3	176.8	-175.8	0	0	0	0	110.1	A64 G69 A73 L76 M83 M84 I86 V137	V61-A64 HydrophobicContact CB-CB 4.07Å; V61-A64 HydrophobicContact CG1-CB 3.92Å; V61-G69 WeakPolarHBondContact CG1-O 3.29Å; V61-A73 HydrophobicContact CG2-CB 4.4Å; V61-L76 HydrophobicContact CG2-CD1 4.22Å; V61-M83 HydrophobicContact CG2-CE 3.69Å; V61-M84 PolarHBondContact N-O 2.83Å; V61-I86 PolarHBondContact O-N 3Å; V61-V137 HydrophobicContact CB-CB 4.47Å; V61-V137 HydrophobicContact CG1-CB 4.23Å; V61-V137 HydrophobicContact CG1-CG1 4.49Å; V61-V137 HydrophobicContact CG2-CB 4.15Å; V61-V137 HydrophobicContact CG2-CG2 4.15Å
62	T	98.8	Very high	97.5	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	142.7	173.8	69.3	0	0	0	0	111.4	I86 F115 V137 N139 V140 M174	T62-I86 CarbonylContact C-O 3.51Å; T62-I86 WeakPolarHBondContact CA-O 3.42Å; T62-I86 HydrophobicContact CG2-CB 4.49Å; T62-F115 HydrophobicContact CG2-CE2 4.25Å; T62-F115 HydrophobicContact CG2-CZ 3.73Å; T62-V137 PolarHBondContact N-O 2.91Å; T62-V137 PolarHBondContact OG1-O 2.71Å; T62-N139 VanDerWaalsContact O-CB 3.27Å; T62-N139 WeakPolarHBondContact O-CB 3.34Å; T62-N139 PolarHBondContact O-ND2 3.17Å; T62-N139 PolarHBondContact OG1-N 2.89Å; T62-V140 PolarHBondContact O-N 2.99Å; T62-V140 PolarHBondContact OG1-N 3.11Å; T62-M174 HydrophobicContact CG2-CE 4.05Å; T62-M174 HydrophobicContact CG2-CG 4.11Å; T62-M174 HydrophobicContact CG2-SD 4.38Å
63	G	97.7	Very high	97.6	Very high	14 Å²	14	27.4 Å²	27.4	14%	0.144	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.3	37.2	-172.3	0	0	0	0	0	112.9	T65 I86 N139	G63-T65 VanDerWaalsContact C-N 3.28Å; G63-T65 PolarHBondContact O-N 3.25Å; G63-I86 PolarHBondContact N-O 3.38Å; G63-N139 PolarHBondContact O-ND2 2.93Å
64	A	97.2	Very high	97.8	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-2.3	-168.6	0	0	0	0	0	116.1	V61 K70 L85 I86	V61-A64 HydrophobicContact CB-CB 4.07Å; V61-A64 HydrophobicContact CG1-CB 3.92Å; A64-K70 VanDerWaalsContact O-CA 3.27Å; A64-K70 WeakPolarHBondContact O-CA 3.41Å; A64-K70 WeakPolarHBondContact O-CB 3.32Å; A64-L85 HydrophobicContact CB-CB 4.05Å; A64-L85 HydrophobicContact CB-CD2 3.85Å; A64-I86 PolarHBondContact N-O 3.27Å
65	T	96.4	Very high	97.9	Very high	28 Å²	28	19.2 Å²	19.2	17%	0.172	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-9.5	-170	50	0	0	0	0	114.8	G63 S87 K92 L93	G63-T65 VanDerWaalsContact C-N 3.28Å; G63-T65 PolarHBondContact O-N 3.25Å; T65-S87 VanDerWaalsContact CG2-CB 3.41Å; T65-S87 WeakPolarHBondContact CG2-OG 3.31Å; T65-S87 PolarHBondContact OG1-OG 3.23Å; T65-K92 HydrophobicContact CG2-CB 3.7Å; T65-L93 HydrophobicContact CG2-CB 4.46Å; T65-L93 HydrophobicContact CG2-CD2 3.69Å; T65-L93 HydrophobicContact CG2-CG 3.74Å
66	D	94.8	Very high	98	Very high	61 Å²	61	18 Å²	18	33%	0.326	9%	0.092	S	C	.	.	S	Bend	trans	-160.6	166.4	-179.1	-152	-16.2	0	0	0	112.2	G69 K70 K244	D66-G69 PolarHBondContact O-N 2.98Å; D66-K70 PolarHBondContact O-N 3.04Å; D66-K244 IonicContact OD1-NZ 2.87Å; D66-K244 WeakPolarHBondContact OD2-CD 3.39Å; D66-K244 WeakPolarHBondContact OD2-CE 3.45Å; D66-K244 WeakPolarHBondContact OD2-CG 3.27Å; D66-K244 IonicContact OD2-NZ 3.21Å; D66-K244 PolarHBondContact OD2-NZ 3.33Å
67	G	96.1	Very high	98	Very high	11 Å²	11	18 Å²	18	11%	0.113	9%	0.093	C	C	.	.	H	α-helix	trans	53.5	-137.3	171.8	0	0	0	0	0	113.9	G69 K70 S71	G67-G69 VanDerWaalsContact C-N 3.32Å; G67-G69 PolarHBondContact O-N 3.49Å; G67-K70 PolarHBondContact O-N 2.9Å; G67-S71 PolarHBondContact O-N 3.34Å; G67-S71 VanDerWaalsContact O-N 3.1Å; G67-S71 PolarHBondContact O-OG 2.91Å
68	I	97.8	Very high	98	Very high	24 Å²	24	19.1 Å²	19.1	12%	0.123	9%	0.094	C	C	.	.	H	α-helix	trans	-57.7	-43.7	-176.1	-66.6	173.6	0	0	0	111.4	K70 S71 Y72 P238 V241 T243 Y261 V262	I68-K70 PolarHBondContact O-N 3.43Å; I68-S71 PolarHBondContact O-N 3.5Å; I68-Y72 HydrophobicContact CG2-CD2 3.56Å; I68-Y72 HydrophobicContact CG2-CE2 3.35Å; I68-Y72 VanDerWaalsContact O-CD2 3.26Å; I68-Y72 WeakPolarHBondContact O-CD2 3.4Å; I68-Y72 PolarHBondContact O-N 2.89Å; I68-P238 HydrophobicContact CD1-CG 4.32Å; I68-V241 HydrophobicContact CD1-CB 4.08Å; I68-V241 HydrophobicContact CD1-CG1 4.37Å; I68-V241 HydrophobicContact CD1-CG2 3.94Å; I68-V241 HydrophobicContact CG1-CB 4.33Å; I68-V241 HydrophobicContact CG1-CG1 4.09Å; I68-V241 HydrophobicContact CG1-CG2 4.48Å; I68-T243 HydrophobicContact CG1-CG2 4.37Å; I68-Y261 HydrophobicContact CD1-CD1 4.45Å; I68-V262 HydrophobicContact CG2-CG2 4.04Å
69	G	98.1	Very high	97.9	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-61.6	-43.3	179.3	0	0	0	0	0	113.1	V61 D66 G67 S71 Y72 A73 N139	V61-G69 WeakPolarHBondContact CG1-O 3.29Å; D66-G69 PolarHBondContact O-N 2.98Å; G67-G69 VanDerWaalsContact C-N 3.32Å; G67-G69 PolarHBondContact O-N 3.49Å; G69-S71 PolarHBondContact O-N 3.08Å; G69-Y72 PolarHBondContact O-N 2.94Å; G69-A73 PolarHBondContact O-N 3.34Å; G69-N139 VanDerWaalsContact CA-ND2 3.26Å; G69-N139 WeakPolarHBondContact CA-ND2 3.09Å; G69-N139 PolarHBondContact N-ND2 3.2Å; G69-N139 PolarHBondContact N-OD1 2.84Å
70	K	98.4	Very high	97.9	Very high	67 Å²	67	23.4 Å²	23.4	29%	0.291	12%	0.123	S	C	.	.	H	α-helix	trans	-61.6	-44.6	174.8	-179.1	177	168.4	178.8	0	111.3	A64 D66 G67 I68 Y72 A73 E74 V96	A64-K70 VanDerWaalsContact O-CA 3.27Å; A64-K70 WeakPolarHBondContact O-CA 3.41Å; A64-K70 WeakPolarHBondContact O-CB 3.32Å; D66-K70 PolarHBondContact O-N 3.04Å; G67-K70 PolarHBondContact O-N 2.9Å; I68-K70 PolarHBondContact O-N 3.43Å; K70-Y72 VanDerWaalsContact C-N 3.34Å; K70-Y72 PolarHBondContact O-N 3.44Å; K70-A73 WeakPolarHBondContact O-CB 3.44Å; K70-A73 PolarHBondContact O-N 3.47Å; K70-A73 VanDerWaalsContact O-N 3.08Å; K70-E74 WeakPolarHBondContact CE-OE1 3.46Å; K70-E74 IonicContact NZ-OE1 3.12Å; K70-E74 WeakPolarHBondContact O-CG 3.43Å; K70-E74 PolarHBondContact O-N 2.91Å; K70-V96 HydrophobicContact CD-CG2 4.14Å; K70-V96 HydrophobicContact CG-CG2 4.4Å
71	S	98.6	Very high	97.9	Very high	3 Å²	3	23.4 Å²	23.4	2%	0.021	12%	0.123	C	C	.	.	H	α-helix	trans	-66.1	-33.1	178.4	-60.6	0	0	0	0	113.4	G67 I68 G69 E74 E75 P258 E259	G67-S71 PolarHBondContact O-N 3.34Å; G67-S71 VanDerWaalsContact O-N 3.1Å; G67-S71 PolarHBondContact O-OG 2.91Å; I68-S71 PolarHBondContact O-N 3.5Å; G69-S71 PolarHBondContact O-N 3.08Å; S71-E74 PolarHBondContact O-N 3.28Å; S71-E75 VanDerWaalsContact O-CB 3.31Å; S71-E75 WeakPolarHBondContact O-CB 3.49Å; S71-E75 PolarHBondContact O-N 3.33Å; S71-P258 WeakPolarHBondContact OG-CB 3.35Å; S71-E259 PolarHBondContact OG-N 2.92Å
72	Y	98.8	Very high	97.9	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-61.1	-45.1	168	-87.4	-69.5	0	0	0	111.8	I68 G69 K70 E74 E75 L76 V137 L191 I193 V262 E265 L266	I68-Y72 HydrophobicContact CG2-CD2 3.56Å; I68-Y72 HydrophobicContact CG2-CE2 3.35Å; I68-Y72 VanDerWaalsContact O-CD2 3.26Å; I68-Y72 WeakPolarHBondContact O-CD2 3.4Å; I68-Y72 PolarHBondContact O-N 2.89Å; G69-Y72 PolarHBondContact O-N 2.94Å; K70-Y72 VanDerWaalsContact C-N 3.34Å; K70-Y72 PolarHBondContact O-N 3.44Å; Y72-E74 VanDerWaalsContact C-N 3.35Å; Y72-E74 PolarHBondContact O-N 3.34Å; Y72-E75 PolarHBondContact O-N 3.3Å; Y72-L76 VanDerWaalsContact O-CB 3.3Å; Y72-L76 WeakPolarHBondContact O-CB 3.23Å; Y72-L76 VanDerWaalsContact O-CG 3.23Å; Y72-L76 WeakPolarHBondContact O-CG 3.38Å; Y72-L76 PolarHBondContact O-N 3.38Å; Y72-V137 HydrophobicContact CD1-CG1 4.18Å; Y72-V137 HydrophobicContact CD1-CG2 4.13Å; Y72-V137 HydrophobicContact CD2-CG1 3.72Å; Y72-V137 HydrophobicContact CE1-CG1 4.44Å; Y72-V137 HydrophobicContact CE2-CG1 4Å; Y72-V137 HydrophobicContact CG-CG1 3.83Å; Y72-V137 HydrophobicContact CG-CG2 4.32Å; Y72-L191 HydrophobicContact CD1-CD1 4.47Å; Y72-L191 HydrophobicContact CE1-CD1 3.79Å; Y72-I193 HydrophobicContact CE2-CD1 3.64Å; Y72-I193 HydrophobicContact CE2-CG1 4.24Å; Y72-I193 WeakPolarHBondContact OH-CD1 3.3Å; Y72-V262 HydrophobicContact CD1-CG1 3.65Å; Y72-V262 HydrophobicContact CD1-CG2 4.41Å; Y72-V262 HydrophobicContact CD2-CG1 4.47Å; Y72-V262 HydrophobicContact CD2-CG2 3.8Å; Y72-V262 HydrophobicContact CE1-CG1 3.92Å; Y72-V262 HydrophobicContact CE1-CG2 4.45Å; Y72-V262 HydrophobicContact CE2-CG2 3.86Å; Y72-V262 HydrophobicContact CG-CG1 3.93Å; Y72-V262 HydrophobicContact CG-CG2 4.08Å; Y72-E265 WeakPolarHBondContact CE1-OE2 3.28Å; Y72-E265 VanDerWaalsContact CZ-OE2 3.22Å; Y72-E265 WeakPolarHBondContact OH-CG 3.41Å; Y72-E265 PolarHBondContact OH-OE1 2.97Å; Y72-E265 PolarHBondContact OH-OE2 3.34Å; Y72-L266 HydrophobicContact CD1-CD2 3.91Å; Y72-L266 HydrophobicContact CD1-CG 4.47Å; Y72-L266 HydrophobicContact CE1-CD2 3.51Å; Y72-L266 HydrophobicContact CE1-CG 4.2Å
73	A	98.8	Very high	97.9	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-61.9	-43.9	178.6	0	0	0	0	0	111.7	V61 G69 K70 A77 M83 L85 L100	V61-A73 HydrophobicContact CG2-CB 4.4Å; G69-A73 PolarHBondContact O-N 3.34Å; K70-A73 WeakPolarHBondContact O-CB 3.44Å; K70-A73 PolarHBondContact O-N 3.47Å; K70-A73 VanDerWaalsContact O-N 3.08Å; A73-A77 WeakPolarHBondContact O-CB 3.38Å; A73-A77 PolarHBondContact O-N 3.1Å; A73-M83 HydrophobicContact CB-CE 4.02Å; A73-L85 HydrophobicContact CB-CD2 3.7Å; A73-L100 HydrophobicContact CB-CD1 3.96Å
74	E	98.6	Very high	97.9	Very high	26 Å²	26	23 Å²	23	12%	0.121	12%	0.119	C	C	.	.	H	α-helix	trans	-63.5	-45.9	176.4	-70.5	172.1	167.9	0	0	112.9	K70 S71 Y72 A77 R78 L100 F104	K70-E74 WeakPolarHBondContact CE-OE1 3.46Å; K70-E74 IonicContact NZ-OE1 3.12Å; K70-E74 WeakPolarHBondContact O-CG 3.43Å; K70-E74 PolarHBondContact O-N 2.91Å; S71-E74 PolarHBondContact O-N 3.28Å; Y72-E74 VanDerWaalsContact C-N 3.35Å; Y72-E74 PolarHBondContact O-N 3.34Å; E74-A77 PolarHBondContact O-N 3.24Å; E74-R78 VanDerWaalsContact O-CB 3.31Å; E74-R78 WeakPolarHBondContact O-CB 3.46Å; E74-R78 PolarHBondContact O-N 3.46Å; E74-L100 HydrophobicContact CB-CD2 4.2Å; E74-L100 HydrophobicContact CG-CD2 3.68Å; E74-F104 HydrophobicContact CB-CE2 4.37Å
75	E	98.2	Very high	98	Very high	28 Å²	28	23 Å²	23	13%	0.131	12%	0.119	C	C	.	.	H	α-helix	trans	-71.9	-34.9	-178.4	179.4	64.8	-156.2	0	0	112.6	S71 Y72 R78 R79 V262 L266	S71-E75 VanDerWaalsContact O-CB 3.31Å; S71-E75 WeakPolarHBondContact O-CB 3.49Å; S71-E75 PolarHBondContact O-N 3.33Å; Y72-E75 PolarHBondContact O-N 3.3Å; E75-R78 IonicContact OE2-CZ 2.7Å; E75-R78 IonicContact OE2-NH1 2.96Å; E75-R78 PolarHBondContact OE2-NH1 3.25Å; E75-R79 VanDerWaalsContact O-CG 3.31Å; E75-R79 WeakPolarHBondContact O-CG 3.29Å; E75-R79 PolarHBondContact O-N 2.84Å; E75-R79 IonicContact OE1-CZ 3.66Å; E75-R79 IonicContact OE1-NE 3.32Å; E75-R79 PolarHBondContact OE1-NE 3.07Å; E75-R79 IonicContact OE1-NH2 3.86Å; E75-R79 PolarHBondContact OE1-NH2 3.41Å; E75-V262 HydrophobicContact CB-CG1 3.98Å; E75-V262 HydrophobicContact CG-CG1 4.29Å; E75-L266 HydrophobicContact CB-CD1 4.09Å; E75-L266 HydrophobicContact CG-CD1 3.25Å; E75-L266 HydrophobicContact CG-CG 4.34Å
76	L	98.6	Very high	98.1	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-72.1	-39.4	173.6	-67.4	169	0	0	0	111.4	L51 A59 V61 Y72 R78 R79 G80 F81 M83 V135 V137 L266	L51-L76 HydrophobicContact CD1-CD2 4.44Å; A59-L76 HydrophobicContact CB-CB 4.27Å; A59-L76 HydrophobicContact CB-CD1 3.95Å; V61-L76 HydrophobicContact CG2-CD1 4.22Å; Y72-L76 VanDerWaalsContact O-CB 3.3Å; Y72-L76 WeakPolarHBondContact O-CB 3.23Å; Y72-L76 VanDerWaalsContact O-CG 3.23Å; Y72-L76 WeakPolarHBondContact O-CG 3.38Å; Y72-L76 PolarHBondContact O-N 3.38Å; L76-R78 VanDerWaalsContact C-N 3.34Å; L76-R78 PolarHBondContact O-N 3.23Å; L76-R79 CarbonylContact O-C 3.56Å; L76-R79 WeakPolarHBondContact O-CA 3.41Å; L76-R79 WeakPolarHBondContact O-CB 3.41Å; L76-R79 PolarHBondContact O-N 3.25Å; L76-R79 VanDerWaalsContact O-N 3.07Å; L76-G80 PolarHBondContact O-N 3.25Å; L76-F81 HydrophobicContact CB-CB 4.48Å; L76-F81 HydrophobicContact CB-CD2 4.18Å; L76-F81 HydrophobicContact CD2-CD2 4.08Å; L76-F81 HydrophobicContact CD2-CE2 4.05Å; L76-F81 WeakPolarHBondContact O-CD2 3.43Å; L76-F81 PolarHBondContact O-N 3.38Å; L76-M83 HydrophobicContact CB-CE 4.2Å; L76-M83 HydrophobicContact CB-SD 3.98Å; L76-V135 HydrophobicContact CD1-CG1 4.13Å; L76-V135 HydrophobicContact CD2-CG1 4.46Å; L76-V137 HydrophobicContact CD1-CG2 3.84Å; L76-L266 HydrophobicContact CD2-CD1 4.21Å
77	A	98.6	Very high	98.3	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.008	10%	0.099	C	C	.	.	H	α-helix	trans	-60.5	-42.9	172.1	0	0	0	0	0	111.7	A73 E74 R79 G80 M83 L100 F104 V106	A73-A77 WeakPolarHBondContact O-CB 3.38Å; A73-A77 PolarHBondContact O-N 3.1Å; E74-A77 PolarHBondContact O-N 3.24Å; A77-R79 PolarHBondContact O-N 2.93Å; A77-G80 WeakPolarHBondContact O-CA 3.21Å; A77-G80 PolarHBondContact O-N 2.78Å; A77-M83 HydrophobicContact CB-CG 4Å; A77-M83 HydrophobicContact CB-SD 4.29Å; A77-L100 HydrophobicContact CB-CB 4.45Å; A77-L100 HydrophobicContact CB-CD1 4.46Å; A77-L100 HydrophobicContact CB-CD2 4.03Å; A77-F104 HydrophobicContact CB-CB 4.13Å; A77-F104 HydrophobicContact CB-CD2 3.56Å; A77-F104 HydrophobicContact CB-CE2 4.26Å; A77-F104 HydrophobicContact CB-CG 4Å; A77-V106 HydrophobicContact CB-CG2 3.82Å; A77-V106 WeakPolarHBondContact O-CG1 3.36Å
78	R	97.8	Very high	98.3	Very high	128 Å²	128	27 Å²	27	48%	0.483	12%	0.124	S	C	.	.	H	α-helix	trans	-57.3	-29.2	173.5	-176.4	-177.6	-66.1	103.9	9.7	113	E74 E75 L76 G80 F104	E74-R78 VanDerWaalsContact O-CB 3.31Å; E74-R78 WeakPolarHBondContact O-CB 3.46Å; E74-R78 PolarHBondContact O-N 3.46Å; E75-R78 IonicContact OE2-CZ 2.7Å; E75-R78 IonicContact OE2-NH1 2.96Å; E75-R78 PolarHBondContact OE2-NH1 3.25Å; L76-R78 VanDerWaalsContact C-N 3.34Å; L76-R78 PolarHBondContact O-N 3.23Å; R78-G80 VanDerWaalsContact C-N 3.29Å; R78-F104 HydrophobicContact CB-CD1 3.94Å; R78-F104 HydrophobicContact CB-CE1 3.72Å; R78-F104 HydrophobicContact CB-CZ 4.29Å; R78-F104 HydrophobicContact CG-CD1 4.42Å; R78-F104 HydrophobicContact CG-CE1 4.08Å
79	R	97.1	Very high	98.3	Very high	57 Å²	57	27.6 Å²	27.6	22%	0.215	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	3	175.4	-66.3	169.2	-173.8	-129.1	1.1	113.4	G48 P53 E75 L76 A77 F81	G48-R79 PolarHBondContact O-NH1 2.83Å; P53-R79 WeakPolarHBondContact CD-O 3.46Å; E75-R79 VanDerWaalsContact O-CG 3.31Å; E75-R79 WeakPolarHBondContact O-CG 3.29Å; E75-R79 PolarHBondContact O-N 2.84Å; E75-R79 IonicContact OE1-CZ 3.66Å; E75-R79 IonicContact OE1-NE 3.32Å; E75-R79 PolarHBondContact OE1-NE 3.07Å; E75-R79 IonicContact OE1-NH2 3.86Å; E75-R79 PolarHBondContact OE1-NH2 3.41Å; L76-R79 CarbonylContact O-C 3.56Å; L76-R79 WeakPolarHBondContact O-CA 3.41Å; L76-R79 WeakPolarHBondContact O-CB 3.41Å; L76-R79 PolarHBondContact O-N 3.25Å; L76-R79 VanDerWaalsContact O-N 3.07Å; A77-R79 PolarHBondContact O-N 2.93Å; R79-F81 HydrophobicContact CB-CD2 4.2Å; R79-F81 HydrophobicContact CB-CE2 4.35Å
80	G	97.9	Very high	98.3	Very high	43 Å²	43	31.1 Å²	31.1	44%	0.443	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.2	11.7	173.8	0	0	0	0	0	115.4	P53 L76 A77 R78	P53-G80 VanDerWaalsContact CG-C 3.46Å; P53-G80 VanDerWaalsContact CG-O 3.24Å; P53-G80 WeakPolarHBondContact CG-O 2.93Å; L76-G80 PolarHBondContact O-N 3.25Å; A77-G80 WeakPolarHBondContact O-CA 3.21Å; A77-G80 PolarHBondContact O-N 2.78Å; R78-G80 VanDerWaalsContact C-N 3.29Å
81	F	98.7	Very high	98.2	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.165	C	C	.	.			trans	-73	139.4	173.8	-72.9	-85.9	0	0	0	110.9	L51 T52 P53 G56 A59 L76 R79 M83 V106 V135	L51-F81 HydrophobicContact CB-CE2 4.4Å; T52-F81 WeakPolarHBondContact O-CE1 3.3Å; T52-F81 WeakPolarHBondContact O-CZ 3.16Å; P53-F81 HydrophobicContact CG-CD1 4.42Å; P53-F81 HydrophobicContact CG-CG 4.39Å; G56-F81 WeakPolarHBondContact O-CD1 3.18Å; G56-F81 WeakPolarHBondContact O-CE1 3.46Å; A59-F81 HydrophobicContact CB-CB 3.85Å; A59-F81 HydrophobicContact CB-CD1 4.08Å; A59-F81 HydrophobicContact CB-CG 4Å; L76-F81 HydrophobicContact CB-CB 4.48Å; L76-F81 HydrophobicContact CB-CD2 4.18Å; L76-F81 HydrophobicContact CD2-CD2 4.08Å; L76-F81 HydrophobicContact CD2-CE2 4.05Å; L76-F81 WeakPolarHBondContact O-CD2 3.43Å; L76-F81 PolarHBondContact O-N 3.38Å; R79-F81 HydrophobicContact CB-CD2 4.2Å; R79-F81 HydrophobicContact CB-CE2 4.35Å; F81-M83 HydrophobicContact CB-SD 4.01Å; F81-V106 WeakPolarHBondContact O-CB 3.48Å; F81-V106 WeakPolarHBondContact O-CG1 3.12Å; F81-V135 HydrophobicContact CE1-CG2 3.74Å; F81-V135 HydrophobicContact CE2-CG2 4.31Å; F81-V135 HydrophobicContact CZ-CG2 3.59Å
82	A	98.8	Very high	98.2	Very high	4 Å²	4	39.7 Å²	39.7	3%	0.033	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	146.4	158.9	0	0	0	0	0	109.2	K57 W58 A59 E107	K57-A82 HydrophobicContact CG-CB 4.13Å; K57-A82 PolarHBondContact O-N 2.94Å; W58-A82 CarbonylContact C-O 3.56Å; W58-A82 VanDerWaalsContact CA-O 3.32Å; W58-A82 WeakPolarHBondContact CA-O 3.5Å; W58-A82 HydrophobicContact CD2-CB 3.52Å; W58-A82 HydrophobicContact CE3-CB 3.61Å; W58-A82 HydrophobicContact CG-CB 4.11Å; W58-A82 HydrophobicContact CH2-CB 4.01Å; W58-A82 HydrophobicContact CZ2-CB 3.95Å; W58-A82 HydrophobicContact CZ3-CB 3.85Å; A59-A82 PolarHBondContact N-O 2.95Å; A82-E107 CarbonylContact C-O 3.56Å; A82-E107 VanDerWaalsContact CA-O 3.27Å; A82-E107 WeakPolarHBondContact CA-O 3.13Å; A82-E107 HydrophobicContact CB-CB 4.04Å
83	M	98.9	Very high	98.2	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	120.6	-167	-59.6	-56.1	-49.7	0	0	112.7	W58 A59 V61 A73 L76 A77 F81 L85 L100 V106 E107 T108 R109	W58-M83 WeakPolarHBondContact CZ3-O 3.27Å; A59-M83 HydrophobicContact CB-CE 3.88Å; A59-M83 HydrophobicContact CB-SD 3.92Å; V61-M83 HydrophobicContact CG2-CE 3.69Å; A73-M83 HydrophobicContact CB-CE 4.02Å; L76-M83 HydrophobicContact CB-CE 4.2Å; L76-M83 HydrophobicContact CB-SD 3.98Å; A77-M83 HydrophobicContact CB-CG 4Å; A77-M83 HydrophobicContact CB-SD 4.29Å; F81-M83 HydrophobicContact CB-SD 4.01Å; M83-L85 HydrophobicContact CB-CD2 3.95Å; M83-L85 HydrophobicContact CB-CG 4.32Å; M83-L85 HydrophobicContact CE-CD2 4.29Å; M83-L100 HydrophobicContact CB-CD1 4.32Å; M83-L100 HydrophobicContact CG-CD1 4.05Å; M83-V106 HydrophobicContact CG-CG2 4.3Å; M83-E107 PolarHBondContact N-O 3.12Å; M83-T108 HydrophobicContact CB-CG2 4.19Å; M83-T108 CarbonylContact O-C 3.32Å; M83-T108 VanDerWaalsContact O-CA 3.27Å; M83-T108 WeakPolarHBondContact O-CA 3.06Å; M83-R109 PolarHBondContact O-N 2.9Å
84	M	98.8	Very high	98.2	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.015	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	107.4	165.1	172.6	57.7	74.8	0	0	109.1	W58 A59 V60 V61 I86 R109 I111 G127 L128 L131	W58-M84 HydrophobicContact CE3-CB 4.25Å; A59-M84 PolarHBondContact O-N 2.85Å; V60-M84 WeakPolarHBondContact CA-O 3.49Å; V60-M84 HydrophobicContact CB-CB 4.41Å; V60-M84 HydrophobicContact CG1-CG 4.17Å; V60-M84 HydrophobicContact CG2-CB 3.9Å; V60-M84 HydrophobicContact CG2-CG 4.08Å; V61-M84 PolarHBondContact N-O 2.83Å; M84-I86 HydrophobicContact CG-CD1 4.36Å; M84-I86 HydrophobicContact CG-CG1 4.18Å; M84-I86 HydrophobicContact SD-CG1 4.42Å; M84-R109 CarbonylContact C-O 3.56Å; M84-R109 WeakPolarHBondContact CA-O 3.39Å; M84-R109 HydrophobicContact CE-CB 3.47Å; M84-R109 VanDerWaalsContact CE-CB 3.47Å; M84-R109 HydrophobicContact CE-CG 4.41Å; M84-R109 HydrophobicContact SD-CB 4.04Å; M84-I111 HydrophobicContact CE-CD1 4.06Å; M84-I111 HydrophobicContact CE-CG1 4.36Å; M84-I111 HydrophobicContact SD-CD1 3.73Å; M84-I111 HydrophobicContact SD-CG1 3.76Å; M84-G127 WeakPolarHBondContact CE-O 3.24Å; M84-L128 HydrophobicContact CE-CD2 4.28Å; M84-L128 HydrophobicContact CG-CD2 3.7Å; M84-L131 HydrophobicContact CB-CD1 4.23Å; M84-L131 HydrophobicContact CE-CD1 3.5Å; M84-L131 VanDerWaalsContact CE-CD1 3.5Å; M84-L131 HydrophobicContact CG-CD1 4.46Å
85	L	98.9	Very high	98.2	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	121.8	-175.5	-52.2	178.6	0	0	0	110.3	A64 A73 M83 L93 V96 A97 L100 R109 T110 I111	A64-L85 HydrophobicContact CB-CB 4.05Å; A64-L85 HydrophobicContact CB-CD2 3.85Å; A73-L85 HydrophobicContact CB-CD2 3.7Å; M83-L85 HydrophobicContact CB-CD2 3.95Å; M83-L85 HydrophobicContact CB-CG 4.32Å; M83-L85 HydrophobicContact CE-CD2 4.29Å; L85-L93 HydrophobicContact CB-CD2 3.61Å; L85-V96 HydrophobicContact CD1-CB 4.27Å; L85-V96 HydrophobicContact CD1-CG1 3.84Å; L85-A97 HydrophobicContact CD1-CB 4.13Å; L85-L100 HydrophobicContact CD1-CD1 4.16Å; L85-L100 HydrophobicContact CD2-CD1 4.15Å; L85-R109 PolarHBondContact N-O 3.38Å; L85-T110 HydrophobicContact CB-CG2 4.4Å; L85-T110 CarbonylContact O-C 3.58Å; L85-T110 VanDerWaalsContact O-CA 3.29Å; L85-T110 WeakPolarHBondContact O-CA 3.45Å; L85-I111 PolarHBondContact O-N 3.33Å
86	I	98.8	Very high	98.2	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	123.2	-179.7	-47.9	-174.5	0	0	0	109.7	V60 V61 T62 G63 A64 M84 I111 V113 F115 I124 M174	V60-I86 HydrophobicContact CG1-CD1 3.87Å; V60-I86 HydrophobicContact CG1-CG1 4.38Å; V61-I86 PolarHBondContact O-N 3Å; T62-I86 CarbonylContact C-O 3.51Å; T62-I86 WeakPolarHBondContact CA-O 3.42Å; T62-I86 HydrophobicContact CG2-CB 4.49Å; G63-I86 PolarHBondContact N-O 3.38Å; A64-I86 PolarHBondContact N-O 3.27Å; M84-I86 HydrophobicContact CG-CD1 4.36Å; M84-I86 HydrophobicContact CG-CG1 4.18Å; M84-I86 HydrophobicContact SD-CG1 4.42Å; I86-I111 WeakPolarHBondContact CA-O 3.36Å; I86-I111 HydrophobicContact CD1-CD1 4.47Å; I86-I111 HydrophobicContact CG1-CB 4.25Å; I86-I111 HydrophobicContact CG2-CB 4.35Å; I86-I111 HydrophobicContact CG2-CG2 4.48Å; I86-I111 WeakPolarHBondContact CG2-O 3.43Å; I86-V113 HydrophobicContact CG2-CG2 3.43Å; I86-V113 VanDerWaalsContact CG2-CG2 3.43Å; I86-F115 HydrophobicContact CG2-CE2 3.7Å; I86-F115 HydrophobicContact CG2-CZ 3.82Å; I86-I124 HydrophobicContact CD1-CG2 3.98Å; I86-M174 HydrophobicContact CD1-CE 3.88Å
87	S	98.1	Very high	98.2	Very high	11 Å²	11	45.1 Å²	45.1	8%	0.077	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	-174.4	177.6	-164.9	0	0	0	0	110.3	T65 I111 A112 V113	T65-S87 VanDerWaalsContact CG2-CB 3.41Å; T65-S87 WeakPolarHBondContact CG2-OG 3.31Å; T65-S87 PolarHBondContact OG1-OG 3.23Å; S87-I111 PolarHBondContact N-O 3.46Å; S87-A112 CarbonylContact O-C 3.52Å; S87-A112 VanDerWaalsContact O-CA 3.24Å; S87-A112 WeakPolarHBondContact O-CA 3.26Å; S87-V113 CarbonylContact C-O 3.58Å; S87-V113 PolarHBondContact O-N 3.18Å; S87-V113 VanDerWaalsContact O-O 3.08Å
88	R	96.4	Very high	98.2	Very high	171 Å²	171	51.8 Å²	51.8	65%	0.645	24%	0.243	S	C	*	.	S	Bend	trans	-85.4	-31.4	-174.8	-70.6	176.9	-63.8	167.9	2.5	114.9	V113 D114	R88-V113 WeakPolarHBondContact CA-O 3.26Å; R88-V113 WeakPolarHBondContact CG-O 3.27Å; R88-D114 HydrophobicContact CG-CB 4.27Å
89	S	96.7	Very high	98.2	Very high	37 Å²	37	47 Å²	47	26%	0.259	23%	0.229	S	C	.	.			trans	-109.7	115.1	-170.9	165.3	0	0	0	0	109.2	K92 L93	S89-K92 PolarHBondContact O-N 3.42Å; S89-K92 WeakPolarHBondContact OG-CG 3.4Å; S89-K92 PolarHBondContact OG-N 3.1Å; S89-L93 WeakPolarHBondContact O-CG 3.42Å; S89-L93 PolarHBondContact O-N 3.35Å; S89-L93 VanDerWaalsContact O-N 3.07Å
90	Q	98.2	Very high	98.3	Very high	74 Å²	74	44.3 Å²	44.3	35%	0.346	22%	0.219	S	C	.	.	H	α-helix	trans	-61.2	-47.6	178.8	-171.1	60.5	54.4	0	0	111	K92 L93 D94 T110 A112	Q90-K92 VanDerWaalsContact C-N 3.33Å; Q90-K92 PolarHBondContact O-N 2.91Å; Q90-L93 CarbonylContact O-C 3.59Å; Q90-L93 WeakPolarHBondContact O-CA 3.05Å; Q90-L93 VanDerWaalsContact O-CB 3.31Å; Q90-L93 WeakPolarHBondContact O-CB 3.5Å; Q90-L93 PolarHBondContact O-N 3.29Å; Q90-D94 PolarHBondContact NE2-OD1 3.5Å; Q90-D94 PolarHBondContact O-N 2.97Å; Q90-T110 PolarHBondContact NE2-OG1 2.93Å; Q90-A112 HydrophobicContact CB-CB 4.02Å
