A0A068BGW6_MOUSE Loading...

MHC class II antigen O region beta locus isoform-003

AlphaFold DB , UniProt , Accession A0A068BGW6, Species MOUSE (Mus musculus, Mouse), Gene H2-Ob, Length 245 aa.

Structure Viewer

Loading PAE data...

(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	40.5	Very low	61.5	Low	252 Å²	252	117 Å²	117	100%	1.241	70%	0.699	S	S	*	*				0	131.2	0	-79.5	132.8	156.9	0	0	108.4
2	G	43.1	Very low	62.5	Low	79 Å²	79	115.1 Å²	115.1	81%	0.814	68%	0.681	S	S	*	*			trans	156.8	51.6	176.7	0	0	0	0	0	112.8	G4	G2-G4 PolarHBondContact O-N 3.45Å; G2-G4 VanDerWaalsContact O-N 3.07Å
3	A	48.3	Very low	63.3	Low	100 Å²	100	112.7 Å²	112.7	83%	0.826	66%	0.663	S	S	*	*			trans	-73	97.5	170	0	0	0	0	0	107.9	R5	A3-R5 PolarHBondContact O-N 2.95Å
4	G	53.4	Low	64.2	Low	78 Å²	78	110.8 Å²	110.8	80%	0.804	65%	0.653	S	S	*	*			trans	-63	103.3	176.4	0	0	0	0	0	110.2	G2 A6	G2-G4 PolarHBondContact O-N 3.45Å; G2-G4 VanDerWaalsContact O-N 3.07Å; G4-A6 PolarHBondContact O-N 3.15Å; G4-A6 VanDerWaalsContact O-N 3.17Å
5	R	58	Low	64.6	Low	243 Å²	243	109.4 Å²	109.4	92%	0.917	64%	0.641	S	S	*	*			trans	-69.1	107.9	167.9	-79.9	-177.6	174.8	-171.4	-1.9	107.5	A3	A3-R5 PolarHBondContact O-N 2.95Å
6	A	60.2	Low	64.7	Low	72 Å²	72	108.1 Å²	108.1	60%	0.595	63%	0.63	S	S	*	*			trans	-55.3	129.9	165.1	0	0	0	0	0	108.2	G4 W8	G4-A6 PolarHBondContact O-N 3.15Å; G4-A6 VanDerWaalsContact O-N 3.17Å; A6-W8 PolarHBondContact O-N 3.29Å
7	P	77.4	Confident	64.8	Low	77 Å²	77	108.9 Å²	108.9	50%	0.5	63%	0.628	S	S	.	*			trans	-55.8	136.9	176.9	-22.3	31.2	0	0	0	109.7	V9 V10 A11	P7-V9 PolarHBondContact O-N 3.47Å; P7-V10 HydrophobicContact CB-CG2 4.23Å; P7-V10 HydrophobicContact CG-CG2 4.17Å; P7-V10 WeakPolarHBondContact O-CA 3.44Å; P7-V10 WeakPolarHBondContact O-CB 3.45Å; P7-V10 PolarHBondContact O-N 2.92Å; P7-A11 PolarHBondContact O-N 2.91Å
8	W	67.9	Low	64.6	Low	202 Å²	202	113.2 Å²	113.2	77%	0.765	63%	0.632	S	S	*	*	H	α-helix	trans	-50.4	-29.7	177	62.1	-81.3	0	0	0	112.6	A6 A11 L12	A6-W8 PolarHBondContact O-N 3.29Å; W8-A11 PolarHBondContact O-N 3.31Å; W8-L12 WeakPolarHBondContact O-CB 3.13Å; W8-L12 PolarHBondContact O-N 2.77Å
9	V	75.8	Confident	64.2	Low	64 Å²	64	113.2 Å²	113.2	39%	0.388	63%	0.63	S	S	.	*	H	α-helix	trans	-60.6	-41.7	173.2	-172.2	0	0	0	0	112.2	P7 L12 L13	P7-V9 PolarHBondContact O-N 3.47Å; V9-L12 PolarHBondContact O-N 2.75Å; V9-L13 HydrophobicContact CG1-CD1 4.07Å; V9-L13 WeakPolarHBondContact O-CB 3.01Å; V9-L13 VanDerWaalsContact O-CG 3.25Å; V9-L13 WeakPolarHBondContact O-CG 3.49Å; V9-L13 PolarHBondContact O-N 2.94Å
10	V	75.3	Confident	63.7	Low	72 Å²	72	112.6 Å²	112.6	44%	0.436	63%	0.626	S	S	.	*	H	α-helix	trans	-69	-41.6	177.2	179.8	0	0	0	0	110.4	P7 L12 L13 V14	P7-V10 HydrophobicContact CB-CG2 4.23Å; P7-V10 HydrophobicContact CG-CG2 4.17Å; P7-V10 WeakPolarHBondContact O-CA 3.44Å; P7-V10 WeakPolarHBondContact O-CB 3.45Å; P7-V10 PolarHBondContact O-N 2.92Å; V10-L12 VanDerWaalsContact C-N 3.33Å; V10-L12 PolarHBondContact O-N 3.49Å; V10-L13 PolarHBondContact O-N 3.12Å; V10-V14 HydrophobicContact CG1-CG2 4.43Å; V10-V14 WeakPolarHBondContact O-CB 3.49Å; V10-V14 VanDerWaalsContact O-CG2 3.24Å; V10-V14 WeakPolarHBondContact O-CG2 3.37Å; V10-V14 PolarHBondContact O-N 3.48Å
11	A	76.2	Confident	63.2	Low	48 Å²	48	110.5 Å²	110.5	40%	0.397	62%	0.619	S	S	.	*	H	α-helix	trans	-63.9	-38.7	175.2	0	0	0	0	0	112	P7 W8 N15	P7-A11 PolarHBondContact O-N 2.91Å; W8-A11 PolarHBondContact O-N 3.31Å; A11-N15 WeakPolarHBondContact O-CB 3.15Å; A11-N15 PolarHBondContact O-N 2.83Å; A11-N15 PolarHBondContact O-ND2 2.86Å
12	L	74.1	Confident	63.6	Low	94 Å²	94	106.2 Å²	106.2	49%	0.492	59%	0.594	S	S	.	*	H	α-helix	trans	-67	-45.3	176.5	-161.3	90.7	0	0	0	111.3	W8 V9 V10 V14 N15 L16	W8-L12 WeakPolarHBondContact O-CB 3.13Å; W8-L12 PolarHBondContact O-N 2.77Å; V9-L12 PolarHBondContact O-N 2.75Å; V10-L12 VanDerWaalsContact C-N 3.33Å; V10-L12 PolarHBondContact O-N 3.49Å; L12-V14 PolarHBondContact O-N 3.22Å; L12-N15 PolarHBondContact O-N 3.26Å; L12-L16 HydrophobicContact CD2-CD1 4.09Å; L12-L16 HydrophobicContact CG-CD1 4.17Å; L12-L16 WeakPolarHBondContact O-CB 3.29Å; L12-L16 WeakPolarHBondContact O-CG 3.4Å; L12-L16 PolarHBondContact O-N 2.78Å
13	L	73.3	Confident	64	Low	84 Å²	84	109.6 Å²	109.6	44%	0.44	59%	0.59	S	S	.	*	H	α-helix	trans	-62.4	-42.4	177.7	-77	168.8	0	0	0	111.9	V9 V10 N15 L16 M17	V9-L13 HydrophobicContact CG1-CD1 4.07Å; V9-L13 WeakPolarHBondContact O-CB 3.01Å; V9-L13 VanDerWaalsContact O-CG 3.25Å; V9-L13 WeakPolarHBondContact O-CG 3.49Å; V9-L13 PolarHBondContact O-N 2.94Å; V10-L13 PolarHBondContact O-N 3.12Å; L13-N15 VanDerWaalsContact C-N 3.34Å; L13-N15 PolarHBondContact O-N 2.96Å; L13-L16 PolarHBondContact O-N 2.84Å; L13-M17 HydrophobicContact CB-CE 4.3Å; L13-M17 WeakPolarHBondContact O-CB 3.42Å; L13-M17 VanDerWaalsContact O-CG 3.26Å; L13-M17 WeakPolarHBondContact O-CG 3.46Å; L13-M17 PolarHBondContact O-N 2.83Å
14	V	74.7	Confident	64.1	Low	86 Å²	86	111.7 Å²	111.7	52%	0.521	59%	0.586	S	S	.	*	H	α-helix	trans	-65	-38.6	175.8	172.9	0	0	0	0	111.3	V10 L12 R18	V10-V14 HydrophobicContact CG1-CG2 4.43Å; V10-V14 WeakPolarHBondContact O-CB 3.49Å; V10-V14 VanDerWaalsContact O-CG2 3.24Å; V10-V14 WeakPolarHBondContact O-CG2 3.37Å; V10-V14 PolarHBondContact O-N 3.48Å; L12-V14 PolarHBondContact O-N 3.22Å; V14-R18 VanDerWaalsContact O-CB 3.24Å; V14-R18 WeakPolarHBondContact O-CB 3.13Å; V14-R18 PolarHBondContact O-N 2.86Å
15	N	70.6	Confident	64	Low	90 Å²	90	115.5 Å²	115.5	48%	0.481	58%	0.583	S	S	.	*	H	α-helix	trans	-69.9	-37.9	175.9	-80.7	-65.1	0	0	0	112.6	A11 L12 L13 R18 L19	A11-N15 WeakPolarHBondContact O-CB 3.15Å; A11-N15 PolarHBondContact O-N 2.83Å; A11-N15 PolarHBondContact O-ND2 2.86Å; L12-N15 PolarHBondContact O-N 3.26Å; L13-N15 VanDerWaalsContact C-N 3.34Å; L13-N15 PolarHBondContact O-N 2.96Å; N15-R18 PolarHBondContact O-N 2.85Å; N15-L19 WeakPolarHBondContact O-CD1 3.23Å; N15-L19 PolarHBondContact O-N 3Å
16	L	66.8	Low	63.7	Low	88 Å²	88	106.5 Å²	106.5	46%	0.461	57%	0.565	S	S	.	*	H	α-helix	trans	-66	-45.7	174.8	-74.7	167.5	0	0	0	111.3	L12 L13 R18 L19 D20	L12-L16 HydrophobicContact CD2-CD1 4.09Å; L12-L16 HydrophobicContact CG-CD1 4.17Å; L12-L16 WeakPolarHBondContact O-CB 3.29Å; L12-L16 WeakPolarHBondContact O-CG 3.4Å; L12-L16 PolarHBondContact O-N 2.78Å; L13-L16 PolarHBondContact O-N 2.84Å; L16-R18 PolarHBondContact O-N 2.89Å; L16-L19 PolarHBondContact O-N 3.42Å; L16-L19 VanDerWaalsContact O-N 3.15Å; L16-D20 PolarHBondContact O-N 2.86Å
17	M	66.9	Low	63.4	Low	122 Å²	122	114 Å²	114	60%	0.601	58%	0.578	S	S	*	*	H	α-helix	trans	-61	-33.7	173.3	-69.3	-179.6	-153.4	0	0	112.3	L13 S21	L13-M17 HydrophobicContact CB-CE 4.3Å; L13-M17 WeakPolarHBondContact O-CB 3.42Å; L13-M17 VanDerWaalsContact O-CG 3.26Å; L13-M17 WeakPolarHBondContact O-CG 3.46Å; L13-M17 PolarHBondContact O-N 2.83Å; M17-S21 PolarHBondContact O-N 2.69Å; M17-S21 PolarHBondContact O-OG 3.42Å