91	E	98.1	Very high	98.3	Very high	143 Å²	143	46.1 Å²	46.1	67%	0.668	22%	0.216	S	C	*	.	H	α-helix	trans	-50.1	-49.7	176	-177.2	-171.5	-174.5	0	0	112.7	L93 D94 D95	E91-L93 VanDerWaalsContact C-N 3.31Å; E91-L93 PolarHBondContact O-N 3.36Å; E91-D94 PolarHBondContact O-N 3.18Å; E91-D95 PolarHBondContact O-N 3.2Å
92	K	98	Very high	98.3	Very high	108 Å²	108	51.8 Å²	51.8	47%	0.47	24%	0.243	S	C	.	.	H	α-helix	trans	-69.4	-29.1	178.1	-68.7	179.8	-179	172.8	0	113.3	T65 S89 Q90 V96	T65-K92 HydrophobicContact CG2-CB 3.7Å; S89-K92 PolarHBondContact O-N 3.42Å; S89-K92 WeakPolarHBondContact OG-CG 3.4Å; S89-K92 PolarHBondContact OG-N 3.1Å; Q90-K92 VanDerWaalsContact C-N 3.33Å; Q90-K92 PolarHBondContact O-N 2.91Å; K92-V96 WeakPolarHBondContact O-CG2 3.39Å; K92-V96 PolarHBondContact O-N 3.36Å
93	L	98.7	Very high	98.3	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-67.8	-43.6	173.7	-76.2	166.2	0	0	0	109.8	T65 L85 S89 Q90 E91 D95 V96 A97 T110 A112	T65-L93 HydrophobicContact CG2-CB 4.46Å; T65-L93 HydrophobicContact CG2-CD2 3.69Å; T65-L93 HydrophobicContact CG2-CG 3.74Å; L85-L93 HydrophobicContact CB-CD2 3.61Å; S89-L93 WeakPolarHBondContact O-CG 3.42Å; S89-L93 PolarHBondContact O-N 3.35Å; S89-L93 VanDerWaalsContact O-N 3.07Å; Q90-L93 CarbonylContact O-C 3.59Å; Q90-L93 WeakPolarHBondContact O-CA 3.05Å; Q90-L93 VanDerWaalsContact O-CB 3.31Å; Q90-L93 WeakPolarHBondContact O-CB 3.5Å; Q90-L93 PolarHBondContact O-N 3.29Å; E91-L93 VanDerWaalsContact C-N 3.31Å; E91-L93 PolarHBondContact O-N 3.36Å; L93-D95 VanDerWaalsContact C-N 3.34Å; L93-D95 PolarHBondContact O-N 2.83Å; L93-V96 PolarHBondContact O-N 2.89Å; L93-A97 WeakPolarHBondContact O-CB 3.48Å; L93-A97 PolarHBondContact O-N 3.48Å; L93-T110 HydrophobicContact CB-CG2 3.89Å; L93-A112 HydrophobicContact CD1-CB 4.18Å
94	D	98.5	Very high	98.3	Very high	65 Å²	65	59.5 Å²	59.5	35%	0.348	28%	0.277	S	S	.	.	H	α-helix	trans	-62.3	-41.2	178.4	-58.9	-24.1	0	0	0	111.3	Q90 E91 A97 R98	Q90-D94 PolarHBondContact NE2-OD1 3.5Å; Q90-D94 PolarHBondContact O-N 2.97Å; E91-D94 PolarHBondContact O-N 3.18Å; D94-A97 PolarHBondContact O-N 2.9Å; D94-R98 VanDerWaalsContact O-CB 3.31Å; D94-R98 WeakPolarHBondContact O-CB 3.44Å; D94-R98 PolarHBondContact O-N 3.48Å
95	D	98.3	Very high	98.2	Very high	89 Å²	89	67.4 Å²	67.4	48%	0.476	31%	0.311	S	S	.	.	H	α-helix	trans	-61.4	-46.2	175.3	-72.5	-19.7	0	0	0	112.2	E91 L93 S99	E91-D95 PolarHBondContact O-N 3.2Å; L93-D95 VanDerWaalsContact C-N 3.34Å; L93-D95 PolarHBondContact O-N 2.83Å; D95-S99 WeakPolarHBondContact O-CB 3.29Å; D95-S99 PolarHBondContact O-N 3.03Å; D95-S99 VanDerWaalsContact O-N 3.09Å
96	V	98.6	Very high	98.2	Very high	7 Å²	7	68.3 Å²	68.3	4%	0.042	32%	0.317	C	S	.	.	H	α-helix	trans	-68.4	-46.3	178.7	174	0	0	0	0	110.3	K70 L85 K92 L93 R98 S99 L100	K70-V96 HydrophobicContact CD-CG2 4.14Å; K70-V96 HydrophobicContact CG-CG2 4.4Å; L85-V96 HydrophobicContact CD1-CB 4.27Å; L85-V96 HydrophobicContact CD1-CG1 3.84Å; K92-V96 WeakPolarHBondContact O-CG2 3.39Å; K92-V96 PolarHBondContact O-N 3.36Å; L93-V96 PolarHBondContact O-N 2.89Å; V96-R98 PolarHBondContact O-N 3.41Å; V96-S99 WeakPolarHBondContact O-CB 3.33Å; V96-S99 PolarHBondContact O-N 3.29Å; V96-L100 HydrophobicContact CG1-CD1 4.05Å; V96-L100 HydrophobicContact CG1-CG 4.22Å; V96-L100 VanDerWaalsContact O-CG 3.3Å; V96-L100 WeakPolarHBondContact O-CG 3.48Å; V96-L100 PolarHBondContact O-N 3.27Å
97	A	98.8	Very high	98.2	Very high	7 Å²	7	72 Å²	72	6%	0.058	33%	0.334	C	S	.	.	H	α-helix	trans	-51.2	-55.3	176.2	0	0	0	0	0	111.2	L85 L93 D94 S99 L100 E101 T108 T110	L85-A97 HydrophobicContact CD1-CB 4.13Å; L93-A97 WeakPolarHBondContact O-CB 3.48Å; L93-A97 PolarHBondContact O-N 3.48Å; D94-A97 PolarHBondContact O-N 2.9Å; A97-S99 VanDerWaalsContact C-N 3.33Å; A97-S99 PolarHBondContact O-N 3.34Å; A97-L100 PolarHBondContact O-N 3.17Å; A97-E101 WeakPolarHBondContact O-CG 3.36Å; A97-E101 PolarHBondContact O-N 3.38Å; A97-T108 VanDerWaalsContact CB-OG1 3.27Å; A97-T108 WeakPolarHBondContact CB-OG1 3.37Å; A97-T110 HydrophobicContact CB-CG2 3.98Å
98	R	98.6	Very high	98.2	Very high	141 Å²	141	72.3 Å²	72.3	53%	0.532	34%	0.336	S	S	.	.	H	α-helix	trans	-57.3	-45.3	178.4	-169	-174.5	-49.4	-178.9	7.6	112.1	D94 V96 L100 E101 E102	D94-R98 VanDerWaalsContact O-CB 3.31Å; D94-R98 WeakPolarHBondContact O-CB 3.44Å; D94-R98 PolarHBondContact O-N 3.48Å; V96-R98 PolarHBondContact O-N 3.41Å; R98-L100 VanDerWaalsContact C-N 3.29Å; R98-L100 PolarHBondContact O-N 2.95Å; R98-E101 PolarHBondContact O-N 3.46Å; R98-E102 HydrophobicContact CG-CG 4.38Å; R98-E102 WeakPolarHBondContact CG-OE1 3.49Å; R98-E102 WeakPolarHBondContact O-CB 3.26Å; R98-E102 VanDerWaalsContact O-CG 3.29Å; R98-E102 WeakPolarHBondContact O-CG 3.38Å; R98-E102 PolarHBondContact O-N 2.77Å
99	S	98.3	Very high	98.3	Very high	27 Å²	27	68.2 Å²	68.2	19%	0.189	32%	0.32	C	S	.	.	H	α-helix	trans	-60.3	-38.1	177.2	-177.1	0	0	0	0	112.5	D95 V96 A97 Q103	D95-S99 WeakPolarHBondContact O-CB 3.29Å; D95-S99 PolarHBondContact O-N 3.03Å; D95-S99 VanDerWaalsContact O-N 3.09Å; V96-S99 WeakPolarHBondContact O-CB 3.33Å; V96-S99 PolarHBondContact O-N 3.29Å; A97-S99 VanDerWaalsContact C-N 3.33Å; A97-S99 PolarHBondContact O-N 3.34Å; S99-Q103 VanDerWaalsContact O-CB 3.3Å; S99-Q103 WeakPolarHBondContact O-CB 3.5Å; S99-Q103 VanDerWaalsContact O-CG 3.23Å; S99-Q103 WeakPolarHBondContact O-CG 3.38Å; S99-Q103 PolarHBondContact O-N 2.8Å; S99-Q103 VanDerWaalsContact O-N 3.13Å; S99-Q103 PolarHBondContact OG-NE2 2.87Å
100	L	98.7	Very high	98.4	Very high	0 Å²	0	68.4 Å²	68.4	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-72.6	-41.9	178.8	-64	-179	0	0	0	111.6	A73 E74 A77 M83 L85 V96 A97 R98 F104 V106 T108	A73-L100 HydrophobicContact CB-CD1 3.96Å; E74-L100 HydrophobicContact CB-CD2 4.2Å; E74-L100 HydrophobicContact CG-CD2 3.68Å; A77-L100 HydrophobicContact CB-CB 4.45Å; A77-L100 HydrophobicContact CB-CD1 4.46Å; A77-L100 HydrophobicContact CB-CD2 4.03Å; M83-L100 HydrophobicContact CB-CD1 4.32Å; M83-L100 HydrophobicContact CG-CD1 4.05Å; L85-L100 HydrophobicContact CD1-CD1 4.16Å; L85-L100 HydrophobicContact CD2-CD1 4.15Å; V96-L100 HydrophobicContact CG1-CD1 4.05Å; V96-L100 HydrophobicContact CG1-CG 4.22Å; V96-L100 VanDerWaalsContact O-CG 3.3Å; V96-L100 WeakPolarHBondContact O-CG 3.48Å; V96-L100 PolarHBondContact O-N 3.27Å; A97-L100 PolarHBondContact O-N 3.17Å; R98-L100 VanDerWaalsContact C-N 3.29Å; R98-L100 PolarHBondContact O-N 2.95Å; L100-F104 HydrophobicContact CB-CD2 4.43Å; L100-F104 HydrophobicContact CD2-CD2 3.85Å; L100-F104 HydrophobicContact CD2-CE2 3.72Å; L100-F104 WeakPolarHBondContact O-CB 3.49Å; L100-F104 PolarHBondContact O-N 2.88Å; L100-V106 HydrophobicContact CB-CG2 4.46Å; L100-T108 HydrophobicContact CB-CG2 4.16Å
101	E	98.5	Very high	98.4	Very high	82 Å²	82	65.5 Å²	65.5	38%	0.383	31%	0.307	S	S	.	.	H	α-helix	trans	-61.7	-44.9	176	-68.9	175.1	170.2	0	0	111.2	A97 R98 K105 V106 T108	A97-E101 WeakPolarHBondContact O-CG 3.36Å; A97-E101 PolarHBondContact O-N 3.38Å; R98-E101 PolarHBondContact O-N 3.46Å; E101-K105 VanDerWaalsContact O-CA 3.27Å; E101-K105 WeakPolarHBondContact O-CA 3.46Å; E101-K105 WeakPolarHBondContact O-CD 3.26Å; E101-K105 PolarHBondContact O-N 2.85Å; E101-V106 WeakPolarHBondContact CG-O 3.36Å; E101-T108 HydrophobicContact CG-CG2 3.6Å; E101-T108 WeakPolarHBondContact OE1-CB 3.28Å; E101-T108 PolarHBondContact OE1-OG1 3.23Å
102	E	98.2	Very high	98.5	Very high	119 Å²	119	59.8 Å²	59.8	56%	0.556	28%	0.284	S	S	*	.	H	α-helix	trans	-66	-46.3	179.7	-75.6	175.1	-175.9	0	0	112.2	R98 K105	R98-E102 HydrophobicContact CG-CG 4.38Å; R98-E102 WeakPolarHBondContact CG-OE1 3.49Å; R98-E102 WeakPolarHBondContact O-CB 3.26Å; R98-E102 VanDerWaalsContact O-CG 3.29Å; R98-E102 WeakPolarHBondContact O-CG 3.38Å; R98-E102 PolarHBondContact O-N 2.77Å; E102-K105 WeakPolarHBondContact O-CE 3.39Å; E102-K105 PolarHBondContact O-NZ 3.16Å
103	Q	98.1	Very high	98.5	Very high	119 Å²	119	55.2 Å²	55.2	56%	0.556	27%	0.265	S	S	*	.	H	α-helix	trans	-81	-40.4	-173.6	-68.6	179	19.3	0	0	113.5	S99	S99-Q103 VanDerWaalsContact O-CB 3.3Å; S99-Q103 WeakPolarHBondContact O-CB 3.5Å; S99-Q103 VanDerWaalsContact O-CG 3.23Å; S99-Q103 WeakPolarHBondContact O-CG 3.38Å; S99-Q103 PolarHBondContact O-N 2.8Å; S99-Q103 VanDerWaalsContact O-N 3.13Å; S99-Q103 PolarHBondContact OG-NE2 2.87Å
104	F	98.1	Very high	98.5	Very high	47 Å²	47	58.1 Å²	58.1	21%	0.206	28%	0.28	C	S	.	.	H	α-helix	trans	-113.4	-6.8	-170.1	-53	-65.1	0	0	0	113.9	E74 A77 R78 L100 V106	E74-F104 HydrophobicContact CB-CE2 4.37Å; A77-F104 HydrophobicContact CB-CB 4.13Å; A77-F104 HydrophobicContact CB-CD2 3.56Å; A77-F104 HydrophobicContact CB-CE2 4.26Å; A77-F104 HydrophobicContact CB-CG 4Å; R78-F104 HydrophobicContact CB-CD1 3.94Å; R78-F104 HydrophobicContact CB-CE1 3.72Å; R78-F104 HydrophobicContact CB-CZ 4.29Å; R78-F104 HydrophobicContact CG-CD1 4.42Å; R78-F104 HydrophobicContact CG-CE1 4.08Å; L100-F104 HydrophobicContact CB-CD2 4.43Å; L100-F104 HydrophobicContact CD2-CD2 3.85Å; L100-F104 HydrophobicContact CD2-CE2 3.72Å; L100-F104 WeakPolarHBondContact O-CB 3.49Å; L100-F104 PolarHBondContact O-N 2.88Å; F104-V106 HydrophobicContact CB-CG1 4.15Å; F104-V106 HydrophobicContact CB-CG2 4.36Å; F104-V106 PolarHBondContact O-N 3.16Å
105	K	97.9	Very high	98.4	Very high	168 Å²	168	55.1 Å²	55.1	73%	0.73	26%	0.264	S	S	*	.			trans	57.4	34.5	179.8	-49.6	-52.6	-173.8	-161.4	0	113.3	E101 E102	E101-K105 VanDerWaalsContact O-CA 3.27Å; E101-K105 WeakPolarHBondContact O-CA 3.46Å; E101-K105 WeakPolarHBondContact O-CD 3.26Å; E101-K105 PolarHBondContact O-N 2.85Å; E102-K105 WeakPolarHBondContact O-CE 3.39Å; E102-K105 PolarHBondContact O-NZ 3.16Å
106	V	98.4	Very high	98.4	Very high	19 Å²	19	51.4 Å²	51.4	12%	0.115	25%	0.247	C	C	.	.			trans	-99.2	154.1	176.7	-60.9	0	0	0	0	110.9	A77 F81 M83 L100 E101 F104 T108	A77-V106 HydrophobicContact CB-CG2 3.82Å; A77-V106 WeakPolarHBondContact O-CG1 3.36Å; F81-V106 WeakPolarHBondContact O-CB 3.48Å; F81-V106 WeakPolarHBondContact O-CG1 3.12Å; M83-V106 HydrophobicContact CG-CG2 4.3Å; L100-V106 HydrophobicContact CB-CG2 4.46Å; E101-V106 WeakPolarHBondContact CG-O 3.36Å; F104-V106 HydrophobicContact CB-CG1 4.15Å; F104-V106 HydrophobicContact CB-CG2 4.36Å; F104-V106 PolarHBondContact O-N 3.16Å; V106-T108 HydrophobicContact CG2-CG2 4.42Å
107	E	98.4	Very high	98.3	Very high	78 Å²	78	56.9 Å²	56.9	36%	0.364	27%	0.27	S	S	.	.			trans	-72.5	141.4	171.7	-171.8	-173.5	164.1	0	0	110.1	K57 W58 A82 M83 R109	K57-E107 WeakPolarHBondContact CE-OE2 3.37Å; K57-E107 IonicContact NZ-OE2 3.34Å; K57-E107 PolarHBondContact NZ-OE2 3.4Å; W58-E107 HydrophobicContact CH2-CB 4.21Å; W58-E107 VanDerWaalsContact CH2-CD 3.46Å; W58-E107 HydrophobicContact CH2-CG 3.66Å; W58-E107 WeakPolarHBondContact CH2-OE1 3.45Å; W58-E107 HydrophobicContact CZ2-CG 4.01Å; W58-E107 WeakPolarHBondContact CZ2-OE1 3.28Å; W58-E107 WeakPolarHBondContact CZ2-OE2 3.45Å; A82-E107 CarbonylContact C-O 3.56Å; A82-E107 VanDerWaalsContact CA-O 3.27Å; A82-E107 WeakPolarHBondContact CA-O 3.13Å; A82-E107 HydrophobicContact CB-CB 4.04Å; M83-E107 PolarHBondContact N-O 3.12Å; E107-R109 IonicContact OE1-NE 3.08Å; E107-R109 IonicContact OE1-NH2 2.72Å
108	T	98.8	Very high	98.2	Very high	18 Å²	18	61.4 Å²	61.4	11%	0.11	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	150.8	173.3	78.5	0	0	0	0	112.7	M83 A97 L100 E101 V106	M83-T108 HydrophobicContact CB-CG2 4.19Å; M83-T108 CarbonylContact O-C 3.32Å; M83-T108 VanDerWaalsContact O-CA 3.27Å; M83-T108 WeakPolarHBondContact O-CA 3.06Å; A97-T108 VanDerWaalsContact CB-OG1 3.27Å; A97-T108 WeakPolarHBondContact CB-OG1 3.37Å; L100-T108 HydrophobicContact CB-CG2 4.16Å; E101-T108 HydrophobicContact CG-CG2 3.6Å; E101-T108 WeakPolarHBondContact OE1-CB 3.28Å; E101-T108 PolarHBondContact OE1-OG1 3.23Å; V106-T108 HydrophobicContact CG2-CG2 4.42Å
109	R	98.7	Very high	98.1	Very high	85 Å²	85	60.7 Å²	60.7	32%	0.321	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	149.8	169.9	-73.7	178.6	-171.3	-164.8	8.2	108.4	W58 M83 M84 L85 E107 D130	W58-R109 HydrophobicContact CH2-CB 4.21Å; W58-R109 HydrophobicContact CH2-CG 3.63Å; W58-R109 HydrophobicContact CZ3-CB 4.02Å; W58-R109 HydrophobicContact CZ3-CG 3.98Å; M83-R109 PolarHBondContact O-N 2.9Å; M84-R109 CarbonylContact C-O 3.56Å; M84-R109 WeakPolarHBondContact CA-O 3.39Å; M84-R109 HydrophobicContact CE-CB 3.47Å; M84-R109 VanDerWaalsContact CE-CB 3.47Å; M84-R109 HydrophobicContact CE-CG 4.41Å; M84-R109 HydrophobicContact SD-CB 4.04Å; L85-R109 PolarHBondContact N-O 3.38Å; E107-R109 IonicContact OE1-NE 3.08Å; E107-R109 IonicContact OE1-NH2 2.72Å; R109-D130 IonicContact CZ-OD2 3.09Å; R109-D130 VanDerWaalsContact NH1-CG 3.26Å; R109-D130 IonicContact NH1-OD1 3.68Å; R109-D130 PolarHBondContact NH1-OD1 3.14Å; R109-D130 IonicContact NH1-OD2 2.71Å; R109-D130 PolarHBondContact NH1-OD2 3.16Å; R109-D130 IonicContact NH2-OD2 3.09Å; R109-D130 PolarHBondContact NH2-OD2 3.19Å
110	T	98.8	Very high	98	Very high	40 Å²	40	60.2 Å²	60.2	25%	0.245	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	143.6	-174.9	64.7	0	0	0	0	111.5	L85 Q90 L93 A97	L85-T110 HydrophobicContact CB-CG2 4.4Å; L85-T110 CarbonylContact O-C 3.58Å; L85-T110 VanDerWaalsContact O-CA 3.29Å; L85-T110 WeakPolarHBondContact O-CA 3.45Å; Q90-T110 PolarHBondContact NE2-OG1 2.93Å; L93-T110 HydrophobicContact CB-CG2 3.89Å; A97-T110 HydrophobicContact CB-CG2 3.98Å
111	I	98.7	Very high	98	Very high	14 Å²	14	60.9 Å²	60.9	7%	0.072	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	112.4	170.9	-61.3	173.7	0	0	0	109	M84 L85 I86 S87 V113 I124	M84-I111 HydrophobicContact CE-CD1 4.06Å; M84-I111 HydrophobicContact CE-CG1 4.36Å; M84-I111 HydrophobicContact SD-CD1 3.73Å; M84-I111 HydrophobicContact SD-CG1 3.76Å; L85-I111 PolarHBondContact O-N 3.33Å; I86-I111 WeakPolarHBondContact CA-O 3.36Å; I86-I111 HydrophobicContact CD1-CD1 4.47Å; I86-I111 HydrophobicContact CG1-CB 4.25Å; I86-I111 HydrophobicContact CG2-CB 4.35Å; I86-I111 HydrophobicContact CG2-CG2 4.48Å; I86-I111 WeakPolarHBondContact CG2-O 3.43Å; S87-I111 PolarHBondContact N-O 3.46Å; I111-V113 HydrophobicContact CG2-CG1 3.8Å; I111-V113 HydrophobicContact CG2-CG2 4.3Å; I111-I124 HydrophobicContact CG2-CG1 4.32Å
112	A	98.6	Very high	98	Very high	23 Å²	23	60.2 Å²	60.2	19%	0.19	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	115.4	171.1	0	0	0	0	0	111.6	S87 Q90 L93 K123	S87-A112 CarbonylContact O-C 3.52Å; S87-A112 VanDerWaalsContact O-CA 3.24Å; S87-A112 WeakPolarHBondContact O-CA 3.26Å; Q90-A112 HydrophobicContact CB-CB 4.02Å; L93-A112 HydrophobicContact CD1-CB 4.18Å; A112-K123 PolarHBondContact O-NZ 3.1Å
113	V	98.5	Very high	98	Very high	12 Å²	12	59.8 Å²	59.8	7%	0.073	30%	0.298	C	S	.	.			trans	-152	155.2	178.9	-71.3	0	0	0	0	111.6	I86 S87 R88 I111 F115 I120 K123 I124	I86-V113 HydrophobicContact CG2-CG2 3.43Å; I86-V113 VanDerWaalsContact CG2-CG2 3.43Å; S87-V113 CarbonylContact C-O 3.58Å; S87-V113 PolarHBondContact O-N 3.18Å; S87-V113 VanDerWaalsContact O-O 3.08Å; R88-V113 WeakPolarHBondContact CA-O 3.26Å; R88-V113 WeakPolarHBondContact CG-O 3.27Å; I111-V113 HydrophobicContact CG2-CG1 3.8Å; I111-V113 HydrophobicContact CG2-CG2 4.3Å; V113-F115 HydrophobicContact CG2-CE2 4.17Å; V113-F115 HydrophobicContact CG2-CZ 4.47Å; V113-I120 HydrophobicContact CB-CB 4.06Å; V113-I120 HydrophobicContact CB-CD1 3.98Å; V113-I120 HydrophobicContact CB-CG2 4.1Å; V113-I120 HydrophobicContact CG1-CB 3.94Å; V113-I120 HydrophobicContact CG1-CG2 4.18Å; V113-I120 HydrophobicContact CG2-CD1 4.08Å; V113-K123 HydrophobicContact CG1-CD 4.03Å; V113-I124 HydrophobicContact CG1-CG1 4.42Å; V113-I124 HydrophobicContact CG2-CD1 4.1Å; V113-I124 HydrophobicContact CG2-CG1 4.35Å
114	D	98.1	Very high	98	Very high	60 Å²	60	54.1 Å²	54.1	32%	0.321	27%	0.272	S	S	.	.			trans	-105.6	109.7	172	-173.9	4.5	0	0	0	111.6	R88 G116 K117	R88-D114 HydrophobicContact CG-CB 4.27Å; D114-G116 PolarHBondContact O-N 2.84Å; D114-G116 PolarHBondContact OD1-N 2.69Å; D114-K117 HydrophobicContact CB-CG 4.27Å; D114-K117 WeakPolarHBondContact O-CB 3.49Å; D114-K117 PolarHBondContact O-N 2.6Å
115	F	98.3	Very high	98.1	Very high	3 Å²	3	56.3 Å²	56.3	1%	0.013	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-5.2	178.2	-75.6	-81.6	0	0	0	114.5	T62 I86 V113 K117 I120 Y121 I124 V140 N165 V166 S170 M174	T62-F115 HydrophobicContact CG2-CE2 4.25Å; T62-F115 HydrophobicContact CG2-CZ 3.73Å; I86-F115 HydrophobicContact CG2-CE2 3.7Å; I86-F115 HydrophobicContact CG2-CZ 3.82Å; V113-F115 HydrophobicContact CG2-CE2 4.17Å; V113-F115 HydrophobicContact CG2-CZ 4.47Å; F115-K117 PolarHBondContact O-N 3.36Å; F115-I120 HydrophobicContact CD1-CD1 3.86Å; F115-I120 HydrophobicContact CE1-CD1 4.27Å; F115-I120 HydrophobicContact CG-CD1 4.16Å; F115-Y121 HydrophobicContact CD1-CE1 4.26Å; F115-Y121 HydrophobicContact CE1-CE1 4.15Å; F115-I124 HydrophobicContact CE1-CD1 4.06Å; F115-I124 HydrophobicContact CZ-CD1 4.15Å; F115-V140 HydrophobicContact CB-CG1 4.34Å; F115-V140 HydrophobicContact CB-CG2 4.27Å; F115-V140 HydrophobicContact CD1-CG1 4.26Å; F115-V140 HydrophobicContact CD2-CB 4.09Å; F115-V140 HydrophobicContact CD2-CG1 3.88Å; F115-V140 HydrophobicContact CD2-CG2 3.74Å; F115-V140 HydrophobicContact CE2-CB 4.36Å; F115-V140 HydrophobicContact CE2-CG1 4.18Å; F115-V140 HydrophobicContact CE2-CG2 4.41Å; F115-V140 HydrophobicContact CG-CG1 3.91Å; F115-V140 HydrophobicContact CG-CG2 4.22Å; F115-V140 HydrophobicContact CZ-CG1 4.49Å; F115-N165 CarbonylContact O-C 3.21Å; F115-V166 HydrophobicContact CB-CG1 4.46Å; F115-V166 HydrophobicContact CB-CG2 4.29Å; F115-S170 VanDerWaalsContact CD1-CB 3.47Å; F115-M174 HydrophobicContact CE1-CG 3.91Å; F115-M174 HydrophobicContact CE1-SD 3.92Å; F115-M174 HydrophobicContact CZ-CG 4.32Å; F115-M174 HydrophobicContact CZ-SD 4.08Å
116	G	97.2	Very high	98.1	Very high	11 Å²	11	55 Å²	55	11%	0.113	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-17.4	165.1	0	0	0	0	0	113.5	D114 N165	D114-G116 PolarHBondContact O-N 2.84Å; D114-G116 PolarHBondContact OD1-N 2.69Å; G116-N165 PolarHBondContact O-ND2 3.41Å
117	K	97.1	Very high	98.1	Very high	121 Å²	121	55.3 Å²	55.3	53%	0.526	29%	0.286	S	S	.	.			trans	-102.6	153.5	-178.6	-53.3	-63.8	-176.3	176.8	0	111.5	D114 F115 D119 I120	D114-K117 HydrophobicContact CB-CG 4.27Å; D114-K117 WeakPolarHBondContact O-CB 3.49Å; D114-K117 PolarHBondContact O-N 2.6Å; F115-K117 PolarHBondContact O-N 3.36Å; K117-D119 WeakPolarHBondContact CB-OD1 3.43Å; K117-I120 HydrophobicContact CB-CG2 3.98Å
118	L	95.3	Very high	98.1	Very high	102 Å²	102	51.8 Å²	51.8	53%	0.534	27%	0.27	S	S	.	.	S	Bend	trans	-103.8	-20.1	-175.8	-63.1	-178.7	0	0	0	113.8	I120 Y121 T169	L118-I120 PolarHBondContact O-N 3.14Å; L118-Y121 HydrophobicContact CD2-CE2 4.35Å; L118-Y121 VanDerWaalsContact O-CD2 3.27Å; L118-Y121 WeakPolarHBondContact O-CD2 3.24Å; L118-T169 HydrophobicContact CD2-CG2 3.84Å
119	D	96.5	Very high	98	Very high	127 Å²	127	54 Å²	54	68%	0.679	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	1.7	-179.9	58.3	-20	0	0	0	113.6	K117	K117-D119 WeakPolarHBondContact CB-OD1 3.43Å
120	I	98.1	Very high	97.9	Very high	17 Å²	17	54.8 Å²	54.8	9%	0.087	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-19.5	-175.7	64	166.1	0	0	0	114.1	V113 F115 K117 L118 S122 K123 I124	V113-I120 HydrophobicContact CB-CB 4.06Å; V113-I120 HydrophobicContact CB-CD1 3.98Å; V113-I120 HydrophobicContact CB-CG2 4.1Å; V113-I120 HydrophobicContact CG1-CB 3.94Å; V113-I120 HydrophobicContact CG1-CG2 4.18Å; V113-I120 HydrophobicContact CG2-CD1 4.08Å; F115-I120 HydrophobicContact CD1-CD1 3.86Å; F115-I120 HydrophobicContact CE1-CD1 4.27Å; F115-I120 HydrophobicContact CG-CD1 4.16Å; K117-I120 HydrophobicContact CB-CG2 3.98Å; L118-I120 PolarHBondContact O-N 3.14Å; I120-S122 PolarHBondContact O-N 3.27Å; I120-K123 PolarHBondContact O-N 3.38Å; I120-I124 HydrophobicContact CD1-CD1 4.07Å; I120-I124 HydrophobicContact CG1-CD1 4.3Å; I120-I124 WeakPolarHBondContact O-CG1 3.45Å; I120-I124 PolarHBondContact O-N 3.02Å
121	Y	98.5	Very high	97.9	Very high	13 Å²	13	53.1 Å²	53.1	5%	0.051	29%	0.29	C	S	.	.	H	α-helix	trans	-73.6	-25.9	-165.8	-64.5	-71	0	0	0	113.4	F115 L118 I124 E125 S170 Q173 L177	F115-Y121 HydrophobicContact CD1-CE1 4.26Å; F115-Y121 HydrophobicContact CE1-CE1 4.15Å; L118-Y121 HydrophobicContact CD2-CE2 4.35Å; L118-Y121 VanDerWaalsContact O-CD2 3.27Å; L118-Y121 WeakPolarHBondContact O-CD2 3.24Å; Y121-I124 HydrophobicContact CD1-CD1 4.03Å; Y121-I124 HydrophobicContact CE1-CD1 4.43Å; Y121-I124 PolarHBondContact O-N 2.79Å; Y121-E125 VanDerWaalsContact O-CB 3.31Å; Y121-E125 WeakPolarHBondContact O-CB 3.2Å; Y121-E125 PolarHBondContact O-N 2.9Å; Y121-S170 VanDerWaalsContact OH-CA 3.32Å; Y121-S170 WeakPolarHBondContact OH-CA 3.48Å; Y121-Q173 HydrophobicContact CD1-CB 3.52Å; Y121-Q173 HydrophobicContact CD1-CG 4.21Å; Y121-Q173 HydrophobicContact CD2-CB 4.23Å; Y121-Q173 HydrophobicContact CD2-CG 3.99Å; Y121-Q173 HydrophobicContact CE1-CB 3.27Å; Y121-Q173 HydrophobicContact CE1-CG 3.95Å; Y121-Q173 HydrophobicContact CE2-CB 4.05Å; Y121-Q173 HydrophobicContact CE2-CG 3.74Å; Y121-Q173 HydrophobicContact CG-CB 4Å; Y121-Q173 HydrophobicContact CG-CG 4.24Å; Y121-L177 HydrophobicContact CD1-CD1 4.47Å
122	S	98.1	Very high	97.9	Very high	68 Å²	68	56.5 Å²	56.5	48%	0.476	31%	0.305	S	S	.	.	H	α-helix	trans	-62.9	-47.6	171.4	49.9	0	0	0	0	111.3	I120 I124 E125 E126	I120-S122 PolarHBondContact O-N 3.27Å; S122-I124 VanDerWaalsContact C-N 3.28Å; S122-I124 PolarHBondContact O-N 2.86Å; S122-E125 WeakPolarHBondContact O-CB 3.41Å; S122-E125 PolarHBondContact O-N 3.24Å; S122-E125 VanDerWaalsContact O-N 3.16Å; S122-E126 WeakPolarHBondContact O-CG 3.46Å; S122-E126 PolarHBondContact O-N 3.36Å
123	K	98.2	Very high	97.9	Very high	110 Å²	110	55.6 Å²	55.6	48%	0.478	30%	0.297	S	S	.	.	H	α-helix	trans	-58.4	-40	174.8	-178.7	-176.7	179.2	-173.2	0	112	A112 V113 I120 G127	A112-K123 PolarHBondContact O-NZ 3.1Å; V113-K123 HydrophobicContact CG1-CD 4.03Å; I120-K123 PolarHBondContact O-N 3.38Å; K123-G127 PolarHBondContact O-N 3.29Å; K123-G127 VanDerWaalsContact O-N 3.14Å
124	I	98.6	Very high	97.9	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-67	-47.8	176	-61.7	170.6	0	0	0	110.1	I86 I111 V113 F115 I120 Y121 S122 E126 G127 L128 M174 L177	I86-I124 HydrophobicContact CD1-CG2 3.98Å; I111-I124 HydrophobicContact CG2-CG1 4.32Å; V113-I124 HydrophobicContact CG1-CG1 4.42Å; V113-I124 HydrophobicContact CG2-CD1 4.1Å; V113-I124 HydrophobicContact CG2-CG1 4.35Å; F115-I124 HydrophobicContact CE1-CD1 4.06Å; F115-I124 HydrophobicContact CZ-CD1 4.15Å; I120-I124 HydrophobicContact CD1-CD1 4.07Å; I120-I124 HydrophobicContact CG1-CD1 4.3Å; I120-I124 WeakPolarHBondContact O-CG1 3.45Å; I120-I124 PolarHBondContact O-N 3.02Å; Y121-I124 HydrophobicContact CD1-CD1 4.03Å; Y121-I124 HydrophobicContact CE1-CD1 4.43Å; Y121-I124 PolarHBondContact O-N 2.79Å; S122-I124 VanDerWaalsContact C-N 3.28Å; S122-I124 PolarHBondContact O-N 2.86Å; I124-E126 VanDerWaalsContact C-N 3.33Å; I124-E126 PolarHBondContact O-N 2.92Å; I124-G127 PolarHBondContact O-N 3.03Å; I124-G127 VanDerWaalsContact O-N 3.12Å; I124-L128 HydrophobicContact CG2-CD1 3.74Å; I124-L128 HydrophobicContact CG2-CG 4.11Å; I124-L128 VanDerWaalsContact O-CG 3.26Å; I124-L128 WeakPolarHBondContact O-CG 3.29Å; I124-L128 PolarHBondContact O-N 2.76Å; I124-M174 HydrophobicContact CD1-SD 3.92Å; I124-M174 HydrophobicContact CG2-CE 3.97Å; I124-M174 HydrophobicContact CG2-SD 3.86Å; I124-L177 HydrophobicContact CB-CD1 4.1Å; I124-L177 HydrophobicContact CG2-CD1 3.75Å
125	E	98.6	Very high	97.9	Very high	93 Å²	93	52.1 Å²	52.1	44%	0.435	28%	0.278	S	S	.	.	H	α-helix	trans	-55.8	-46.8	179.6	-173.6	159.7	-151.2	0	0	112	Y121 S122 G127 L128 A129 R176 L177	Y121-E125 VanDerWaalsContact O-CB 3.31Å; Y121-E125 WeakPolarHBondContact O-CB 3.2Å; Y121-E125 PolarHBondContact O-N 2.9Å; S122-E125 WeakPolarHBondContact O-CB 3.41Å; S122-E125 PolarHBondContact O-N 3.24Å; S122-E125 VanDerWaalsContact O-N 3.16Å; E125-G127 PolarHBondContact O-N 3.5Å; E125-L128 PolarHBondContact O-N 3.43Å; E125-A129 PolarHBondContact O-N 2.9Å; E125-A129 VanDerWaalsContact O-N 3.12Å; E125-R176 IonicContact OE2-NH2 3.91Å; E125-L177 HydrophobicContact CB-CD1 4.43Å; E125-L177 HydrophobicContact CB-CD2 3.64Å; E125-L177 VanDerWaalsContact CD-CD2 3.48Å; E125-L177 HydrophobicContact CG-CD2 3.71Å
126	E	98.3	Very high	97.9	Very high	142 Å²	142	52 Å²	52	66%	0.664	28%	0.277	S	S	*	.	H	α-helix	trans	-58.2	-47.2	174	-72.2	170.1	-165.9	0	0	111.8	S122 I124 L128 A129	S122-E126 WeakPolarHBondContact O-CG 3.46Å; S122-E126 PolarHBondContact O-N 3.36Å; I124-E126 VanDerWaalsContact C-N 3.33Å; I124-E126 PolarHBondContact O-N 2.92Å; E126-L128 PolarHBondContact O-N 2.97Å; E126-A129 VanDerWaalsContact O-CB 3.27Å; E126-A129 WeakPolarHBondContact O-CB 3.36Å; E126-A129 PolarHBondContact O-N 3.01Å; E126-A129 VanDerWaalsContact O-N 3.17Å
127	G	98.2	Very high	98	Very high	24 Å²	24	51.5 Å²	51.5	25%	0.247	27%	0.272	C	S	.	.	H	α-helix	trans	-68	-15	178.8	0	0	0	0	0	115	M84 K123 I124 E125	M84-G127 WeakPolarHBondContact CE-O 3.24Å; K123-G127 PolarHBondContact O-N 3.29Å; K123-G127 VanDerWaalsContact O-N 3.14Å; I124-G127 PolarHBondContact O-N 3.03Å; I124-G127 VanDerWaalsContact O-N 3.12Å; E125-G127 PolarHBondContact O-N 3.5Å
128	L	98.6	Very high	98.1	Very high	5 Å²	5	45.8 Å²	45.8	3%	0.026	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-2.6	176.5	-64	-175.9	0	0	0	112.9	V60 M84 I124 E125 E126 D130 L131 I133 M174 L177 V178 K181	V60-L128 HydrophobicContact CG2-CD2 3.8Å; M84-L128 HydrophobicContact CE-CD2 4.28Å; M84-L128 HydrophobicContact CG-CD2 3.7Å; I124-L128 HydrophobicContact CG2-CD1 3.74Å; I124-L128 HydrophobicContact CG2-CG 4.11Å; I124-L128 VanDerWaalsContact O-CG 3.26Å; I124-L128 WeakPolarHBondContact O-CG 3.29Å; I124-L128 PolarHBondContact O-N 2.76Å; E125-L128 PolarHBondContact O-N 3.43Å; E126-L128 PolarHBondContact O-N 2.97Å; L128-D130 PolarHBondContact O-N 3.22Å; L128-L131 HydrophobicContact CD2-CD1 4.04Å; L128-L131 PolarHBondContact O-N 3.36Å; L128-I133 HydrophobicContact CB-CD1 4.07Å; L128-I133 HydrophobicContact CD1-CD1 4.09Å; L128-I133 HydrophobicContact CD2-CD1 3.95Å; L128-I133 HydrophobicContact CG-CD1 4.24Å; L128-M174 HydrophobicContact CD1-CE 4.27Å; L128-L177 HydrophobicContact CD1-CB 4.48Å; L128-V178 HydrophobicContact CD1-CG2 4.08Å; L128-K181 PolarHBondContact O-NZ 3.17Å; L128-K181 VanDerWaalsContact O-NZ 3.15Å
129	A	97	Very high	98.3	Very high	63 Å²	63	42.1 Å²	42.1	52%	0.521	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-37.7	-167.3	0	0	0	0	0	113.3	E125 E126 K181	E125-A129 PolarHBondContact O-N 2.9Å; E125-A129 VanDerWaalsContact O-N 3.12Å; E126-A129 VanDerWaalsContact O-CB 3.27Å; E126-A129 WeakPolarHBondContact O-CB 3.36Å; E126-A129 PolarHBondContact O-N 3.01Å; E126-A129 VanDerWaalsContact O-N 3.17Å; A129-K181 VanDerWaalsContact C-NZ 3.34Å; A129-K181 PolarHBondContact O-NZ 3.33Å
130	D	96.8	Very high	98.3	Very high	103 Å²	103	37.2 Å²	37.2	55%	0.551	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-1.4	-178.7	67.9	-39.1	0	0	0	113.8	R109 L128	R109-D130 IonicContact CZ-OD2 3.09Å; R109-D130 VanDerWaalsContact NH1-CG 3.26Å; R109-D130 IonicContact NH1-OD1 3.68Å; R109-D130 PolarHBondContact NH1-OD1 3.14Å; R109-D130 IonicContact NH1-OD2 2.71Å; R109-D130 PolarHBondContact NH1-OD2 3.16Å; R109-D130 IonicContact NH2-OD2 3.09Å; R109-D130 PolarHBondContact NH2-OD2 3.19Å; L128-D130 PolarHBondContact O-N 3.22Å
131	L	98.3	Very high	98.2	Very high	5 Å²	5	37.1 Å²	37.1	3%	0.026	21%	0.207	C	C	.	.			trans	-92.1	129.9	-171.8	-53.1	-170.5	0	0	0	112.7	W58 M84 L128 I133	W58-L131 HydrophobicContact CB-CB 4.42Å; W58-L131 HydrophobicContact CD2-CD1 4.09Å; W58-L131 HydrophobicContact CD2-CD2 3.96Å; W58-L131 HydrophobicContact CD2-CG 4.46Å; W58-L131 HydrophobicContact CE3-CD1 4.18Å; W58-L131 HydrophobicContact CG-CB 4.13Å; W58-L131 HydrophobicContact CG-CD1 4.3Å; W58-L131 HydrophobicContact CG-CD2 4.23Å; W58-L131 HydrophobicContact CG-CG 4.46Å; W58-L131 HydrophobicContact CZ2-CD2 3.92Å; M84-L131 HydrophobicContact CB-CD1 4.23Å; M84-L131 HydrophobicContact CE-CD1 3.5Å; M84-L131 VanDerWaalsContact CE-CD1 3.5Å; M84-L131 HydrophobicContact CG-CD1 4.46Å; L128-L131 HydrophobicContact CD2-CD1 4.04Å; L128-L131 PolarHBondContact O-N 3.36Å; L131-I133 HydrophobicContact CB-CD1 4.5Å; L131-I133 HydrophobicContact CB-CG1 3.92Å; L131-I133 PolarHBondContact O-N 3.42Å
132	E	98.3	Very high	98	Very high	84 Å²	84	38.1 Å²	38.1	39%	0.393	21%	0.214	S	C	.	.			trans	-81.5	88.2	164.5	-167.9	179.6	127.5	0	0	110.1	G56 K57 W58 G134 K187	G56-E132 CarbonylContact C-O 3.16Å; G56-E132 VanDerWaalsContact C-O 3.32Å; G56-E132 WeakPolarHBondContact CA-O 3.47Å; G56-E132 WeakPolarHBondContact CA-OE1 3.14Å; K57-E132 PolarHBondContact N-O 3.47Å; K57-E132 VanDerWaalsContact N-O 3.09Å; W58-E132 PolarHBondContact N-O 3.26Å; E132-G134 PolarHBondContact O-N 2.85Å; E132-K187 IonicContact OE1-NZ 3.91Å
133	I	98.8	Very high	97.8	Very high	4 Å²	4	36.7 Å²	36.7	2%	0.021	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	114.5	-176	-55.5	161.9	0	0	0	110.3	W58 V60 L128 L131 V135 V178 M182 R185	W58-I133 CarbonylContact O-C 3.52Å; W58-I133 WeakPolarHBondContact O-CA 3.05Å; V60-I133 HydrophobicContact CB-CG2 4.47Å; V60-I133 HydrophobicContact CG2-CB 4.47Å; V60-I133 HydrophobicContact CG2-CD1 3.87Å; V60-I133 HydrophobicContact CG2-CG1 3.92Å; V60-I133 HydrophobicContact CG2-CG2 3.71Å; L128-I133 HydrophobicContact CB-CD1 4.07Å; L128-I133 HydrophobicContact CD1-CD1 4.09Å; L128-I133 HydrophobicContact CD2-CD1 3.95Å; L128-I133 HydrophobicContact CG-CD1 4.24Å; L131-I133 HydrophobicContact CB-CD1 4.5Å; L131-I133 HydrophobicContact CB-CG1 3.92Å; L131-I133 PolarHBondContact O-N 3.42Å; I133-V135 WeakPolarHBondContact CG2-O 3.38Å; I133-V178 HydrophobicContact CB-CG1 3.95Å; I133-V178 HydrophobicContact CD1-CB 4.5Å; I133-V178 HydrophobicContact CD1-CG1 4.13Å; I133-V178 HydrophobicContact CD1-CG2 3.79Å; I133-V178 HydrophobicContact CG2-CG1 3.6Å; I133-M182 HydrophobicContact CG2-CE 4.04Å; I133-R185 PolarHBondContact O-NH2 3.14Å
134	G	98.5	Very high	97.6	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-28.5	175.7	0	0	0	0	0	113.8	L55 W58 E132 G188 V189	L55-G134 WeakPolarHBondContact O-CA 3.4Å; W58-G134 PolarHBondContact O-N 3.31Å; E132-G134 PolarHBondContact O-N 2.85Å; G134-G188 WeakPolarHBondContact O-CA 3.44Å; G134-V189 PolarHBondContact O-N 3.07Å
135	V	98.9	Very high	97.3	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	133.3	-178.7	-175.2	0	0	0	0	110.4	L51 L55 W58 A59 V60 L76 F81 I133 V137 V189	L51-V135 HydrophobicContact CD2-CG2 3.76Å; L55-V135 HydrophobicContact CD1-CG2 4.46Å; W58-V135 PolarHBondContact O-N 2.95Å; A59-V135 CarbonylContact C-O 3.53Å; A59-V135 WeakPolarHBondContact CA-O 3.36Å; A59-V135 HydrophobicContact CB-CB 4.02Å; V60-V135 PolarHBondContact N-O 2.93Å; L76-V135 HydrophobicContact CD1-CG1 4.13Å; L76-V135 HydrophobicContact CD2-CG1 4.46Å; F81-V135 HydrophobicContact CE1-CG2 3.74Å; F81-V135 HydrophobicContact CE2-CG2 4.31Å; F81-V135 HydrophobicContact CZ-CG2 3.59Å; I133-V135 WeakPolarHBondContact CG2-O 3.38Å; V135-V137 HydrophobicContact CG1-CG2 4.09Å; V135-V189 CarbonylContact C-O 3.5Å; V135-V189 VanDerWaalsContact CA-O 3.29Å; V135-V189 WeakPolarHBondContact CA-O 3.5Å; V135-V189 HydrophobicContact CG2-CB 4.42Å
136	L	98.9	Very high	97	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	124.8	166.9	171	63.1	0	0	0	109.2	V60 N138 M174 V178 V189 I190 L191	V60-L136 HydrophobicContact CB-CD1 3.85Å; V60-L136 HydrophobicContact CG1-CD1 3.77Å; V60-L136 CarbonylContact O-C 3.46Å; V60-L136 WeakPolarHBondContact O-CA 3.12Å; L136-N138 WeakPolarHBondContact CD2-ND2 3.46Å; L136-M174 HydrophobicContact CD1-CB 4.48Å; L136-M174 HydrophobicContact CD1-CE 4.1Å; L136-M174 HydrophobicContact CD2-CB 4.15Å; L136-V178 HydrophobicContact CB-CG1 4.34Å; L136-V178 HydrophobicContact CD2-CB 4.09Å; L136-V178 HydrophobicContact CD2-CG2 4.04Å; L136-V189 PolarHBondContact N-O 3.44Å; L136-I190 HydrophobicContact CB-CG1 4.32Å; L136-I190 HydrophobicContact CB-CG2 4.42Å; L136-I190 HydrophobicContact CD2-CG2 4.15Å; L136-I190 HydrophobicContact CG-CG2 4.36Å; L136-I190 CarbonylContact O-C 3.55Å; L136-I190 WeakPolarHBondContact O-CA 3.46Å; L136-L191 PolarHBondContact O-N 3.35Å
137	V	98.9	Very high	96.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	101.4	171.5	-172.9	0	0	0	0	108.9	V60 V61 T62 Y72 L76 V135 N139 L191 I193	V60-V137 PolarHBondContact O-N 3.18Å; V61-V137 HydrophobicContact CB-CB 4.47Å; V61-V137 HydrophobicContact CG1-CB 4.23Å; V61-V137 HydrophobicContact CG1-CG1 4.49Å; V61-V137 HydrophobicContact CG2-CB 4.15Å; V61-V137 HydrophobicContact CG2-CG2 4.15Å; T62-V137 PolarHBondContact N-O 2.91Å; T62-V137 PolarHBondContact OG1-O 2.71Å; Y72-V137 HydrophobicContact CD1-CG1 4.18Å; Y72-V137 HydrophobicContact CD1-CG2 4.13Å; Y72-V137 HydrophobicContact CD2-CG1 3.72Å; Y72-V137 HydrophobicContact CE1-CG1 4.44Å; Y72-V137 HydrophobicContact CE2-CG1 4Å; Y72-V137 HydrophobicContact CG-CG1 3.83Å; Y72-V137 HydrophobicContact CG-CG2 4.32Å; L76-V137 HydrophobicContact CD1-CG2 3.84Å; V135-V137 HydrophobicContact CG1-CG2 4.09Å; V137-N139 HydrophobicContact CG1-CB 3.96Å; V137-N139 PolarHBondContact O-N 3.39Å; V137-N139 VanDerWaalsContact O-N 3.1Å; V137-L191 CarbonylContact C-O 3.44Å; V137-L191 WeakPolarHBondContact CA-O 3.48Å; V137-L191 HydrophobicContact CG1-CB 4.47Å; V137-L191 HydrophobicContact CG2-CB 4.41Å; V137-L191 HydrophobicContact CG2-CD1 4.24Å; V137-I193 HydrophobicContact CG1-CD1 4.36Å; V137-I193 HydrophobicContact CG1-CG1 4.28Å
138	N	98.8	Very high	96.9	Very high	2 Å²	2	25.5 Å²	25.5	1%	0.011	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	84.6	172.3	-73.8	-44.4	0	0	0	109.5	L136 V171 M174 T175 L191 N192 I193	L136-N138 WeakPolarHBondContact CD2-ND2 3.46Å; N138-V171 HydrophobicContact CB-CG1 4.32Å; N138-V171 HydrophobicContact CB-CG2 4.26Å; N138-M174 WeakPolarHBondContact OD1-CB 3.31Å; N138-T175 PolarHBondContact ND2-OG1 3Å; N138-L191 PolarHBondContact N-O 3.49Å; N138-N192 WeakPolarHBondContact CB-OD1 3.37Å; N138-N192 PolarHBondContact ND2-OD1 2.9Å; N138-I193 PolarHBondContact O-N 3.43Å
139	N	98.6	Very high	96.9	Very high	24 Å²	24	29.6 Å²	29.6	13%	0.128	17%	0.168	C	C	.	.			trans	-106.3	-21.9	-176.2	159.2	88.1	0	0	0	113.9	T62 G63 G69 V137 G141 I193	T62-N139 VanDerWaalsContact O-CB 3.27Å; T62-N139 WeakPolarHBondContact O-CB 3.34Å; T62-N139 PolarHBondContact O-ND2 3.17Å; T62-N139 PolarHBondContact OG1-N 2.89Å; G63-N139 PolarHBondContact O-ND2 2.93Å; G69-N139 VanDerWaalsContact CA-ND2 3.26Å; G69-N139 WeakPolarHBondContact CA-ND2 3.09Å; G69-N139 PolarHBondContact N-ND2 3.2Å; G69-N139 PolarHBondContact N-OD1 2.84Å; V137-N139 HydrophobicContact CG1-CB 3.96Å; V137-N139 PolarHBondContact O-N 3.39Å; V137-N139 VanDerWaalsContact O-N 3.1Å; N139-G141 PolarHBondContact O-N 3.42Å; N139-I193 HydrophobicContact CB-CB 4.44Å; N139-I193 HydrophobicContact CB-CG1 3.75Å
140	V	97.1	Very high	96.9	Very high	24 Å²	24	31.9 Å²	31.9	15%	0.145	16%	0.164	C	C	.	.			trans	-52.6	135.9	-179.3	71.8	0	0	0	0	111.1	T62 F115 V166	T62-V140 PolarHBondContact O-N 2.99Å; T62-V140 PolarHBondContact OG1-N 3.11Å; F115-V140 HydrophobicContact CB-CG1 4.34Å; F115-V140 HydrophobicContact CB-CG2 4.27Å; F115-V140 HydrophobicContact CD1-CG1 4.26Å; F115-V140 HydrophobicContact CD2-CB 4.09Å; F115-V140 HydrophobicContact CD2-CG1 3.88Å; F115-V140 HydrophobicContact CD2-CG2 3.74Å; F115-V140 HydrophobicContact CE2-CB 4.36Å; F115-V140 HydrophobicContact CE2-CG1 4.18Å; F115-V140 HydrophobicContact CE2-CG2 4.41Å; F115-V140 HydrophobicContact CG-CG1 3.91Å; F115-V140 HydrophobicContact CG-CG2 4.22Å; F115-V140 HydrophobicContact CZ-CG1 4.49Å; V140-V166 HydrophobicContact CG2-CG1 3.94Å
141	G	95.4	Very high	96.9	Very high	16 Å²	16	33.8 Å²	33.8	17%	0.165	17%	0.173	C	C	.	.			trans	-169.1	150.3	-176.8	0	0	0	0	0	112.2	N139 N167 M245	N139-G141 PolarHBondContact O-N 3.42Å; G141-N167 WeakPolarHBondContact CA-OD1 3.46Å; G141-M245 WeakPolarHBondContact O-CE 3.47Å
142	V	96.1	Very high	96.8	Very high	33 Å²	33	39 Å²	39	20%	0.2	20%	0.197	C	C	.	.			trans	-124.2	151.8	169.9	-69	0	0	0	0	110	T163 V166 N167 Y208	V142-T163 HydrophobicContact CG2-CG2 4.42Å; V142-V166 HydrophobicContact CB-CG1 4.49Å; V142-V166 HydrophobicContact CG1-CG1 4.04Å; V142-V166 HydrophobicContact CG2-CB 3.92Å; V142-V166 HydrophobicContact CG2-CG1 4.07Å; V142-V166 HydrophobicContact CG2-CG2 4.37Å; V142-N167 PolarHBondContact N-OD1 2.96Å; V142-N167 PolarHBondContact O-ND2 2.76Å; V142-N167 PolarHBondContact O-OD1 3Å; V142-Y208 VanDerWaalsContact O-CD2 3.22Å; V142-Y208 WeakPolarHBondContact O-CD2 3.19Å; V142-Y208 WeakPolarHBondContact O-CE2 3.42Å
143	S	93.7	Very high	96.7	Very high	39 Å²	39	35.6 Å²	35.6	27%	0.273	18%	0.181	S	C	.	.			trans	-135	-176.8	173.9	-162	0	0	0	0	109.6	Y208	S143-Y208 WeakPolarHBondContact OG-CD2 3.46Å
144	Y	94	Very high	96.5	Very high	22 Å²	22	39.5 Å²	39.5	9%	0.086	21%	0.207	C	C	.	.			trans	-68.3	141.3	179.4	-71	-112.2	0	0	0	110.9	Y146 I153 F159 L205 V207	Y144-Y146 WeakPolarHBondContact CB-O 3.44Å; Y144-Y146 PolarHBondContact O-N 3Å; Y144-I153 HydrophobicContact CE1-CD1 3.46Å; Y144-I153 VanDerWaalsContact CE1-CD1 3.46Å; Y144-I153 HydrophobicContact CE1-CG1 3.9Å; Y144-F159 HydrophobicContact CD1-CE1 4.47Å; Y144-F159 HydrophobicContact CD1-CE2 4.33Å; Y144-F159 AromaticContact CD1-CZ 3.81Å; Y144-F159 HydrophobicContact CD1-CZ 3.81Å; Y144-F159 AromaticContact CD2-CZ 3.73Å; Y144-F159 HydrophobicContact CD2-CZ 3.73Å; Y144-F159 AromaticContact CE1-CE1 3.85Å; Y144-F159 HydrophobicContact CE1-CE1 3.85Å; Y144-F159 HydrophobicContact CE1-CE2 4.48Å; Y144-F159 AromaticContact CE1-CZ 3.62Å; Y144-F159 HydrophobicContact CE1-CZ 3.62Å; Y144-F159 AromaticContact CE2-CE1 3.99Å; Y144-F159 HydrophobicContact CE2-CE1 3.99Å; Y144-F159 AromaticContact CE2-CZ 3.51Å; Y144-F159 HydrophobicContact CE2-CZ 3.51Å; Y144-F159 HydrophobicContact CG-CE2 4.33Å; Y144-F159 AromaticContact CG-CZ 3.86Å; Y144-F159 HydrophobicContact CG-CZ 3.86Å; Y144-F159 AromaticContact CZ-CE1 3.55Å; Y144-F159 AromaticContact CZ-CZ 3.44Å; Y144-F159 VanDerWaalsContact CZ-CZ 3.44Å; Y144-L205 HydrophobicContact CD1-CD2 4.22Å; Y144-L205 HydrophobicContact CD2-CB 4.28Å; Y144-L205 HydrophobicContact CD2-CD2 3.46Å; Y144-L205 VanDerWaalsContact CD2-CD2 3.46Å; Y144-L205 HydrophobicContact CD2-CG 4.48Å; Y144-L205 HydrophobicContact CE2-CB 4.26Å; Y144-L205 HydrophobicContact CE2-CD2 4.2Å; Y144-L205 HydrophobicContact CG-CD2 3.49Å; Y144-L205 VanDerWaalsContact CG-CD2 3.49Å; Y144-V207 WeakPolarHBondContact OH-CB 3.35Å; Y144-V207 WeakPolarHBondContact OH-CG2 3.33Å; Y144-V207 PolarHBondContact OH-N 2.87Å
145	P	90.7	Very high	96.4	Very high	71 Å²	71	44.9 Å²	44.9	46%	0.461	24%	0.236	S	C	.	.	S	Bend	trans	-61.9	-26.8	169.1	-22.8	33.8	0	0	0	113	R247	P145-R247 PolarHBondContact O-NH1 2.75Å; P145-R247 PolarHBondContact O-NH2 3.03Å
146	Y	93.4	Very high	96.3	Very high	23 Å²	23	46.9 Å²	46.9	9%	0.09	25%	0.247	C	C	.	.	S	Bend	trans	-164.9	156.2	172.2	60.8	-78.7	0	0	0	108.5	Y144 E148 R309 Y312 L313	Y144-Y146 WeakPolarHBondContact CB-O 3.44Å; Y144-Y146 PolarHBondContact O-N 3Å; Y146-E148 HydrophobicContact CD2-CB 4.42Å; Y146-E148 HydrophobicContact CE2-CB 4.01Å; Y146-E148 HydrophobicContact CE2-CG 4.23Å; Y146-E148 WeakPolarHBondContact CE2-OE2 3.43Å; Y146-E148 PolarHBondContact O-N 3.49Å; Y146-R309 HydrophobicContact CD2-CG 4.48Å; Y146-Y312 AromaticContact CD1-CD1 3.54Å; Y146-Y312 HydrophobicContact CD1-CD1 3.54Å; Y146-Y312 HydrophobicContact CD1-CD2 4.39Å; Y146-Y312 AromaticContact CD1-CE1 3.17Å; Y146-Y312 HydrophobicContact CD1-CE1 3.17Å; Y146-Y312 HydrophobicContact CD1-CE2 4.09Å; Y146-Y312 HydrophobicContact CD1-CG 4.14Å; Y146-Y312 AromaticContact CD1-CZ 3.47Å; Y146-Y312 VanDerWaalsContact CD1-CZ 3.47Å; Y146-Y312 AromaticContact CD2-CD1 3.53Å; Y146-Y312 HydrophobicContact CD2-CD1 3.53Å; Y146-Y312 AromaticContact CD2-CE1 4Å; Y146-Y312 HydrophobicContact CD2-CE1 4Å; Y146-Y312 HydrophobicContact CD2-CG 4.11Å; Y146-Y312 AromaticContact CE1-CD1 3.94Å; Y146-Y312 HydrophobicContact CE1-CD1 3.94Å; Y146-Y312 AromaticContact CE1-CE1 3.34Å; Y146-Y312 HydrophobicContact CE1-CE1 3.34Å; Y146-Y312 AromaticContact CE1-CZ 3.9Å; Y146-Y312 AromaticContact CE2-CD1 3.88Å; Y146-Y312 HydrophobicContact CE2-CD1 3.88Å; Y146-Y312 HydrophobicContact CE2-CE1 4.09Å; Y146-Y312 AromaticContact CG-CD1 3.34Å; Y146-Y312 HydrophobicContact CG-CD1 3.34Å; Y146-Y312 HydrophobicContact CG-CD2 4.22Å; Y146-Y312 AromaticContact CG-CE1 3.55Å; Y146-Y312 HydrophobicContact CG-CE1 3.55Å; Y146-Y312 HydrophobicContact CG-CE2 4.38Å; Y146-Y312 AromaticContact CG-CG 3.71Å; Y146-Y312 HydrophobicContact CG-CG 3.71Å; Y146-Y312 AromaticContact CZ-CE1 3.81Å; Y146-L313 HydrophobicContact CE2-CD2 4.14Å
147	P	96.8	Very high	96.2	Very high	9 Å²	9	54.3 Å²	54.3	6%	0.058	28%	0.281	C	S	.	.			trans	-61.1	133.3	177.1	-21.5	32.9	0	0	0	111.8	L204 L205 N305 Q308 R309	P147-L204 HydrophobicContact CB-CB 3.76Å; P147-L204 HydrophobicContact CB-CD2 4.13Å; P147-L205 HydrophobicContact CB-CD2 4.26Å; P147-L205 HydrophobicContact CG-CD2 4.33Å; P147-N305 HydrophobicContact CB-CB 3.8Å; P147-N305 HydrophobicContact CG-CB 4.11Å; P147-Q308 HydrophobicContact CG-CB 4Å; P147-R309 VanDerWaalsContact O-CB 3.27Å; P147-R309 WeakPolarHBondContact O-CB 3.5Å; P147-R309 WeakPolarHBondContact O-CD 3.43Å; P147-R309 WeakPolarHBondContact O-CG 3.33Å
148	E	97.6	Very high	96.1	Very high	8 Å²	8	58.9 Å²	58.9	4%	0.037	31%	0.306	C	S	.	.			trans	-146.7	149.8	-177.2	-172.5	50.1	-86.3	0	0	111.1	Y146 H152 I153 L204 R309	Y146-E148 HydrophobicContact CD2-CB 4.42Å; Y146-E148 HydrophobicContact CE2-CB 4.01Å; Y146-E148 HydrophobicContact CE2-CG 4.23Å; Y146-E148 WeakPolarHBondContact CE2-OE2 3.43Å; Y146-E148 PolarHBondContact O-N 3.49Å; E148-H152 HydrophobicContact CG-CB 3.86Å; E148-H152 WeakPolarHBondContact CG-O 3.36Å; E148-H152 WeakPolarHBondContact OE1-CB 3.43Å; E148-H152 IonicContact OE1-ND1 3.53Å; E148-I153 HydrophobicContact CB-CG1 4.4Å; E148-I153 HydrophobicContact CG-CG1 4.39Å; E148-L204 PolarHBondContact N-O 3.32Å; E148-L204 VanDerWaalsContact N-O 3.07Å; E148-L204 CarbonylContact O-C 3.5Å; E148-L204 VanDerWaalsContact O-CA 3.26Å; E148-L204 WeakPolarHBondContact O-CA 3.36Å; E148-L204 VanDerWaalsContact O-O 3.13Å; E148-R309 VanDerWaalsContact CD-NE 3.25Å; E148-R309 IonicContact OE1-CZ 3.51Å; E148-R309 IonicContact OE1-NE 3.17Å; E148-R309 PolarHBondContact OE1-NE 3.07Å; E148-R309 IonicContact OE1-NH2 3.08Å; E148-R309 PolarHBondContact OE1-NH2 2.87Å; E148-R309 IonicContact OE2-CZ 2.71Å; E148-R309 IonicContact OE2-NE 2.93Å; E148-R309 PolarHBondContact OE2-NE 3.27Å; E148-R309 VanDerWaalsContact OE2-NE 3.12Å; E148-R309 IonicContact OE2-NH2 3.67Å; E148-R309 PolarHBondContact OE2-NH2 3.42Å; E148-R309 VanDerWaalsContact OE2-NH2 3.08Å
149	Y	97.7	Very high	96.1	Very high	91 Å²	91	60 Å²	60	36%	0.357	31%	0.31	S	S	.	.			trans	-64.9	141.8	171.4	-71.5	-77.3	0	0	0	110.2	L151 H152 I153 L204 R306	Y149-L151 VanDerWaalsContact C-N 3.34Å; Y149-L151 PolarHBondContact O-N 3.48Å; Y149-H152 WeakPolarHBondContact O-CA 3.09Å; Y149-H152 PolarHBondContact O-N 3.4Å; Y149-I153 PolarHBondContact O-N 3.23Å; Y149-L204 HydrophobicContact CD1-CD1 4.34Å; Y149-L204 HydrophobicContact CE1-CD1 4.02Å; Y149-R306 PolarHBondContact OH-NE 3.41Å
150	Y	97.1	Very high	96	Very high	111 Å²	111	60.9 Å²	60.9	44%	0.435	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-50.1	-49.4	-171.5	-177.8	-105.7	0	0	0	113.8	H152 I153 L156 I160 V207	Y150-H152 PolarHBondContact O-N 2.87Å; Y150-I153 HydrophobicContact CD2-CD1 4.19Å; Y150-I153 WeakPolarHBondContact O-CD1 3.35Å; Y150-I153 WeakPolarHBondContact O-CG1 3.44Å; Y150-I153 PolarHBondContact O-N 3.31Å; Y150-L156 HydrophobicContact CD1-CD2 4.46Å; Y150-L156 HydrophobicContact CD2-CD1 4.32Å; Y150-L156 HydrophobicContact CE1-CD2 4.07Å; Y150-L156 HydrophobicContact CE2-CD1 3.99Å; Y150-I160 HydrophobicContact CE2-CD1 4.43Å; Y150-I160 WeakPolarHBondContact OH-CD1 3.38Å; Y150-V207 HydrophobicContact CD2-CG2 4.17Å; Y150-V207 HydrophobicContact CE2-CG2 3.85Å
151	L	97.4	Very high	96	Very high	143 Å²	143	63 Å²	63	75%	0.749	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-72.2	-9.8	-179.4	-60.4	179.1	0	0	0	114.3	Y149	Y149-L151 VanDerWaalsContact C-N 3.34Å; Y149-L151 PolarHBondContact O-N 3.48Å
152	H	96.7	Very high	96.2	Very high	116 Å²	116	64.5 Å²	64.5	54%	0.537	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-107.2	5.7	-179.3	-60.1	152.5	0	0	0	113	E148 Y149 Y150 P154	E148-H152 HydrophobicContact CG-CB 3.86Å; E148-H152 WeakPolarHBondContact CG-O 3.36Å; E148-H152 WeakPolarHBondContact OE1-CB 3.43Å; E148-H152 IonicContact OE1-ND1 3.53Å; Y149-H152 WeakPolarHBondContact O-CA 3.09Å; Y149-H152 PolarHBondContact O-N 3.4Å; Y150-H152 PolarHBondContact O-N 2.87Å; H152-P154 WeakPolarHBondContact O-CD 3.22Å
153	I	96.4	Very high	96.3	Very high	11 Å²	11	63 Å²	63	6%	0.056	32%	0.323	C	S	.	.	S	Bend	trans	-66.6	124.6	175	-62	168.4	0	0	0	108.3	Y144 E148 Y149 Y150 N155 L156 F159	Y144-I153 HydrophobicContact CE1-CD1 3.46Å; Y144-I153 VanDerWaalsContact CE1-CD1 3.46Å; Y144-I153 HydrophobicContact CE1-CG1 3.9Å; E148-I153 HydrophobicContact CB-CG1 4.4Å; E148-I153 HydrophobicContact CG-CG1 4.39Å; Y149-I153 PolarHBondContact O-N 3.23Å; Y150-I153 HydrophobicContact CD2-CD1 4.19Å; Y150-I153 WeakPolarHBondContact O-CD1 3.35Å; Y150-I153 WeakPolarHBondContact O-CG1 3.44Å; Y150-I153 PolarHBondContact O-N 3.31Å; I153-N155 PolarHBondContact O-N 3.35Å; I153-L156 HydrophobicContact CB-CD1 3.91Å; I153-L156 HydrophobicContact CD1-CD1 3.83Å; I153-L156 HydrophobicContact CG1-CD1 4.4Å; I153-L156 HydrophobicContact CG2-CD1 4.3Å; I153-L156 PolarHBondContact O-N 2.98Å; I153-F159 HydrophobicContact CD1-CD1 4.14Å; I153-F159 HydrophobicContact CD1-CE1 4.02Å; I153-F159 HydrophobicContact CG2-CB 3.84Å; I153-F159 HydrophobicContact CG2-CD1 3.69Å; I153-F159 HydrophobicContact CG2-CD2 4.02Å; I153-F159 HydrophobicContact CG2-CE1 4.26Å; I153-F159 HydrophobicContact CG2-CG 3.55Å
154	P	94.3	Very high	96.5	Very high	87 Å²	87	64.1 Å²	64.1	57%	0.565	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	132.7	177.5	-22.8	33.8	0	0	0	111.5	H152 L156	H152-P154 WeakPolarHBondContact O-CD 3.22Å; P154-L156 PolarHBondContact O-N 3.25Å
155	N	95.9	Very high	96.7	Very high	113 Å²	113	64.1 Å²	64.1	60%	0.604	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	57	-177.2	-164.9	-13.1	0	0	0	111.6	I153 E157 N158 F159	I153-N155 PolarHBondContact O-N 3.35Å; N155-E157 VanDerWaalsContact C-N 3.28Å; N155-E157 PolarHBondContact O-N 2.9Å; N155-N158 PolarHBondContact O-N 3.13Å; N155-N158 VanDerWaalsContact OD1-CB 3.25Å; N155-N158 WeakPolarHBondContact OD1-CB 3.42Å; N155-N158 PolarHBondContact OD1-N 3.31Å; N155-F159 WeakPolarHBondContact O-CB 3.42Å; N155-F159 PolarHBondContact O-N 2.87Å