18	R	60.8	Low	62.6	Low	186 Å²	186	118 Å²	118	70%	0.702	60%	0.596	S	S	*	*	H	α-helix	trans	-72.6	-33.6	176.1	-166.3	176.7	-176.6	166.1	2.1	112.8	V14 N15 L16 S21 F22	V14-R18 VanDerWaalsContact O-CB 3.24Å; V14-R18 WeakPolarHBondContact O-CB 3.13Å; V14-R18 PolarHBondContact O-N 2.86Å; N15-R18 PolarHBondContact O-N 2.85Å; L16-R18 PolarHBondContact O-N 2.89Å; R18-S21 VanDerWaalsContact CA-OG 3.31Å; R18-S21 WeakPolarHBondContact CA-OG 3.17Å; R18-S21 PolarHBondContact O-OG 3.28Å; R18-F22 WeakPolarHBondContact O-CB 3.43Å; R18-F22 PolarHBondContact O-N 3.39Å
19	L	56.9	Low	62.5	Low	113 Å²	113	112.9 Å²	112.9	59%	0.592	59%	0.59	S	S	*	*	H	α-helix	trans	-71.4	-40.3	171.6	-102.4	116.2	0	0	0	111.5	N15 L16 F22 M23	N15-L19 WeakPolarHBondContact O-CD1 3.23Å; N15-L19 PolarHBondContact O-N 3Å; L16-L19 PolarHBondContact O-N 3.42Å; L16-L19 VanDerWaalsContact O-N 3.15Å; L19-F22 PolarHBondContact O-N 2.83Å; L19-M23 VanDerWaalsContact O-CG 3.29Å; L19-M23 WeakPolarHBondContact O-CG 3.35Å; L19-M23 PolarHBondContact O-N 2.97Å; L19-M23 VanDerWaalsContact O-N 3.1Å
20	D	54.3	Low	62.4	Low	101 Å²	101	114.6 Å²	114.6	54%	0.54	60%	0.603	S	S	.	*	H	α-helix	trans	-65.9	-39	176.7	-75.3	-23.1	0	0	0	111.7	L16 F22 M23 I24	L16-D20 PolarHBondContact O-N 2.86Å; D20-F22 VanDerWaalsContact C-N 3.34Å; D20-F22 PolarHBondContact O-N 2.92Å; D20-M23 PolarHBondContact O-N 3.5Å; D20-I24 VanDerWaalsContact O-CG1 3.27Å; D20-I24 WeakPolarHBondContact O-CG1 3.19Å; D20-I24 PolarHBondContact O-N 3.09Å
21	S	52.7	Low	62.6	Low	69 Å²	69	119 Å²	119	48%	0.483	62%	0.619	S	S	.	*	H	α-helix	trans	-68.9	-29.9	173.9	37.4	0	0	0	0	113.2	M17 R18 M23 E25	M17-S21 PolarHBondContact O-N 2.69Å; M17-S21 PolarHBondContact O-OG 3.42Å; R18-S21 VanDerWaalsContact CA-OG 3.31Å; R18-S21 WeakPolarHBondContact CA-OG 3.17Å; R18-S21 PolarHBondContact O-OG 3.28Å; S21-M23 VanDerWaalsContact C-N 3.31Å; S21-E25 PolarHBondContact O-N 3.28Å
22	F	49.4	Very low	63.1	Low	162 Å²	162	122.5 Å²	122.5	71%	0.711	63%	0.631	S	S	*	*	H	α-helix	trans	-73	-23.3	173.3	-159.5	-97	0	0	0	113	R18 L19 D20	R18-F22 WeakPolarHBondContact O-CB 3.43Å; R18-F22 PolarHBondContact O-N 3.39Å; L19-F22 PolarHBondContact O-N 2.83Å; D20-F22 VanDerWaalsContact C-N 3.34Å; D20-F22 PolarHBondContact O-N 2.92Å
23	M	50.6	Low	63.7	Low	151 Å²	151	124.5 Å²	124.5	74%	0.744	64%	0.636	S	S	*	*	H	α-helix	trans	-92.8	-17.9	177.3	-63.1	-71.1	-86.6	0	0	113.1	L19 D20 S21	L19-M23 VanDerWaalsContact O-CG 3.29Å; L19-M23 WeakPolarHBondContact O-CG 3.35Å; L19-M23 PolarHBondContact O-N 2.97Å; L19-M23 VanDerWaalsContact O-N 3.1Å; D20-M23 PolarHBondContact O-N 3.5Å; S21-M23 VanDerWaalsContact C-N 3.31Å
24	I	50.6	Low	64.7	Low	144 Å²	144	123.7 Å²	123.7	74%	0.738	63%	0.634	S	S	*	*	H	α-helix	trans	-89.7	-12.8	174.4	-65.4	169.6	0	0	0	112.2	D20 G26	D20-I24 VanDerWaalsContact O-CG1 3.27Å; D20-I24 WeakPolarHBondContact O-CG1 3.19Å; D20-I24 PolarHBondContact O-N 3.09Å; I24-G26 PolarHBondContact O-N 2.58Å
25	E	51.2	Low	65.6	Low	158 Å²	158	125.8 Å²	125.8	74%	0.738	64%	0.641	S	S	*	*	S	Bend	trans	-73.9	66.3	160.1	-158.2	159.1	-164.4	0	0	108.3	S21 R27	S21-E25 PolarHBondContact O-N 3.28Å; E25-R27 PolarHBondContact O-N 3.05Å
26	G	52.8	Low	66.8	Low	53 Å²	53	125 Å²	125	55%	0.546	63%	0.634	S	S	.	*			trans	-47.8	118.9	164.3	0	0	0	0	0	106.2	I24 D28	I24-G26 PolarHBondContact O-N 2.58Å; G26-D28 PolarHBondContact O-N 3.07Å
27	R	53.6	Low	68.3	Low	230 Å²	230	124.1 Å²	124.1	87%	0.868	64%	0.64	S	S	*	*			trans	-59.7	95.5	179.1	-166.5	-174.6	-73.3	165.2	-5.1	106.3	E25 S29	E25-R27 PolarHBondContact O-N 3.05Å; R27-S29 VanDerWaalsContact C-N 3.28Å; R27-S29 PolarHBondContact O-N 3.33Å; R27-S29 PolarHBondContact O-OG 2.85Å
28	D	60.3	Low	69.7	Low	162 Å²	162	123 Å²	123	87%	0.866	63%	0.632	S	S	*	*			trans	-56.1	96.8	-180	-114	-7.7	0	0	0	106.6	G26	G26-D28 PolarHBondContact O-N 3.07Å
29	S	64.7	Low	71.4	Confident	93 Å²	93	117.6 Å²	117.6	65%	0.65	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-77.1	125.4	172.9	-61.2	0	0	0	0	104.6	R27 E31	R27-S29 VanDerWaalsContact C-N 3.28Å; R27-S29 PolarHBondContact O-N 3.33Å; R27-S29 PolarHBondContact O-OG 2.85Å; S29-E31 PolarHBondContact O-N 2.89Å
30	P	74.4	Confident	73.3	Confident	100 Å²	100	114.6 Å²	114.6	65%	0.649	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-56.5	131.6	-177.9	22.3	-31.9	0	0	0	109.4	N32	P30-N32 PolarHBondContact O-N 2.87Å; P30-N32 PolarHBondContact O-ND2 2.89Å
31	E	80.4	Confident	75.2	Confident	165 Å²	165	111.7 Å²	111.7	77%	0.771	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-62.2	117.2	170.8	-66.7	-175.2	171.6	0	0	108.3	S29 F33	S29-E31 PolarHBondContact O-N 2.89Å; E31-F33 HydrophobicContact CB-CE2 3.98Å
32	N	85.1	Confident	77.2	Confident	122 Å²	122	113.3 Å²	113.3	65%	0.652	59%	0.594	S	S	*	*			trans	-104.3	119.1	-177.6	-70.4	-42.9	0	0	0	109.8	P30	P30-N32 PolarHBondContact O-N 2.87Å; P30-N32 PolarHBondContact O-ND2 2.89Å
33	F	88.1	Confident	79.2	Confident	135 Å²	135	109 Å²	109	59%	0.592	58%	0.576	S	S	*	*			trans	-106.7	120.3	170.2	-59.9	-86.6	0	0	0	108.7	E31 F58	E31-F33 HydrophobicContact CB-CE2 3.98Å; F33-F58 HydrophobicContact CD1-CE2 4.47Å; F33-F58 AromaticContact CD1-CZ 3.88Å; F33-F58 HydrophobicContact CD1-CZ 3.88Å
34	V	93.5	Very high	81	Confident	68 Å²	68	105.9 Å²	105.9	41%	0.412	57%	0.565	S	S	.	*			trans	-116	117.8	-175.4	-175.3	0	0	0	0	109.4	Q36 N59	V34-Q36 HydrophobicContact CG1-CG 3.81Å; V34-N59 PolarHBondContact N-OD1 3.34Å; V34-N59 PolarHBondContact O-N 2.85Å
35	I	93.4	Very high	82.7	Confident	129 Å²	129	105 Å²	105	66%	0.662	56%	0.562	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-108.9	128.8	172.5	-55.1	177.6	0	0	0	108	I57 F58	I35-I57 WeakPolarHBondContact CA-O 3.5Å; I35-F58 HydrophobicContact CG1-CD2 3.97Å; I35-F58 HydrophobicContact CG1-CE2 4.33Å
36	Q	97.3	Very high	84.3	Confident	73 Å²	73	98.7 Å²	98.7	34%	0.341	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	142.9	177.2	-47.5	-177.2	-83.3	0	0	110	V34 I57	V34-Q36 HydrophobicContact CG1-CG 3.81Å; Q36-I57 HydrophobicContact CB-CB 4.27Å; Q36-I57 PolarHBondContact N-O 2.77Å; Q36-I57 PolarHBondContact O-N 2.83Å
37	A	96.5	Very high	86.2	Confident	70 Å²	70	98.6 Å²	98.6	58%	0.579	53%	0.528	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.1	127.4	166.7	0	0	0	0	0	108.2	R55 F56	A37-R55 CarbonylContact C-O 3.54Å; A37-R55 VanDerWaalsContact CA-O 3.3Å; A37-R55 WeakPolarHBondContact CA-O 3.45Å; A37-F56 HydrophobicContact CB-CD1 4.26Å; A37-F56 HydrophobicContact CB-CE1 4.31Å
38	K	96.9	Very high	87.9	Confident	100 Å²	100	94.4 Å²	94.4	44%	0.435	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	124	177.7	-66.9	-175.2	179.7	177.8	0	109.2	V54 R55 I57	K38-V54 CarbonylContact O-C 3.46Å; K38-V54 VanDerWaalsContact O-CA 3.29Å; K38-V54 WeakPolarHBondContact O-CA 3.31Å; K38-R55 HydrophobicContact CB-CB 4.47Å; K38-R55 PolarHBondContact N-O 2.9Å; K38-R55 PolarHBondContact O-N 2.81Å; K38-I57 HydrophobicContact CD-CD1 3.89Å; K38-I57 HydrophobicContact CG-CD1 4.22Å