156	L	96.7	Very high	97.1	Very high	42 Å²	42	60.9 Å²	60.9	22%	0.22	31%	0.306	C	S	.	.	H	α-helix	trans	-53	-43	-171.6	175.7	60.9	0	0	0	112.7	Y150 I153 P154 F159 I160	Y150-L156 HydrophobicContact CD1-CD2 4.46Å; Y150-L156 HydrophobicContact CD2-CD1 4.32Å; Y150-L156 HydrophobicContact CE1-CD2 4.07Å; Y150-L156 HydrophobicContact CE2-CD1 3.99Å; I153-L156 HydrophobicContact CB-CD1 3.91Å; I153-L156 HydrophobicContact CD1-CD1 3.83Å; I153-L156 HydrophobicContact CG1-CD1 4.4Å; I153-L156 HydrophobicContact CG2-CD1 4.3Å; I153-L156 PolarHBondContact O-N 2.98Å; P154-L156 PolarHBondContact O-N 3.25Å; L156-F159 PolarHBondContact O-N 3.47Å; L156-I160 HydrophobicContact CD1-CD1 3.69Å; L156-I160 HydrophobicContact CD1-CG1 3.85Å; L156-I160 HydrophobicContact CD2-CD1 4.46Å; L156-I160 HydrophobicContact CG-CD1 3.71Å; L156-I160 HydrophobicContact CG-CG1 4.32Å; L156-I160 VanDerWaalsContact O-CG1 3.22Å; L156-I160 WeakPolarHBondContact O-CG1 3.39Å; L156-I160 PolarHBondContact O-N 2.89Å
157	E	96.9	Very high	97.3	Very high	155 Å²	155	59.8 Å²	59.8	72%	0.724	30%	0.302	S	S	*	.	H	α-helix	trans	-58.1	-55.1	178.8	-175	-174.7	166.4	0	0	111.6	N155 F159 I160 T161	N155-E157 VanDerWaalsContact C-N 3.28Å; N155-E157 PolarHBondContact O-N 2.9Å; E157-F159 VanDerWaalsContact C-N 3.3Å; E157-F159 PolarHBondContact O-N 3.44Å; E157-I160 PolarHBondContact O-N 3.17Å; E157-T161 PolarHBondContact O-N 2.84Å; E157-T161 PolarHBondContact O-OG1 2.94Å
158	N	97	Very high	97.4	Very high	96 Å²	96	61.4 Å²	61.4	51%	0.513	31%	0.309	S	S	.	.	H	α-helix	trans	-63.3	-37.7	177.7	-178.1	59.4	0	0	0	111.7	N155 I160 N162	N155-N158 PolarHBondContact O-N 3.13Å; N155-N158 VanDerWaalsContact OD1-CB 3.25Å; N155-N158 WeakPolarHBondContact OD1-CB 3.42Å; N155-N158 PolarHBondContact OD1-N 3.31Å; N158-I160 PolarHBondContact O-N 2.97Å; N158-N162 WeakPolarHBondContact O-CB 3.37Å; N158-N162 PolarHBondContact O-N 2.89Å
159	F	97.7	Very high	97.4	Very high	26 Å²	26	62.7 Å²	62.7	11%	0.114	32%	0.317	C	S	.	.	H	α-helix	trans	-60.1	-45.1	175.9	176.2	-92.2	0	0	0	111.9	Y144 I153 N155 L156 E157 T163 V207	Y144-F159 HydrophobicContact CD1-CE1 4.47Å; Y144-F159 HydrophobicContact CD1-CE2 4.33Å; Y144-F159 AromaticContact CD1-CZ 3.81Å; Y144-F159 HydrophobicContact CD1-CZ 3.81Å; Y144-F159 AromaticContact CD2-CZ 3.73Å; Y144-F159 HydrophobicContact CD2-CZ 3.73Å; Y144-F159 AromaticContact CE1-CE1 3.85Å; Y144-F159 HydrophobicContact CE1-CE1 3.85Å; Y144-F159 HydrophobicContact CE1-CE2 4.48Å; Y144-F159 AromaticContact CE1-CZ 3.62Å; Y144-F159 HydrophobicContact CE1-CZ 3.62Å; Y144-F159 AromaticContact CE2-CE1 3.99Å; Y144-F159 HydrophobicContact CE2-CE1 3.99Å; Y144-F159 AromaticContact CE2-CZ 3.51Å; Y144-F159 HydrophobicContact CE2-CZ 3.51Å; Y144-F159 HydrophobicContact CG-CE2 4.33Å; Y144-F159 AromaticContact CG-CZ 3.86Å; Y144-F159 HydrophobicContact CG-CZ 3.86Å; Y144-F159 AromaticContact CZ-CE1 3.55Å; Y144-F159 AromaticContact CZ-CZ 3.44Å; Y144-F159 VanDerWaalsContact CZ-CZ 3.44Å; I153-F159 HydrophobicContact CD1-CD1 4.14Å; I153-F159 HydrophobicContact CD1-CE1 4.02Å; I153-F159 HydrophobicContact CG2-CB 3.84Å; I153-F159 HydrophobicContact CG2-CD1 3.69Å; I153-F159 HydrophobicContact CG2-CD2 4.02Å; I153-F159 HydrophobicContact CG2-CE1 4.26Å; I153-F159 HydrophobicContact CG2-CG 3.55Å; N155-F159 WeakPolarHBondContact O-CB 3.42Å; N155-F159 PolarHBondContact O-N 2.87Å; L156-F159 PolarHBondContact O-N 3.47Å; E157-F159 VanDerWaalsContact C-N 3.3Å; E157-F159 PolarHBondContact O-N 3.44Å; F159-T163 WeakPolarHBondContact O-CB 3.33Å; F159-T163 PolarHBondContact O-N 2.86Å; F159-T163 PolarHBondContact O-OG1 3.35Å; F159-V207 HydrophobicContact CE1-CB 4.04Å; F159-V207 HydrophobicContact CE1-CG1 4.33Å; F159-V207 HydrophobicContact CE1-CG2 4.21Å
160	I	97.7	Very high	97.5	Very high	42 Å²	42	58.4 Å²	58.4	22%	0.215	30%	0.301	C	S	.	.	H	α-helix	trans	-61.5	-57.6	177.7	-69.7	163	0	0	0	109.6	Y150 L156 E157 N158 N162 T163 I164	Y150-I160 HydrophobicContact CE2-CD1 4.43Å; Y150-I160 WeakPolarHBondContact OH-CD1 3.38Å; L156-I160 HydrophobicContact CD1-CD1 3.69Å; L156-I160 HydrophobicContact CD1-CG1 3.85Å; L156-I160 HydrophobicContact CD2-CD1 4.46Å; L156-I160 HydrophobicContact CG-CD1 3.71Å; L156-I160 HydrophobicContact CG-CG1 4.32Å; L156-I160 VanDerWaalsContact O-CG1 3.22Å; L156-I160 WeakPolarHBondContact O-CG1 3.39Å; L156-I160 PolarHBondContact O-N 2.89Å; E157-I160 PolarHBondContact O-N 3.17Å; N158-I160 PolarHBondContact O-N 2.97Å; I160-N162 PolarHBondContact O-N 2.78Å; I160-T163 PolarHBondContact O-N 2.72Å; I160-I164 HydrophobicContact CG2-CD1 3.64Å; I160-I164 HydrophobicContact CG2-CG1 4.47Å; I160-I164 WeakPolarHBondContact O-CG1 3.2Å; I160-I164 PolarHBondContact O-N 2.68Å
161	T	97.7	Very high	97.5	Very high	70 Å²	70	53.3 Å²	53.3	43%	0.429	28%	0.281	S	S	.	.	H	α-helix	trans	-59.4	-46.4	-175.8	-58.6	0	0	0	0	111.4	E157 I164 N165	E157-T161 PolarHBondContact O-N 2.84Å; E157-T161 PolarHBondContact O-OG1 2.94Å; T161-I164 PolarHBondContact O-N 3.08Å; T161-N165 WeakPolarHBondContact O-CB 3.5Å; T161-N165 VanDerWaalsContact O-CG 3.23Å; T161-N165 PolarHBondContact O-N 3.36Å
162	N	98	Very high	97.6	Very high	47 Å²	47	48.4 Å²	48.4	25%	0.251	26%	0.258	S	S	.	.	H	α-helix	trans	-64.3	-43	177.9	-178.2	72.7	0	0	0	112.3	N158 I160 N165 V166	N158-N162 WeakPolarHBondContact O-CB 3.37Å; N158-N162 PolarHBondContact O-N 2.89Å; I160-N162 PolarHBondContact O-N 2.78Å; N162-N165 PolarHBondContact O-N 2.87Å; N162-V166 WeakPolarHBondContact O-CB 3.13Å; N162-V166 VanDerWaalsContact O-CG2 3.23Å; N162-V166 WeakPolarHBondContact O-CG2 3.34Å; N162-V166 PolarHBondContact O-N 2.94Å
163	T	98.1	Very high	97.7	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.006	25%	0.245	C	C	.	.	H	α-helix	trans	-65.9	-40.5	179.9	-56.8	0	0	0	0	111.4	V142 F159 I160 N167 V207 T211	V142-T163 HydrophobicContact CG2-CG2 4.42Å; F159-T163 WeakPolarHBondContact O-CB 3.33Å; F159-T163 PolarHBondContact O-N 2.86Å; F159-T163 PolarHBondContact O-OG1 3.35Å; I160-T163 PolarHBondContact O-N 2.72Å; T163-N167 WeakPolarHBondContact O-CB 3.31Å; T163-N167 PolarHBondContact O-N 3Å; T163-V207 HydrophobicContact CG2-CG1 3.94Å; T163-T211 HydrophobicContact CG2-CG2 4Å
164	I	98.4	Very high	97.8	Very high	62 Å²	62	45 Å²	45	32%	0.318	24%	0.242	S	C	.	.	H	α-helix	trans	-65.4	-48.5	176.1	-68.6	172.2	0	0	0	110.4	I160 T161 V166 M168 T169	I160-I164 HydrophobicContact CG2-CD1 3.64Å; I160-I164 HydrophobicContact CG2-CG1 4.47Å; I160-I164 WeakPolarHBondContact O-CG1 3.2Å; I160-I164 PolarHBondContact O-N 2.68Å; T161-I164 PolarHBondContact O-N 3.08Å; I164-V166 PolarHBondContact O-N 3.43Å; I164-M168 HydrophobicContact CG1-SD 4.36Å; I164-M168 HydrophobicContact CG2-SD 4.26Å; I164-M168 WeakPolarHBondContact O-CA 3.47Å; I164-M168 VanDerWaalsContact O-CB 3.31Å; I164-M168 WeakPolarHBondContact O-CB 3.21Å; I164-M168 PolarHBondContact O-N 3.14Å; I164-T169 PolarHBondContact O-N 2.84Å; I164-T169 VanDerWaalsContact O-N 3.09Å
165	N	98.4	Very high	98	Very high	22 Å²	22	41.1 Å²	41.1	12%	0.118	22%	0.217	C	C	.	.	I	π-helix	trans	-59.6	-49.6	-179.9	-74.1	-9.4	0	0	0	111.8	F115 G116 T161 N162 T169 S170	F115-N165 CarbonylContact O-C 3.21Å; G116-N165 PolarHBondContact O-ND2 3.41Å; T161-N165 WeakPolarHBondContact O-CB 3.5Å; T161-N165 VanDerWaalsContact O-CG 3.23Å; T161-N165 PolarHBondContact O-N 3.36Å; N162-N165 PolarHBondContact O-N 2.87Å; N165-T169 WeakPolarHBondContact O-CB 3.26Å; N165-T169 PolarHBondContact O-N 3.31Å; N165-S170 PolarHBondContact O-N 3.04Å
166	V	98.5	Very high	98.2	Very high	4 Å²	4	41.6 Å²	41.6	2%	0.024	21%	0.21	C	C	.	.	I	π-helix	trans	-72.1	-39	-176.3	178.2	0	0	0	0	112.3	F115 V140 V142 N162 I164 S170	F115-V166 HydrophobicContact CB-CG1 4.46Å; F115-V166 HydrophobicContact CB-CG2 4.29Å; V140-V166 HydrophobicContact CG2-CG1 3.94Å; V142-V166 HydrophobicContact CB-CG1 4.49Å; V142-V166 HydrophobicContact CG1-CG1 4.04Å; V142-V166 HydrophobicContact CG2-CB 3.92Å; V142-V166 HydrophobicContact CG2-CG1 4.07Å; V142-V166 HydrophobicContact CG2-CG2 4.37Å; N162-V166 WeakPolarHBondContact O-CB 3.13Å; N162-V166 VanDerWaalsContact O-CG2 3.23Å; N162-V166 WeakPolarHBondContact O-CG2 3.34Å; N162-V166 PolarHBondContact O-N 2.94Å; I164-V166 PolarHBondContact O-N 3.43Å; V166-S170 WeakPolarHBondContact O-CB 3.41Å; V166-S170 PolarHBondContact O-OG 3.01Å
167	N	98.5	Very high	98.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.205	C	C	.	.	I	π-helix	trans	-94.4	-27.3	-172.9	-65.8	-2	0	0	0	114.1	G141 V142 T163 V171 T211 V215	G141-N167 WeakPolarHBondContact CA-OD1 3.46Å; V142-N167 PolarHBondContact N-OD1 2.96Å; V142-N167 PolarHBondContact O-ND2 2.76Å; V142-N167 PolarHBondContact O-OD1 3Å; T163-N167 WeakPolarHBondContact O-CB 3.31Å; T163-N167 PolarHBondContact O-N 3Å; N167-V171 WeakPolarHBondContact O-CG2 3.44Å; N167-T211 HydrophobicContact CB-CG2 4.21Å; N167-T211 PolarHBondContact ND2-OG1 3.07Å; N167-V215 WeakPolarHBondContact O-CG2 3.41Å
168	M	98.4	Very high	98.4	Very high	42 Å²	42	33.2 Å²	33.2	21%	0.207	17%	0.17	C	C	.	.	I	π-helix	trans	-113	-58.4	-174.7	-61.5	172.3	47.7	0	0	111.2	I164 S170 V171 C172 T211 F214	I164-M168 HydrophobicContact CG1-SD 4.36Å; I164-M168 HydrophobicContact CG2-SD 4.26Å; I164-M168 WeakPolarHBondContact O-CA 3.47Å; I164-M168 VanDerWaalsContact O-CB 3.31Å; I164-M168 WeakPolarHBondContact O-CB 3.21Å; I164-M168 PolarHBondContact O-N 3.14Å; M168-S170 VanDerWaalsContact C-N 3.31Å; M168-S170 PolarHBondContact O-N 2.95Å; M168-V171 PolarHBondContact O-N 3Å; M168-C172 PolarHBondContact O-N 2.91Å; M168-T211 HydrophobicContact CG-CG2 3.92Å; M168-T211 HydrophobicContact SD-CG2 3.63Å; M168-F214 HydrophobicContact CB-CD1 3.79Å; M168-F214 HydrophobicContact CB-CE1 3.87Å; M168-F214 HydrophobicContact CE-CB 4.1Å; M168-F214 HydrophobicContact CE-CD1 3.91Å; M168-F214 HydrophobicContact CE-CD2 3.62Å; M168-F214 HydrophobicContact CE-CE1 4.23Å; M168-F214 HydrophobicContact CE-CE2 3.95Å; M168-F214 HydrophobicContact CE-CG 3.59Å; M168-F214 HydrophobicContact CE-CZ 4.25Å; M168-F214 HydrophobicContact CG-CB 4.23Å; M168-F214 HydrophobicContact CG-CD1 3.62Å; M168-F214 HydrophobicContact CG-CE1 4.23Å; M168-F214 HydrophobicContact CG-CG 4.03Å; M168-F214 HydrophobicContact SD-CB 4.25Å; M168-F214 HydrophobicContact SD-CD1 4.4Å; M168-F214 HydrophobicContact SD-CG 4.24Å
169	T	98.6	Very high	98.4	Very high	36 Å²	36	29.2 Å²	29.2	22%	0.221	15%	0.149	C	C	.	.	I	π-helix	trans	-61.2	-41.5	-174.6	-52.3	0	0	0	0	111.6	L118 I164 N165 V171 C172 Q173	L118-T169 HydrophobicContact CD2-CG2 3.84Å; I164-T169 PolarHBondContact O-N 2.84Å; I164-T169 VanDerWaalsContact O-N 3.09Å; N165-T169 WeakPolarHBondContact O-CB 3.26Å; N165-T169 PolarHBondContact O-N 3.31Å; T169-V171 VanDerWaalsContact C-N 3.33Å; T169-V171 PolarHBondContact O-N 3.42Å; T169-C172 PolarHBondContact O-N 3.41Å; T169-Q173 HydrophobicContact CG2-CG 4.04Å; T169-Q173 WeakPolarHBondContact O-CB 3.27Å; T169-Q173 WeakPolarHBondContact O-CG 3.36Å; T169-Q173 PolarHBondContact O-N 3.26Å
170	S	98.6	Very high	98.5	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.007	17%	0.169	C	C	.	.	H	α-helix	trans	-55.8	-44.4	176.7	69.9	0	0	0	0	112.8	F115 Y121 N165 V166 M168 Q173 M174	F115-S170 VanDerWaalsContact CD1-CB 3.47Å; Y121-S170 VanDerWaalsContact OH-CA 3.32Å; Y121-S170 WeakPolarHBondContact OH-CA 3.48Å; N165-S170 PolarHBondContact O-N 3.04Å; V166-S170 WeakPolarHBondContact O-CB 3.41Å; V166-S170 PolarHBondContact O-OG 3.01Å; M168-S170 VanDerWaalsContact C-N 3.31Å; M168-S170 PolarHBondContact O-N 2.95Å; S170-Q173 PolarHBondContact O-N 3.05Å; S170-M174 VanDerWaalsContact O-CB 3.26Å; S170-M174 WeakPolarHBondContact O-CB 3.23Å; S170-M174 WeakPolarHBondContact O-CG 3.35Å; S170-M174 PolarHBondContact O-N 2.83Å
171	V	98.7	Very high	98.5	Very high	4 Å²	4	33.5 Å²	33.5	2%	0.024	17%	0.174	C	C	.	.	H	α-helix	trans	-65.1	-44.6	-178.6	-178.6	0	0	0	0	110.2	N138 N167 M168 T169 T175 N192 V215 F218	N138-V171 HydrophobicContact CB-CG1 4.32Å; N138-V171 HydrophobicContact CB-CG2 4.26Å; N167-V171 WeakPolarHBondContact O-CG2 3.44Å; M168-V171 PolarHBondContact O-N 3Å; T169-V171 VanDerWaalsContact C-N 3.33Å; T169-V171 PolarHBondContact O-N 3.42Å; V171-T175 WeakPolarHBondContact O-CB 3.2Å; V171-T175 PolarHBondContact O-N 3.37Å; V171-T175 VanDerWaalsContact O-N 3.08Å; V171-T175 PolarHBondContact O-OG1 2.78Å; V171-N192 HydrophobicContact CG1-CB 4.4Å; V171-V215 HydrophobicContact CG2-CG2 3.98Å; V171-F218 HydrophobicContact CG1-CD1 3.91Å; V171-F218 HydrophobicContact CG1-CE1 3.85Å
172	C	98.8	Very high	98.5	Very high	39 Å²	39	30.2 Å²	30.2	26%	0.264	15%	0.154	S	C	.	.	H	α-helix	trans	-63.2	-48.7	177	-63.1	0	0	0	0	111.7	M168 T169 T175 R176 F218	M168-C172 PolarHBondContact O-N 2.91Å; T169-C172 PolarHBondContact O-N 3.41Å; C172-T175 PolarHBondContact O-N 2.78Å; C172-R176 WeakPolarHBondContact O-CB 3.27Å; C172-R176 PolarHBondContact O-N 3.31Å; C172-F218 HydrophobicContact CB-CZ 4.33Å
173	Q	98.8	Very high	98.5	Very high	57 Å²	57	29.6 Å²	29.6	27%	0.266	15%	0.152	S	C	.	.	H	α-helix	trans	-68.9	-46.2	-175.9	-71	-69.7	-3	0	0	112.1	Y121 T169 S170 T175 R176 L177	Y121-Q173 HydrophobicContact CD1-CB 3.52Å; Y121-Q173 HydrophobicContact CD1-CG 4.21Å; Y121-Q173 HydrophobicContact CD2-CB 4.23Å; Y121-Q173 HydrophobicContact CD2-CG 3.99Å; Y121-Q173 HydrophobicContact CE1-CB 3.27Å; Y121-Q173 HydrophobicContact CE1-CG 3.95Å; Y121-Q173 HydrophobicContact CE2-CB 4.05Å; Y121-Q173 HydrophobicContact CE2-CG 3.74Å; Y121-Q173 HydrophobicContact CG-CB 4Å; Y121-Q173 HydrophobicContact CG-CG 4.24Å; T169-Q173 HydrophobicContact CG2-CG 4.04Å; T169-Q173 WeakPolarHBondContact O-CB 3.27Å; T169-Q173 WeakPolarHBondContact O-CG 3.36Å; T169-Q173 PolarHBondContact O-N 3.26Å; S170-Q173 PolarHBondContact O-N 3.05Å; Q173-T175 VanDerWaalsContact C-N 3.28Å; Q173-T175 PolarHBondContact O-N 2.71Å; Q173-R176 WeakPolarHBondContact O-CB 3.38Å; Q173-R176 PolarHBondContact O-N 3.5Å; Q173-R176 VanDerWaalsContact O-N 3.13Å; Q173-L177 WeakPolarHBondContact O-CG 3.32Å; Q173-L177 PolarHBondContact O-N 3.34Å
174	M	98.9	Very high	98.5	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.4	-39	176.1	-69.9	-57.9	-54.8	0	0	111.8	V60 T62 I86 F115 I124 L128 L136 N138 S170 L177 V178	V60-M174 HydrophobicContact CG1-CE 4.03Å; T62-M174 HydrophobicContact CG2-CE 4.05Å; T62-M174 HydrophobicContact CG2-CG 4.11Å; T62-M174 HydrophobicContact CG2-SD 4.38Å; I86-M174 HydrophobicContact CD1-CE 3.88Å; F115-M174 HydrophobicContact CE1-CG 3.91Å; F115-M174 HydrophobicContact CE1-SD 3.92Å; F115-M174 HydrophobicContact CZ-CG 4.32Å; F115-M174 HydrophobicContact CZ-SD 4.08Å; I124-M174 HydrophobicContact CD1-SD 3.92Å; I124-M174 HydrophobicContact CG2-CE 3.97Å; I124-M174 HydrophobicContact CG2-SD 3.86Å; L128-M174 HydrophobicContact CD1-CE 4.27Å; L136-M174 HydrophobicContact CD1-CB 4.48Å; L136-M174 HydrophobicContact CD1-CE 4.1Å; L136-M174 HydrophobicContact CD2-CB 4.15Å; N138-M174 WeakPolarHBondContact OD1-CB 3.31Å; S170-M174 VanDerWaalsContact O-CB 3.26Å; S170-M174 WeakPolarHBondContact O-CB 3.23Å; S170-M174 WeakPolarHBondContact O-CG 3.35Å; S170-M174 PolarHBondContact O-N 2.83Å; M174-L177 PolarHBondContact O-N 3.1Å; M174-L177 HydrophobicContact SD-CD1 4.38Å; M174-V178 WeakPolarHBondContact O-CG2 3.38Å; M174-V178 PolarHBondContact O-N 3.37Å
175	T	98.8	Very high	98.5	Very high	4 Å²	4	33.8 Å²	33.8	3%	0.025	18%	0.182	C	C	.	.	H	α-helix	trans	-62.9	-45.7	173.6	-58.7	0	0	0	0	111.1	N138 V171 C172 Q173 L177 V178 L179 I190 F218 L222	N138-T175 PolarHBondContact ND2-OG1 3Å; V171-T175 WeakPolarHBondContact O-CB 3.2Å; V171-T175 PolarHBondContact O-N 3.37Å; V171-T175 VanDerWaalsContact O-N 3.08Å; V171-T175 PolarHBondContact O-OG1 2.78Å; C172-T175 PolarHBondContact O-N 2.78Å; Q173-T175 VanDerWaalsContact C-N 3.28Å; Q173-T175 PolarHBondContact O-N 2.71Å; T175-L177 VanDerWaalsContact C-N 3.27Å; T175-L177 PolarHBondContact O-N 3.38Å; T175-V178 PolarHBondContact O-N 3.32Å; T175-L179 HydrophobicContact CG2-CB 4.23Å; T175-L179 HydrophobicContact CG2-CD2 4.12Å; T175-L179 WeakPolarHBondContact O-CB 3.29Å; T175-L179 PolarHBondContact O-N 3.28Å; T175-I190 HydrophobicContact CG2-CD1 3.88Å; T175-F218 HydrophobicContact CG2-CE1 4.47Å; T175-F218 HydrophobicContact CG2-CZ 4.38Å; T175-L222 HydrophobicContact CG2-CD1 3.7Å
176	R	98.6	Very high	98.5	Very high	123 Å²	123	36.3 Å²	36.3	46%	0.464	20%	0.201	S	C	.	.	H	α-helix	trans	-55.4	-40.8	175.6	-176.8	-170.6	71.8	80.5	-1.3	112.4	E125 C172 Q173 P180	E125-R176 IonicContact OE2-NH2 3.91Å; C172-R176 WeakPolarHBondContact O-CB 3.27Å; C172-R176 PolarHBondContact O-N 3.31Å; Q173-R176 WeakPolarHBondContact O-CB 3.38Å; Q173-R176 PolarHBondContact O-N 3.5Å; Q173-R176 VanDerWaalsContact O-N 3.13Å; R176-P180 WeakPolarHBondContact O-CD 3.35Å; R176-P180 WeakPolarHBondContact O-CG 3.4Å
177	L	98.7	Very high	98.4	Very high	20 Å²	20	39.6 Å²	39.6	11%	0.105	22%	0.215	C	C	.	.	H	α-helix	trans	-69.2	-34.5	-178.5	-68.1	179.8	0	0	0	113.1	Y121 I124 E125 L128 Q173 M174 T175	Y121-L177 HydrophobicContact CD1-CD1 4.47Å; I124-L177 HydrophobicContact CB-CD1 4.1Å; I124-L177 HydrophobicContact CG2-CD1 3.75Å; E125-L177 HydrophobicContact CB-CD1 4.43Å; E125-L177 HydrophobicContact CB-CD2 3.64Å; E125-L177 VanDerWaalsContact CD-CD2 3.48Å; E125-L177 HydrophobicContact CG-CD2 3.71Å; L128-L177 HydrophobicContact CD1-CB 4.48Å; Q173-L177 WeakPolarHBondContact O-CG 3.32Å; Q173-L177 PolarHBondContact O-N 3.34Å; M174-L177 PolarHBondContact O-N 3.1Å; M174-L177 HydrophobicContact SD-CD1 4.38Å; T175-L177 VanDerWaalsContact C-N 3.27Å; T175-L177 PolarHBondContact O-N 3.38Å
178	V	98.6	Very high	98.4	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.006	22%	0.216	C	C	.	.	H	α-helix	trans	-100.4	-37.3	-170.8	178.9	0	0	0	0	113	L128 I133 L136 M174 T175 P180 K181 M182	L128-V178 HydrophobicContact CD1-CG2 4.08Å; I133-V178 HydrophobicContact CB-CG1 3.95Å; I133-V178 HydrophobicContact CD1-CB 4.5Å; I133-V178 HydrophobicContact CD1-CG1 4.13Å; I133-V178 HydrophobicContact CD1-CG2 3.79Å; I133-V178 HydrophobicContact CG2-CG1 3.6Å; L136-V178 HydrophobicContact CB-CG1 4.34Å; L136-V178 HydrophobicContact CD2-CB 4.09Å; L136-V178 HydrophobicContact CD2-CG2 4.04Å; M174-V178 WeakPolarHBondContact O-CG2 3.38Å; M174-V178 PolarHBondContact O-N 3.37Å; T175-V178 PolarHBondContact O-N 3.32Å; V178-P180 VanDerWaalsContact C-CD 3.5Å; V178-K181 PolarHBondContact O-N 2.69Å; V178-M182 HydrophobicContact CG1-CE 3.47Å; V178-M182 VanDerWaalsContact CG1-CE 3.47Å; V178-M182 HydrophobicContact CG1-CG 4.09Å; V178-M182 HydrophobicContact CG1-SD 3.83Å; V178-M182 PolarHBondContact O-N 3.3Å
179	L	98.6	Very high	98.4	Very high	12 Å²	12	37.7 Å²	37.7	6%	0.063	21%	0.207	C	C	.	.	H	α-helix	trans	-58.7	-42	-170.9	-177.8	61.8	0	0	0	114.4	T175 K181 M182 V183 I190 Y226 I231	T175-L179 HydrophobicContact CG2-CB 4.23Å; T175-L179 HydrophobicContact CG2-CD2 4.12Å; T175-L179 WeakPolarHBondContact O-CB 3.29Å; T175-L179 PolarHBondContact O-N 3.28Å; L179-K181 VanDerWaalsContact C-N 3.31Å; L179-K181 PolarHBondContact O-N 3.33Å; L179-M182 WeakPolarHBondContact O-CB 3.19Å; L179-M182 PolarHBondContact O-N 3.32Å; L179-M182 VanDerWaalsContact O-N 3.1Å; L179-V183 HydrophobicContact CD1-CG2 3.9Å; L179-V183 HydrophobicContact CG-CG2 4.14Å; L179-V183 WeakPolarHBondContact O-CG2 3.35Å; L179-V183 PolarHBondContact O-N 3.46Å; L179-I190 HydrophobicContact CB-CD1 4.4Å; L179-I190 HydrophobicContact CD1-CD1 4.13Å; L179-Y226 HydrophobicContact CD1-CD1 4.46Å; L179-Y226 HydrophobicContact CD1-CG 4.43Å; L179-Y226 HydrophobicContact CD2-CD2 4.04Å; L179-Y226 HydrophobicContact CD2-CE1 4.17Å; L179-Y226 HydrophobicContact CD2-CE2 3.7Å; L179-Y226 HydrophobicContact CD2-CG 4.45Å; L179-I231 HydrophobicContact CD1-CG1 4.42Å; L179-I231 HydrophobicContact CD1-CG2 3.94Å
180	P	98.4	Very high	98.4	Very high	81 Å²	81	36 Å²	36	53%	0.526	20%	0.196	S	C	.	.	H	α-helix	trans	-56.9	-43	-178.7	-26.8	35.7	0	0	0	113.1	R176 V178 V183 A184	R176-P180 WeakPolarHBondContact O-CD 3.35Å; R176-P180 WeakPolarHBondContact O-CG 3.4Å; V178-P180 VanDerWaalsContact C-CD 3.5Å; P180-V183 PolarHBondContact O-N 3.32Å; P180-A184 WeakPolarHBondContact O-CB 3.34Å; P180-A184 PolarHBondContact O-N 2.57Å
181	K	98	Very high	98.4	Very high	78 Å²	78	36 Å²	36	34%	0.339	20%	0.196	S	C	.	.	H	α-helix	trans	-70.4	-33.2	178.4	-67.9	-177.4	177.8	179.8	0	112.5	L128 A129 V178 L179 R185	L128-K181 PolarHBondContact O-NZ 3.17Å; L128-K181 VanDerWaalsContact O-NZ 3.15Å; A129-K181 VanDerWaalsContact C-NZ 3.34Å; A129-K181 PolarHBondContact O-NZ 3.33Å; V178-K181 PolarHBondContact O-N 2.69Å; L179-K181 VanDerWaalsContact C-N 3.31Å; L179-K181 PolarHBondContact O-N 3.33Å; K181-R185 WeakPolarHBondContact O-CG 3.49Å; K181-R185 PolarHBondContact O-N 3.18Å; K181-R185 PolarHBondContact O-NH1 3.25Å
182	M	98.6	Very high	98.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-66.6	-45.4	173.8	-70.1	-178.7	164.3	0	0	111	I133 V178 L179 R185 S186 K187 I190 I231	I133-M182 HydrophobicContact CG2-CE 4.04Å; V178-M182 HydrophobicContact CG1-CE 3.47Å; V178-M182 VanDerWaalsContact CG1-CE 3.47Å; V178-M182 HydrophobicContact CG1-CG 4.09Å; V178-M182 HydrophobicContact CG1-SD 3.83Å; V178-M182 PolarHBondContact O-N 3.3Å; L179-M182 WeakPolarHBondContact O-CB 3.19Å; L179-M182 PolarHBondContact O-N 3.32Å; L179-M182 VanDerWaalsContact O-N 3.1Å; M182-R185 CarbonylContact O-C 3.58Å; M182-R185 PolarHBondContact O-N 3.37Å; M182-R185 VanDerWaalsContact O-N 3.16Å; M182-S186 PolarHBondContact O-N 2.9Å; M182-K187 PolarHBondContact O-N 3.29Å; M182-I190 HydrophobicContact CE-CG1 4.41Å; M182-I190 HydrophobicContact SD-CD1 4.17Å; M182-I190 HydrophobicContact SD-CG1 3.87Å; M182-I231 HydrophobicContact CB-CD1 3.88Å
183	V	98.5	Very high	98.4	Very high	34 Å²	34	34.3 Å²	34.3	21%	0.206	18%	0.184	C	C	.	.	H	α-helix	trans	-60.3	-45.7	177.6	166.2	0	0	0	0	111.4	L179 P180 R185 S186 Y226 I231	L179-V183 HydrophobicContact CD1-CG2 3.9Å; L179-V183 HydrophobicContact CG-CG2 4.14Å; L179-V183 WeakPolarHBondContact O-CG2 3.35Å; L179-V183 PolarHBondContact O-N 3.46Å; P180-V183 PolarHBondContact O-N 3.32Å; V183-R185 PolarHBondContact O-N 3.08Å; V183-R185 VanDerWaalsContact O-N 3.1Å; V183-S186 PolarHBondContact O-N 3.5Å; V183-Y226 HydrophobicContact CG2-CD1 3.59Å; V183-Y226 HydrophobicContact CG2-CE1 3.82Å; V183-I231 HydrophobicContact CG2-CD1 4.48Å; V183-I231 HydrophobicContact CG2-CG1 3.99Å
184	A	98.1	Very high	98.4	Very high	86 Å²	86	31.8 Å²	31.8	71%	0.711	17%	0.173	S	C	*	.	H	α-helix	trans	-57.7	-26.6	177.9	0	0	0	0	0	113.4	P180	P180-A184 WeakPolarHBondContact O-CB 3.34Å; P180-A184 PolarHBondContact O-N 2.57Å
185	R	97.7	Very high	98.4	Very high	66 Å²	66	32.4 Å²	32.4	25%	0.249	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101	-0.7	176.7	-57.3	-173.4	-48.6	-101.6	-2.4	113.5	I133 K181 M182 V183 K187	I133-R185 PolarHBondContact O-NH2 3.14Å; K181-R185 WeakPolarHBondContact O-CG 3.49Å; K181-R185 PolarHBondContact O-N 3.18Å; K181-R185 PolarHBondContact O-NH1 3.25Å; M182-R185 CarbonylContact O-C 3.58Å; M182-R185 PolarHBondContact O-N 3.37Å; M182-R185 VanDerWaalsContact O-N 3.16Å; V183-R185 PolarHBondContact O-N 3.08Å; V183-R185 VanDerWaalsContact O-N 3.1Å; R185-K187 HydrophobicContact CB-CG 4.06Å; R185-K187 PolarHBondContact O-N 3.01Å; R185-K187 VanDerWaalsContact O-N 3.11Å