39	A	96.2	Very high	89.6	Confident	71 Å²	71	92.8 Å²	92.8	59%	0.587	50%	0.504	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.1	103.7	176.7	0	0	0	0	0	109.1	V54	A39-V54 HydrophobicContact CB-CG1 4.49Å; A39-V54 HydrophobicContact CB-CG2 4.14Å
40	D	96.3	Very high	91.1	Very high	50 Å²	50	89 Å²	89	27%	0.267	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	128.4	-178.5	-58.5	-37.5	0	0	0	109.7	Y42 L52 L53 R55	D40-Y42 HydrophobicContact CB-CD2 4.27Å; D40-Y42 HydrophobicContact CB-CE2 3.43Å; D40-Y42 VanDerWaalsContact CB-CE2 3.43Å; D40-Y42 PolarHBondContact OD2-OH 3.3Å; D40-L52 WeakPolarHBondContact O-CA 3.4Å; D40-L52 WeakPolarHBondContact O-CD1 3.23Å; D40-L53 PolarHBondContact N-O 3.1Å; D40-L53 PolarHBondContact O-N 3.34Å; D40-R55 IonicContact OD2-NE 3.49Å; D40-R55 PolarHBondContact OD2-NE 3.37Å
41	C	95.9	Very high	92.2	Very high	40 Å²	40	86 Å²	86	27%	0.27	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	113.6	172.3	-61.3	0	0	0	0	109.3	F43 C105	C41-F43 HydrophobicContact CB-CD2 4.37Å; C41-F43 HydrophobicContact CB-CE1 4.49Å; C41-F43 HydrophobicContact CB-CE2 3.47Å; C41-F43 VanDerWaalsContact CB-CE2 3.47Å; C41-F43 HydrophobicContact CB-CZ 3.53Å; C41-F43 WeakPolarHBondContact O-CD2 3.42Å; C41-F43 WeakPolarHBondContact O-CE2 3.31Å; C41-C105 HydrophobicContact CB-CB 3.65Å; C41-C105 WeakPolarHBondContact CB-SG 3.26Å; C41-C105 WeakPolarHBondContact SG-CA 3.3Å; C41-C105 WeakPolarHBondContact SG-CB 3.17Å; C41-C105 CovalentContact SG-SG 2.04Å; C41-C105 PolarHBondContact SG-SG 3.35Å
42	Y	93.4	Very high	93	Very high	103 Å²	103	78.3 Å²	78.3	40%	0.404	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	123.7	176.7	-56.9	-90	0	0	0	109.7	D40 V50 H51 L53	D40-Y42 HydrophobicContact CB-CD2 4.27Å; D40-Y42 HydrophobicContact CB-CE2 3.43Å; D40-Y42 VanDerWaalsContact CB-CE2 3.43Å; D40-Y42 PolarHBondContact OD2-OH 3.3Å; Y42-V50 WeakPolarHBondContact O-CA 3.47Å; Y42-H51 AromaticContact CD2-CD2 3.67Å; Y42-H51 PolarHBondContact N-O 3.48Å; Y42-H51 PolarHBondContact O-N 2.8Å; Y42-L53 HydrophobicContact CE2-CB 4.2Å
43	F	91.8	Very high	93.6	Very high	72 Å²	72	73.2 Å²	73.2	32%	0.316	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	126.1	-174.4	-64.2	-79.3	0	0	0	110	C41 G46 V50 C105 Y109	C41-F43 HydrophobicContact CB-CD2 4.37Å; C41-F43 HydrophobicContact CB-CE1 4.49Å; C41-F43 HydrophobicContact CB-CE2 3.47Å; C41-F43 VanDerWaalsContact CB-CE2 3.47Å; C41-F43 HydrophobicContact CB-CZ 3.53Å; C41-F43 WeakPolarHBondContact O-CD2 3.42Å; C41-F43 WeakPolarHBondContact O-CE2 3.31Å; F43-G46 WeakPolarHBondContact CB-O 3.27Å; F43-V50 HydrophobicContact CD1-CG1 4.12Å; F43-V50 HydrophobicContact CD1-CG2 3.83Å; F43-V50 HydrophobicContact CE1-CG1 3.83Å; F43-V50 HydrophobicContact CE1-CG2 4.04Å; F43-C105 HydrophobicContact CE1-CB 4.05Å; F43-C105 HydrophobicContact CZ-CB 3.85Å; F43-C105 WeakPolarHBondContact CZ-O 3.25Å; F43-Y109 HydrophobicContact CB-CD2 4.23Å; F43-Y109 HydrophobicContact CB-CE2 4.11Å; F43-Y109 AromaticContact CD1-CD2 3.48Å; F43-Y109 HydrophobicContact CD1-CD2 3.48Å; F43-Y109 VanDerWaalsContact CD1-CD2 3.48Å; F43-Y109 HydrophobicContact CD1-CE2 4.14Å; F43-Y109 HydrophobicContact CD1-CG 4.06Å; F43-Y109 AromaticContact CD2-CD2 3.86Å; F43-Y109 HydrophobicContact CD2-CD2 3.86Å; F43-Y109 HydrophobicContact CD2-CE2 4.42Å; F43-Y109 AromaticContact CE1-CD2 3.71Å; F43-Y109 HydrophobicContact CE1-CD2 3.71Å; F43-Y109 AromaticContact CE1-CG 3.97Å; F43-Y109 HydrophobicContact CE1-CG 3.97Å; F43-Y109 HydrophobicContact CE2-CD2 4.04Å; F43-Y109 AromaticContact CG-CD2 3.57Å; F43-Y109 HydrophobicContact CG-CD2 3.57Å; F43-Y109 AromaticContact CG-CE2 3.97Å; F43-Y109 HydrophobicContact CG-CE2 3.97Å; F43-Y109 AromaticContact CZ-CD2 3.98Å; F43-Y109 HydrophobicContact CZ-CD2 3.98Å; F43-Y109 HydrophobicContact CZ-CG 4.35Å
44	T	88.3	Confident	94.1	Very high	86 Å²	86	68.1 Å²	68.1	53%	0.528	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	129.9	173.8	-52.9	0	0	0	0	109.5	K49	T44-K49 PolarHBondContact N-O 3.41Å; T44-K49 PolarHBondContact O-N 3.06Å
45	N	87.3	Confident	94.3	Very high	125 Å²	125	68.4 Å²	68.4	67%	0.668	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	57	-174.2	-161.4	21.6	0	0	0	112.1	T47 E48	N45-T47 PolarHBondContact O-N 3.26Å; N45-E48 HydrophobicContact CB-CB 4.32Å; N45-E48 PolarHBondContact ND2-OE2 2.87Å; N45-E48 PolarHBondContact O-N 3.05Å
46	G	84.6	Confident	94.5	Very high	26 Å²	26	64.1 Å²	64.1	27%	0.268	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.1	-115.4	-174.7	0	0	0	0	0	111.7	F43 Y109	F43-G46 WeakPolarHBondContact CB-O 3.27Å; G46-Y109 WeakPolarHBondContact CA-OH 3.4Å
47	T	91.3	Very high	94.5	Very high	50 Å²	50	61.3 Å²	61.3	31%	0.307	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	6.8	177.3	63.7	0	0	0	0	112.9	N45 K49 R106 Y109	N45-T47 PolarHBondContact O-N 3.26Å; T47-K49 PolarHBondContact O-N 2.81Å; T47-R106 PolarHBondContact O-NH1 3.06Å; T47-R106 PolarHBondContact O-NH2 2.82Å; T47-R106 VanDerWaalsContact O-NH2 3.15Å; T47-Y109 HydrophobicContact CG2-CD1 3.27Å; T47-Y109 HydrophobicContact CG2-CD2 4.37Å; T47-Y109 HydrophobicContact CG2-CE1 3.79Å; T47-Y109 HydrophobicContact CG2-CG 3.62Å
48	E	91.1	Very high	94.5	Very high	143 Å²	143	61.2 Å²	61.2	67%	0.668	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-55.1	-177.3	-172.7	177.8	179.7	0	0	111.4	N45 R106	N45-E48 HydrophobicContact CB-CB 4.32Å; N45-E48 PolarHBondContact ND2-OE2 2.87Å; N45-E48 PolarHBondContact O-N 3.05Å; E48-R106 PolarHBondContact O-NH2 2.77Å
49	K	94.5	Very high	94.3	Very high	127 Å²	127	59.7 Å²	59.7	55%	0.552	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.2	124.7	173	-175	179.6	-177.6	-176.3	0	109.6	T44 T47	T44-K49 PolarHBondContact N-O 3.41Å; T44-K49 PolarHBondContact O-N 3.06Å; T47-K49 PolarHBondContact O-N 2.81Å
50	V	96.5	Very high	94.1	Very high	13 Å²	13	63.6 Å²	63.6	8%	0.079	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	121.6	179.2	-175.9	0	0	0	0	108	Y42 F43 V101 C105 R106	Y42-V50 WeakPolarHBondContact O-CA 3.47Å; F43-V50 HydrophobicContact CD1-CG1 4.12Å; F43-V50 HydrophobicContact CD1-CG2 3.83Å; F43-V50 HydrophobicContact CE1-CG1 3.83Å; F43-V50 HydrophobicContact CE1-CG2 4.04Å; V50-V101 HydrophobicContact CB-CG1 3.88Å; V50-V101 HydrophobicContact CG1-CG1 3.85Å; V50-C105 HydrophobicContact CG1-CB 3.6Å; V50-R106 HydrophobicContact CG2-CG 4.06Å
51	H	97.6	Very high	94	Very high	38 Å²	38	67 Å²	67	18%	0.176	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	121.7	175.9	174.9	73.4	0	0	0	108.6	Y42 D67 D69	Y42-H51 AromaticContact CD2-CD2 3.67Å; Y42-H51 PolarHBondContact N-O 3.48Å; Y42-H51 PolarHBondContact O-N 2.8Å; H51-D67 IonicContact CE1-OD1 3.38Å; H51-D67 PolarHBondContact CE1-OD1 3.31Å; H51-D67 VanDerWaalsContact CE1-OD1 3.3Å; H51-D67 IonicContact CE1-OD2 3.86Å; H51-D67 IonicContact ND1-OD1 2.88Å; H51-D69 IonicContact CE1-OD1 3.6Å; H51-D69 IonicContact CE1-OD2 3.12Å; H51-D69 IonicContact CG-OD1 3.81Å; H51-D69 IonicContact ND1-OD1 3.69Å; H51-D69 PolarHBondContact ND1-OD1 2.85Å; H51-D69 IonicContact ND1-OD2 2.72Å; H51-D69 PolarHBondContact ND1-OD2 2.87Å
52	L	97.8	Very high	94.1	Very high	4 Å²	4	66.8 Å²	66.8	2%	0.021	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	125.8	177	168.7	63.5	0	0	0	109	D40 V54 S68 A100 V101	D40-L52 WeakPolarHBondContact O-CA 3.4Å; D40-L52 WeakPolarHBondContact O-CD1 3.23Å; L52-V54 HydrophobicContact CD1-CG2 3.91Å; L52-V54 HydrophobicContact CD2-CG2 4.41Å; L52-V54 HydrophobicContact CG-CG2 4.11Å; L52-S68 PolarHBondContact N-OG 3.25Å; L52-S68 WeakPolarHBondContact O-CB 3.4Å; L52-S68 PolarHBondContact O-N 2.82Å; L52-S68 PolarHBondContact O-OG 3.12Å; L52-A100 HydrophobicContact CD2-CB 3.51Å; L52-V101 HydrophobicContact CB-CG2 3.87Å; L52-V101 HydrophobicContact CD2-CG2 4.2Å
53	L	98.1	Very high	94.3	Very high	14 Å²	14	63.1 Å²	63.1	7%	0.073	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	117.7	174.9	-171.1	68.4	0	0	0	109.4	D40 Y42 R55 H65 F66 D67	D40-L53 PolarHBondContact N-O 3.1Å; D40-L53 PolarHBondContact O-N 3.34Å; Y42-L53 HydrophobicContact CE2-CB 4.2Å; L53-R55 HydrophobicContact CD2-CG 4.13Å; L53-R55 VanDerWaalsContact CD2-CZ 3.43Å; L53-R55 VanDerWaalsContact CD2-NH2 3.28Å; L53-R55 HydrophobicContact CG-CG 4.06Å; L53-H65 HydrophobicContact CD1-CB 4.13Å; L53-F66 WeakPolarHBondContact CA-O 3.3Å; L53-D67 HydrophobicContact CD1-CB 4.25Å
54	V	97.8	Very high	94.6	Very high	29 Å²	29	59.7 Å²	59.7	18%	0.176	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	104.1	176.4	-172.7	0	0	0	0	109.2	K38 A39 L52 F56 H65 F66	K38-V54 CarbonylContact O-C 3.46Å; K38-V54 VanDerWaalsContact O-CA 3.29Å; K38-V54 WeakPolarHBondContact O-CA 3.31Å; A39-V54 HydrophobicContact CB-CG1 4.49Å; A39-V54 HydrophobicContact CB-CG2 4.14Å; L52-V54 HydrophobicContact CD1-CG2 3.91Å; L52-V54 HydrophobicContact CD2-CG2 4.41Å; L52-V54 HydrophobicContact CG-CG2 4.11Å; V54-F56 HydrophobicContact CB-CE2 4.46Å; V54-F56 HydrophobicContact CG1-CE2 3.86Å; V54-F56 HydrophobicContact CG1-CZ 3.97Å; V54-H65 CarbonylContact O-C 3.55Å; V54-H65 WeakPolarHBondContact O-CA 3.49Å; V54-H65 VanDerWaalsContact O-CB 3.24Å; V54-H65 WeakPolarHBondContact O-CB 3.42Å; V54-F66 HydrophobicContact CB-CB 4.11Å; V54-F66 PolarHBondContact N-O 3.45Å; V54-F66 PolarHBondContact O-N 2.8Å
55	R	98.2	Very high	95.1	Very high	73 Å²	73	56.8 Å²	56.8	28%	0.275	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	131.4	-176.9	-55.8	173.2	-174.3	-105.6	1.8	110.7	A37 K38 D40 L53 I57 E62	A37-R55 CarbonylContact C-O 3.54Å; A37-R55 VanDerWaalsContact CA-O 3.3Å; A37-R55 WeakPolarHBondContact CA-O 3.45Å; K38-R55 HydrophobicContact CB-CB 4.47Å; K38-R55 PolarHBondContact N-O 2.9Å; K38-R55 PolarHBondContact O-N 2.81Å; D40-R55 IonicContact OD2-NE 3.49Å; D40-R55 PolarHBondContact OD2-NE 3.37Å; L53-R55 HydrophobicContact CD2-CG 4.13Å; L53-R55 VanDerWaalsContact CD2-CZ 3.43Å; L53-R55 VanDerWaalsContact CD2-NH2 3.28Å; L53-R55 HydrophobicContact CG-CG 4.06Å; R55-I57 HydrophobicContact CB-CD1 4.42Å; R55-I57 HydrophobicContact CB-CG1 4.32Å; R55-E62 HydrophobicContact CB-CG 4.07Å; R55-E62 VanDerWaalsContact CD-OE2 3.29Å; R55-E62 WeakPolarHBondContact CD-OE2 3.27Å; R55-E62 HydrophobicContact CG-CG 4.5Å; R55-E62 IonicContact CZ-OE2 2.77Å; R55-E62 IonicContact NE-OE2 3.88Å; R55-E62 IonicContact NH1-OE2 2.75Å; R55-E62 PolarHBondContact NH1-OE2 2.98Å
56	F	97.6	Very high	95.6	Very high	39 Å²	39	50.9 Å²	50.9	17%	0.171	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	123.2	171.4	-61.4	-95.2	0	0	0	108.8	A37 V54 E62 Y63 L64 F73 W87	A37-F56 HydrophobicContact CB-CD1 4.26Å; A37-F56 HydrophobicContact CB-CE1 4.31Å; V54-F56 HydrophobicContact CB-CE2 4.46Å; V54-F56 HydrophobicContact CG1-CE2 3.86Å; V54-F56 HydrophobicContact CG1-CZ 3.97Å; F56-E62 WeakPolarHBondContact O-CA 3.25Å; F56-Y63 HydrophobicContact CB-CD1 4.2Å; F56-Y63 HydrophobicContact CB-CE1 3.52Å; F56-Y63 WeakPolarHBondContact O-CD1 3.45Å; F56-Y63 PolarHBondContact O-N 2.97Å; F56-L64 HydrophobicContact CB-CD2 4.5Å; F56-L64 WeakPolarHBondContact CB-O 3.43Å; F56-L64 HydrophobicContact CD2-CD2 3.37Å; F56-L64 HydrophobicContact CE2-CD2 3.82Å; F56-L64 HydrophobicContact CG-CD2 4.13Å; F56-L64 PolarHBondContact N-O 2.86Å; F56-F73 HydrophobicContact CE2-CD1 4.4Å; F56-F73 HydrophobicContact CE2-CE1 4.09Å; F56-F73 HydrophobicContact CZ-CE1 4.47Å; F56-W87 HydrophobicContact CD1-CH2 4.13Å; F56-W87 HydrophobicContact CD1-CZ3 4.36Å; F56-W87 HydrophobicContact CD2-CZ3 4.14Å; F56-W87 AromaticContact CE1-CH2 3.84Å; F56-W87 HydrophobicContact CE1-CH2 3.84Å; F56-W87 AromaticContact CE1-CZ3 3.93Å; F56-W87 HydrophobicContact CE1-CZ3 3.93Å; F56-W87 HydrophobicContact CE2-CH2 4.38Å; F56-W87 AromaticContact CE2-CZ3 3.68Å; F56-W87 HydrophobicContact CE2-CZ3 3.68Å; F56-W87 HydrophobicContact CG-CZ3 4.46Å; F56-W87 AromaticContact CZ-CH2 3.97Å; F56-W87 HydrophobicContact CZ-CH2 3.97Å; F56-W87 AromaticContact CZ-CZ3 3.56Å; F56-W87 HydrophobicContact CZ-CZ3 3.56Å
57	I	97.9	Very high	96.3	Very high	15 Å²	15	50.9 Å²	50.9	8%	0.077	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	127.2	-166.6	-53.2	170.4	0	0	0	108.9	I35 Q36 K38 R55 L60 E61 E62	I35-I57 WeakPolarHBondContact CA-O 3.5Å; Q36-I57 HydrophobicContact CB-CB 4.27Å; Q36-I57 PolarHBondContact N-O 2.77Å; Q36-I57 PolarHBondContact O-N 2.83Å; K38-I57 HydrophobicContact CD-CD1 3.89Å; K38-I57 HydrophobicContact CG-CD1 4.22Å; R55-I57 HydrophobicContact CB-CD1 4.42Å; R55-I57 HydrophobicContact CB-CG1 4.32Å; I57-L60 VanDerWaalsContact CG2-C 3.5Å; I57-E61 CarbonylContact C-O 3.58Å; I57-E61 VanDerWaalsContact CA-O 3.31Å; I57-E61 WeakPolarHBondContact CA-O 3.46Å; I57-E62 HydrophobicContact CG1-CB 4.27Å; I57-E62 HydrophobicContact CG1-CG 4.4Å
58	F	95.6	Very high	96.6	Very high	67 Å²	67	49.8 Å²	49.8	29%	0.294	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	119.8	175.5	-176.3	-103	0	0	0	109.4	F33 I35 L60 E61 Y63 L79	F33-F58 HydrophobicContact CD1-CE2 4.47Å; F33-F58 AromaticContact CD1-CZ 3.88Å; F33-F58 HydrophobicContact CD1-CZ 3.88Å; I35-F58 HydrophobicContact CG1-CD2 3.97Å; I35-F58 HydrophobicContact CG1-CE2 4.33Å; F58-L60 PolarHBondContact O-N 2.85Å; F58-L60 VanDerWaalsContact O-N 3.11Å; F58-E61 PolarHBondContact N-O 2.82Å; F58-E61 WeakPolarHBondContact O-CB 3.38Å; F58-E61 PolarHBondContact O-N 3.44Å; F58-Y63 HydrophobicContact CB-CD1 4Å; F58-Y63 HydrophobicContact CB-CE1 4.41Å; F58-L79 HydrophobicContact CB-CD2 4.43Å; F58-L79 HydrophobicContact CD1-CD2 4.32Å; F58-L79 HydrophobicContact CG-CD2 4.44Å
59	N	91.9	Very high	96.8	Very high	69 Å²	69	47.7 Å²	47.7	37%	0.369	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.8	40.4	179.7	-67.7	-19	0	0	0	114.2	V34 E61	V34-N59 PolarHBondContact N-OD1 3.34Å; V34-N59 PolarHBondContact O-N 2.85Å; N59-E61 VanDerWaalsContact C-N 3.31Å