186	S	97.9	Very high	98.3	Very high	74 Å²	74	32.4 Å²	32.4	52%	0.517	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	49	32.5	-173.8	-52.8	0	0	0	0	114.7	M182 V183 Q229	M182-S186 PolarHBondContact O-N 2.9Å; V183-S186 PolarHBondContact O-N 3.5Å; S186-Q229 CarbonylContact C-O 3.59Å; S186-Q229 WeakPolarHBondContact CA-O 3.33Å; S186-Q229 WeakPolarHBondContact CB-O 3.25Å
187	K	97.1	Very high	98.2	Very high	73 Å²	73	27.8 Å²	27.8	32%	0.317	16%	0.164	S	C	.	.			trans	-153.5	134.7	178.9	67.2	-175.1	-177.6	170.2	0	110.8	K54 L55 E132 M182 R185	K54-K187 PolarHBondContact O-NZ 2.9Å; L55-K187 HydrophobicContact CD2-CB 4.37Å; E132-K187 IonicContact OE1-NZ 3.91Å; M182-K187 PolarHBondContact O-N 3.29Å; R185-K187 HydrophobicContact CB-CG 4.06Å; R185-K187 PolarHBondContact O-N 3.01Å; R185-K187 VanDerWaalsContact O-N 3.11Å
188	G	98.2	Very high	98	Very high	2 Å²	2	27.2 Å²	27.2	2%	0.021	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.7	156.3	175.8	0	0	0	0	0	112.1	G134 I232	G134-G188 WeakPolarHBondContact O-CA 3.44Å; G188-I232 PolarHBondContact O-N 2.83Å
189	V	98.8	Very high	97.9	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.006	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	130.9	178	-179.8	0	0	0	0	110	L50 L51 L55 G134 V135 L136 L191 I232 V269	L50-V189 HydrophobicContact CD2-CG2 3.6Å; L51-V189 HydrophobicContact CD2-CB 4.16Å; L51-V189 HydrophobicContact CD2-CG1 4.17Å; L51-V189 HydrophobicContact CD2-CG2 3.95Å; L55-V189 HydrophobicContact CD1-CG2 3.72Å; G134-V189 PolarHBondContact O-N 3.07Å; V135-V189 CarbonylContact C-O 3.5Å; V135-V189 VanDerWaalsContact CA-O 3.29Å; V135-V189 WeakPolarHBondContact CA-O 3.5Å; V135-V189 HydrophobicContact CG2-CB 4.42Å; L136-V189 PolarHBondContact N-O 3.44Å; V189-L191 HydrophobicContact CG1-CD2 3.62Å; V189-L191 HydrophobicContact CG1-CG 4.02Å; V189-I232 CarbonylContact C-O 3.54Å; V189-I232 VanDerWaalsContact CA-O 3.29Å; V189-I232 WeakPolarHBondContact CA-O 3.24Å; V189-I232 HydrophobicContact CG1-CG2 4.42Å; V189-I232 HydrophobicContact CG2-CB 4.19Å; V189-V269 HydrophobicContact CG1-CG1 3.85Å; V189-V269 HydrophobicContact CG2-CG1 4.47Å
190	I	98.9	Very high	97.7	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	118.1	171.7	-54.3	-177.1	0	0	0	108.7	L136 T175 L179 M182 N192 I232 I233 Q234	L136-I190 HydrophobicContact CB-CG1 4.32Å; L136-I190 HydrophobicContact CB-CG2 4.42Å; L136-I190 HydrophobicContact CD2-CG2 4.15Å; L136-I190 HydrophobicContact CG-CG2 4.36Å; L136-I190 CarbonylContact O-C 3.55Å; L136-I190 WeakPolarHBondContact O-CA 3.46Å; T175-I190 HydrophobicContact CG2-CD1 3.88Å; L179-I190 HydrophobicContact CB-CD1 4.4Å; L179-I190 HydrophobicContact CD1-CD1 4.13Å; M182-I190 HydrophobicContact CE-CG1 4.41Å; M182-I190 HydrophobicContact SD-CD1 4.17Å; M182-I190 HydrophobicContact SD-CG1 3.87Å; I190-N192 WeakPolarHBondContact CG2-OD1 3.32Å; I190-I232 PolarHBondContact N-O 3.28Å; I190-I233 HydrophobicContact CB-CG1 4.19Å; I190-I233 HydrophobicContact CB-CG2 4.31Å; I190-I233 HydrophobicContact CD1-CD1 4.43Å; I190-I233 HydrophobicContact CD1-CG1 4.49Å; I190-I233 CarbonylContact O-C 3.4Å; I190-I233 WeakPolarHBondContact O-CA 3.5Å; I190-Q234 PolarHBondContact O-N 2.65Å
191	L	98.9	Very high	97.6	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	113.5	175.8	-53.2	-177	0	0	0	108.7	Y72 L136 V137 N138 V189 Q234 L266 V269	Y72-L191 HydrophobicContact CD1-CD1 4.47Å; Y72-L191 HydrophobicContact CE1-CD1 3.79Å; L136-L191 PolarHBondContact O-N 3.35Å; V137-L191 CarbonylContact C-O 3.44Å; V137-L191 WeakPolarHBondContact CA-O 3.48Å; V137-L191 HydrophobicContact CG1-CB 4.47Å; V137-L191 HydrophobicContact CG2-CB 4.41Å; V137-L191 HydrophobicContact CG2-CD1 4.24Å; N138-L191 PolarHBondContact N-O 3.49Å; V189-L191 HydrophobicContact CG1-CD2 3.62Å; V189-L191 HydrophobicContact CG1-CG 4.02Å; L191-Q234 HydrophobicContact CD2-CB 3.84Å; L191-L266 HydrophobicContact CD1-CD2 3.7Å; L191-V269 HydrophobicContact CD1-CG2 4.32Å; L191-V269 HydrophobicContact CD2-CG1 4.36Å; L191-V269 HydrophobicContact CD2-CG2 3.89Å
192	N	98.9	Very high	97.5	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	112	-179.1	-72	-22.4	0	0	0	109.9	N138 V171 I190 S194 V215 S219 Q234 V236	N138-N192 WeakPolarHBondContact CB-OD1 3.37Å; N138-N192 PolarHBondContact ND2-OD1 2.9Å; V171-N192 HydrophobicContact CG1-CB 4.4Å; I190-N192 WeakPolarHBondContact CG2-OD1 3.32Å; N192-S194 PolarHBondContact O-N 3.48Å; N192-S194 VanDerWaalsContact O-N 3.14Å; N192-V215 HydrophobicContact CB-CG1 3.92Å; N192-S219 WeakPolarHBondContact CB-OG 3.34Å; N192-S219 PolarHBondContact ND2-OG 2.9Å; N192-Q234 PolarHBondContact N-O 3.32Å; N192-V236 PolarHBondContact O-N 2.94Å
193	I	98.6	Very high	97.5	Very high	9 Å²	9	30.2 Å²	30.2	5%	0.046	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	99.8	-175.7	-48.2	-51.3	0	0	0	109.8	Y72 V137 N138 N139 K212 V236 P238	Y72-I193 HydrophobicContact CE2-CD1 3.64Å; Y72-I193 HydrophobicContact CE2-CG1 4.24Å; Y72-I193 WeakPolarHBondContact OH-CD1 3.3Å; V137-I193 HydrophobicContact CG1-CD1 4.36Å; V137-I193 HydrophobicContact CG1-CG1 4.28Å; N138-I193 PolarHBondContact O-N 3.43Å; N139-I193 HydrophobicContact CB-CB 4.44Å; N139-I193 HydrophobicContact CB-CG1 3.75Å; I193-K212 PolarHBondContact O-NZ 3.42Å; I193-V236 HydrophobicContact CD1-CB 3.79Å; I193-V236 HydrophobicContact CD1-CG1 4.21Å; I193-V236 HydrophobicContact CD1-CG2 3.87Å; I193-P238 HydrophobicContact CG2-CG 4.06Å
194	S	98.4	Very high	97.4	Very high	4 Å²	4	29.1 Å²	29.1	3%	0.028	17%	0.173	C	C	.	.			trans	-83.7	-136.7	169.6	-178.5	0	0	0	0	110.4	N192 K212 V236	N192-S194 PolarHBondContact O-N 3.48Å; N192-S194 VanDerWaalsContact O-N 3.14Å; S194-K212 PolarHBondContact OG-O 2.58Å; S194-V236 CarbonylContact C-O 3.53Å; S194-V236 VanDerWaalsContact CA-O 3.27Å; S194-V236 WeakPolarHBondContact CA-O 3.42Å; S194-V236 WeakPolarHBondContact CB-O 3.5Å; S194-V236 PolarHBondContact N-O 2.87Å
195	S	97.9	Very high	97.4	Very high	13 Å²	13	26 Å²	26	9%	0.091	15%	0.145	C	C	.	.			trans	-166.9	154.5	177.1	179.5	0	0	0	0	109.2	S197 G198	S195-S197 PolarHBondContact O-N 3.5Å; S195-S197 VanDerWaalsContact O-N 3.14Å; S195-S197 PolarHBondContact OG-N 3.08Å; S195-S197 VanDerWaalsContact OG-N 3.07Å; S195-S197 PolarHBondContact OG-OG 3.3Å; S195-G198 WeakPolarHBondContact O-CA 3.3Å; S195-G198 PolarHBondContact O-N 3.4Å
196	A	96.8	Very high	97.3	Very high	4 Å²	4	26.4 Å²	26.4	3%	0.033	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-55.3	-25.8	164.2	0	0	0	0	0	112.8	G198 M199 P238 F239	A196-G198 PolarHBondContact O-N 3.49Å; A196-M199 HydrophobicContact CB-SD 4.09Å; A196-M199 WeakPolarHBondContact O-CB 3.27Å; A196-M199 PolarHBondContact O-N 2.94Å; A196-P238 WeakPolarHBondContact CB-O 3.08Å; A196-P238 PolarHBondContact N-O 3.27Å; A196-F239 HydrophobicContact CB-CB 4.4Å; A196-F239 HydrophobicContact CB-CD1 3.55Å; A196-F239 HydrophobicContact CB-CD2 3.63Å; A196-F239 HydrophobicContact CB-CE1 3.58Å; A196-F239 HydrophobicContact CB-CE2 3.67Å; A196-F239 HydrophobicContact CB-CG 3.59Å; A196-F239 HydrophobicContact CB-CZ 3.64Å
197	S	95.9	Very high	97.3	Very high	26 Å²	26	23.8 Å²	23.8	18%	0.182	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-66.1	-11.9	171.9	-57.3	0	0	0	0	113.8	S195 Y200 S209	S195-S197 PolarHBondContact O-N 3.5Å; S195-S197 VanDerWaalsContact O-N 3.14Å; S195-S197 PolarHBondContact OG-N 3.08Å; S195-S197 VanDerWaalsContact OG-N 3.07Å; S195-S197 PolarHBondContact OG-OG 3.3Å; S197-Y200 VanDerWaalsContact O-O 3.07Å; S197-S209 WeakPolarHBondContact O-CA 3.35Å; S197-S209 WeakPolarHBondContact O-CB 3.44Å
198	G	96.2	Very high	97.4	Very high	8 Å²	8	21.6 Å²	21.6	8%	0.082	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-87	-8.6	172.2	0	0	0	0	0	113.7	S195 A196	S195-G198 WeakPolarHBondContact O-CA 3.3Å; S195-G198 PolarHBondContact O-N 3.4Å; A196-G198 PolarHBondContact O-N 3.49Å
199	M	96	Very high	97.4	Very high	52 Å²	52	21.9 Å²	21.9	26%	0.256	13%	0.127	S	C	.	.	S	Bend	trans	-80.7	-20.2	-178.1	-61.4	170.8	62.3	0	0	112.7	A196 L237 F239 N276 T289	A196-M199 HydrophobicContact CB-SD 4.09Å; A196-M199 WeakPolarHBondContact O-CB 3.27Å; A196-M199 PolarHBondContact O-N 2.94Å; M199-L237 HydrophobicContact CG-CD2 3.39Å; M199-L237 HydrophobicContact SD-CB 4.33Å; M199-L237 HydrophobicContact SD-CD2 4.11Å; M199-F239 HydrophobicContact SD-CE2 4.49Å; M199-N276 PolarHBondContact SD-ND2 3.38Å; M199-T289 HydrophobicContact CB-CG2 4.32Å; M199-T289 HydrophobicContact CE-CG2 3.36Å
200	Y	94.3	Very high	97.4	Very high	51 Å²	51	24.5 Å²	24.5	20%	0.2	15%	0.149	C	C	.	.	S	Bend	trans	-162	160	-179.1	39.2	-99.2	0	0	0	110.4	S197 V202 V297	S197-Y200 VanDerWaalsContact O-O 3.07Å; Y200-V202 HydrophobicContact CD2-CG2 4.13Å; Y200-V202 HydrophobicContact CE2-CG2 4.21Å; Y200-V202 WeakPolarHBondContact O-CG2 3.36Å; Y200-V202 PolarHBondContact O-N 3.02Å; Y200-V297 HydrophobicContact CD1-CG1 4.14Å; Y200-V297 HydrophobicContact CD2-CG1 3.87Å; Y200-V297 HydrophobicContact CE1-CG1 3.98Å; Y200-V297 HydrophobicContact CE2-CG1 3.69Å; Y200-V297 HydrophobicContact CG-CG1 4.09Å
201	P	95.6	Very high	97.3	Very high	83 Å²	83	24.6 Å²	24.6	54%	0.539	15%	0.149	S	C	.	.			trans	-58.1	134.5	174.9	-24.7	34.5	0	0	0	112.5	I298	P201-I298 HydrophobicContact CB-CD1 4.35Å; P201-I298 HydrophobicContact CB-CG1 4.5Å; P201-I298 HydrophobicContact CG-CD1 4.21Å
202	V	96.5	Very high	97.3	Very high	14 Å²	14	25 Å²	25	9%	0.085	15%	0.151	C	C	.	.			trans	-119.7	95.9	178.5	-173.1	0	0	0	0	110.1	Y200 L205 T206 N305	Y200-V202 HydrophobicContact CD2-CG2 4.13Å; Y200-V202 HydrophobicContact CE2-CG2 4.21Å; Y200-V202 WeakPolarHBondContact O-CG2 3.36Å; Y200-V202 PolarHBondContact O-N 3.02Å; V202-L205 HydrophobicContact CB-CB 4.39Å; V202-L205 HydrophobicContact CG1-CB 4.07Å; V202-L205 HydrophobicContact CG1-CD1 4.02Å; V202-L205 HydrophobicContact CG1-CG 4.39Å; V202-L205 CarbonylContact O-C 3.56Å; V202-L205 PolarHBondContact O-N 2.93Å; V202-T206 PolarHBondContact O-N 3.44Å; V202-N305 VanDerWaalsContact CG1-ND2 3.34Å; V202-N305 WeakPolarHBondContact CG1-ND2 3.49Å
203	P	97.4	Very high	97.3	Very high	35 Å²	35	26.1 Å²	26.1	23%	0.227	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	143.1	-179.8	-28.7	38.4	0	0	0	112.4	L205 I298 A302 N305	P203-L205 PolarHBondContact O-N 2.86Å; P203-I298 HydrophobicContact CG-CG2 3.77Å; P203-A302 HydrophobicContact CB-CB 3.86Å; P203-A302 HydrophobicContact CG-CB 3.93Å; P203-N305 PolarHBondContact O-ND2 2.95Å
204	L	97.7	Very high	97.3	Very high	10 Å²	10	29.1 Å²	29.1	5%	0.052	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	70	-0.2	-172	-68.7	66.9	0	0	0	115.3	P147 E148 Y149 N305 R306 R309	P147-L204 HydrophobicContact CB-CB 3.76Å; P147-L204 HydrophobicContact CB-CD2 4.13Å; E148-L204 PolarHBondContact N-O 3.32Å; E148-L204 VanDerWaalsContact N-O 3.07Å; E148-L204 CarbonylContact O-C 3.5Å; E148-L204 VanDerWaalsContact O-CA 3.26Å; E148-L204 WeakPolarHBondContact O-CA 3.36Å; E148-L204 VanDerWaalsContact O-O 3.13Å; Y149-L204 HydrophobicContact CD1-CD1 4.34Å; Y149-L204 HydrophobicContact CE1-CD1 4.02Å; L204-N305 HydrophobicContact CB-CB 4.08Å; L204-N305 HydrophobicContact CD2-CB 4.21Å; L204-R306 HydrophobicContact CD1-CG 4.33Å; L204-R306 HydrophobicContact CD2-CG 4.01Å; L204-R309 HydrophobicContact CD2-CB 4.29Å
205	L	97.4	Very high	97.3	Very high	22 Å²	22	28.9 Å²	28.9	12%	0.115	17%	0.172	C	C	.	.			trans	-131.2	26.2	171.5	-61.5	176.7	0	0	0	111	Y144 P147 V202 P203 V207 Y208 S209	Y144-L205 HydrophobicContact CD1-CD2 4.22Å; Y144-L205 HydrophobicContact CD2-CB 4.28Å; Y144-L205 HydrophobicContact CD2-CD2 3.46Å; Y144-L205 VanDerWaalsContact CD2-CD2 3.46Å; Y144-L205 HydrophobicContact CD2-CG 4.48Å; Y144-L205 HydrophobicContact CE2-CB 4.26Å; Y144-L205 HydrophobicContact CE2-CD2 4.2Å; Y144-L205 HydrophobicContact CG-CD2 3.49Å; Y144-L205 VanDerWaalsContact CG-CD2 3.49Å; P147-L205 HydrophobicContact CB-CD2 4.26Å; P147-L205 HydrophobicContact CG-CD2 4.33Å; V202-L205 HydrophobicContact CB-CB 4.39Å; V202-L205 HydrophobicContact CG1-CB 4.07Å; V202-L205 HydrophobicContact CG1-CD1 4.02Å; V202-L205 HydrophobicContact CG1-CG 4.39Å; V202-L205 CarbonylContact O-C 3.56Å; V202-L205 PolarHBondContact O-N 2.93Å; P203-L205 PolarHBondContact O-N 2.86Å; L205-V207 PolarHBondContact O-N 3.06Å; L205-Y208 WeakPolarHBondContact O-CB 3.4Å; L205-Y208 PolarHBondContact O-N 3.37Å; L205-Y208 VanDerWaalsContact O-N 3.11Å; L205-S209 PolarHBondContact O-N 3.03Å; L205-S209 PolarHBondContact O-OG 3.29Å
206	T	97	Very high	97.4	Very high	73 Å²	73	28.6 Å²	28.6	45%	0.448	17%	0.169	S	C	.	.	H	α-helix	trans	-54.6	-48.9	-163.8	-52.5	0	0	0	0	113.5	V202 Y208 S209 A210	V202-T206 PolarHBondContact O-N 3.44Å; T206-Y208 VanDerWaalsContact C-N 3.33Å; T206-Y208 PolarHBondContact O-N 3.49Å; T206-S209 WeakPolarHBondContact CA-OG 3.32Å; T206-S209 PolarHBondContact O-N 3.42Å; T206-S209 PolarHBondContact O-OG 3.41Å; T206-A210 WeakPolarHBondContact O-CB 3.43Å; T206-A210 PolarHBondContact O-N 2.91Å
207	V	97.8	Very high	97.5	Very high	19 Å²	19	34.7 Å²	34.7	12%	0.115	20%	0.195	C	C	.	.	H	α-helix	trans	-62.8	-44.7	-178.1	-179	0	0	0	0	109.9	Y144 Y150 F159 T163 L205 A210 T211	Y144-V207 WeakPolarHBondContact OH-CB 3.35Å; Y144-V207 WeakPolarHBondContact OH-CG2 3.33Å; Y144-V207 PolarHBondContact OH-N 2.87Å; Y150-V207 HydrophobicContact CD2-CG2 4.17Å; Y150-V207 HydrophobicContact CE2-CG2 3.85Å; F159-V207 HydrophobicContact CE1-CB 4.04Å; F159-V207 HydrophobicContact CE1-CG1 4.33Å; F159-V207 HydrophobicContact CE1-CG2 4.21Å; T163-V207 HydrophobicContact CG2-CG1 3.94Å; L205-V207 PolarHBondContact O-N 3.06Å; V207-A210 PolarHBondContact O-N 3.05Å; V207-T211 HydrophobicContact CG1-CG2 4.4Å; V207-T211 WeakPolarHBondContact O-CG2 3.36Å; V207-T211 PolarHBondContact O-N 3.16Å
208	Y	98	Very high	97.6	Very high	27 Å²	27	35.7 Å²	35.7	11%	0.106	20%	0.196	C	C	.	.	H	α-helix	trans	-61	-49.6	176.7	175.5	-100.8	0	0	0	111.4	V142 S143 L205 T206 A210 T211 K212	V142-Y208 VanDerWaalsContact O-CD2 3.22Å; V142-Y208 WeakPolarHBondContact O-CD2 3.19Å; V142-Y208 WeakPolarHBondContact O-CE2 3.42Å; S143-Y208 WeakPolarHBondContact OG-CD2 3.46Å; L205-Y208 WeakPolarHBondContact O-CB 3.4Å; L205-Y208 PolarHBondContact O-N 3.37Å; L205-Y208 VanDerWaalsContact O-N 3.11Å; T206-Y208 VanDerWaalsContact C-N 3.33Å; T206-Y208 PolarHBondContact O-N 3.49Å; Y208-A210 VanDerWaalsContact C-N 3.29Å; Y208-A210 PolarHBondContact O-N 3.35Å; Y208-T211 PolarHBondContact O-N 2.6Å; Y208-T211 PolarHBondContact O-OG1 3.18Å; Y208-K212 HydrophobicContact CD2-CG 4.34Å; Y208-K212 HydrophobicContact CE1-CG 4.09Å; Y208-K212 HydrophobicContact CE2-CD 4.35Å; Y208-K212 HydrophobicContact CE2-CG 3.91Å; Y208-K212 PolarHBondContact O-N 3.38Å
209	S	97.9	Very high	97.7	Very high	8 Å²	8	35.3 Å²	35.3	6%	0.056	19%	0.193	C	C	.	.	H	α-helix	trans	-57.9	-41.9	177.8	57	0	0	0	0	112.3	S197 L205 T206 K212 A213	S197-S209 WeakPolarHBondContact O-CA 3.35Å; S197-S209 WeakPolarHBondContact O-CB 3.44Å; L205-S209 PolarHBondContact O-N 3.03Å; L205-S209 PolarHBondContact O-OG 3.29Å; T206-S209 WeakPolarHBondContact CA-OG 3.32Å; T206-S209 PolarHBondContact O-N 3.42Å; T206-S209 PolarHBondContact O-OG 3.41Å; S209-K212 PolarHBondContact O-N 3.26Å; S209-A213 PolarHBondContact O-N 3.33Å
210	A	98.4	Very high	97.8	Very high	56 Å²	56	35.9 Å²	35.9	46%	0.463	19%	0.192	S	C	.	.	H	α-helix	trans	-65	-43.6	177.7	0	0	0	0	0	111.8	T206 V207 Y208 K212 A213 F214	T206-A210 WeakPolarHBondContact O-CB 3.43Å; T206-A210 PolarHBondContact O-N 2.91Å; V207-A210 PolarHBondContact O-N 3.05Å; Y208-A210 VanDerWaalsContact C-N 3.29Å; Y208-A210 PolarHBondContact O-N 3.35Å; A210-K212 VanDerWaalsContact C-N 3.29Å; A210-K212 PolarHBondContact O-N 2.75Å; A210-A213 PolarHBondContact O-N 3.26Å; A210-F214 PolarHBondContact O-N 3.29Å
211	T	98.6	Very high	98	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.012	20%	0.197	C	C	.	.	H	α-helix	trans	-62.5	-36.2	176.9	66.9	0	0	0	0	112.4	T163 N167 M168 V207 Y208 F214 V215	T163-T211 HydrophobicContact CG2-CG2 4Å; N167-T211 HydrophobicContact CB-CG2 4.21Å; N167-T211 PolarHBondContact ND2-OG1 3.07Å; M168-T211 HydrophobicContact CG-CG2 3.92Å; M168-T211 HydrophobicContact SD-CG2 3.63Å; V207-T211 HydrophobicContact CG1-CG2 4.4Å; V207-T211 WeakPolarHBondContact O-CG2 3.36Å; V207-T211 PolarHBondContact O-N 3.16Å; Y208-T211 PolarHBondContact O-N 2.6Å; Y208-T211 PolarHBondContact O-OG1 3.18Å; T211-F214 WeakPolarHBondContact O-CB 3.45Å; T211-F214 PolarHBondContact O-N 3.28Å; T211-V215 WeakPolarHBondContact O-CG2 3.5Å; T211-V215 PolarHBondContact O-N 2.65Å; T211-V215 VanDerWaalsContact O-N 3.1Å
212	K	98.4	Very high	98.2	Very high	8 Å²	8	31.9 Å²	31.9	4%	0.035	18%	0.176	C	C	.	.	H	α-helix	trans	-76.3	-34.6	178.4	-65.7	-54.8	-165.2	176	0	112.2	I193 S194 Y208 S209 A210 F214 V215 D216	I193-K212 PolarHBondContact O-NZ 3.42Å; S194-K212 PolarHBondContact OG-O 2.58Å; Y208-K212 HydrophobicContact CD2-CG 4.34Å; Y208-K212 HydrophobicContact CE1-CG 4.09Å; Y208-K212 HydrophobicContact CE2-CD 4.35Å; Y208-K212 HydrophobicContact CE2-CG 3.91Å; Y208-K212 PolarHBondContact O-N 3.38Å; S209-K212 PolarHBondContact O-N 3.26Å; A210-K212 VanDerWaalsContact C-N 3.29Å; A210-K212 PolarHBondContact O-N 2.75Å; K212-F214 VanDerWaalsContact C-N 3.32Å; K212-F214 PolarHBondContact O-N 3.34Å; K212-V215 PolarHBondContact O-N 2.98Å; K212-D216 PolarHBondContact O-N 3.28Å; K212-D216 VanDerWaalsContact O-N 3.07Å
213	A	98.6	Very high	98.3	Very high	24 Å²	24	32.6 Å²	32.6	20%	0.198	18%	0.179	C	C	.	.	H	α-helix	trans	-59.5	-44.2	168	0	0	0	0	0	111.2	S209 A210 V215 D216 F217	S209-A213 PolarHBondContact O-N 3.33Å; A210-A213 PolarHBondContact O-N 3.26Å; A213-V215 PolarHBondContact O-N 2.95Å; A213-D216 WeakPolarHBondContact O-CB 3.21Å; A213-D216 PolarHBondContact O-N 3.06Å; A213-D216 VanDerWaalsContact O-N 3.16Å; A213-F217 VanDerWaalsContact O-CD2 3.24Å; A213-F217 WeakPolarHBondContact O-CD2 3.23Å; A213-F217 PolarHBondContact O-N 3.49Å
214	F	98.8	Very high	98.3	Very high	72 Å²	72	35.2 Å²	35.2	32%	0.316	19%	0.188	S	C	.	.	H	α-helix	trans	-55.5	-49.8	174.2	172.4	-89	0	0	0	112.1	M168 A210 T211 K212 D216 F217 F218	M168-F214 HydrophobicContact CB-CD1 3.79Å; M168-F214 HydrophobicContact CB-CE1 3.87Å; M168-F214 HydrophobicContact CE-CB 4.1Å; M168-F214 HydrophobicContact CE-CD1 3.91Å; M168-F214 HydrophobicContact CE-CD2 3.62Å; M168-F214 HydrophobicContact CE-CE1 4.23Å; M168-F214 HydrophobicContact CE-CE2 3.95Å; M168-F214 HydrophobicContact CE-CG 3.59Å; M168-F214 HydrophobicContact CE-CZ 4.25Å; M168-F214 HydrophobicContact CG-CB 4.23Å; M168-F214 HydrophobicContact CG-CD1 3.62Å; M168-F214 HydrophobicContact CG-CE1 4.23Å; M168-F214 HydrophobicContact CG-CG 4.03Å; M168-F214 HydrophobicContact SD-CB 4.25Å; M168-F214 HydrophobicContact SD-CD1 4.4Å; M168-F214 HydrophobicContact SD-CG 4.24Å; A210-F214 PolarHBondContact O-N 3.29Å; T211-F214 WeakPolarHBondContact O-CB 3.45Å; T211-F214 PolarHBondContact O-N 3.28Å; K212-F214 VanDerWaalsContact C-N 3.32Å; K212-F214 PolarHBondContact O-N 3.34Å; F214-D216 PolarHBondContact O-N 3.45Å; F214-F217 PolarHBondContact O-N 2.85Å; F214-F218 HydrophobicContact CE1-CB 4.23Å; F214-F218 HydrophobicContact CE1-CG 4.43Å; F214-F218 HydrophobicContact CZ-CB 4.45Å; F214-F218 HydrophobicContact CZ-CD2 4.4Å; F214-F218 WeakPolarHBondContact O-CB 3.36Å; F214-F218 PolarHBondContact O-N 2.84Å
215	V	98.8	Very high	98.3	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-58.1	-39.1	178.7	174.5	0	0	0	0	111.4	N167 V171 N192 T211 K212 A213 S219	N167-V215 WeakPolarHBondContact O-CG2 3.41Å; V171-V215 HydrophobicContact CG2-CG2 3.98Å; N192-V215 HydrophobicContact CB-CG1 3.92Å; T211-V215 WeakPolarHBondContact O-CG2 3.5Å; T211-V215 PolarHBondContact O-N 2.65Å; T211-V215 VanDerWaalsContact O-N 3.1Å; K212-V215 PolarHBondContact O-N 2.98Å; A213-V215 PolarHBondContact O-N 2.95Å; V215-S219 VanDerWaalsContact O-CB 3.3Å; V215-S219 WeakPolarHBondContact O-CB 3.36Å; V215-S219 PolarHBondContact O-N 3.14Å; V215-S219 PolarHBondContact O-OG 3.36Å
216	D	98.7	Very high	98.4	Very high	6 Å²	6	42 Å²	42	3%	0.032	22%	0.217	C	C	.	.	H	α-helix	trans	-64.6	-51.7	176.6	173.8	56.2	0	0	0	112.7	K212 A213 F214 F218 S219 R220 S235 L237 Q274	K212-D216 PolarHBondContact O-N 3.28Å; K212-D216 VanDerWaalsContact O-N 3.07Å; A213-D216 WeakPolarHBondContact O-CB 3.21Å; A213-D216 PolarHBondContact O-N 3.06Å; A213-D216 VanDerWaalsContact O-N 3.16Å; F214-D216 PolarHBondContact O-N 3.45Å; D216-F218 PolarHBondContact O-N 3.45Å; D216-S219 PolarHBondContact O-N 2.83Å; D216-R220 WeakPolarHBondContact O-CG 3.38Å; D216-R220 PolarHBondContact O-N 2.82Å; D216-R220 IonicContact OD1-NE 3.48Å; D216-R220 PolarHBondContact OD1-NE 3.49Å; D216-R220 VanDerWaalsContact OD1-NE 3.09Å; D216-R220 IonicContact OD2-CZ 2.71Å; D216-R220 IonicContact OD2-NE 2.86Å; D216-R220 PolarHBondContact OD2-NE 2.9Å; D216-R220 VanDerWaalsContact OD2-NE 3.08Å; D216-R220 IonicContact OD2-NH2 3.83Å; D216-R220 PolarHBondContact OD2-NH2 3.03Å; D216-S235 WeakPolarHBondContact CA-OG 3.31Å; D216-S235 WeakPolarHBondContact OD1-CB 3.42Å; D216-S235 PolarHBondContact OD1-OG 3.41Å; D216-L237 HydrophobicContact CB-CD2 4.36Å; D216-Q274 PolarHBondContact OD1-NE2 3.45Å; D216-Q274 PolarHBondContact OD2-NE2 3.27Å
217	F	98.6	Very high	98.4	Very high	132 Å²	132	44 Å²	44	58%	0.579	22%	0.216	S	C	*	.	H	α-helix	trans	-61.8	-44.9	177.8	-78.8	-73.6	0	0	0	112.4	A213 F214 S219 R220 G221	A213-F217 VanDerWaalsContact O-CD2 3.24Å; A213-F217 WeakPolarHBondContact O-CD2 3.23Å; A213-F217 PolarHBondContact O-N 3.49Å; F214-F217 PolarHBondContact O-N 2.85Å; F217-S219 VanDerWaalsContact C-N 3.33Å; F217-S219 PolarHBondContact O-N 2.78Å; F217-R220 PolarHBondContact O-N 2.94Å; F217-G221 PolarHBondContact O-N 3.03Å
218	F	98.8	Very high	98.4	Very high	47 Å²	47	53.9 Å²	53.9	21%	0.206	25%	0.251	C	S	.	.	H	α-helix	trans	-56	-47.9	176.7	175.7	-101.3	0	0	0	111.5	V171 C172 T175 F214 D216 G221 L222	V171-F218 HydrophobicContact CG1-CD1 3.91Å; V171-F218 HydrophobicContact CG1-CE1 3.85Å; C172-F218 HydrophobicContact CB-CZ 4.33Å; T175-F218 HydrophobicContact CG2-CE1 4.47Å; T175-F218 HydrophobicContact CG2-CZ 4.38Å; F214-F218 HydrophobicContact CE1-CB 4.23Å; F214-F218 HydrophobicContact CE1-CG 4.43Å; F214-F218 HydrophobicContact CZ-CB 4.45Å; F214-F218 HydrophobicContact CZ-CD2 4.4Å; F214-F218 WeakPolarHBondContact O-CB 3.36Å; F214-F218 PolarHBondContact O-N 2.84Å; D216-F218 PolarHBondContact O-N 3.45Å; F218-G221 PolarHBondContact O-N 3.05Å; F218-L222 HydrophobicContact CD1-CD1 4.14Å; F218-L222 HydrophobicContact CD2-CD1 4.44Å; F218-L222 HydrophobicContact CE1-CD1 3.45Å; F218-L222 VanDerWaalsContact CE1-CD1 3.45Å; F218-L222 HydrophobicContact CE1-CG 4.39Å; F218-L222 HydrophobicContact CE2-CD1 3.8Å; F218-L222 HydrophobicContact CE2-CG 4.2Å; F218-L222 HydrophobicContact CZ-CD1 3.27Å; F218-L222 HydrophobicContact CZ-CG 4.15Å; F218-L222 WeakPolarHBondContact O-CG 3.49Å; F218-L222 PolarHBondContact O-N 2.93Å
219	S	98.8	Very high	98.4	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.007	26%	0.264	C	S	.	.	H	α-helix	trans	-65.2	-43.5	-178.4	-55.6	0	0	0	0	112.5	N192 V215 D216 F217 H223	N192-S219 WeakPolarHBondContact CB-OG 3.34Å; N192-S219 PolarHBondContact ND2-OG 2.9Å; V215-S219 VanDerWaalsContact O-CB 3.3Å; V215-S219 WeakPolarHBondContact O-CB 3.36Å; V215-S219 PolarHBondContact O-N 3.14Å; V215-S219 PolarHBondContact O-OG 3.36Å; D216-S219 PolarHBondContact O-N 2.83Å; F217-S219 VanDerWaalsContact C-N 3.33Å; F217-S219 PolarHBondContact O-N 2.78Å; S219-H223 WeakPolarHBondContact O-CB 3.45Å; S219-H223 PolarHBondContact O-N 3.5Å
220	R	98.5	Very high	98.3	Very high	64 Å²	64	57.9 Å²	57.9	24%	0.242	28%	0.281	C	S	.	.	H	α-helix	trans	-69.3	-37.5	179.6	-71.7	-174.1	-72.6	103.9	-4.7	112.2	D216 F217 H223 E224	D216-R220 WeakPolarHBondContact O-CG 3.38Å; D216-R220 PolarHBondContact O-N 2.82Å; D216-R220 IonicContact OD1-NE 3.48Å; D216-R220 PolarHBondContact OD1-NE 3.49Å; D216-R220 VanDerWaalsContact OD1-NE 3.09Å; D216-R220 IonicContact OD2-CZ 2.71Å; D216-R220 IonicContact OD2-NE 2.86Å; D216-R220 PolarHBondContact OD2-NE 2.9Å; D216-R220 VanDerWaalsContact OD2-NE 3.08Å; D216-R220 IonicContact OD2-NH2 3.83Å; D216-R220 PolarHBondContact OD2-NH2 3.03Å; F217-R220 PolarHBondContact O-N 2.94Å; R220-H223 PolarHBondContact O-N 3.07Å; R220-E224 PolarHBondContact O-N 3.34Å
221	G	98.6	Very high	98.3	Very high	30 Å²	30	55.2 Å²	55.2	31%	0.309	26%	0.259	S	S	.	.	H	α-helix	trans	-59.7	-55.8	173.3	0	0	0	0	0	111.1	F217 F218 H223 E224 E225	F217-G221 PolarHBondContact O-N 3.03Å; F218-G221 PolarHBondContact O-N 3.05Å; G221-H223 VanDerWaalsContact C-N 3.28Å; G221-H223 PolarHBondContact O-N 3.48Å; G221-E224 PolarHBondContact O-N 2.87Å; G221-E224 VanDerWaalsContact O-N 3.08Å; G221-E225 WeakPolarHBondContact O-CG 3.34Å; G221-E225 PolarHBondContact O-N 3.2Å; G221-E225 VanDerWaalsContact O-N 3.14Å
222	L	98.4	Very high	98.3	Very high	19 Å²	19	56.9 Å²	56.9	10%	0.099	27%	0.267	C	S	.	.	H	α-helix	trans	-61.1	-35.5	179	-69.8	-171.7	0	0	0	113	T175 F218 E224 E225 Y226 I233	T175-L222 HydrophobicContact CG2-CD1 3.7Å; F218-L222 HydrophobicContact CD1-CD1 4.14Å; F218-L222 HydrophobicContact CD2-CD1 4.44Å; F218-L222 HydrophobicContact CE1-CD1 3.45Å; F218-L222 VanDerWaalsContact CE1-CD1 3.45Å; F218-L222 HydrophobicContact CE1-CG 4.39Å; F218-L222 HydrophobicContact CE2-CD1 3.8Å; F218-L222 HydrophobicContact CE2-CG 4.2Å; F218-L222 HydrophobicContact CZ-CD1 3.27Å; F218-L222 HydrophobicContact CZ-CG 4.15Å; F218-L222 WeakPolarHBondContact O-CG 3.49Å; F218-L222 PolarHBondContact O-N 2.93Å; L222-E224 VanDerWaalsContact C-N 3.3Å; L222-E224 PolarHBondContact O-N 3.49Å; L222-E225 WeakPolarHBondContact CD2-OE2 3.39Å; L222-E225 PolarHBondContact O-N 2.77Å; L222-Y226 HydrophobicContact CB-CD2 4.5Å; L222-Y226 HydrophobicContact CD2-CD2 4.37Å; L222-Y226 HydrophobicContact CD2-CE2 3.95Å; L222-Y226 WeakPolarHBondContact O-CD2 3.47Å; L222-Y226 PolarHBondContact O-N 3.49Å; L222-I233 HydrophobicContact CB-CD1 3.58Å; L222-I233 HydrophobicContact CD1-CD1 4.41Å
223	H	98.5	Very high	98.3	Very high	29 Å²	29	56.5 Å²	56.5	13%	0.134	27%	0.265	C	S	.	.	H	α-helix	trans	-58	-45.2	175.5	-177.9	55.4	0	0	0	111.6	S219 R220 G221 E225 Y226 R227 I233 N273	S219-H223 WeakPolarHBondContact O-CB 3.45Å; S219-H223 PolarHBondContact O-N 3.5Å; R220-H223 PolarHBondContact O-N 3.07Å; G221-H223 VanDerWaalsContact C-N 3.28Å; G221-H223 PolarHBondContact O-N 3.48Å; H223-E225 VanDerWaalsContact C-N 3.34Å; H223-E225 PolarHBondContact O-N 2.78Å; H223-Y226 PolarHBondContact O-N 3.39Å; H223-R227 WeakPolarHBondContact O-CA 3.31Å; H223-R227 WeakPolarHBondContact O-CB 3.49Å; H223-R227 WeakPolarHBondContact O-CG 3.33Å; H223-R227 PolarHBondContact O-N 3.46Å; H223-I233 HydrophobicContact CB-CB 4.05Å; H223-I233 WeakPolarHBondContact CB-O 3.46Å; H223-I233 PolarHBondContact ND1-N 3.44Å; H223-I233 PolarHBondContact ND1-O 2.82Å; H223-N273 VanDerWaalsContact CD2-CB 3.5Å; H223-N273 WeakPolarHBondContact CD2-CB 3.2Å
224	E	98.3	Very high	98.3	Very high	90 Å²	90	55.3 Å²	55.3	42%	0.421	26%	0.256	S	S	.	.	H	α-helix	trans	-67.1	-35	178.4	-72.8	-60.2	142.5	0	0	112.6	R220 G221 L222 R227	R220-E224 PolarHBondContact O-N 3.34Å; G221-E224 PolarHBondContact O-N 2.87Å; G221-E224 VanDerWaalsContact O-N 3.08Å; L222-E224 VanDerWaalsContact C-N 3.3Å; L222-E224 PolarHBondContact O-N 3.49Å; E224-R227 IonicContact OE1-CZ 2.97Å; E224-R227 IonicContact OE1-NE 2.6Å; E224-R227 IonicContact OE1-NH1 2.89Å; E224-R227 PolarHBondContact OE1-NH1 3.21Å; E224-R227 VanDerWaalsContact OE1-NH1 3.17Å; E224-R227 IonicContact OE2-CZ 2.77Å; E224-R227 IonicContact OE2-NE 2.9Å; E224-R227 PolarHBondContact OE2-NE 2.9Å; E224-R227 IonicContact OE2-NH1 3.34Å; E224-R227 PolarHBondContact OE2-NH1 2.76Å; E224-R227 IonicContact OE2-NH2 3.76Å; E224-R227 PolarHBondContact OE2-NH2 2.91Å
225	E	98.4	Very high	98.3	Very high	115 Å²	115	51.9 Å²	51.9	54%	0.537	24%	0.241	S	C	.	.	H	α-helix	trans	-65	-39.4	176.2	-68.1	169.9	-151.8	0	0	112.7	G221 L222 H223	G221-E225 WeakPolarHBondContact O-CG 3.34Å; G221-E225 PolarHBondContact O-N 3.2Å; G221-E225 VanDerWaalsContact O-N 3.14Å; L222-E225 WeakPolarHBondContact CD2-OE2 3.39Å; L222-E225 PolarHBondContact O-N 2.77Å; H223-E225 VanDerWaalsContact C-N 3.34Å; H223-E225 PolarHBondContact O-N 2.78Å
226	Y	98.4	Very high	98.3	Very high	60 Å²	60	51.9 Å²	51.9	24%	0.235	24%	0.241	C	C	.	.	H	α-helix	trans	-113.6	-6.7	-169.1	-65.5	-83.4	0	0	0	115.5	L179 V183 L222 H223 R228 Q229 I231	L179-Y226 HydrophobicContact CD1-CD1 4.46Å; L179-Y226 HydrophobicContact CD1-CG 4.43Å; L179-Y226 HydrophobicContact CD2-CD2 4.04Å; L179-Y226 HydrophobicContact CD2-CE1 4.17Å; L179-Y226 HydrophobicContact CD2-CE2 3.7Å; L179-Y226 HydrophobicContact CD2-CG 4.45Å; V183-Y226 HydrophobicContact CG2-CD1 3.59Å; V183-Y226 HydrophobicContact CG2-CE1 3.82Å; L222-Y226 HydrophobicContact CB-CD2 4.5Å; L222-Y226 HydrophobicContact CD2-CD2 4.37Å; L222-Y226 HydrophobicContact CD2-CE2 3.95Å; L222-Y226 WeakPolarHBondContact O-CD2 3.47Å; L222-Y226 PolarHBondContact O-N 3.49Å; H223-Y226 PolarHBondContact O-N 3.39Å; Y226-R228 VanDerWaalsContact C-N 3.25Å; Y226-R228 PolarHBondContact O-N 2.93Å; Y226-Q229 WeakPolarHBondContact O-CA 3.24Å; Y226-Q229 WeakPolarHBondContact O-CB 3.22Å; Y226-Q229 PolarHBondContact O-N 2.72Å; Y226-I231 PolarHBondContact O-N 2.99Å
227	R	97.2	Very high	98.3	Very high	116 Å²	116	51.7 Å²	51.7	44%	0.438	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-58.4	-34.6	-179	63.9	-179.8	-169.4	167.4	0.6	113.9	H223 E224 Q229 G230 I231	H223-R227 WeakPolarHBondContact O-CA 3.31Å; H223-R227 WeakPolarHBondContact O-CB 3.49Å; H223-R227 WeakPolarHBondContact O-CG 3.33Å; H223-R227 PolarHBondContact O-N 3.46Å; E224-R227 IonicContact OE1-CZ 2.97Å; E224-R227 IonicContact OE1-NE 2.6Å; E224-R227 IonicContact OE1-NH1 2.89Å; E224-R227 PolarHBondContact OE1-NH1 3.21Å; E224-R227 VanDerWaalsContact OE1-NH1 3.17Å; E224-R227 IonicContact OE2-CZ 2.77Å; E224-R227 IonicContact OE2-NE 2.9Å; E224-R227 PolarHBondContact OE2-NE 2.9Å; E224-R227 IonicContact OE2-NH1 3.34Å; E224-R227 PolarHBondContact OE2-NH1 2.76Å; E224-R227 IonicContact OE2-NH2 3.76Å; E224-R227 PolarHBondContact OE2-NH2 2.91Å; R227-Q229 PolarHBondContact O-N 3.08Å; R227-G230 PolarHBondContact O-N 3.09Å; R227-I231 WeakPolarHBondContact CA-O 3.33Å
228	R	97.5	Very high	98.2	Very high	226 Å²	226	45.8 Å²	45.8	85%	0.853	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-72.7	-16.1	177.4	-68.3	-174	177.5	177.9	0.2	112.8	Y226 G230	Y226-R228 VanDerWaalsContact C-N 3.25Å; Y226-R228 PolarHBondContact O-N 2.93Å; R228-G230 VanDerWaalsContact C-N 3.3Å
229	Q	97.9	Very high	98.1	Very high	78 Å²	78	44.8 Å²	44.8	36%	0.364	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-93.8	13.2	175.3	-55.9	177.1	53.6	0	0	111.6	S186 Y226 R227 I231	S186-Q229 CarbonylContact C-O 3.59Å; S186-Q229 WeakPolarHBondContact CA-O 3.33Å; S186-Q229 WeakPolarHBondContact CB-O 3.25Å; Y226-Q229 WeakPolarHBondContact O-CA 3.24Å; Y226-Q229 WeakPolarHBondContact O-CB 3.22Å; Y226-Q229 PolarHBondContact O-N 2.72Å; R227-Q229 PolarHBondContact O-N 3.08Å; Q229-I231 VanDerWaalsContact C-N 3.33Å; Q229-I231 PolarHBondContact O-N 3.27Å
230	G	96.4	Very high	98	Very high	40 Å²	40	49.2 Å²	49.2	41%	0.412	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.1	12.4	177.8	0	0	0	0	0	114.9	R227 R228	R227-G230 PolarHBondContact O-N 3.09Å; R228-G230 VanDerWaalsContact C-N 3.3Å
231	I	98.4	Very high	97.9	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	129.1	179.6	-47.1	-49.7	0	0	0	110.4	L179 M182 V183 Y226 R227 Q229 I233	L179-I231 HydrophobicContact CD1-CG1 4.42Å; L179-I231 HydrophobicContact CD1-CG2 3.94Å; M182-I231 HydrophobicContact CB-CD1 3.88Å; V183-I231 HydrophobicContact CG2-CD1 4.48Å; V183-I231 HydrophobicContact CG2-CG1 3.99Å; Y226-I231 PolarHBondContact O-N 2.99Å; R227-I231 WeakPolarHBondContact CA-O 3.33Å; Q229-I231 VanDerWaalsContact C-N 3.33Å; Q229-I231 PolarHBondContact O-N 3.27Å; I231-I233 HydrophobicContact CG2-CD1 4.24Å; I231-I233 HydrophobicContact CG2-CG1 3.91Å
232	I	98.3	Very high	97.7	Very high	36 Å²	36	45.6 Å²	45.6	19%	0.185	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	124.3	174.2	-64.5	167.8	0	0	0	107.9	L50 G188 V189 I190 V269	L50-I232 HydrophobicContact CD1-CD1 3.39Å; L50-I232 HydrophobicContact CD2-CD1 3.68Å; L50-I232 HydrophobicContact CG-CD1 4.17Å; G188-I232 PolarHBondContact O-N 2.83Å; V189-I232 CarbonylContact C-O 3.54Å; V189-I232 VanDerWaalsContact CA-O 3.29Å; V189-I232 WeakPolarHBondContact CA-O 3.24Å; V189-I232 HydrophobicContact CG1-CG2 4.42Å; V189-I232 HydrophobicContact CG2-CB 4.19Å; I190-I232 PolarHBondContact N-O 3.28Å; I232-V269 HydrophobicContact CG2-CG1 4.43Å
233	I	98.6	Very high	97.4	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	121	175.3	-54.7	-179.9	0	0	0	106	I190 L222 H223 I231	I190-I233 HydrophobicContact CB-CG1 4.19Å; I190-I233 HydrophobicContact CB-CG2 4.31Å; I190-I233 HydrophobicContact CD1-CD1 4.43Å; I190-I233 HydrophobicContact CD1-CG1 4.49Å; I190-I233 CarbonylContact O-C 3.4Å; I190-I233 WeakPolarHBondContact O-CA 3.5Å; L222-I233 HydrophobicContact CB-CD1 3.58Å; L222-I233 HydrophobicContact CD1-CD1 4.41Å; H223-I233 HydrophobicContact CB-CB 4.05Å; H223-I233 WeakPolarHBondContact CB-O 3.46Å; H223-I233 PolarHBondContact ND1-N 3.44Å; H223-I233 PolarHBondContact ND1-O 2.82Å; I231-I233 HydrophobicContact CG2-CD1 4.24Å; I231-I233 HydrophobicContact CG2-CG1 3.91Å
234	Q	98.4	Very high	97	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	130.9	-175.1	-170.7	179.1	50.5	0	0	110.1	I190 L191 N192 V236 E265 T268 Q272 N273 T275	I190-Q234 PolarHBondContact O-N 2.65Å; L191-Q234 HydrophobicContact CD2-CB 3.84Å; N192-Q234 PolarHBondContact N-O 3.32Å; Q234-V236 HydrophobicContact CG-CG2 4.42Å; Q234-E265 PolarHBondContact OE1-OE1 3.47Å; Q234-T268 PolarHBondContact NE2-O 2.87Å; Q234-T268 PolarHBondContact NE2-OG1 3.5Å; Q234-T268 VanDerWaalsContact NE2-OG1 3.16Å; Q234-Q272 WeakPolarHBondContact CG-O 3.37Å; Q234-Q272 PolarHBondContact NE2-O 3.1Å; Q234-N273 WeakPolarHBondContact CA-O 3.34Å; Q234-T275 HydrophobicContact CG-CG2 4.18Å
235	S	98.6	Very high	96.4	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	125	165.5	-163.6	0	0	0	0	110.3	D216 N273 Q274 T275	D216-S235 WeakPolarHBondContact CA-OG 3.31Å; D216-S235 WeakPolarHBondContact OD1-CB 3.42Å; D216-S235 PolarHBondContact OD1-OG 3.41Å; S235-N273 PolarHBondContact N-O 3.2Å; S235-Q274 WeakPolarHBondContact O-CA 3.46Å; S235-T275 PolarHBondContact O-N 3.12Å
236	V	98.6	Very high	95.9	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	122.4	179.1	-169.8	0	0	0	0	108.4	N192 I193 S194 Q234 P238 Y261 E265 T275	N192-V236 PolarHBondContact O-N 2.94Å; I193-V236 HydrophobicContact CD1-CB 3.79Å; I193-V236 HydrophobicContact CD1-CG1 4.21Å; I193-V236 HydrophobicContact CD1-CG2 3.87Å; S194-V236 CarbonylContact C-O 3.53Å; S194-V236 VanDerWaalsContact CA-O 3.27Å; S194-V236 WeakPolarHBondContact CA-O 3.42Å; S194-V236 WeakPolarHBondContact CB-O 3.5Å; S194-V236 PolarHBondContact N-O 2.87Å; Q234-V236 HydrophobicContact CG-CG2 4.42Å; V236-P238 VanDerWaalsContact C-CD 3.4Å; V236-P238 HydrophobicContact CG1-CG 4.33Å; V236-P238 WeakPolarHBondContact O-CD 3.5Å; V236-Y261 HydrophobicContact CG1-CE1 4.49Å; V236-Y261 WeakPolarHBondContact CG1-OH 3.08Å; V236-E265 HydrophobicContact CG1-CG 3.63Å; V236-E265 HydrophobicContact CG2-CG 4.4Å; V236-E265 WeakPolarHBondContact CG2-OE1 3.36Å; V236-T275 CarbonylContact C-O 3.54Å; V236-T275 WeakPolarHBondContact CA-O 3.44Å; V236-T275 HydrophobicContact CG1-CG2 4.4Å; V236-T275 HydrophobicContact CG2-CG2 4.41Å
237	L	98.4	Very high	95.4	Very high	2 Å²	2	53.7 Å²	53.7	1%	0.01	25%	0.247	C	C	.	.			trans	-118.2	71.9	-175.2	-63.6	87.8	0	0	0	110.8	M199 D216 Q274 T275 N276	M199-L237 HydrophobicContact CG-CD2 3.39Å; M199-L237 HydrophobicContact SD-CB 4.33Å; M199-L237 HydrophobicContact SD-CD2 4.11Å; D216-L237 HydrophobicContact CB-CD2 4.36Å; L237-Q274 HydrophobicContact CD1-CG 3.5Å; L237-T275 PolarHBondContact N-O 3.46Å; L237-N276 PolarHBondContact O-ND2 3.44Å
238	P	97.8	Very high	94.9	Very high	8 Å²	8	50 Å²	50	5%	0.052	24%	0.235	C	C	.	.			trans	-60.8	142.2	179	-12.4	20.5	0	0	0	111.8	I68 I193 A196 V236 V241 Y261	I68-P238 HydrophobicContact CD1-CG 4.32Å; I193-P238 HydrophobicContact CG2-CG 4.06Å; A196-P238 WeakPolarHBondContact CB-O 3.08Å; A196-P238 PolarHBondContact N-O 3.27Å; V236-P238 VanDerWaalsContact C-CD 3.4Å; V236-P238 HydrophobicContact CG1-CG 4.33Å; V236-P238 WeakPolarHBondContact O-CD 3.5Å; P238-V241 HydrophobicContact CB-CG2 4.29Å; P238-Y261 WeakPolarHBondContact CA-OH 3.37Å; P238-Y261 HydrophobicContact CB-CE1 4.08Å; P238-Y261 HydrophobicContact CB-CE2 4.01Å; P238-Y261 VanDerWaalsContact CB-OH 3.31Å; P238-Y261 WeakPolarHBondContact CB-OH 3.47Å; P238-Y261 HydrophobicContact CG-CE1 3.93Å; P238-Y261 VanDerWaalsContact CG-OH 3.23Å; P238-Y261 WeakPolarHBondContact CG-OH 3.42Å
239	F	96.9	Very high	94.3	Very high	26 Å²	26	50.6 Å²	50.6	11%	0.114	24%	0.238	C	C	.	.			trans	-78.5	-160.6	154.2	-75.9	-97.9	0	0	0	109	A196 M199 V241 H281 M284	A196-F239 HydrophobicContact CB-CB 4.4Å; A196-F239 HydrophobicContact CB-CD1 3.55Å; A196-F239 HydrophobicContact CB-CD2 3.63Å; A196-F239 HydrophobicContact CB-CE1 3.58Å; A196-F239 HydrophobicContact CB-CE2 3.67Å; A196-F239 HydrophobicContact CB-CG 3.59Å; A196-F239 HydrophobicContact CB-CZ 3.64Å; M199-F239 HydrophobicContact SD-CE2 4.49Å; F239-V241 PolarHBondContact O-N 3.09Å; F239-H281 HydrophobicContact CB-CB 4.44Å; F239-H281 HydrophobicContact CD2-CB 3.82Å; F239-H281 VanDerWaalsContact CE2-O 3.27Å; F239-H281 WeakPolarHBondContact CE2-O 3.3Å; F239-H281 PolarHBondContact N-CE1 3.2Å; F239-H281 PolarHBondContact N-ND1 3.04Å; F239-H281 VanDerWaalsContact N-ND1 3.1Å; F239-M284 HydrophobicContact CD1-CE 3.9Å; F239-M284 HydrophobicContact CD2-CB 4.37Å; F239-M284 HydrophobicContact CE1-CB 4.27Å; F239-M284 HydrophobicContact CE1-CE 4.19Å; F239-M284 HydrophobicContact CE2-CB 3.98Å; F239-M284 HydrophobicContact CG-CE 4.39Å; F239-M284 HydrophobicContact CZ-CB 3.92Å
240	F	95.8	Very high	94	Very high	93 Å²	93	55.4 Å²	55.4	41%	0.408	26%	0.257	S	S	.	.			trans	-61.2	128	-179.5	-71.9	-65.3	0	0	0	111.9	T246 I248 K255 H281	F240-T246 HydrophobicContact CD1-CG2 3.99Å; F240-I248 HydrophobicContact CB-CD1 3.73Å; F240-I248 HydrophobicContact CD1-CD1 4.02Å; F240-I248 HydrophobicContact CG-CD1 4.04Å; F240-K255 HydrophobicContact CB-CG 3.82Å; F240-K255 WeakPolarHBondContact O-CA 3.1Å; F240-H281 PolarHBondContact O-CE1 3.28Å; F240-H281 PolarHBondContact O-NE2 2.96Å
241	V	96.1	Very high	93.8	Very high	3 Å²	3	56.7 Å²	56.7	2%	0.018	26%	0.259	C	S	.	.			trans	-118.5	141.7	169.9	-179.1	0	0	0	0	107.7	I68 P238 F239 T243 T246 P256 P258 Y261	I68-V241 HydrophobicContact CD1-CB 4.08Å; I68-V241 HydrophobicContact CD1-CG1 4.37Å; I68-V241 HydrophobicContact CD1-CG2 3.94Å; I68-V241 HydrophobicContact CG1-CB 4.33Å; I68-V241 HydrophobicContact CG1-CG1 4.09Å; I68-V241 HydrophobicContact CG1-CG2 4.48Å; P238-V241 HydrophobicContact CB-CG2 4.29Å; F239-V241 PolarHBondContact O-N 3.09Å; V241-T243 HydrophobicContact CB-CG2 4.42Å; V241-T243 HydrophobicContact CG1-CG2 4.15Å; V241-T243 PolarHBondContact O-N 3.45Å; V241-T246 WeakPolarHBondContact O-CG2 3.33Å; V241-T246 PolarHBondContact O-OG1 3.05Å; V241-P256 WeakPolarHBondContact CG1-O 3.35Å; V241-P258 HydrophobicContact CG1-CB 4.23Å; V241-P258 HydrophobicContact CG1-CG 3.95Å; V241-Y261 HydrophobicContact CG2-CD1 4.17Å; V241-Y261 HydrophobicContact CG2-CD2 3.77Å; V241-Y261 HydrophobicContact CG2-CE2 4.26Å; V241-Y261 HydrophobicContact CG2-CG 3.73Å
242	A	95.3	Very high	93.7	Very high	15 Å²	15	59.6 Å²	59.6	12%	0.124	28%	0.276	C	S	.	.	S	Bend	trans	-70.4	90.2	-176.3	0	0	0	0	0	111.6	I248 P251 P256 P258	A242-I248 HydrophobicContact CB-CB 4.4Å; A242-I248 HydrophobicContact CB-CG2 3.94Å; A242-P251 HydrophobicContact CB-CB 4.44Å; A242-P251 HydrophobicContact CB-CG 4.16Å; A242-P256 PolarHBondContact N-O 3.45Å; A242-P258 VanDerWaalsContact O-CD 3.29Å; A242-P258 WeakPolarHBondContact O-CD 3.22Å; A242-P258 WeakPolarHBondContact O-CG 3.41Å
243	T	92.4	Very high	93.4	Very high	22 Å²	22	63.4 Å²	63.4	14%	0.135	30%	0.297	C	S	.	.	S	Bend	trans	-132.3	168.1	-177.1	62.3	0	0	0	0	110.7	I68 V241 M245 T246 R247 P258	I68-T243 HydrophobicContact CG1-CG2 4.37Å; V241-T243 HydrophobicContact CB-CG2 4.42Å; V241-T243 HydrophobicContact CG1-CG2 4.15Å; V241-T243 PolarHBondContact O-N 3.45Å; T243-M245 PolarHBondContact O-N 3.19Å; T243-M245 PolarHBondContact OG1-N 2.86Å; T243-T246 PolarHBondContact N-OG1 3.06Å; T243-T246 PolarHBondContact O-N 3.39Å; T243-T246 PolarHBondContact O-OG1 3.19Å; T243-T246 PolarHBondContact OG1-N 3.45Å; T243-T246 PolarHBondContact OG1-OG1 2.93Å; T243-R247 PolarHBondContact O-N 3.32Å; T243-R247 VanDerWaalsContact O-N 3.08Å; T243-P258 HydrophobicContact CG2-CG 3.7Å
244	K	88.9	Confident	93.2	Very high	151 Å²	151	66 Å²	66	66%	0.657	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-33	171.7	-60.5	-165.9	-165.5	134.5	0	112.5	D66 R247	D66-K244 IonicContact OD1-NZ 2.87Å; D66-K244 WeakPolarHBondContact OD2-CD 3.39Å; D66-K244 WeakPolarHBondContact OD2-CE 3.45Å; D66-K244 WeakPolarHBondContact OD2-CG 3.27Å; D66-K244 IonicContact OD2-NZ 3.21Å; D66-K244 PolarHBondContact OD2-NZ 3.33Å; K244-R247 PolarHBondContact O-N 3.02Å
245	M	86.3	Confident	93.1	Very high	112 Å²	112	68.9 Å²	68.9	55%	0.552	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-45.3	177.8	-174.5	-175.9	-69.2	0	0	111.9	G141 T243 R247	G141-M245 WeakPolarHBondContact O-CE 3.47Å; T243-M245 PolarHBondContact O-N 3.19Å; T243-M245 PolarHBondContact OG1-N 2.86Å; M245-R247 VanDerWaalsContact C-N 3.29Å; M245-R247 PolarHBondContact O-N 3.37Å
246	T	86.9	Confident	93	Very high	44 Å²	44	68.9 Å²	68.9	27%	0.27	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-12.6	179.8	60.1	0	0	0	0	113.2	F240 V241 T243 I248	F240-T246 HydrophobicContact CD1-CG2 3.99Å; V241-T246 WeakPolarHBondContact O-CG2 3.33Å; V241-T246 PolarHBondContact O-OG1 3.05Å; T243-T246 PolarHBondContact N-OG1 3.06Å; T243-T246 PolarHBondContact O-N 3.39Å; T243-T246 PolarHBondContact O-OG1 3.19Å; T243-T246 PolarHBondContact OG1-N 3.45Å; T243-T246 PolarHBondContact OG1-OG1 2.93Å; T246-I248 PolarHBondContact O-N 3.19Å
247	R	88.1	Confident	93	Very high	154 Å²	154	71.1 Å²	71.1	58%	0.581	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	21.2	-175.9	-54.9	179.7	179.5	149.6	3.4	113.6	P145 T243 K244 M245	P145-R247 PolarHBondContact O-NH1 2.75Å; P145-R247 PolarHBondContact O-NH2 3.03Å; T243-R247 PolarHBondContact O-N 3.32Å; T243-R247 VanDerWaalsContact O-N 3.08Å; K244-R247 PolarHBondContact O-N 3.02Å; M245-R247 VanDerWaalsContact C-N 3.29Å; M245-R247 PolarHBondContact O-N 3.37Å
248	I	87.8	Confident	92.9	Very high	40 Å²	40	71.5 Å²	71.5	21%	0.205	34%	0.339	C	S	.	.			trans	-85.5	119.9	176.4	-65.9	164.4	0	0	0	107.9	F240 A242 T246 K255	F240-I248 HydrophobicContact CB-CD1 3.73Å; F240-I248 HydrophobicContact CD1-CD1 4.02Å; F240-I248 HydrophobicContact CG-CD1 4.04Å; A242-I248 HydrophobicContact CB-CB 4.4Å; A242-I248 HydrophobicContact CB-CG2 3.94Å; T246-I248 PolarHBondContact O-N 3.19Å; I248-K255 HydrophobicContact CD1-CD 3.95Å; I248-K255 HydrophobicContact CD1-CG 4.19Å; I248-K255 HydrophobicContact CG2-CD 4.47Å
249	R	85.1	Confident	92.9	Very high	238 Å²	238	75.8 Å²	75.8	90%	0.898	36%	0.359	S	S	*	.			trans	-94.9	-32.6	-178.8	-66.9	-175.9	176	-176.5	-3.8	113.9
250	K	91.2	Very high	92.9	Very high	178 Å²	178	81.1 Å²	81.1	77%	0.774	38%	0.378	S	S	*	.	S	Bend	trans	-109	112	-177.3	-68.8	-171	177.7	-173.7	0	109
251	P	92.9	Very high	93	Very high	68 Å²	68	76.7 Å²	76.7	44%	0.442	36%	0.358	S	S	.	.			trans	-62.2	146.4	173.4	-20.2	31.9	0	0	0	111.4	A242 K255 T257	A242-P251 HydrophobicContact CB-CB 4.44Å; A242-P251 HydrophobicContact CB-CG 4.16Å; P251-K255 CarbonylContact C-O 3.56Å; P251-K255 VanDerWaalsContact CA-O 3.24Å; P251-K255 WeakPolarHBondContact CA-O 3.19Å; P251-T257 HydrophobicContact CB-CG2 3.89Å; P251-T257 HydrophobicContact CG-CG2 3.52Å
252	T	94.6	Very high	93.1	Very high	62 Å²	62	76.6 Å²	76.6	38%	0.38	36%	0.358	S	S	.	.			trans	-133.4	175.8	173.3	57.8	0	0	0	0	109.3	D254 K255	T252-D254 VanDerWaalsContact C-N 3.27Å; T252-D254 WeakPolarHBondContact CB-OD1 3.39Å; T252-D254 PolarHBondContact O-N 2.94Å; T252-D254 PolarHBondContact OG1-OD1 2.94Å; T252-K255 PolarHBondContact N-O 2.91Å; T252-K255 CarbonylContact O-C 3.47Å; T252-K255 PolarHBondContact O-N 3.34Å; T252-K255 VanDerWaalsContact O-N 3.07Å; T252-K255 VanDerWaalsContact O-O 3.1Å; T252-K255 WeakPolarHBondContact OG1-CB 3.15Å; T252-K255 PolarHBondContact OG1-N 3.45Å
253	L	93.5	Very high	93.1	Very high	116 Å²	116	77.5 Å²	77.5	61%	0.607	37%	0.366	S	S	*	.	S	Bend	trans	-57	-41.5	179	-177.2	67.6	0	0	0	112.2	Y278 P280	L253-Y278 WeakPolarHBondContact O-CE1 3.46Å; L253-Y278 PolarHBondContact O-OH 3.38Å; L253-P280 HydrophobicContact CD1-CG 4.23Å; L253-P280 HydrophobicContact CG-CG 4.17Å
254	D	93.3	Very high	93.3	Very high	53 Å²	53	77.7 Å²	77.7	28%	0.283	37%	0.369	S	S	.	.	S	Bend	trans	-83.8	-12.7	177.2	63.3	-51.1	0	0	0	113.6	T252 H281 M284	T252-D254 VanDerWaalsContact C-N 3.27Å; T252-D254 WeakPolarHBondContact CB-OD1 3.39Å; T252-D254 PolarHBondContact O-N 2.94Å; T252-D254 PolarHBondContact OG1-OD1 2.94Å; D254-H281 PolarHBondContact O-CD2 2.93Å; D254-H281 PolarHBondContact O-NE2 3.16Å; D254-M284 HydrophobicContact CB-SD 4.07Å
255	K	95.9	Very high	93.7	Very high	61 Å²	61	70.5 Å²	70.5	27%	0.265	34%	0.338	S	S	.	.	S	Bend	trans	-127.9	71.4	179.7	-62.6	158.7	-173.6	111.4	0	109.4	F240 I248 P251 T252	F240-K255 HydrophobicContact CB-CG 3.82Å; F240-K255 WeakPolarHBondContact O-CA 3.1Å; I248-K255 HydrophobicContact CD1-CD 3.95Å; I248-K255 HydrophobicContact CD1-CG 4.19Å; I248-K255 HydrophobicContact CG2-CD 4.47Å; P251-K255 CarbonylContact C-O 3.56Å; P251-K255 VanDerWaalsContact CA-O 3.24Å; P251-K255 WeakPolarHBondContact CA-O 3.19Å; T252-K255 PolarHBondContact N-O 2.91Å; T252-K255 CarbonylContact O-C 3.47Å; T252-K255 PolarHBondContact O-N 3.34Å; T252-K255 VanDerWaalsContact O-N 3.07Å; T252-K255 VanDerWaalsContact O-O 3.1Å; T252-K255 WeakPolarHBondContact OG1-CB 3.15Å; T252-K255 PolarHBondContact OG1-N 3.45Å
256	P	97.4	Very high	94.2	Very high	1 Å²	1	65.2 Å²	65.2	1%	0.006	31%	0.312	C	S	.	.			trans	-64.8	166	-176.2	30.6	-38	0	0	0	111.4	V241 A242 R260 Y261 Y278	V241-P256 WeakPolarHBondContact CG1-O 3.35Å; A242-P256 PolarHBondContact N-O 3.45Å; P256-R260 HydrophobicContact CB-CB 4.29Å; P256-R260 HydrophobicContact CB-CG 4.26Å; P256-Y261 HydrophobicContact CG-CD2 4.11Å; P256-Y278 HydrophobicContact CB-CD1 4.4Å; P256-Y278 HydrophobicContact CB-CE1 3.93Å; P256-Y278 HydrophobicContact CG-CD1 3.72Å; P256-Y278 HydrophobicContact CG-CE1 3.67Å; P256-Y278 HydrophobicContact CG-CG 4.34Å