60	L	92.4	Very high	97	Very high	152 Å²	152	46.7 Å²	46.7	80%	0.796	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.2	-5.1	-176.6	-49	171.5	0	0	0	116.3	I57 F58	I57-L60 VanDerWaalsContact CG2-C 3.5Å; F58-L60 PolarHBondContact O-N 2.85Å; F58-L60 VanDerWaalsContact O-N 3.11Å
61	E	95.6	Very high	97	Very high	121 Å²	121	46.5 Å²	46.5	57%	0.565	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93.7	119.9	174.8	-172.5	170.9	-169.8	0	0	110.5	I57 F58 N59 Y63 T77	I57-E61 CarbonylContact C-O 3.58Å; I57-E61 VanDerWaalsContact CA-O 3.31Å; I57-E61 WeakPolarHBondContact CA-O 3.46Å; F58-E61 PolarHBondContact N-O 2.82Å; F58-E61 WeakPolarHBondContact O-CB 3.38Å; F58-E61 PolarHBondContact O-N 3.44Å; N59-E61 VanDerWaalsContact C-N 3.31Å; E61-Y63 PolarHBondContact O-N 3.09Å; E61-T77 HydrophobicContact CG-CG2 4.32Å; E61-T77 WeakPolarHBondContact OE1-CG2 3.34Å
62	E	97.3	Very high	97	Very high	36 Å²	36	48.5 Å²	48.5	17%	0.168	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	113.5	171.5	-171.6	-174.9	146.9	0	0	108.9	R55 F56 I57 H65 L76	R55-E62 HydrophobicContact CB-CG 4.07Å; R55-E62 VanDerWaalsContact CD-OE2 3.29Å; R55-E62 WeakPolarHBondContact CD-OE2 3.27Å; R55-E62 HydrophobicContact CG-CG 4.5Å; R55-E62 IonicContact CZ-OE2 2.77Å; R55-E62 IonicContact NE-OE2 3.88Å; R55-E62 IonicContact NH1-OE2 2.75Å; R55-E62 PolarHBondContact NH1-OE2 2.98Å; F56-E62 WeakPolarHBondContact O-CA 3.25Å; I57-E62 HydrophobicContact CG1-CB 4.27Å; I57-E62 HydrophobicContact CG1-CG 4.4Å; E62-H65 WeakPolarHBondContact OE1-CB 3.4Å; E62-H65 IonicContact OE1-CG 3.55Å; E62-H65 IonicContact OE1-ND1 2.91Å; E62-H65 PolarHBondContact OE1-ND1 3.12Å; E62-L76 HydrophobicContact CB-CD1 4.06Å; E62-L76 HydrophobicContact CG-CD1 3.7Å; E62-L76 WeakPolarHBondContact OE1-CD1 3.38Å
63	Y	97.5	Very high	97.1	Very high	27 Å²	27	48.5 Å²	48.5	11%	0.106	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	-23.6	-173	74.6	-89.8	0	0	0	112.6	F56 F58 E61 L76 T77 L79 D83	F56-Y63 HydrophobicContact CB-CD1 4.2Å; F56-Y63 HydrophobicContact CB-CE1 3.52Å; F56-Y63 WeakPolarHBondContact O-CD1 3.45Å; F56-Y63 PolarHBondContact O-N 2.97Å; F58-Y63 HydrophobicContact CB-CD1 4Å; F58-Y63 HydrophobicContact CB-CE1 4.41Å; E61-Y63 PolarHBondContact O-N 3.09Å; Y63-L76 PolarHBondContact O-N 3.28Å; Y63-T77 WeakPolarHBondContact CB-OG1 3.35Å; Y63-T77 PolarHBondContact O-N 3.26Å; Y63-L79 HydrophobicContact CD2-CD2 4.45Å; Y63-L79 HydrophobicContact CD2-CG 4.34Å; Y63-L79 HydrophobicContact CG-CD2 4.24Å; Y63-D83 WeakPolarHBondContact CE2-OD2 3.44Å
64	L	97.9	Very high	97.1	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	149.2	-179	174.8	150.2	0	0	0	110.3	F56 F73 V74 G80 D83 A84 W87	F56-L64 HydrophobicContact CB-CD2 4.5Å; F56-L64 WeakPolarHBondContact CB-O 3.43Å; F56-L64 HydrophobicContact CD2-CD2 3.37Å; F56-L64 HydrophobicContact CE2-CD2 3.82Å; F56-L64 HydrophobicContact CG-CD2 4.13Å; F56-L64 PolarHBondContact N-O 2.86Å; L64-F73 HydrophobicContact CD2-CB 4.36Å; L64-F73 HydrophobicContact CD2-CD1 3.79Å; L64-V74 CarbonylContact C-O 3.45Å; L64-V74 WeakPolarHBondContact CA-O 2.94Å; L64-G80 WeakPolarHBondContact CD1-O 3.36Å; L64-D83 HydrophobicContact CD1-CB 3.71Å; L64-A84 HydrophobicContact CD1-CB 3.7Å; L64-A84 VanDerWaalsContact CD1-N 3.32Å; L64-W87 HydrophobicContact CD2-CE3 4.06Å; L64-W87 HydrophobicContact CD2-CZ3 3.67Å
65	H	98.4	Very high	97.1	Very high	24 Å²	24	50 Å²	50	11%	0.111	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	159.7	167.2	60.7	-115.1	0	0	0	113.6	L53 V54 E62 F73 V74	L53-H65 HydrophobicContact CD1-CB 4.13Å; V54-H65 CarbonylContact O-C 3.55Å; V54-H65 WeakPolarHBondContact O-CA 3.49Å; V54-H65 VanDerWaalsContact O-CB 3.24Å; V54-H65 WeakPolarHBondContact O-CB 3.42Å; E62-H65 WeakPolarHBondContact OE1-CB 3.4Å; E62-H65 IonicContact OE1-CG 3.55Å; E62-H65 IonicContact OE1-ND1 2.91Å; E62-H65 PolarHBondContact OE1-ND1 3.12Å; H65-F73 CarbonylContact O-C 3.52Å; H65-F73 VanDerWaalsContact O-CA 3.24Å; H65-F73 WeakPolarHBondContact O-CA 3.08Å; H65-V74 PolarHBondContact N-O 2.92Å; H65-V74 PolarHBondContact O-N 3.18Å
66	F	98.5	Very high	97	Very high	1 Å²	1	51 Å²	51	0%	0.004	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	128.1	160.1	177.4	-97.9	0	0	0	109.8	L53 V54 F73 L94 S97 R98	L53-F66 WeakPolarHBondContact CA-O 3.3Å; V54-F66 HydrophobicContact CB-CB 4.11Å; V54-F66 PolarHBondContact N-O 3.45Å; V54-F66 PolarHBondContact O-N 2.8Å; F66-F73 HydrophobicContact CB-CD1 3.64Å; F66-F73 HydrophobicContact CB-CE1 3.63Å; F66-F73 HydrophobicContact CB-CG 4.38Å; F66-F73 HydrophobicContact CB-CZ 4.31Å; F66-F73 HydrophobicContact CD2-CD1 4.25Å; F66-F73 HydrophobicContact CD2-CD2 4.17Å; F66-F73 HydrophobicContact CD2-CE1 4.21Å; F66-F73 HydrophobicContact CD2-CE2 4.08Å; F66-F73 HydrophobicContact CD2-CG 4.27Å; F66-F73 HydrophobicContact CD2-CZ 4.13Å; F66-F73 HydrophobicContact CG-CD1 4.44Å; F66-F73 HydrophobicContact CG-CE1 4.3Å; F66-L94 HydrophobicContact CE2-CD2 4.41Å; F66-S97 WeakPolarHBondContact CE1-O 3.42Å; F66-S97 VanDerWaalsContact CE2-CB 3.46Å; F66-R98 HydrophobicContact CE2-CG 4.49Å; F66-R98 HydrophobicContact CZ-CG 4.01Å
67	D	98.3	Very high	96.9	Very high	27 Å²	27	50.5 Å²	50.5	14%	0.144	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	124.2	174.9	-174.3	-45.8	0	0	0	109.4	H51 L53 D69 L70 G71 M72	H51-D67 IonicContact CE1-OD1 3.38Å; H51-D67 PolarHBondContact CE1-OD1 3.31Å; H51-D67 VanDerWaalsContact CE1-OD1 3.3Å; H51-D67 IonicContact CE1-OD2 3.86Å; H51-D67 IonicContact ND1-OD1 2.88Å; L53-D67 HydrophobicContact CD1-CB 4.25Å; D67-D69 VanDerWaalsContact C-N 3.35Å; D67-D69 WeakPolarHBondContact OD1-CA 3.29Å; D67-D69 VanDerWaalsContact OD1-CB 3.31Å; D67-D69 WeakPolarHBondContact OD1-CB 3.3Å; D67-D69 PolarHBondContact OD1-N 2.72Å; D67-L70 HydrophobicContact CB-CB 4.17Å; D67-L70 HydrophobicContact CB-CD1 4.06Å; D67-L70 HydrophobicContact CB-CG 4.12Å; D67-L70 PolarHBondContact O-N 3.1Å; D67-L70 PolarHBondContact OD1-N 3.17Å; D67-G71 WeakPolarHBondContact O-CA 3.08Å; D67-G71 PolarHBondContact O-N 2.85Å; D67-M72 PolarHBondContact N-O 2.72Å; D67-M72 PolarHBondContact O-N 3.31Å
68	S	97.6	Very high	96.8	Very high	26 Å²	26	57.9 Å²	57.9	18%	0.182	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-27.4	-179.7	64.5	0	0	0	0	114.8	L52 L70 G71	L52-S68 PolarHBondContact N-OG 3.25Å; L52-S68 WeakPolarHBondContact O-CB 3.4Å; L52-S68 PolarHBondContact O-N 2.82Å; L52-S68 PolarHBondContact O-OG 3.12Å; S68-L70 VanDerWaalsContact C-N 3.32Å; S68-G71 PolarHBondContact O-N 3.44Å
69	D	96.8	Very high	96.8	Very high	99 Å²	99	59.5 Å²	59.5	53%	0.529	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-32.8	179.1	-66.5	11	0	0	0	109.8	H51 D67	H51-D69 IonicContact CE1-OD1 3.6Å; H51-D69 IonicContact CE1-OD2 3.12Å; H51-D69 IonicContact CG-OD1 3.81Å; H51-D69 IonicContact ND1-OD1 3.69Å; H51-D69 PolarHBondContact ND1-OD1 2.85Å; H51-D69 IonicContact ND1-OD2 2.72Å; H51-D69 PolarHBondContact ND1-OD2 2.87Å; D67-D69 VanDerWaalsContact C-N 3.35Å; D67-D69 WeakPolarHBondContact OD1-CA 3.29Å; D67-D69 VanDerWaalsContact OD1-CB 3.31Å; D67-D69 WeakPolarHBondContact OD1-CB 3.3Å; D67-D69 PolarHBondContact OD1-N 2.72Å