257	T	97.7	Very high	94.6	Very high	46 Å²	46	65.5 Å²	65.5	28%	0.282	31%	0.312	S	S	.	.			trans	-66.9	156.9	164.5	74.9	0	0	0	0	110.1	P251 E259 R260 Y261	P251-T257 HydrophobicContact CB-CG2 3.89Å; P251-T257 HydrophobicContact CG-CG2 3.52Å; T257-E259 WeakPolarHBondContact CB-OE2 3.44Å; T257-E259 PolarHBondContact O-N 3.39Å; T257-E259 PolarHBondContact OG1-OE2 2.89Å; T257-R260 PolarHBondContact O-N 3.05Å; T257-R260 PolarHBondContact OG1-N 2.67Å; T257-Y261 WeakPolarHBondContact O-CB 3.2Å; T257-Y261 PolarHBondContact O-N 2.95Å
258	P	97.4	Very high	94.9	Very high	10 Å²	10	58.2 Å²	58.2	7%	0.065	28%	0.284	C	S	.	.	H	α-helix	trans	-56.2	-38.5	176.4	-27.4	39.2	0	0	0	113.3	S71 V241 A242 T243 Y261 V262	S71-P258 WeakPolarHBondContact OG-CB 3.35Å; V241-P258 HydrophobicContact CG1-CB 4.23Å; V241-P258 HydrophobicContact CG1-CG 3.95Å; A242-P258 VanDerWaalsContact O-CD 3.29Å; A242-P258 WeakPolarHBondContact O-CD 3.22Å; A242-P258 WeakPolarHBondContact O-CG 3.41Å; T243-P258 HydrophobicContact CG2-CG 3.7Å; P258-Y261 PolarHBondContact O-N 3.28Å; P258-V262 WeakPolarHBondContact O-CB 3.43Å; P258-V262 WeakPolarHBondContact O-CG2 3.46Å; P258-V262 PolarHBondContact O-N 2.92Å
259	E	97.1	Very high	95.3	Very high	99 Å²	99	56.6 Å²	56.6	46%	0.463	28%	0.276	S	S	.	.	H	α-helix	trans	-66.4	-47.6	-179	-52	72.9	-155.3	0	0	110.4	S71 T257 Y261 V262 A263	S71-E259 PolarHBondContact OG-N 2.92Å; T257-E259 WeakPolarHBondContact CB-OE2 3.44Å; T257-E259 PolarHBondContact O-N 3.39Å; T257-E259 PolarHBondContact OG1-OE2 2.89Å; E259-Y261 VanDerWaalsContact C-N 3.31Å; E259-Y261 PolarHBondContact O-N 3.47Å; E259-V262 PolarHBondContact O-N 3.13Å; E259-A263 VanDerWaalsContact O-CB 3.32Å; E259-A263 WeakPolarHBondContact O-CB 3.45Å; E259-A263 PolarHBondContact O-N 3.43Å
260	R	97.1	Very high	95.6	Very high	137 Å²	137	47 Å²	47	52%	0.517	25%	0.252	S	S	.	.	H	α-helix	trans	-63.7	-39.1	176.7	180	174	178.6	171.2	1	111.7	P256 T257 A264 Y278	P256-R260 HydrophobicContact CB-CB 4.29Å; P256-R260 HydrophobicContact CB-CG 4.26Å; T257-R260 PolarHBondContact O-N 3.05Å; T257-R260 PolarHBondContact OG1-N 2.67Å; R260-A264 PolarHBondContact O-N 3.22Å; R260-Y278 HydrophobicContact CG-CE2 4.36Å; R260-Y278 VanDerWaalsContact CZ-OH 3.24Å; R260-Y278 PolarHBondContact NE-OH 2.71Å; R260-Y278 PolarHBondContact NH2-OH 3.36Å; R260-Y278 VanDerWaalsContact NH2-OH 3.16Å
261	Y	98.3	Very high	95.8	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63.2	-53.4	178.1	179.7	-96.5	0	0	0	111.1	I68 V236 P238 V241 P256 T257 P258 E259 A263 A264 E265 N276 Y278 H281	I68-Y261 HydrophobicContact CD1-CD1 4.45Å; V236-Y261 HydrophobicContact CG1-CE1 4.49Å; V236-Y261 WeakPolarHBondContact CG1-OH 3.08Å; P238-Y261 WeakPolarHBondContact CA-OH 3.37Å; P238-Y261 HydrophobicContact CB-CE1 4.08Å; P238-Y261 HydrophobicContact CB-CE2 4.01Å; P238-Y261 VanDerWaalsContact CB-OH 3.31Å; P238-Y261 WeakPolarHBondContact CB-OH 3.47Å; P238-Y261 HydrophobicContact CG-CE1 3.93Å; P238-Y261 VanDerWaalsContact CG-OH 3.23Å; P238-Y261 WeakPolarHBondContact CG-OH 3.42Å; V241-Y261 HydrophobicContact CG2-CD1 4.17Å; V241-Y261 HydrophobicContact CG2-CD2 3.77Å; V241-Y261 HydrophobicContact CG2-CE2 4.26Å; V241-Y261 HydrophobicContact CG2-CG 3.73Å; P256-Y261 HydrophobicContact CG-CD2 4.11Å; T257-Y261 WeakPolarHBondContact O-CB 3.2Å; T257-Y261 PolarHBondContact O-N 2.95Å; P258-Y261 PolarHBondContact O-N 3.28Å; E259-Y261 VanDerWaalsContact C-N 3.31Å; E259-Y261 PolarHBondContact O-N 3.47Å; Y261-A263 PolarHBondContact O-N 3.38Å; Y261-A264 PolarHBondContact O-N 3.14Å; Y261-E265 HydrophobicContact CE1-CB 4.25Å; Y261-E265 HydrophobicContact CE1-CG 4.41Å; Y261-E265 WeakPolarHBondContact O-CB 3.31Å; Y261-E265 PolarHBondContact O-N 2.9Å; Y261-N276 WeakPolarHBondContact CE2-O 3.25Å; Y261-N276 PolarHBondContact OH-O 3.49Å; Y261-Y278 HydrophobicContact CD2-CG 4.34Å; Y261-H281 AromaticContact CD2-ND1 3.99Å; Y261-H281 AromaticContact CE2-CE1 3.97Å; Y261-H281 AromaticContact CE2-ND1 3.5Å
262	V	98	Very high	95.8	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.006	22%	0.219	C	C	.	.	H	α-helix	trans	-64.9	-41.7	-177.1	168.8	0	0	0	0	111.7	I68 Y72 E75 P258 E259 A264 E265 L266	I68-V262 HydrophobicContact CG2-CG2 4.04Å; Y72-V262 HydrophobicContact CD1-CG1 3.65Å; Y72-V262 HydrophobicContact CD1-CG2 4.41Å; Y72-V262 HydrophobicContact CD2-CG1 4.47Å; Y72-V262 HydrophobicContact CD2-CG2 3.8Å; Y72-V262 HydrophobicContact CE1-CG1 3.92Å; Y72-V262 HydrophobicContact CE1-CG2 4.45Å; Y72-V262 HydrophobicContact CE2-CG2 3.86Å; Y72-V262 HydrophobicContact CG-CG1 3.93Å; Y72-V262 HydrophobicContact CG-CG2 4.08Å; E75-V262 HydrophobicContact CB-CG1 3.98Å; E75-V262 HydrophobicContact CG-CG1 4.29Å; P258-V262 WeakPolarHBondContact O-CB 3.43Å; P258-V262 WeakPolarHBondContact O-CG2 3.46Å; P258-V262 PolarHBondContact O-N 2.92Å; E259-V262 PolarHBondContact O-N 3.13Å; V262-A264 VanDerWaalsContact C-N 3.26Å; V262-A264 PolarHBondContact O-N 3.37Å; V262-E265 PolarHBondContact O-N 3.4Å; V262-E265 VanDerWaalsContact O-N 3.11Å; V262-L266 HydrophobicContact CG1-CD1 4.35Å; V262-L266 HydrophobicContact CG1-CG 4.19Å; V262-L266 WeakPolarHBondContact O-CG 3.32Å; V262-L266 PolarHBondContact O-N 3.17Å
263	A	95.9	Very high	95.7	Very high	35 Å²	35	40.6 Å²	40.6	29%	0.289	22%	0.218	S	C	.	.	H	α-helix	trans	-59.1	-39.7	176.8	0	0	0	0	0	112	E259 Y261 N267	E259-A263 VanDerWaalsContact O-CB 3.32Å; E259-A263 WeakPolarHBondContact O-CB 3.45Å; E259-A263 PolarHBondContact O-N 3.43Å; Y261-A263 PolarHBondContact O-N 3.38Å; A263-N267 PolarHBondContact O-ND2 3.29Å
264	A	96.1	Very high	95.9	Very high	26 Å²	26	38.8 Å²	38.8	22%	0.215	21%	0.207	C	C	.	.	H	α-helix	trans	-71.2	-38.2	174.4	0	0	0	0	0	112.3	R260 Y261 V262 N267 G277 Y278	R260-A264 PolarHBondContact O-N 3.22Å; Y261-A264 PolarHBondContact O-N 3.14Å; V262-A264 VanDerWaalsContact C-N 3.26Å; V262-A264 PolarHBondContact O-N 3.37Å; A264-N267 WeakPolarHBondContact O-CB 3.31Å; A264-N267 PolarHBondContact O-N 3.39Å; A264-G277 CarbonylContact C-O 3.1Å; A264-Y278 HydrophobicContact CB-CD2 3.76Å
265	E	97.1	Very high	96.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-68.6	-43.1	-175.8	-176.6	-78.5	161.9	0	0	111.9	Y72 Q234 V236 Y261 V262 N267 T268 G277	Y72-E265 WeakPolarHBondContact CE1-OE2 3.28Å; Y72-E265 VanDerWaalsContact CZ-OE2 3.22Å; Y72-E265 WeakPolarHBondContact OH-CG 3.41Å; Y72-E265 PolarHBondContact OH-OE1 2.97Å; Y72-E265 PolarHBondContact OH-OE2 3.34Å; Q234-E265 PolarHBondContact OE1-OE1 3.47Å; V236-E265 HydrophobicContact CG1-CG 3.63Å; V236-E265 HydrophobicContact CG2-CG 4.4Å; V236-E265 WeakPolarHBondContact CG2-OE1 3.36Å; Y261-E265 HydrophobicContact CE1-CB 4.25Å; Y261-E265 HydrophobicContact CE1-CG 4.41Å; Y261-E265 WeakPolarHBondContact O-CB 3.31Å; Y261-E265 PolarHBondContact O-N 2.9Å; V262-E265 PolarHBondContact O-N 3.4Å; V262-E265 VanDerWaalsContact O-N 3.11Å; E265-N267 PolarHBondContact O-N 2.99Å; E265-N267 VanDerWaalsContact O-N 3.1Å; E265-T268 WeakPolarHBondContact O-CB 3.49Å; E265-T268 PolarHBondContact O-N 3.36Å; E265-T268 PolarHBondContact O-OG1 3.04Å; E265-G277 WeakPolarHBondContact CA-O 3.36Å; E265-G277 WeakPolarHBondContact CB-O 3.47Å; E265-G277 PolarHBondContact N-O 3.11Å
266	L	96.8	Very high	96.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.7	-21.5	178.4	-69.7	-168.9	0	0	0	113	G48 L51 Y72 E75 L76 L191 V262 T268 V269	G48-L266 WeakPolarHBondContact CA-O 3.42Å; L51-L266 HydrophobicContact CD1-CB 4.05Å; L51-L266 HydrophobicContact CD1-CD1 4.12Å; L51-L266 HydrophobicContact CD1-CD2 3.54Å; L51-L266 HydrophobicContact CD1-CG 4.13Å; Y72-L266 HydrophobicContact CD1-CD2 3.91Å; Y72-L266 HydrophobicContact CD1-CG 4.47Å; Y72-L266 HydrophobicContact CE1-CD2 3.51Å; Y72-L266 HydrophobicContact CE1-CG 4.2Å; E75-L266 HydrophobicContact CB-CD1 4.09Å; E75-L266 HydrophobicContact CG-CD1 3.25Å; E75-L266 HydrophobicContact CG-CG 4.34Å; L76-L266 HydrophobicContact CD2-CD1 4.21Å; L191-L266 HydrophobicContact CD1-CD2 3.7Å; V262-L266 HydrophobicContact CG1-CD1 4.35Å; V262-L266 HydrophobicContact CG1-CG 4.19Å; V262-L266 WeakPolarHBondContact O-CG 3.32Å; V262-L266 PolarHBondContact O-N 3.17Å; L266-T268 PolarHBondContact O-N 3.48Å; L266-V269 HydrophobicContact CD2-CG2 4.3Å; L266-V269 PolarHBondContact O-N 3.44Å
267	N	94.8	Very high	96	Very high	50 Å²	50	34.5 Å²	34.5	27%	0.267	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-14.8	174.5	-68.8	-13.7	0	0	0	113.2	G48 A263 A264 E265 L271	G48-N267 PolarHBondContact N-OD1 2.93Å; A263-N267 PolarHBondContact O-ND2 3.29Å; A264-N267 WeakPolarHBondContact O-CB 3.31Å; A264-N267 PolarHBondContact O-N 3.39Å; E265-N267 PolarHBondContact O-N 2.99Å; E265-N267 VanDerWaalsContact O-N 3.1Å; N267-L271 WeakPolarHBondContact O-CD1 3.46Å
268	T	95.3	Very high	95.9	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.006	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-11.7	178.5	76.2	0	0	0	0	113.4	I42 W43 Q234 E265 L266 G270 L271 Q272	I42-T268 HydrophobicContact CG2-CG2 4.27Å; W43-T268 HydrophobicContact CH2-CG2 4.29Å; W43-T268 HydrophobicContact CZ3-CG2 4.19Å; Q234-T268 PolarHBondContact NE2-O 2.87Å; Q234-T268 PolarHBondContact NE2-OG1 3.5Å; Q234-T268 VanDerWaalsContact NE2-OG1 3.16Å; E265-T268 WeakPolarHBondContact O-CB 3.49Å; E265-T268 PolarHBondContact O-N 3.36Å; E265-T268 PolarHBondContact O-OG1 3.04Å; L266-T268 PolarHBondContact O-N 3.48Å; T268-G270 PolarHBondContact O-N 3.41Å; T268-L271 WeakPolarHBondContact O-CA 3.44Å; T268-L271 WeakPolarHBondContact O-CB 3.36Å; T268-L271 PolarHBondContact O-N 3.32Å; T268-Q272 PolarHBondContact O-N 3.38Å
269	V	95.7	Very high	95.8	Very high	6 Å²	6	37.7 Å²	37.7	4%	0.036	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	128.3	-174.1	177.8	0	0	0	0	110.4	L50 L51 V189 L191 I232 L266 L271	L50-V269 HydrophobicContact CD2-CG1 4.08Å; L51-V269 HydrophobicContact CD1-CB 4.25Å; L51-V269 HydrophobicContact CD1-CG1 4.33Å; L51-V269 HydrophobicContact CD1-CG2 4.06Å; L51-V269 HydrophobicContact CD2-CG1 4.25Å; L51-V269 HydrophobicContact CG-CG1 4.23Å; V189-V269 HydrophobicContact CG1-CG1 3.85Å; V189-V269 HydrophobicContact CG2-CG1 4.47Å; L191-V269 HydrophobicContact CD1-CG2 4.32Å; L191-V269 HydrophobicContact CD2-CG1 4.36Å; L191-V269 HydrophobicContact CD2-CG2 3.89Å; I232-V269 HydrophobicContact CG2-CG1 4.43Å; L266-V269 HydrophobicContact CD2-CG2 4.3Å; L266-V269 PolarHBondContact O-N 3.44Å; V269-L271 PolarHBondContact O-N 3.12Å
270	G	92.6	Very high	95.8	Very high	38 Å²	38	34.1 Å²	34.1	39%	0.392	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.5	-5	-174.4	0	0	0	0	0	114.7	T268	T268-G270 PolarHBondContact O-N 3.41Å
271	L	93.7	Very high	95.8	Very high	54 Å²	54	27.6 Å²	27.6	28%	0.283	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-29.7	174.1	-55.4	-179	0	0	0	112.2	I42 N267 T268 V269	I42-L271 HydrophobicContact CG1-CB 4.24Å; N267-L271 WeakPolarHBondContact O-CD1 3.46Å; T268-L271 WeakPolarHBondContact O-CA 3.44Å; T268-L271 WeakPolarHBondContact O-CB 3.36Å; T268-L271 PolarHBondContact O-N 3.32Å; V269-L271 PolarHBondContact O-N 3.12Å
272	Q	92.9	Very high	95.7	Very high	52 Å²	52	28.5 Å²	28.5	24%	0.243	16%	0.164	C	C	.	.			trans	-133.9	140.4	175.8	-58	-166.2	-77.7	0	0	110.4	I42 Q234 T268 T275	I42-Q272 HydrophobicContact CD1-CG 3.61Å; I42-Q272 HydrophobicContact CG1-CG 4.02Å; I42-Q272 HydrophobicContact CG2-CG 4.32Å; Q234-Q272 WeakPolarHBondContact CG-O 3.37Å; Q234-Q272 PolarHBondContact NE2-O 3.1Å; T268-Q272 PolarHBondContact O-N 3.38Å; Q272-T275 PolarHBondContact OE1-OG1 2.83Å
273	N	93.8	Very high	95.5	Very high	66 Å²	66	31.7 Å²	31.7	35%	0.353	18%	0.183	S	C	.	.	S	Bend	trans	-83.5	-26.4	169.5	60.6	-12.4	0	0	0	112.4	H223 Q234 S235	H223-N273 VanDerWaalsContact CD2-CB 3.5Å; H223-N273 WeakPolarHBondContact CD2-CB 3.2Å; Q234-N273 WeakPolarHBondContact CA-O 3.34Å; S235-N273 PolarHBondContact N-O 3.2Å
274	Q	96.9	Very high	95.5	Very high	78 Å²	78	33.2 Å²	33.2	36%	0.364	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	123.6	174.9	-173	-172.4	52.2	0	0	108.7	D216 S235 L237	D216-Q274 PolarHBondContact OD1-NE2 3.45Å; D216-Q274 PolarHBondContact OD2-NE2 3.27Å; S235-Q274 WeakPolarHBondContact O-CA 3.46Å; L237-Q274 HydrophobicContact CD1-CG 3.5Å
275	T	96.8	Very high	95.4	Very high	4 Å²	4	32.1 Å²	32.1	3%	0.025	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	153.8	-176.4	-170.5	0	0	0	0	112	Q234 S235 V236 L237 Q272 G277	Q234-T275 HydrophobicContact CG-CG2 4.18Å; S235-T275 PolarHBondContact O-N 3.12Å; V236-T275 CarbonylContact C-O 3.54Å; V236-T275 WeakPolarHBondContact CA-O 3.44Å; V236-T275 HydrophobicContact CG1-CG2 4.4Å; V236-T275 HydrophobicContact CG2-CG2 4.41Å; L237-T275 PolarHBondContact N-O 3.46Å; Q272-T275 PolarHBondContact OE1-OG1 2.83Å; T275-G277 VanDerWaalsContact C-N 3.31Å; T275-G277 PolarHBondContact OG1-N 2.93Å
276	N	97.2	Very high	95.3	Very high	21 Å²	21	38.1 Å²	38.1	11%	0.112	20%	0.199	C	C	.	.			trans	-88	-2.2	164.9	-62.7	105.7	0	0	0	112.4	M199 L237 Y261 Y278 H281 A282	M199-N276 PolarHBondContact SD-ND2 3.38Å; L237-N276 PolarHBondContact O-ND2 3.44Å; Y261-N276 WeakPolarHBondContact CE2-O 3.25Å; Y261-N276 PolarHBondContact OH-O 3.49Å; N276-Y278 PolarHBondContact O-N 3.48Å; N276-H281 HydrophobicContact CB-CB 3.82Å; N276-A282 HydrophobicContact CB-CB 4.41Å
277	G	94.9	Very high	95.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.214	C	C	.	.	S	Bend	trans	74.2	-16	172.8	0	0	0	0	0	116	A264 E265 T275	A264-G277 CarbonylContact C-O 3.1Å; E265-G277 WeakPolarHBondContact CA-O 3.36Å; E265-G277 WeakPolarHBondContact CB-O 3.47Å; E265-G277 PolarHBondContact N-O 3.11Å; T275-G277 VanDerWaalsContact C-N 3.31Å; T275-G277 PolarHBondContact OG1-N 2.93Å
278	Y	96.4	Very high	95	Very high	11 Å²	11	39.6 Å²	39.6	4%	0.043	21%	0.21	C	C	.	.	S	Bend	trans	-144.9	136.7	-176.2	178.9	-122.7	0	0	0	110.7	L253 P256 R260 Y261 A264 N276 P280 H281 A282	L253-Y278 WeakPolarHBondContact O-CE1 3.46Å; L253-Y278 PolarHBondContact O-OH 3.38Å; P256-Y278 HydrophobicContact CB-CD1 4.4Å; P256-Y278 HydrophobicContact CB-CE1 3.93Å; P256-Y278 HydrophobicContact CG-CD1 3.72Å; P256-Y278 HydrophobicContact CG-CE1 3.67Å; P256-Y278 HydrophobicContact CG-CG 4.34Å; R260-Y278 HydrophobicContact CG-CE2 4.36Å; R260-Y278 VanDerWaalsContact CZ-OH 3.24Å; R260-Y278 PolarHBondContact NE-OH 2.71Å; R260-Y278 PolarHBondContact NH2-OH 3.36Å; R260-Y278 VanDerWaalsContact NH2-OH 3.16Å; Y261-Y278 HydrophobicContact CD2-CG 4.34Å; A264-Y278 HydrophobicContact CB-CD2 3.76Å; N276-Y278 PolarHBondContact O-N 3.48Å; Y278-P280 HydrophobicContact CD1-CB 4.12Å; Y278-P280 HydrophobicContact CD1-CG 4.03Å; Y278-P280 HydrophobicContact CE1-CB 3.8Å; Y278-P280 VanDerWaalsContact CE1-CD 3.45Å; Y278-P280 HydrophobicContact CE1-CG 3.44Å; Y278-P280 VanDerWaalsContact CE1-CG 3.44Å; Y278-P280 HydrophobicContact CE2-CG 4.43Å; Y278-H281 HydrophobicContact CD1-CB 4.49Å; Y278-H281 AromaticContact CD1-CD2 3.75Å; Y278-H281 AromaticContact CD1-CG 3.96Å; Y278-H281 CarbonylContact O-C 3.52Å; Y278-H281 WeakPolarHBondContact O-CA 3.45Å; Y278-H281 VanDerWaalsContact O-CB 3.28Å; Y278-H281 WeakPolarHBondContact O-CB 3.26Å; Y278-H281 PolarHBondContact O-N 2.83Å; Y278-A282 PolarHBondContact O-N 2.86Å
279	F	94.8	Very high	94.9	Very high	113 Å²	113	42.6 Å²	42.6	50%	0.496	23%	0.228	S	C	.	.	H	α-helix	trans	-56.9	-50.1	-168.1	173.4	-102.8	0	0	0	113.8	W43 H281 A282 V283	W43-F279 HydrophobicContact CB-CD2 4.34Å; W43-F279 AromaticContact CD1-CD2 3.9Å; W43-F279 HydrophobicContact CD2-CB 4.03Å; W43-F279 AromaticContact CD2-CD2 3.77Å; W43-F279 HydrophobicContact CD2-CD2 3.77Å; W43-F279 HydrophobicContact CD2-CG 4.4Å; W43-F279 HydrophobicContact CE3-CB 3.69Å; W43-F279 HydrophobicContact CE3-CD2 4.32Å; W43-F279 AromaticContact CG-CD2 3.75Å; W43-F279 HydrophobicContact CG-CD2 3.75Å; W43-F279 HydrophobicContact CG-CE2 4.44Å; W43-F279 HydrophobicContact CH2-CB 4.49Å; W43-F279 HydrophobicContact CZ3-CB 3.94Å; W43-F279 VanDerWaalsContact CZ3-N 3.3Å; F279-H281 VanDerWaalsContact C-N 3.25Å; F279-H281 PolarHBondContact O-N 3.3Å; F279-A282 WeakPolarHBondContact O-CB 3.48Å; F279-A282 PolarHBondContact O-N 3.44Å; F279-V283 HydrophobicContact CE1-CG2 4.12Å; F279-V283 HydrophobicContact CE2-CG2 4.04Å; F279-V283 HydrophobicContact CZ-CG2 3.83Å; F279-V283 PolarHBondContact O-N 3.47Å
280	P	96.4	Very high	94.7	Very high	23 Å²	23	50.2 Å²	50.2	15%	0.149	26%	0.256	C	S	.	.	H	α-helix	trans	-54.9	-39	172	-29.6	36.9	0	0	0	113.8	L253 Y278 V283 M284	L253-P280 HydrophobicContact CD1-CG 4.23Å; L253-P280 HydrophobicContact CG-CG 4.17Å; Y278-P280 HydrophobicContact CD1-CB 4.12Å; Y278-P280 HydrophobicContact CD1-CG 4.03Å; Y278-P280 HydrophobicContact CE1-CB 3.8Å; Y278-P280 VanDerWaalsContact CE1-CD 3.45Å; Y278-P280 HydrophobicContact CE1-CG 3.44Å; Y278-P280 VanDerWaalsContact CE1-CG 3.44Å; Y278-P280 HydrophobicContact CE2-CG 4.43Å; P280-V283 PolarHBondContact O-N 3.24Å; P280-M284 VanDerWaalsContact O-CG 3.29Å; P280-M284 WeakPolarHBondContact O-CG 3.42Å; P280-M284 PolarHBondContact O-N 3.45Å
281	H	97.4	Very high	94.6	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-67.3	-36.5	176.5	-72.4	-166	0	0	0	111.9	F239 F240 D254 Y261 N276 Y278 F279 M284 G285	F239-H281 HydrophobicContact CB-CB 4.44Å; F239-H281 HydrophobicContact CD2-CB 3.82Å; F239-H281 VanDerWaalsContact CE2-O 3.27Å; F239-H281 WeakPolarHBondContact CE2-O 3.3Å; F239-H281 PolarHBondContact N-CE1 3.2Å; F239-H281 PolarHBondContact N-ND1 3.04Å; F239-H281 VanDerWaalsContact N-ND1 3.1Å; F240-H281 PolarHBondContact O-CE1 3.28Å; F240-H281 PolarHBondContact O-NE2 2.96Å; D254-H281 PolarHBondContact O-CD2 2.93Å; D254-H281 PolarHBondContact O-NE2 3.16Å; Y261-H281 AromaticContact CD2-ND1 3.99Å; Y261-H281 AromaticContact CE2-CE1 3.97Å; Y261-H281 AromaticContact CE2-ND1 3.5Å; N276-H281 HydrophobicContact CB-CB 3.82Å; Y278-H281 HydrophobicContact CD1-CB 4.49Å; Y278-H281 AromaticContact CD1-CD2 3.75Å; Y278-H281 AromaticContact CD1-CG 3.96Å; Y278-H281 CarbonylContact O-C 3.52Å; Y278-H281 WeakPolarHBondContact O-CA 3.45Å; Y278-H281 VanDerWaalsContact O-CB 3.28Å; Y278-H281 WeakPolarHBondContact O-CB 3.26Å; Y278-H281 PolarHBondContact O-N 2.83Å; F279-H281 VanDerWaalsContact C-N 3.25Å; F279-H281 PolarHBondContact O-N 3.3Å; H281-M284 PolarHBondContact O-N 2.94Å; H281-G285 PolarHBondContact O-N 3.32Å
282	A	95.4	Very high	94.5	Very high	20 Å²	20	53 Å²	53	17%	0.165	26%	0.263	C	S	.	.	H	α-helix	trans	-67.1	-39.4	176.1	0	0	0	0	0	112.1	W43 N276 Y278 F279 G285 W286	W43-A282 HydrophobicContact CH2-CB 3.82Å; W43-A282 HydrophobicContact CZ2-CB 3.29Å; N276-A282 HydrophobicContact CB-CB 4.41Å; Y278-A282 PolarHBondContact O-N 2.86Å; F279-A282 WeakPolarHBondContact O-CB 3.48Å; F279-A282 PolarHBondContact O-N 3.44Å; A282-G285 PolarHBondContact O-N 3.26Å; A282-W286 WeakPolarHBondContact O-CB 3.47Å; A282-W286 PolarHBondContact O-N 2.89Å
283	V	94.5	Very high	94.6	Very high	67 Å²	67	54.1 Å²	54.1	41%	0.406	28%	0.275	S	S	.	.	H	α-helix	trans	-62	-47.6	172.3	176.3	0	0	0	0	110.2	F279 P280 G285 W286 V287	F279-V283 HydrophobicContact CE1-CG2 4.12Å; F279-V283 HydrophobicContact CE2-CG2 4.04Å; F279-V283 HydrophobicContact CZ-CG2 3.83Å; F279-V283 PolarHBondContact O-N 3.47Å; P280-V283 PolarHBondContact O-N 3.24Å; V283-G285 PolarHBondContact O-N 3.03Å; V283-W286 PolarHBondContact O-N 3.44Å; V283-V287 WeakPolarHBondContact O-CG2 3.27Å; V283-V287 PolarHBondContact O-N 3.21Å
284	M	95.4	Very high	94.6	Very high	68 Å²	68	54.8 Å²	54.8	34%	0.335	29%	0.285	S	S	.	.	H	α-helix	trans	-58.5	-46.6	176.2	-70.9	176.1	71.5	0	0	111.9	F239 D254 P280 H281 W286 V287 T288	F239-M284 HydrophobicContact CD1-CE 3.9Å; F239-M284 HydrophobicContact CD2-CB 4.37Å; F239-M284 HydrophobicContact CE1-CB 4.27Å; F239-M284 HydrophobicContact CE1-CE 4.19Å; F239-M284 HydrophobicContact CE2-CB 3.98Å; F239-M284 HydrophobicContact CG-CE 4.39Å; F239-M284 HydrophobicContact CZ-CB 3.92Å; D254-M284 HydrophobicContact CB-SD 4.07Å; P280-M284 VanDerWaalsContact O-CG 3.29Å; P280-M284 WeakPolarHBondContact O-CG 3.42Å; P280-M284 PolarHBondContact O-N 3.45Å; H281-M284 PolarHBondContact O-N 2.94Å; M284-W286 VanDerWaalsContact C-N 3.34Å; M284-W286 PolarHBondContact O-N 3.11Å; M284-V287 PolarHBondContact O-N 3.49Å; M284-T288 WeakPolarHBondContact O-CG2 3.35Å; M284-T288 PolarHBondContact O-N 2.77Å; M284-T288 PolarHBondContact O-OG1 3.4Å; M284-T288 VanDerWaalsContact O-OG1 3.05Å
285	G	95	Very high	94.4	Very high	2 Å²	2	54.9 Å²	54.9	2%	0.021	29%	0.294	C	S	.	.	H	α-helix	trans	-60.5	-41.6	177.7	0	0	0	0	0	112.7	H281 A282 V283 T288 T289	H281-G285 PolarHBondContact O-N 3.32Å; A282-G285 PolarHBondContact O-N 3.26Å; V283-G285 PolarHBondContact O-N 3.03Å; G285-T288 PolarHBondContact O-OG1 3.39Å; G285-T289 WeakPolarHBondContact O-CB 3.49Å; G285-T289 WeakPolarHBondContact O-CG2 3.21Å; G285-T289 PolarHBondContact O-N 3.3Å; G285-T289 PolarHBondContact O-OG1 2.89Å
286	W	93.6	Very high	94.4	Very high	127 Å²	127	58.5 Å²	58.5	48%	0.481	31%	0.312	S	S	.	.	H	α-helix	trans	-64	-46.6	175.2	178.3	79.7	0	0	0	111.8	A282 V283 M284 T288 T289 R290 L291	A282-W286 WeakPolarHBondContact O-CB 3.47Å; A282-W286 PolarHBondContact O-N 2.89Å; V283-W286 PolarHBondContact O-N 3.44Å; M284-W286 VanDerWaalsContact C-N 3.34Å; M284-W286 PolarHBondContact O-N 3.11Å; W286-T288 PolarHBondContact O-N 3.28Å; W286-T289 PolarHBondContact O-N 3.23Å; W286-R290 HydrophobicContact CG-CG 4.36Å; W286-R290 WeakPolarHBondContact O-CA 3.38Å; W286-R290 VanDerWaalsContact O-CB 3.24Å; W286-R290 WeakPolarHBondContact O-CB 3.49Å; W286-R290 PolarHBondContact O-N 3.38Å; W286-L291 HydrophobicContact CE3-CD1 4.1Å; W286-L291 HydrophobicContact CE3-CG 4.3Å; W286-L291 HydrophobicContact CH2-CD1 3.58Å; W286-L291 HydrophobicContact CH2-CD2 3.76Å; W286-L291 HydrophobicContact CH2-CG 3.77Å; W286-L291 HydrophobicContact CZ2-CD1 4.47Å; W286-L291 HydrophobicContact CZ2-CD2 4Å; W286-L291 HydrophobicContact CZ2-CG 4.18Å; W286-L291 HydrophobicContact CZ3-CD1 3.36Å; W286-L291 HydrophobicContact CZ3-CD2 4.35Å; W286-L291 HydrophobicContact CZ3-CG 3.84Å
287	V	93.8	Very high	94.2	Very high	52 Å²	52	58.2 Å²	58.2	32%	0.315	31%	0.311	S	S	.	.	I	π-helix	trans	-58.7	-49.1	176.9	172.3	0	0	0	0	110.8	V283 M284 T289 L291 V292	V283-V287 WeakPolarHBondContact O-CG2 3.27Å; V283-V287 PolarHBondContact O-N 3.21Å; M284-V287 PolarHBondContact O-N 3.49Å; V287-T289 VanDerWaalsContact C-N 3.31Å; V287-T289 PolarHBondContact O-N 2.86Å; V287-L291 HydrophobicContact CG2-CD1 4.3Å; V287-L291 PolarHBondContact O-N 3.28Å; V287-V292 HydrophobicContact CG1-CG2 3.97Å; V287-V292 PolarHBondContact O-N 2.89Å
288	T	93.4	Very high	94.3	Very high	29 Å²	29	60.5 Å²	60.5	18%	0.178	32%	0.323	C	S	.	.	I	π-helix	trans	-73.9	-18.3	-174.8	57.6	0	0	0	0	114.1	M284 G285 W286 V297	M284-T288 WeakPolarHBondContact O-CG2 3.35Å; M284-T288 PolarHBondContact O-N 2.77Å; M284-T288 PolarHBondContact O-OG1 3.4Å; M284-T288 VanDerWaalsContact O-OG1 3.05Å; G285-T288 PolarHBondContact O-OG1 3.39Å; W286-T288 PolarHBondContact O-N 3.28Å; T288-V297 WeakPolarHBondContact O-CG2 3.32Å
289	T	92.4	Very high	94.3	Very high	63 Å²	63	66.5 Å²	66.5	39%	0.387	35%	0.35	S	S	.	.	I	π-helix	trans	-110.2	-20.5	-179.5	58.4	0	0	0	0	114.8	M199 G285 W286 V287	M199-T289 HydrophobicContact CB-CG2 4.32Å; M199-T289 HydrophobicContact CE-CG2 3.36Å; G285-T289 WeakPolarHBondContact O-CB 3.49Å; G285-T289 WeakPolarHBondContact O-CG2 3.21Å; G285-T289 PolarHBondContact O-N 3.3Å; G285-T289 PolarHBondContact O-OG1 2.89Å; W286-T289 PolarHBondContact O-N 3.23Å; V287-T289 VanDerWaalsContact C-N 3.31Å; V287-T289 PolarHBondContact O-N 2.86Å
290	R	90.6	Very high	94.3	Very high	167 Å²	167	65.4 Å²	65.4	63%	0.63	35%	0.349	S	S	*	.	I	π-helix	trans	-115.8	-34.2	-175	-56.7	-58.5	-172.8	133.7	-5.3	114	W286	W286-R290 HydrophobicContact CG-CG 4.36Å; W286-R290 WeakPolarHBondContact O-CA 3.38Å; W286-R290 VanDerWaalsContact O-CB 3.24Å; W286-R290 WeakPolarHBondContact O-CB 3.49Å; W286-R290 PolarHBondContact O-N 3.38Å
291	L	91.1	Very high	94.2	Very high	104 Å²	104	65.2 Å²	65.2	55%	0.545	35%	0.35	S	S	.	.	I	π-helix	trans	-97.3	-43	-176.9	-65.7	-171.9	0	0	0	112.7	W286 V287	W286-L291 HydrophobicContact CE3-CD1 4.1Å; W286-L291 HydrophobicContact CE3-CG 4.3Å; W286-L291 HydrophobicContact CH2-CD1 3.58Å; W286-L291 HydrophobicContact CH2-CD2 3.76Å; W286-L291 HydrophobicContact CH2-CG 3.77Å; W286-L291 HydrophobicContact CZ2-CD1 4.47Å; W286-L291 HydrophobicContact CZ2-CD2 4Å; W286-L291 HydrophobicContact CZ2-CG 4.18Å; W286-L291 HydrophobicContact CZ3-CD1 3.36Å; W286-L291 HydrophobicContact CZ3-CD2 4.35Å; W286-L291 HydrophobicContact CZ3-CG 3.84Å; V287-L291 HydrophobicContact CG2-CD1 4.3Å; V287-L291 PolarHBondContact O-N 3.28Å
292	V	92.4	Very high	94.1	Very high	47 Å²	47	65.8 Å²	65.8	29%	0.285	36%	0.355	S	S	.	.	S	Bend	trans	-94.2	127.1	-173.6	-174	0	0	0	0	109.8	V287 S294 I296 V297	V287-V292 HydrophobicContact CG1-CG2 3.97Å; V287-V292 PolarHBondContact O-N 2.89Å; V292-S294 PolarHBondContact O-N 3.45Å; V292-I296 HydrophobicContact CG1-CB 3.81Å; V292-I296 HydrophobicContact CG1-CG2 3.78Å; V292-V297 HydrophobicContact CB-CG2 3.88Å; V292-V297 HydrophobicContact CG1-CG2 3.63Å
293	P	94.3	Very high	94.2	Very high	74 Å²	74	72.3 Å²	72.3	48%	0.481	38%	0.376	S	S	.	.			trans	-52.4	136.7	171.1	-27.2	33.7	0	0	0	112.1	S295 I296 V297	P293-S295 PolarHBondContact O-N 3.47Å; P293-S295 VanDerWaalsContact O-N 3.16Å; P293-I296 HydrophobicContact CB-CD1 4.37Å; P293-I296 HydrophobicContact CB-CG1 4.37Å; P293-I296 HydrophobicContact CG-CD1 4.15Å; P293-I296 WeakPolarHBondContact O-CB 3.42Å; P293-I296 PolarHBondContact O-N 3.23Å; P293-V297 PolarHBondContact O-N 2.9Å
294	S	92.9	Very high	94.2	Very high	81 Å²	81	73 Å²	73	57%	0.566	38%	0.375	S	S	*	.	H	α-helix	trans	-57.3	-34.5	-175.7	58.2	0	0	0	0	113.1	V292 I296 V297 I298	V292-S294 PolarHBondContact O-N 3.45Å; S294-I296 VanDerWaalsContact C-N 3.29Å; S294-I296 PolarHBondContact O-N 2.89Å; S294-V297 PolarHBondContact O-N 2.85Å; S294-I298 WeakPolarHBondContact O-CB 3.43Å; S294-I298 WeakPolarHBondContact O-CD1 3.42Å; S294-I298 WeakPolarHBondContact O-CG1 3.35Å; S294-I298 PolarHBondContact O-N 3.34Å
295	S	94.2	Very high	94.3	Very high	79 Å²	79	69.9 Å²	69.9	55%	0.552	36%	0.36	S	S	*	.	H	α-helix	trans	-57.9	-39.6	175.2	55.9	0	0	0	0	112.7	P293 F299	P293-S295 PolarHBondContact O-N 3.47Å; P293-S295 VanDerWaalsContact O-N 3.16Å; S295-F299 VanDerWaalsContact O-CB 3.26Å; S295-F299 WeakPolarHBondContact O-CB 3.37Å; S295-F299 PolarHBondContact O-N 3.47Å
296	I	95.6	Very high	94.4	Very high	80 Å²	80	76.2 Å²	76.2	41%	0.41	38%	0.383	S	S	.	.	H	α-helix	trans	-71	-43.5	177.9	-61.4	-179.8	0	0	0	110.2	V292 P293 S294 I298 F299 L300	V292-I296 HydrophobicContact CG1-CB 3.81Å; V292-I296 HydrophobicContact CG1-CG2 3.78Å; P293-I296 HydrophobicContact CB-CD1 4.37Å; P293-I296 HydrophobicContact CB-CG1 4.37Å; P293-I296 HydrophobicContact CG-CD1 4.15Å; P293-I296 WeakPolarHBondContact O-CB 3.42Å; P293-I296 PolarHBondContact O-N 3.23Å; S294-I296 VanDerWaalsContact C-N 3.29Å; S294-I296 PolarHBondContact O-N 2.89Å; I296-I298 PolarHBondContact O-N 2.93Å; I296-F299 PolarHBondContact O-N 3.28Å; I296-L300 HydrophobicContact CG2-CD1 3.94Å; I296-L300 HydrophobicContact CG2-CG 4.28Å; I296-L300 WeakPolarHBondContact O-CB 3.17Å; I296-L300 WeakPolarHBondContact O-CG 3.37Å; I296-L300 PolarHBondContact O-N 3.47Å
297	V	94.6	Very high	94.5	Very high	15 Å²	15	75.7 Å²	75.7	9%	0.091	39%	0.39	C	S	.	.	H	α-helix	trans	-60.3	-46.4	177.3	180	0	0	0	0	111	Y200 T288 V292 P293 S294 L300 G301	Y200-V297 HydrophobicContact CD1-CG1 4.14Å; Y200-V297 HydrophobicContact CD2-CG1 3.87Å; Y200-V297 HydrophobicContact CE1-CG1 3.98Å; Y200-V297 HydrophobicContact CE2-CG1 3.69Å; Y200-V297 HydrophobicContact CG-CG1 4.09Å; T288-V297 WeakPolarHBondContact O-CG2 3.32Å; V292-V297 HydrophobicContact CB-CG2 3.88Å; V292-V297 HydrophobicContact CG1-CG2 3.63Å; P293-V297 PolarHBondContact O-N 2.9Å; S294-V297 PolarHBondContact O-N 2.85Å; V297-L300 PolarHBondContact O-N 2.79Å; V297-G301 PolarHBondContact O-N 3.48Å
298	I	95.4	Very high	94.5	Very high	49 Å²	49	77.3 Å²	77.3	25%	0.251	39%	0.394	S	S	.	.	H	α-helix	trans	-62.2	-45	177.1	-67.2	165.4	0	0	0	110.4	P201 P203 S294 I296 G301 A302	P201-I298 HydrophobicContact CB-CD1 4.35Å; P201-I298 HydrophobicContact CB-CG1 4.5Å; P201-I298 HydrophobicContact CG-CD1 4.21Å; P203-I298 HydrophobicContact CG-CG2 3.77Å; S294-I298 WeakPolarHBondContact O-CB 3.43Å; S294-I298 WeakPolarHBondContact O-CD1 3.42Å; S294-I298 WeakPolarHBondContact O-CG1 3.35Å; S294-I298 PolarHBondContact O-N 3.34Å; I296-I298 PolarHBondContact O-N 2.93Å; I298-G301 PolarHBondContact O-N 2.96Å; I298-A302 VanDerWaalsContact O-CB 3.3Å; I298-A302 WeakPolarHBondContact O-CB 3.47Å; I298-A302 PolarHBondContact O-N 3.2Å
299	F	96.2	Very high	94.7	Very high	136 Å²	136	78.2 Å²	78.2	60%	0.596	39%	0.394	S	S	*	.	H	α-helix	trans	-60.9	-49.2	178.3	173.8	-98.9	0	0	0	112.4	S295 I296 A302 R303	S295-F299 VanDerWaalsContact O-CB 3.26Å; S295-F299 WeakPolarHBondContact O-CB 3.37Å; S295-F299 PolarHBondContact O-N 3.47Å; I296-F299 PolarHBondContact O-N 3.28Å; F299-A302 PolarHBondContact O-N 2.99Å; F299-R303 PolarHBondContact O-N 3.32Å
300	L	94.9	Very high	94.8	Very high	91 Å²	91	79.2 Å²	79.2	48%	0.476	40%	0.4	S	S	.	.	H	α-helix	trans	-64.2	-42.5	178.5	-69.5	176.8	0	0	0	111.5	I296 V297 R303 M304	I296-L300 HydrophobicContact CG2-CD1 3.94Å; I296-L300 HydrophobicContact CG2-CG 4.28Å; I296-L300 WeakPolarHBondContact O-CB 3.17Å; I296-L300 WeakPolarHBondContact O-CG 3.37Å; I296-L300 PolarHBondContact O-N 3.47Å; V297-L300 PolarHBondContact O-N 2.79Å; L300-R303 PolarHBondContact O-N 3.34Å; L300-M304 PolarHBondContact O-N 3.07Å
301	G	94.4	Very high	95	Very high	18 Å²	18	72.3 Å²	72.3	19%	0.186	38%	0.381	C	S	.	.	H	α-helix	trans	-60.2	-45.2	174.4	0	0	0	0	0	112.4	V297 I298 R303 M304 N305	V297-G301 PolarHBondContact O-N 3.48Å; I298-G301 PolarHBondContact O-N 2.96Å; G301-R303 PolarHBondContact O-N 3.33Å; G301-M304 PolarHBondContact O-N 3.5Å; G301-N305 WeakPolarHBondContact O-CB 3.42Å; G301-N305 PolarHBondContact O-N 3.38Å
302	A	95.9	Very high	95.1	Very high	13 Å²	13	70 Å²	70	11%	0.107	37%	0.365	C	S	.	.	H	α-helix	trans	-61.3	-43.9	176.1	0	0	0	0	0	112	P203 I298 F299 N305 R306	P203-A302 HydrophobicContact CB-CB 3.86Å; P203-A302 HydrophobicContact CG-CB 3.93Å; I298-A302 VanDerWaalsContact O-CB 3.3Å; I298-A302 WeakPolarHBondContact O-CB 3.47Å; I298-A302 PolarHBondContact O-N 3.2Å; F299-A302 PolarHBondContact O-N 2.99Å; A302-N305 PolarHBondContact O-N 3.48Å; A302-R306 WeakPolarHBondContact O-CB 3.22Å; A302-R306 VanDerWaalsContact O-CG 3.3Å; A302-R306 WeakPolarHBondContact O-CG 3.33Å; A302-R306 PolarHBondContact O-N 3.46Å
303	R	97	Very high	95.2	Very high	157 Å²	157	68.8 Å²	68.8	59%	0.592	36%	0.357	S	S	*	.	H	α-helix	trans	-59.8	-47.8	176.3	-176.8	179.5	176.3	-173.5	-0.5	111.1	F299 L300 G301 N305 R306 L307	F299-R303 PolarHBondContact O-N 3.32Å; L300-R303 PolarHBondContact O-N 3.34Å; G301-R303 PolarHBondContact O-N 3.33Å; R303-N305 PolarHBondContact O-N 3.4Å; R303-R306 PolarHBondContact O-N 3.13Å; R303-L307 WeakPolarHBondContact O-CG 3.26Å; R303-L307 PolarHBondContact O-N 3.41Å; R303-L307 VanDerWaalsContact O-N 3.13Å
304	M	95.3	Very high	95.2	Very high	81 Å²	81	70.2 Å²	70.2	40%	0.399	36%	0.357	S	S	.	.	H	α-helix	trans	-59.5	-47.4	177.3	-177.4	-178.8	68	0	0	111.6	L300 G301 R306 L307 Q308	L300-M304 PolarHBondContact O-N 3.07Å; G301-M304 PolarHBondContact O-N 3.5Å; M304-R306 PolarHBondContact O-N 2.94Å; M304-L307 WeakPolarHBondContact O-CB 3.47Å; M304-L307 PolarHBondContact O-N 2.89Å; M304-Q308 WeakPolarHBondContact O-CG 3.22Å; M304-Q308 PolarHBondContact O-N 3.36Å
305	N	96.7	Very high	95.2	Very high	3 Å²	3	72.7 Å²	72.7	2%	0.016	35%	0.354	C	S	.	.	H	α-helix	trans	-65.9	-37.6	-178.7	-74.6	-13.3	0	0	0	112.5	P147 V202 P203 L204 G301 A302 R303 L307 Q308 R309	P147-N305 HydrophobicContact CB-CB 3.8Å; P147-N305 HydrophobicContact CG-CB 4.11Å; V202-N305 VanDerWaalsContact CG1-ND2 3.34Å; V202-N305 WeakPolarHBondContact CG1-ND2 3.49Å; P203-N305 PolarHBondContact O-ND2 2.95Å; L204-N305 HydrophobicContact CB-CB 4.08Å; L204-N305 HydrophobicContact CD2-CB 4.21Å; G301-N305 WeakPolarHBondContact O-CB 3.42Å; G301-N305 PolarHBondContact O-N 3.38Å; A302-N305 PolarHBondContact O-N 3.48Å; R303-N305 PolarHBondContact O-N 3.4Å; N305-L307 VanDerWaalsContact C-N 3.34Å; N305-L307 PolarHBondContact O-N 2.95Å; N305-Q308 PolarHBondContact O-N 3.38Å; N305-R309 WeakPolarHBondContact O-CB 3.2Å; N305-R309 PolarHBondContact O-N 3.34Å
306	R	97.5	Very high	95.1	Very high	134 Å²	134	73.7 Å²	73.7	51%	0.506	35%	0.346	S	S	.	.	H	α-helix	trans	-61.4	-41.6	172.9	-74.3	176.4	-175.4	178.6	4.3	111.8	Y149 L204 A302 R303 M304 R309 T310	Y149-R306 PolarHBondContact OH-NE 3.41Å; L204-R306 HydrophobicContact CD1-CG 4.33Å; L204-R306 HydrophobicContact CD2-CG 4.01Å; A302-R306 WeakPolarHBondContact O-CB 3.22Å; A302-R306 VanDerWaalsContact O-CG 3.3Å; A302-R306 WeakPolarHBondContact O-CG 3.33Å; A302-R306 PolarHBondContact O-N 3.46Å; R303-R306 PolarHBondContact O-N 3.13Å; M304-R306 PolarHBondContact O-N 2.94Å; R306-R309 WeakPolarHBondContact O-CB 3.44Å; R306-R309 PolarHBondContact O-N 3.39Å; R306-T310 PolarHBondContact O-N 3.09Å; R306-T310 PolarHBondContact O-OG1 3.45Å; R306-T310 VanDerWaalsContact O-OG1 3.08Å
307	L	95.9	Very high	94.9	Very high	117 Å²	117	76.6 Å²	76.6	61%	0.613	35%	0.351	S	S	*	.	H	α-helix	trans	-64	-45.4	176	-70.5	171.2	0	0	0	111.8	R303 M304 N305 R309 T310 G311	R303-L307 WeakPolarHBondContact O-CG 3.26Å; R303-L307 PolarHBondContact O-N 3.41Å; R303-L307 VanDerWaalsContact O-N 3.13Å; M304-L307 WeakPolarHBondContact O-CB 3.47Å; M304-L307 PolarHBondContact O-N 2.89Å; N305-L307 VanDerWaalsContact C-N 3.34Å; N305-L307 PolarHBondContact O-N 2.95Å; L307-R309 VanDerWaalsContact C-N 3.33Å; L307-R309 PolarHBondContact O-N 2.94Å; L307-T310 PolarHBondContact O-N 3.07Å; L307-G311 PolarHBondContact O-N 2.91Å
308	Q	94.4	Very high	94.9	Very high	85 Å²	85	79.9 Å²	79.9	40%	0.397	37%	0.368	S	S	.	.	H	α-helix	trans	-60.3	-43.3	176.5	-72.5	-177	-2.6	0	0	111.9	P147 M304 N305 G311 Y312	P147-Q308 HydrophobicContact CG-CB 4Å; M304-Q308 WeakPolarHBondContact O-CG 3.22Å; M304-Q308 PolarHBondContact O-N 3.36Å; N305-Q308 PolarHBondContact O-N 3.38Å; Q308-G311 PolarHBondContact O-N 3.08Å; Q308-Y312 WeakPolarHBondContact O-CB 3.37Å; Q308-Y312 PolarHBondContact O-N 2.92Å
309	R	95.9	Very high	94.7	Very high	49 Å²	49	85.1 Å²	85.1	19%	0.185	39%	0.385	C	S	.	.	H	α-helix	trans	-58.2	-53.7	174.4	-179.4	-178.4	-178.7	-84.9	-2.5	111.6	Y146 P147 E148 L204 N305 R306 L307 G311 Y312 L313	Y146-R309 HydrophobicContact CD2-CG 4.48Å; P147-R309 VanDerWaalsContact O-CB 3.27Å; P147-R309 WeakPolarHBondContact O-CB 3.5Å; P147-R309 WeakPolarHBondContact O-CD 3.43Å; P147-R309 WeakPolarHBondContact O-CG 3.33Å; E148-R309 VanDerWaalsContact CD-NE 3.25Å; E148-R309 IonicContact OE1-CZ 3.51Å; E148-R309 IonicContact OE1-NE 3.17Å; E148-R309 PolarHBondContact OE1-NE 3.07Å; E148-R309 IonicContact OE1-NH2 3.08Å; E148-R309 PolarHBondContact OE1-NH2 2.87Å; E148-R309 IonicContact OE2-CZ 2.71Å; E148-R309 IonicContact OE2-NE 2.93Å; E148-R309 PolarHBondContact OE2-NE 3.27Å; E148-R309 VanDerWaalsContact OE2-NE 3.12Å; E148-R309 IonicContact OE2-NH2 3.67Å; E148-R309 PolarHBondContact OE2-NH2 3.42Å; E148-R309 VanDerWaalsContact OE2-NH2 3.08Å; L204-R309 HydrophobicContact CD2-CB 4.29Å; N305-R309 WeakPolarHBondContact O-CB 3.2Å; N305-R309 PolarHBondContact O-N 3.34Å; R306-R309 WeakPolarHBondContact O-CB 3.44Å; R306-R309 PolarHBondContact O-N 3.39Å; L307-R309 VanDerWaalsContact C-N 3.33Å; L307-R309 PolarHBondContact O-N 2.94Å; R309-G311 VanDerWaalsContact C-N 3.32Å; R309-G311 PolarHBondContact O-N 3.49Å; R309-Y312 PolarHBondContact O-N 2.84Å; R309-Y312 VanDerWaalsContact O-N 3.13Å; R309-L313 HydrophobicContact CG-CD1 4Å; R309-L313 HydrophobicContact CG-CG 4.42Å; R309-L313 WeakPolarHBondContact O-CG 3.3Å; R309-L313 PolarHBondContact O-N 3.48Å
310	T	95.9	Very high	94.4	Very high	84 Å²	84	83.6 Å²	83.6	52%	0.515	38%	0.379	S	S	.	.	H	α-helix	trans	-58.1	-45.5	-179.7	-61.4	0	0	0	0	111.2	R306 L307 Y312 L313 H314	R306-T310 PolarHBondContact O-N 3.09Å; R306-T310 PolarHBondContact O-OG1 3.45Å; R306-T310 VanDerWaalsContact O-OG1 3.08Å; L307-T310 PolarHBondContact O-N 3.07Å; T310-Y312 VanDerWaalsContact C-N 3.34Å; T310-Y312 PolarHBondContact O-N 3.41Å; T310-L313 PolarHBondContact O-N 3.34Å; T310-H314 WeakPolarHBondContact O-CB 3.49Å; T310-H314 PolarHBondContact O-N 3.12Å
311	G	94.2	Very high	94.2	Very high	22 Å²	22	85.5 Å²	85.5	23%	0.227	39%	0.386	C	S	.	.	H	α-helix	trans	-62.6	-38.5	176.7	0	0	0	0	0	113.2	L307 Q308 R309 R315	L307-G311 PolarHBondContact O-N 2.91Å; Q308-G311 PolarHBondContact O-N 3.08Å; R309-G311 VanDerWaalsContact C-N 3.32Å; R309-G311 PolarHBondContact O-N 3.49Å; G311-R315 WeakPolarHBondContact O-CG 3.47Å; G311-R315 VanDerWaalsContact O-CZ 3.28Å; G311-R315 PolarHBondContact O-N 2.99Å; G311-R315 VanDerWaalsContact O-N 3.14Å; G311-R315 PolarHBondContact O-NH1 2.95Å
312	Y	93.4	Very high	93.8	Very high	55 Å²	55	93.4 Å²	93.4	22%	0.216	41%	0.41	C	S	.	.	H	α-helix	trans	-64.8	-50.7	175.2	178.2	-91.5	0	0	0	111.8	Y146 Q308 R309 T310 H314 R315 R316	Y146-Y312 AromaticContact CD1-CD1 3.54Å; Y146-Y312 HydrophobicContact CD1-CD1 3.54Å; Y146-Y312 HydrophobicContact CD1-CD2 4.39Å; Y146-Y312 AromaticContact CD1-CE1 3.17Å; Y146-Y312 HydrophobicContact CD1-CE1 3.17Å; Y146-Y312 HydrophobicContact CD1-CE2 4.09Å; Y146-Y312 HydrophobicContact CD1-CG 4.14Å; Y146-Y312 AromaticContact CD1-CZ 3.47Å; Y146-Y312 VanDerWaalsContact CD1-CZ 3.47Å; Y146-Y312 AromaticContact CD2-CD1 3.53Å; Y146-Y312 HydrophobicContact CD2-CD1 3.53Å; Y146-Y312 AromaticContact CD2-CE1 4Å; Y146-Y312 HydrophobicContact CD2-CE1 4Å; Y146-Y312 HydrophobicContact CD2-CG 4.11Å; Y146-Y312 AromaticContact CE1-CD1 3.94Å; Y146-Y312 HydrophobicContact CE1-CD1 3.94Å; Y146-Y312 AromaticContact CE1-CE1 3.34Å; Y146-Y312 HydrophobicContact CE1-CE1 3.34Å; Y146-Y312 AromaticContact CE1-CZ 3.9Å; Y146-Y312 AromaticContact CE2-CD1 3.88Å; Y146-Y312 HydrophobicContact CE2-CD1 3.88Å; Y146-Y312 HydrophobicContact CE2-CE1 4.09Å; Y146-Y312 AromaticContact CG-CD1 3.34Å; Y146-Y312 HydrophobicContact CG-CD1 3.34Å; Y146-Y312 HydrophobicContact CG-CD2 4.22Å; Y146-Y312 AromaticContact CG-CE1 3.55Å; Y146-Y312 HydrophobicContact CG-CE1 3.55Å; Y146-Y312 HydrophobicContact CG-CE2 4.38Å; Y146-Y312 AromaticContact CG-CG 3.71Å; Y146-Y312 HydrophobicContact CG-CG 3.71Å; Y146-Y312 AromaticContact CZ-CE1 3.81Å; Q308-Y312 WeakPolarHBondContact O-CB 3.37Å; Q308-Y312 PolarHBondContact O-N 2.92Å; R309-Y312 PolarHBondContact O-N 2.84Å; R309-Y312 VanDerWaalsContact O-N 3.13Å; T310-Y312 VanDerWaalsContact C-N 3.34Å; T310-Y312 PolarHBondContact O-N 3.41Å; Y312-H314 VanDerWaalsContact C-N 3.29Å; Y312-H314 PolarHBondContact O-N 3.19Å; Y312-R315 PolarHBondContact O-N 3.05Å; Y312-R316 PolarHBondContact O-N 2.99Å
313	L	94	Very high	93.1	Very high	22 Å²	22	97 Å²	97	12%	0.115	43%	0.427	C	S	.	.	H	α-helix	trans	-63.8	-34.6	-179.2	-67.1	177.2	0	0	0	112.4	Y146 R309 T310 R316 R317	Y146-L313 HydrophobicContact CE2-CD2 4.14Å; R309-L313 HydrophobicContact CG-CD1 4Å; R309-L313 HydrophobicContact CG-CG 4.42Å; R309-L313 WeakPolarHBondContact O-CG 3.3Å; R309-L313 PolarHBondContact O-N 3.48Å; T310-L313 PolarHBondContact O-N 3.34Å; L313-R316 PolarHBondContact O-N 3.25Å; L313-R317 PolarHBondContact O-N 3.2Å
314	H	94.5	Very high	91.9	Very high	104 Å²	104	91.1 Å²	91.1	48%	0.481	42%	0.416	S	S	.	.	H	α-helix	trans	-63.9	-49.6	173.4	-179.6	67.2	0	0	0	111.5	T310 Y312 R316 R317 L318	T310-H314 WeakPolarHBondContact O-CB 3.49Å; T310-H314 PolarHBondContact O-N 3.12Å; Y312-H314 VanDerWaalsContact C-N 3.29Å; Y312-H314 PolarHBondContact O-N 3.19Å; H314-R316 VanDerWaalsContact C-N 3.28Å; H314-R316 PolarHBondContact O-N 2.95Å; H314-R317 PolarHBondContact O-N 3.43Å; H314-L318 PolarHBondContact O-N 3.5Å; H314-L318 VanDerWaalsContact O-N 3.07Å
315	R	93.1	Very high	90.3	Very high	133 Å²	133	89.9 Å²	89.9	50%	0.502	42%	0.419	S	S	.	.	H	α-helix	trans	-61.8	-34.6	176	-73.1	-174.4	-63.8	-90.4	0.3	112.9	G311 Y312 R319	G311-R315 WeakPolarHBondContact O-CG 3.47Å; G311-R315 VanDerWaalsContact O-CZ 3.28Å; G311-R315 PolarHBondContact O-N 2.99Å; G311-R315 VanDerWaalsContact O-N 3.14Å; G311-R315 PolarHBondContact O-NH1 2.95Å; Y312-R315 PolarHBondContact O-N 3.05Å; R315-R319 VanDerWaalsContact O-CG 3.31Å; R315-R319 WeakPolarHBondContact O-CG 3.38Å; R315-R319 PolarHBondContact O-N 3.36Å; R315-R319 VanDerWaalsContact O-N 3.17Å
316	R	91.2	Very high	88.4	Confident	99 Å²	99	93.1 Å²	93.1	37%	0.374	44%	0.441	S	S	.	.	H	α-helix	trans	-64.8	-48.1	176.5	-161.3	-177.6	78.6	-161.2	-2.9	111.1	Y312 L313 H314 L318 R319 E320	Y312-R316 PolarHBondContact O-N 2.99Å; L313-R316 PolarHBondContact O-N 3.25Å; H314-R316 VanDerWaalsContact C-N 3.28Å; H314-R316 PolarHBondContact O-N 2.95Å; R316-L318 VanDerWaalsContact C-N 3.35Å; R316-L318 PolarHBondContact O-N 3.38Å; R316-R319 WeakPolarHBondContact O-CB 3.45Å; R316-R319 PolarHBondContact O-N 3.34Å; R316-R319 VanDerWaalsContact O-N 3.11Å; R316-E320 WeakPolarHBondContact CG-OE1 3.3Å; R316-E320 IonicContact NE-OE1 3.39Å; R316-E320 PolarHBondContact NE-OE1 2.86Å; R316-E320 VanDerWaalsContact NE-OE1 3.09Å; R316-E320 WeakPolarHBondContact O-CG 3.42Å; R316-E320 PolarHBondContact O-N 3.23Å
317	R	92.9	Very high	86.4	Confident	141 Å²	141	93.1 Å²	93.1	53%	0.532	45%	0.451	S	S	.	.	H	α-helix	trans	-57.2	-44.2	175.6	-80.4	-176.1	-95.5	172.2	-11.1	112.7	L313 H314 R319 E320 Q321	L313-R317 PolarHBondContact O-N 3.2Å; H314-R317 PolarHBondContact O-N 3.43Å; R317-R319 VanDerWaalsContact C-N 3.31Å; R317-R319 PolarHBondContact O-N 2.71Å; R317-E320 PolarHBondContact O-N 3.08Å; R317-Q321 WeakPolarHBondContact O-CG 3.48Å; R317-Q321 PolarHBondContact O-N 3.41Å
318	L	93.4	Very high	84.3	Confident	85 Å²	85	96.3 Å²	96.3	45%	0.445	46%	0.46	S	S	.	.	H	α-helix	trans	-61.5	-37.8	176.5	-70	175.8	0	0	0	112.7	H314 R316 R322	H314-L318 PolarHBondContact O-N 3.5Å; H314-L318 VanDerWaalsContact O-N 3.07Å; R316-L318 VanDerWaalsContact C-N 3.35Å; R316-L318 PolarHBondContact O-N 3.38Å; L318-R322 WeakPolarHBondContact O-CB 3.26Å; L318-R322 PolarHBondContact O-N 3.27Å
319	R	91.8	Very high	82.2	Confident	159 Å²	159	98 Å²	98	60%	0.6	48%	0.476	S	S	*	.	H	α-helix	trans	-68.5	-42.9	176.2	-70.4	169.4	-178.9	-170.5	-2.6	111.9	R315 R316 R317 Q321 R322 N323	R315-R319 VanDerWaalsContact O-CG 3.31Å; R315-R319 WeakPolarHBondContact O-CG 3.38Å; R315-R319 PolarHBondContact O-N 3.36Å; R315-R319 VanDerWaalsContact O-N 3.17Å; R316-R319 WeakPolarHBondContact O-CB 3.45Å; R316-R319 PolarHBondContact O-N 3.34Å; R316-R319 VanDerWaalsContact O-N 3.11Å; R317-R319 VanDerWaalsContact C-N 3.31Å; R317-R319 PolarHBondContact O-N 2.71Å; R319-Q321 VanDerWaalsContact C-N 3.35Å; R319-R322 PolarHBondContact O-N 3.12Å; R319-N323 WeakPolarHBondContact O-CB 3.42Å; R319-N323 PolarHBondContact O-N 2.87Å; R319-N323 PolarHBondContact O-OD1 3.12Å
320	E	90.3	Very high	79.6	Confident	103 Å²	103	106.3 Å²	106.3	48%	0.481	52%	0.517	S	S	.	.	H	α-helix	trans	-62	-42.8	176.4	-71	163.1	-173.5	0	0	110.9	R316 R317 N323 G324	R316-E320 WeakPolarHBondContact CG-OE1 3.3Å; R316-E320 IonicContact NE-OE1 3.39Å; R316-E320 PolarHBondContact NE-OE1 2.86Å; R316-E320 VanDerWaalsContact NE-OE1 3.09Å; R316-E320 WeakPolarHBondContact O-CG 3.42Å; R316-E320 PolarHBondContact O-N 3.23Å; R317-E320 PolarHBondContact O-N 3.08Å; E320-N323 PolarHBondContact O-N 2.71Å; E320-G324 PolarHBondContact O-N 3.4Å
321	Q	89.5	Confident	78.8	Confident	131 Å²	131	107.4 Å²	107.4	61%	0.612	52%	0.517	S	S	*	.	H	α-helix	trans	-63.6	-45.3	174.7	-74.2	175.2	-17.8	0	0	112.5	R317 R319 G324 A325	R317-Q321 WeakPolarHBondContact O-CG 3.48Å; R317-Q321 PolarHBondContact O-N 3.41Å; R319-Q321 VanDerWaalsContact C-N 3.35Å; Q321-G324 PolarHBondContact O-N 3.49Å; Q321-A325 VanDerWaalsContact O-CB 3.28Å; Q321-A325 WeakPolarHBondContact O-CB 3.38Å; Q321-A325 PolarHBondContact O-N 2.94Å
322	R	86.8	Confident	78	Confident	184 Å²	184	111.9 Å²	111.9	69%	0.694	53%	0.532	S	S	*	.	H	α-helix	trans	-62.8	-43.4	178	-166.7	-179.1	77.8	168.9	9.6	111.9	L318 R319 A325 S326	L318-R322 WeakPolarHBondContact O-CB 3.26Å; L318-R322 PolarHBondContact O-N 3.27Å; R319-R322 PolarHBondContact O-N 3.12Å; R322-A325 PolarHBondContact O-N 3.36Å; R322-S326 PolarHBondContact O-N 3.27Å
323	N	81.1	Confident	77.2	Confident	88 Å²	88	115.1 Å²	115.1	47%	0.471	55%	0.55	S	S	.	.	H	α-helix	trans	-71.4	-38.3	179.7	-66.8	1.7	0	0	0	111.6	R319 E320 A325 S326 L327	R319-N323 WeakPolarHBondContact O-CB 3.42Å; R319-N323 PolarHBondContact O-N 2.87Å; R319-N323 PolarHBondContact O-OD1 3.12Å; E320-N323 PolarHBondContact O-N 2.71Å; N323-A325 VanDerWaalsContact C-N 3.35Å; N323-S326 WeakPolarHBondContact O-CB 3.47Å; N323-S326 PolarHBondContact O-N 2.9Å; N323-L327 PolarHBondContact O-N 3.08Å; N323-L327 VanDerWaalsContact O-N 3.12Å
324	G	72.4	Confident	76.2	Confident	34 Å²	34	120.5 Å²	120.5	35%	0.351	58%	0.575	S	S	.	*	H	α-helix	trans	-69.5	-29.1	174.7	0	0	0	0	0	113.6	E320 Q321	E320-G324 PolarHBondContact O-N 3.4Å; Q321-G324 PolarHBondContact O-N 3.49Å
325	A	60.7	Low	75	Confident	56 Å²	56	121.6 Å²	121.6	46%	0.463	58%	0.581	S	S	.	*	H	α-helix	trans	-71.2	-39.5	170.3	0	0	0	0	0	111.8	Q321 R322 N323 L327 K328 T329	Q321-A325 VanDerWaalsContact O-CB 3.28Å; Q321-A325 WeakPolarHBondContact O-CB 3.38Å; Q321-A325 PolarHBondContact O-N 2.94Å; R322-A325 PolarHBondContact O-N 3.36Å; N323-A325 VanDerWaalsContact C-N 3.35Å; A325-L327 VanDerWaalsContact C-N 3.3Å; A325-L327 PolarHBondContact O-N 3.27Å; A325-K328 PolarHBondContact O-N 3.29Å; A325-T329 PolarHBondContact O-OG1 3.22Å
326	S	58	Low	73.8	Confident	70 Å²	70	120.8 Å²	120.8	49%	0.49	59%	0.587	S	S	.	*	H	α-helix	trans	-62.7	-33.5	175.6	-162.9	0	0	0	0	113	R322 N323 K328 T329	R322-S326 PolarHBondContact O-N 3.27Å; N323-S326 WeakPolarHBondContact O-CB 3.47Å; N323-S326 PolarHBondContact O-N 2.9Å; S326-K328 VanDerWaalsContact C-N 3.34Å; S326-T329 PolarHBondContact O-OG1 3.04Å
327	L	54.2	Low	72.6	Confident	135 Å²	135	122.4 Å²	122.4	71%	0.707	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-10.8	177.4	-74.6	162.3	0	0	0	114.1	N323 A325	N323-L327 PolarHBondContact O-N 3.08Å; N323-L327 VanDerWaalsContact O-N 3.12Å; A325-L327 VanDerWaalsContact C-N 3.3Å; A325-L327 PolarHBondContact O-N 3.27Å
328	K	53.2	Low	71	Confident	184 Å²	184	120.9 Å²	120.9	80%	0.8	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	-2.4	176.4	-75.8	-173.9	176.7	-170.9	0	113.2	A325 S326	A325-K328 PolarHBondContact O-N 3.29Å; S326-K328 VanDerWaalsContact C-N 3.34Å
329	T	49.5	Very low	69.1	Low	121 Å²	121	123.9 Å²	123.9	74%	0.742	62%	0.621	S	S	*	*			trans	-113.3	8.9	-176.8	28.8	0	0	0	0	113.2	A325 S326	A325-T329 PolarHBondContact O-OG1 3.22Å; S326-T329 PolarHBondContact O-OG1 3.04Å
330	E	42.1	Very low	67.1	Low	222 Å²	222	120.7 Å²	120.7	100%	1.037	62%	0.623	S	S	*	*			trans	-109.8	0	165.8	-70	-177.5	170.3	0	0	109.7

Retrieved 330 of 330 residues in 275.2 ms (Link to these results)

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