70	L	97.4	Very high	97	Very high	107 Å²	107	56.2 Å²	56.2	56%	0.56	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-28.4	170.3	-57.2	179.5	0	0	0	112.5	D67 S68 M72 V74	D67-L70 HydrophobicContact CB-CB 4.17Å; D67-L70 HydrophobicContact CB-CD1 4.06Å; D67-L70 HydrophobicContact CB-CG 4.12Å; D67-L70 PolarHBondContact O-N 3.1Å; D67-L70 PolarHBondContact OD1-N 3.17Å; S68-L70 VanDerWaalsContact C-N 3.32Å; L70-M72 VanDerWaalsContact C-N 3.31Å; L70-M72 HydrophobicContact CB-CG 4.08Å; L70-M72 PolarHBondContact O-N 3.3Å; L70-V74 HydrophobicContact CD1-CG2 3.64Å
71	G	97	Very high	97.2	Very high	9 Å²	9	54.5 Å²	54.5	9%	0.093	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.2	26.8	-177.3	0	0	0	0	0	113.7	D67 S68 R98	D67-G71 WeakPolarHBondContact O-CA 3.08Å; D67-G71 PolarHBondContact O-N 2.85Å; S68-G71 PolarHBondContact O-N 3.44Å; G71-R98 VanDerWaalsContact O-CZ 3.25Å; G71-R98 PolarHBondContact O-NE 2.73Å; G71-R98 PolarHBondContact O-NH2 3.22Å
72	M	98	Very high	97.4	Very high	80 Å²	80	52.6 Å²	52.6	39%	0.394	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	168	-177.7	62.9	-176.1	-71	0	0	112.3	D67 L70 N88 L94	D67-M72 PolarHBondContact N-O 2.72Å; D67-M72 PolarHBondContact O-N 3.31Å; L70-M72 VanDerWaalsContact C-N 3.31Å; L70-M72 HydrophobicContact CB-CG 4.08Å; L70-M72 PolarHBondContact O-N 3.3Å; M72-N88 WeakPolarHBondContact CB-OD1 3.48Å; M72-N88 WeakPolarHBondContact CE-ND2 3.37Å; M72-L94 HydrophobicContact CB-CD2 4.24Å
73	F	98.3	Very high	97.3	Very high	4 Å²	4	53 Å²	53	2%	0.018	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	136.2	173.7	-61.6	-89.5	0	0	0	110.5	F56 L64 H65 F66 W87 N88 L93 L94 S97	F56-F73 HydrophobicContact CE2-CD1 4.4Å; F56-F73 HydrophobicContact CE2-CE1 4.09Å; F56-F73 HydrophobicContact CZ-CE1 4.47Å; L64-F73 HydrophobicContact CD2-CB 4.36Å; L64-F73 HydrophobicContact CD2-CD1 3.79Å; H65-F73 CarbonylContact O-C 3.52Å; H65-F73 VanDerWaalsContact O-CA 3.24Å; H65-F73 WeakPolarHBondContact O-CA 3.08Å; F66-F73 HydrophobicContact CB-CD1 3.64Å; F66-F73 HydrophobicContact CB-CE1 3.63Å; F66-F73 HydrophobicContact CB-CG 4.38Å; F66-F73 HydrophobicContact CB-CZ 4.31Å; F66-F73 HydrophobicContact CD2-CD1 4.25Å; F66-F73 HydrophobicContact CD2-CD2 4.17Å; F66-F73 HydrophobicContact CD2-CE1 4.21Å; F66-F73 HydrophobicContact CD2-CE2 4.08Å; F66-F73 HydrophobicContact CD2-CG 4.27Å; F66-F73 HydrophobicContact CD2-CZ 4.13Å; F66-F73 HydrophobicContact CG-CD1 4.44Å; F66-F73 HydrophobicContact CG-CE1 4.3Å; F73-W87 AromaticContact CD1-CE3 3.58Å; F73-W87 HydrophobicContact CD1-CE3 3.58Å; F73-W87 HydrophobicContact CD1-CZ3 4.07Å; F73-W87 HydrophobicContact CD2-CB 3.81Å; F73-W87 HydrophobicContact CD2-CE3 4.41Å; F73-W87 AromaticContact CE1-CE3 3.48Å; F73-W87 HydrophobicContact CE1-CE3 3.48Å; F73-W87 VanDerWaalsContact CE1-CE3 3.48Å; F73-W87 AromaticContact CE1-CZ3 3.88Å; F73-W87 HydrophobicContact CE1-CZ3 3.88Å; F73-W87 HydrophobicContact CE2-CB 4.06Å; F73-W87 HydrophobicContact CE2-CE3 4.38Å; F73-W87 HydrophobicContact CG-CB 4.24Å; F73-W87 HydrophobicContact CG-CE3 4.03Å; F73-W87 AromaticContact CZ-CE3 3.92Å; F73-W87 HydrophobicContact CZ-CE3 3.92Å; F73-N88 PolarHBondContact N-OD1 2.91Å; F73-N88 PolarHBondContact O-ND2 3.28Å; F73-L93 HydrophobicContact CE2-CD2 3.91Å; F73-L93 HydrophobicContact CE2-CG 3.86Å; F73-L93 HydrophobicContact CZ-CD1 4.36Å; F73-L93 HydrophobicContact CZ-CD2 3.93Å; F73-L93 HydrophobicContact CZ-CG 3.86Å; F73-L94 HydrophobicContact CD2-CD2 3.9Å; F73-L94 HydrophobicContact CE2-CD2 4.02Å; F73-S97 WeakPolarHBondContact CZ-OG 3.04Å
74	V	98.3	Very high	97.3	Very high	43 Å²	43	52 Å²	52	26%	0.261	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	123.9	-178.6	-176.8	0	0	0	0	108.1	L64 H65 L70	L64-V74 CarbonylContact C-O 3.45Å; L64-V74 WeakPolarHBondContact CA-O 2.94Å; H65-V74 PolarHBondContact N-O 2.92Å; H65-V74 PolarHBondContact O-N 3.18Å; L70-V74 HydrophobicContact CD1-CG2 3.64Å
75	A	97.9	Very high	97.3	Very high	32 Å²	32	56.7 Å²	56.7	26%	0.264	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	136.4	171.7	0	0	0	0	0	110	G80 E81 A84	A75-G80 VanDerWaalsContact CB-C 3.45Å; A75-E81 HydrophobicContact CB-CG 4.09Å; A75-A84 HydrophobicContact CB-CB 3.98Å
76	L	97.3	Very high	97.3	Very high	92 Å²	92	60.6 Å²	60.6	48%	0.482	32%	0.324	S	S	.	.	S	Bend	trans	-101.3	-20.2	173.9	-66.1	-177.3	0	0	0	112.5	E62 Y63	E62-L76 HydrophobicContact CB-CD1 4.06Å; E62-L76 HydrophobicContact CG-CD1 3.7Å; E62-L76 WeakPolarHBondContact OE1-CD1 3.38Å; Y63-L76 PolarHBondContact O-N 3.28Å
77	T	96.1	Very high	97.2	Very high	30 Å²	30	62.4 Å²	62.4	18%	0.184	33%	0.331	C	S	.	.	S	Bend	trans	-137.9	163.2	-176.9	66.8	0	0	0	0	109.7	E61 Y63 L79 G80 E81	E61-T77 HydrophobicContact CG-CG2 4.32Å; E61-T77 WeakPolarHBondContact OE1-CG2 3.34Å; Y63-T77 WeakPolarHBondContact CB-OG1 3.35Å; Y63-T77 PolarHBondContact O-N 3.26Å; T77-L79 PolarHBondContact O-N 2.82Å; T77-L79 VanDerWaalsContact O-N 3.17Å; T77-G80 PolarHBondContact O-N 3.42Å; T77-E81 PolarHBondContact O-N 3.1Å
78	E	95.4	Very high	97.2	Very high	169 Å²	169	63 Å²	63	79%	0.79	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-30.2	175.4	-63.5	-176.2	177.7	0	0	112.4	G80 E81	E78-G80 VanDerWaalsContact C-N 3.25Å; E78-G80 PolarHBondContact O-N 3.49Å; E78-E81 PolarHBondContact O-N 3.29Å
79	L	94.1	Very high	97.2	Very high	101 Å²	101	69.6 Å²	69.6	53%	0.529	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-33.8	175.9	-176.9	66.6	0	0	0	112.2	F58 Y63 T77	F58-L79 HydrophobicContact CB-CD2 4.43Å; F58-L79 HydrophobicContact CD1-CD2 4.32Å; F58-L79 HydrophobicContact CG-CD2 4.44Å; Y63-L79 HydrophobicContact CD2-CD2 4.45Å; Y63-L79 HydrophobicContact CD2-CG 4.34Å; Y63-L79 HydrophobicContact CG-CD2 4.24Å; T77-L79 PolarHBondContact O-N 2.82Å; T77-L79 VanDerWaalsContact O-N 3.17Å
80	G	96.7	Very high	97.3	Very high	0 Å²	0	69.7 Å²	69.7	0%	0	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-17.8	-176.8	0	0	0	0	0	115.1	L64 A75 T77 E78 D83 A84	L64-G80 WeakPolarHBondContact CD1-O 3.36Å; A75-G80 VanDerWaalsContact CB-C 3.45Å; T77-G80 PolarHBondContact O-N 3.42Å; E78-G80 VanDerWaalsContact C-N 3.25Å; E78-G80 PolarHBondContact O-N 3.49Å; G80-D83 PolarHBondContact O-N 3.27Å; G80-A84 WeakPolarHBondContact O-CB 3.49Å; G80-A84 PolarHBondContact O-N 3.27Å
81	E	97.8	Very high	97.2	Very high	117 Å²	117	69.4 Å²	69.4	55%	0.547	35%	0.351	S	S	.	.	H	α-helix	trans	-53.5	-50.6	179.9	-67.1	-171.3	167.2	0	0	113.9	A75 T77 E78 D83 A84 D85	A75-E81 HydrophobicContact CB-CG 4.09Å; T77-E81 PolarHBondContact O-N 3.1Å; E78-E81 PolarHBondContact O-N 3.29Å; E81-D83 VanDerWaalsContact C-N 3.3Å; E81-D83 PolarHBondContact O-N 3.19Å; E81-A84 PolarHBondContact O-N 3.23Å; E81-D85 WeakPolarHBondContact O-CB 3.29Å; E81-D85 PolarHBondContact O-N 2.83Å
82	P	97.9	Very high	97.2	Very high	80 Å²	80	74 Å²	74	52%	0.519	37%	0.374	S	S	.	.	H	α-helix	trans	-62.7	-37.7	-179.5	24	-34.5	0	0	0	112.5	Q86	P82-Q86 VanDerWaalsContact O-CB 3.29Å; P82-Q86 WeakPolarHBondContact O-CB 3.45Å; P82-Q86 PolarHBondContact O-N 2.77Å
83	D	97.1	Very high	97.1	Very high	44 Å²	44	72.3 Å²	72.3	24%	0.235	37%	0.366	C	S	.	.	H	α-helix	trans	-68.5	-46.6	178	-79.2	-17.3	0	0	0	111.1	Y63 L64 G80 E81 D85 Q86 W87	Y63-D83 WeakPolarHBondContact CE2-OD2 3.44Å; L64-D83 HydrophobicContact CD1-CB 3.71Å; G80-D83 PolarHBondContact O-N 3.27Å; E81-D83 VanDerWaalsContact C-N 3.3Å; E81-D83 PolarHBondContact O-N 3.19Å; D83-D85 PolarHBondContact O-N 2.86Å; D83-Q86 PolarHBondContact O-N 3.49Å; D83-W87 HydrophobicContact CB-CZ2 4.41Å; D83-W87 WeakPolarHBondContact O-CB 3.45Å; D83-W87 PolarHBondContact O-N 2.83Å
84	A	97.7	Very high	97	Very high	6 Å²	6	72.6 Å²	72.6	5%	0.05	37%	0.368	C	S	.	.	H	α-helix	trans	-60.2	-46.8	178	0	0	0	0	0	111.1	L64 A75 G80 E81 Q86 W87 N88	L64-A84 HydrophobicContact CD1-CB 3.7Å; L64-A84 VanDerWaalsContact CD1-N 3.32Å; A75-A84 HydrophobicContact CB-CB 3.98Å; G80-A84 WeakPolarHBondContact O-CB 3.49Å; G80-A84 PolarHBondContact O-N 3.27Å; E81-A84 PolarHBondContact O-N 3.23Å; A84-Q86 VanDerWaalsContact C-N 3.34Å; A84-Q86 PolarHBondContact O-N 3.24Å; A84-W87 PolarHBondContact O-N 3.36Å; A84-N88 WeakPolarHBondContact O-CB 3.48Å; A84-N88 PolarHBondContact O-N 3.27Å; A84-N88 PolarHBondContact O-ND2 3.31Å
85	D	97.1	Very high	96.9	Very high	99 Å²	99	75.8 Å²	75.8	53%	0.529	38%	0.38	S	S	.	.	H	α-helix	trans	-60.7	-42.7	177.8	-93.9	7	0	0	0	112.3	E81 D83 K89	E81-D85 WeakPolarHBondContact O-CB 3.29Å; E81-D85 PolarHBondContact O-N 2.83Å; D83-D85 PolarHBondContact O-N 2.86Å; D85-K89 WeakPolarHBondContact O-CD 3.45Å; D85-K89 WeakPolarHBondContact O-CE 3.36Å; D85-K89 VanDerWaalsContact O-CG 3.25Å; D85-K89 WeakPolarHBondContact O-CG 3.36Å
86	Q	97.3	Very high	96.8	Very high	106 Å²	106	78.1 Å²	78.1	50%	0.495	39%	0.391	S	S	.	.	H	α-helix	trans	-70.5	-45.6	179.1	-174.5	-178.2	13.8	0	0	111.4	P82 D83 A84 K89 R90	P82-Q86 VanDerWaalsContact O-CB 3.29Å; P82-Q86 WeakPolarHBondContact O-CB 3.45Å; P82-Q86 PolarHBondContact O-N 2.77Å; D83-Q86 PolarHBondContact O-N 3.49Å; A84-Q86 VanDerWaalsContact C-N 3.34Å; A84-Q86 PolarHBondContact O-N 3.24Å; Q86-K89 PolarHBondContact O-N 3.25Å; Q86-R90 PolarHBondContact O-N 3.23Å
87	W	97.8	Very high	96.7	Very high	39 Å²	39	74.7 Å²	74.7	15%	0.148	37%	0.374	C	S	.	.	H	α-helix	trans	-73.6	-34	-173.4	-67.9	13.7	0	0	0	111.7	F56 L64 F73 D83 A84 K89 R90 L93	F56-W87 HydrophobicContact CD1-CH2 4.13Å; F56-W87 HydrophobicContact CD1-CZ3 4.36Å; F56-W87 HydrophobicContact CD2-CZ3 4.14Å; F56-W87 AromaticContact CE1-CH2 3.84Å; F56-W87 HydrophobicContact CE1-CH2 3.84Å; F56-W87 AromaticContact CE1-CZ3 3.93Å; F56-W87 HydrophobicContact CE1-CZ3 3.93Å; F56-W87 HydrophobicContact CE2-CH2 4.38Å; F56-W87 AromaticContact CE2-CZ3 3.68Å; F56-W87 HydrophobicContact CE2-CZ3 3.68Å; F56-W87 HydrophobicContact CG-CZ3 4.46Å; F56-W87 AromaticContact CZ-CH2 3.97Å; F56-W87 HydrophobicContact CZ-CH2 3.97Å; F56-W87 AromaticContact CZ-CZ3 3.56Å; F56-W87 HydrophobicContact CZ-CZ3 3.56Å; L64-W87 HydrophobicContact CD2-CE3 4.06Å; L64-W87 HydrophobicContact CD2-CZ3 3.67Å; F73-W87 AromaticContact CD1-CE3 3.58Å; F73-W87 HydrophobicContact CD1-CE3 3.58Å; F73-W87 HydrophobicContact CD1-CZ3 4.07Å; F73-W87 HydrophobicContact CD2-CB 3.81Å; F73-W87 HydrophobicContact CD2-CE3 4.41Å; F73-W87 AromaticContact CE1-CE3 3.48Å; F73-W87 HydrophobicContact CE1-CE3 3.48Å; F73-W87 VanDerWaalsContact CE1-CE3 3.48Å; F73-W87 AromaticContact CE1-CZ3 3.88Å; F73-W87 HydrophobicContact CE1-CZ3 3.88Å; F73-W87 HydrophobicContact CE2-CB 4.06Å; F73-W87 HydrophobicContact CE2-CE3 4.38Å; F73-W87 HydrophobicContact CG-CB 4.24Å; F73-W87 HydrophobicContact CG-CE3 4.03Å; F73-W87 AromaticContact CZ-CE3 3.92Å; F73-W87 HydrophobicContact CZ-CE3 3.92Å; D83-W87 HydrophobicContact CB-CZ2 4.41Å; D83-W87 WeakPolarHBondContact O-CB 3.45Å; D83-W87 PolarHBondContact O-N 2.83Å; A84-W87 PolarHBondContact O-N 3.36Å; W87-K89 PolarHBondContact O-N 3.15Å; W87-R90 PolarHBondContact O-N 3.19Å; W87-R90 VanDerWaalsContact O-N 3.13Å; W87-L93 HydrophobicContact CB-CD2 3.68Å; W87-L93 HydrophobicContact CD2-CD2 3.95Å; W87-L93 HydrophobicContact CE3-CD2 4.32Å; W87-L93 HydrophobicContact CG-CD2 3.66Å
88	N	98	Very high	96.7	Very high	40 Å²	40	78.5 Å²	78.5	21%	0.214	39%	0.385	C	S	.	.	H	α-helix	trans	-69.9	-19.3	173.5	-71.5	-32.5	0	0	0	113.5	M72 F73 A84 L94	M72-N88 WeakPolarHBondContact CB-OD1 3.48Å; M72-N88 WeakPolarHBondContact CE-ND2 3.37Å; F73-N88 PolarHBondContact N-OD1 2.91Å; F73-N88 PolarHBondContact O-ND2 3.28Å; A84-N88 WeakPolarHBondContact O-CB 3.48Å; A84-N88 PolarHBondContact O-N 3.27Å; A84-N88 PolarHBondContact O-ND2 3.31Å; N88-L94 WeakPolarHBondContact O-CD1 3.38Å
89	K	97.6	Very high	96.8	Very high	164 Å²	164	72.5 Å²	72.5	71%	0.713	37%	0.365	S	S	*	.	H	α-helix	trans	-83.2	-15.4	171.9	-70.1	166	-169.4	156.3	0	112.6	D85 Q86 W87 L91	D85-K89 WeakPolarHBondContact O-CD 3.45Å; D85-K89 WeakPolarHBondContact O-CE 3.36Å; D85-K89 VanDerWaalsContact O-CG 3.25Å; D85-K89 WeakPolarHBondContact O-CG 3.36Å; Q86-K89 PolarHBondContact O-N 3.25Å; W87-K89 PolarHBondContact O-N 3.15Å; K89-L91 PolarHBondContact O-N 2.99Å
90	R	97.9	Very high	96.9	Very high	101 Å²	101	68.5 Å²	68.5	38%	0.381	35%	0.346	S	S	.	.			trans	-89.2	99.9	176.8	-75	-157.6	-61.4	-146.1	-2.7	111.1	Q86 W87 D92 L93 L94	Q86-R90 PolarHBondContact O-N 3.23Å; W87-R90 PolarHBondContact O-N 3.19Å; W87-R90 VanDerWaalsContact O-N 3.13Å; R90-D92 VanDerWaalsContact C-N 3.33Å; R90-D92 WeakPolarHBondContact CB-OD1 3.24Å; R90-D92 PolarHBondContact O-N 3.4Å; R90-L93 HydrophobicContact CB-CB 4.02Å; R90-L93 PolarHBondContact O-N 2.79Å; R90-L94 PolarHBondContact O-N 3.47Å; R90-L94 VanDerWaalsContact O-N 3.09Å
91	L	95.9	Very high	96.9	Very high	102 Å²	102	69.4 Å²	69.4	53%	0.534	35%	0.352	S	S	.	.	H	α-helix	trans	-62.4	-39.5	-177.5	-174.1	64.7	0	0	0	112.5	K89 L93 L94 E95	K89-L91 PolarHBondContact O-N 2.99Å; L91-L93 VanDerWaalsContact C-N 3.31Å; L91-L93 PolarHBondContact O-N 2.91Å; L91-L94 PolarHBondContact O-N 2.79Å; L91-E95 HydrophobicContact CD1-CG 4.03Å; L91-E95 HydrophobicContact CG-CG 4.13Å; L91-E95 WeakPolarHBondContact O-CB 3.39Å; L91-E95 WeakPolarHBondContact O-CG 3.4Å; L91-E95 PolarHBondContact O-N 3.07Å
92	D	96.6	Very high	96.7	Very high	106 Å²	106	68.2 Å²	68.2	57%	0.567	35%	0.349	S	S	*	.	H	α-helix	trans	-57.4	-43.2	177.2	60.8	-47.9	0	0	0	112.3	R90 T96	R90-D92 VanDerWaalsContact C-N 3.33Å; R90-D92 WeakPolarHBondContact CB-OD1 3.24Å; R90-D92 PolarHBondContact O-N 3.4Å; D92-T96 WeakPolarHBondContact O-CB 3.47Å; D92-T96 PolarHBondContact O-N 3.33Å; D92-T96 VanDerWaalsContact O-N 3.09Å; D92-T96 PolarHBondContact O-OG1 3.41Å
93	L	95.8	Very high	96.4	Very high	43 Å²	43	69.8 Å²	69.8	23%	0.225	35%	0.351	C	S	.	.	H	α-helix	trans	-70.4	-46.1	178.1	-177	62.2	0	0	0	111.4	F73 W87 R90 L91 T96 S97	F73-L93 HydrophobicContact CE2-CD2 3.91Å; F73-L93 HydrophobicContact CE2-CG 3.86Å; F73-L93 HydrophobicContact CZ-CD1 4.36Å; F73-L93 HydrophobicContact CZ-CD2 3.93Å; F73-L93 HydrophobicContact CZ-CG 3.86Å; W87-L93 HydrophobicContact CB-CD2 3.68Å; W87-L93 HydrophobicContact CD2-CD2 3.95Å; W87-L93 HydrophobicContact CE3-CD2 4.32Å; W87-L93 HydrophobicContact CG-CD2 3.66Å; R90-L93 HydrophobicContact CB-CB 4.02Å; R90-L93 PolarHBondContact O-N 2.79Å; L91-L93 VanDerWaalsContact C-N 3.31Å; L91-L93 PolarHBondContact O-N 2.91Å; L93-T96 PolarHBondContact O-N 2.87Å; L93-S97 WeakPolarHBondContact O-CB 3.09Å; L93-S97 PolarHBondContact O-N 3.29Å; L93-S97 PolarHBondContact O-OG 3.03Å
94	L	96.2	Very high	96.2	Very high	11 Å²	11	70.6 Å²	70.6	6%	0.058	36%	0.358	C	S	.	.	H	α-helix	trans	-61.6	-45.2	178.1	-82.2	178.8	0	0	0	112.6	F66 M72 F73 N88 R90 L91 S97 R98	F66-L94 HydrophobicContact CE2-CD2 4.41Å; M72-L94 HydrophobicContact CB-CD2 4.24Å; F73-L94 HydrophobicContact CD2-CD2 3.9Å; F73-L94 HydrophobicContact CE2-CD2 4.02Å; N88-L94 WeakPolarHBondContact O-CD1 3.38Å; R90-L94 PolarHBondContact O-N 3.47Å; R90-L94 VanDerWaalsContact O-N 3.09Å; L91-L94 PolarHBondContact O-N 2.79Å; L94-S97 PolarHBondContact O-N 3.41Å; L94-R98 WeakPolarHBondContact O-CB 3.48Å; L94-R98 WeakPolarHBondContact O-CD 3.31Å; L94-R98 WeakPolarHBondContact O-CG 3.35Å; L94-R98 PolarHBondContact O-N 3.07Å
95	E	96.3	Very high	96.1	Very high	110 Å²	110	70.3 Å²	70.3	51%	0.514	36%	0.355	S	S	.	.	H	α-helix	trans	-63.6	-42.8	177.9	-74	-177.5	172.8	0	0	111.3	L91 R98 A99	L91-E95 HydrophobicContact CD1-CG 4.03Å; L91-E95 HydrophobicContact CG-CG 4.13Å; L91-E95 WeakPolarHBondContact O-CB 3.39Å; L91-E95 WeakPolarHBondContact O-CG 3.4Å; L91-E95 PolarHBondContact O-N 3.07Å; E95-R98 PolarHBondContact O-N 3.45Å; E95-A99 VanDerWaalsContact O-CB 3.28Å; E95-A99 WeakPolarHBondContact O-CB 3.2Å; E95-A99 PolarHBondContact O-N 2.81Å
96	T	95.9	Very high	95.9	Very high	80 Å²	80	68.9 Å²	68.9	49%	0.491	34%	0.342	S	S	.	.	H	α-helix	trans	-62.7	-45.4	175.9	-58.4	0	0	0	0	111.5	D92 L93 R98 A99 A100	D92-T96 WeakPolarHBondContact O-CB 3.47Å; D92-T96 PolarHBondContact O-N 3.33Å; D92-T96 VanDerWaalsContact O-N 3.09Å; D92-T96 PolarHBondContact O-OG1 3.41Å; L93-T96 PolarHBondContact O-N 2.87Å; T96-R98 PolarHBondContact O-N 3.49Å; T96-A99 PolarHBondContact O-N 2.95Å; T96-A100 PolarHBondContact O-N 2.57Å
97	S	95.9	Very high	95.3	Very high	20 Å²	20	68.1 Å²	68.1	14%	0.14	34%	0.339	C	S	.	.	H	α-helix	trans	-64.4	-39.6	177.8	-69.1	0	0	0	0	112.4	F66 F73 L93 L94 A100	F66-S97 WeakPolarHBondContact CE1-O 3.42Å; F66-S97 VanDerWaalsContact CE2-CB 3.46Å; F73-S97 WeakPolarHBondContact CZ-OG 3.04Å; L93-S97 WeakPolarHBondContact O-CB 3.09Å; L93-S97 PolarHBondContact O-N 3.29Å; L93-S97 PolarHBondContact O-OG 3.03Å; L94-S97 PolarHBondContact O-N 3.41Å; S97-A100 VanDerWaalsContact O-CB 3.25Å; S97-A100 WeakPolarHBondContact O-CB 3.34Å; S97-A100 PolarHBondContact O-N 3.17Å
98	R	96.6	Very high	94.9	Very high	110 Å²	110	72.6 Å²	72.6	42%	0.415	36%	0.359	S	S	.	.	H	α-helix	trans	-65	-41	173.1	-70.5	165.8	-173.8	156.2	1.4	111.6	F66 G71 L94 E95 T96 A100	F66-R98 HydrophobicContact CE2-CG 4.49Å; F66-R98 HydrophobicContact CZ-CG 4.01Å; G71-R98 VanDerWaalsContact O-CZ 3.25Å; G71-R98 PolarHBondContact O-NE 2.73Å; G71-R98 PolarHBondContact O-NH2 3.22Å; L94-R98 WeakPolarHBondContact O-CB 3.48Å; L94-R98 WeakPolarHBondContact O-CD 3.31Å; L94-R98 WeakPolarHBondContact O-CG 3.35Å; L94-R98 PolarHBondContact O-N 3.07Å; E95-R98 PolarHBondContact O-N 3.45Å; T96-R98 PolarHBondContact O-N 3.49Å; R98-A100 PolarHBondContact O-N 3.15Å
99	A	96.8	Very high	94.4	Very high	43 Å²	43	74.4 Å²	74.4	36%	0.355	36%	0.364	S	S	.	.	H	α-helix	trans	-66	-27.7	177.9	0	0	0	0	0	112.4	E95 T96 V101 N102 M103	E95-A99 VanDerWaalsContact O-CB 3.28Å; E95-A99 WeakPolarHBondContact O-CB 3.2Å; E95-A99 PolarHBondContact O-N 2.81Å; T96-A99 PolarHBondContact O-N 2.95Å; A99-V101 PolarHBondContact O-N 2.86Å; A99-V101 VanDerWaalsContact O-N 3.12Å; A99-N102 PolarHBondContact O-N 2.04Å; A99-M103 HydrophobicContact CB-SD 4.26Å; A99-M103 WeakPolarHBondContact O-CG 3.25Å; A99-M103 PolarHBondContact O-N 3.45Å
100	A	96.4	Very high	93.6	Very high	17 Å²	17	71.8 Å²	71.8	14%	0.14	35%	0.352	C	S	.	.	H	α-helix	trans	-54.3	-30.4	-179.2	0	0	0	0	0	113.7	L52 T96 S97 R98 N102 V104 C105	L52-A100 HydrophobicContact CD2-CB 3.51Å; T96-A100 PolarHBondContact O-N 2.57Å; S97-A100 VanDerWaalsContact O-CB 3.25Å; S97-A100 WeakPolarHBondContact O-CB 3.34Å; S97-A100 PolarHBondContact O-N 3.17Å; R98-A100 PolarHBondContact O-N 3.15Å; A100-N102 VanDerWaalsContact C-N 3.26Å; A100-N102 PolarHBondContact O-N 3.02Å; A100-V104 HydrophobicContact CB-CG2 4.34Å; A100-V104 WeakPolarHBondContact O-CA 3.13Å; A100-V104 VanDerWaalsContact O-CB 3.25Å; A100-V104 WeakPolarHBondContact O-CB 3.46Å; A100-V104 PolarHBondContact O-N 3.37Å; A100-C105 PolarHBondContact O-N 3.37Å; A100-C105 VanDerWaalsContact O-N 3.15Å
101	V	96.5	Very high	92.8	Very high	19 Å²	19	72.3 Å²	72.3	12%	0.115	36%	0.362	C	S	.	.	I	π-helix	trans	-55.2	-44.8	172.7	179.8	0	0	0	0	111.2	V50 L52 A99 C105 R106	V50-V101 HydrophobicContact CB-CG1 3.88Å; V50-V101 HydrophobicContact CG1-CG1 3.85Å; L52-V101 HydrophobicContact CB-CG2 3.87Å; L52-V101 HydrophobicContact CD2-CG2 4.2Å; A99-V101 PolarHBondContact O-N 2.86Å; A99-V101 VanDerWaalsContact O-N 3.12Å; V101-C105 VanDerWaalsContact O-CB 3.31Å; V101-C105 WeakPolarHBondContact O-CB 3.27Å; V101-C105 PolarHBondContact O-N 3.45Å; V101-R106 PolarHBondContact O-N 2.8Å
102	N	94.1	Very high	92	Very high	93 Å²	93	68.4 Å²	68.4	50%	0.497	35%	0.346	S	S	.	.	I	π-helix	trans	-85.3	-47.6	-178	-68	-32	0	0	0	111.9	A99 A100 R106 Q107	A99-N102 PolarHBondContact O-N 2.04Å; A100-N102 VanDerWaalsContact C-N 3.26Å; A100-N102 PolarHBondContact O-N 3.02Å; N102-R106 WeakPolarHBondContact OD1-CD 3.44Å; N102-R106 PolarHBondContact OD1-NE 2.89Å; N102-Q107 WeakPolarHBondContact O-CG 3.23Å
103	M	91.3	Very high	91.3	Very high	113 Å²	113	64.8 Å²	64.8	56%	0.557	33%	0.331	S	S	*	.	I	π-helix	trans	-76.5	-27.5	-173.9	66	-180	-100.2	0	0	113.5	A99 Q107	A99-M103 HydrophobicContact CB-SD 4.26Å; A99-M103 WeakPolarHBondContact O-CG 3.25Å; A99-M103 PolarHBondContact O-N 3.45Å; M103-Q107 WeakPolarHBondContact O-CB 3.31Å; M103-Q107 WeakPolarHBondContact O-CG 3.14Å
104	V	92.6	Very high	90.7	Very high	61 Å²	61	63.9 Å²	63.9	37%	0.37	33%	0.328	S	S	.	.	I	π-helix	trans	-104.8	-70	177.4	-175.6	0	0	0	0	109.8	A100 R106 Q107 K108	A100-V104 HydrophobicContact CB-CG2 4.34Å; A100-V104 WeakPolarHBondContact O-CA 3.13Å; A100-V104 VanDerWaalsContact O-CB 3.25Å; A100-V104 WeakPolarHBondContact O-CB 3.46Å; A100-V104 PolarHBondContact O-N 3.37Å; V104-R106 PolarHBondContact O-N 3.42Å; V104-Q107 PolarHBondContact O-N 2.72Å; V104-K108 HydrophobicContact CG1-CG 4.19Å; V104-K108 VanDerWaalsContact O-CB 3.25Å; V104-K108 WeakPolarHBondContact O-CB 3.24Å; V104-K108 WeakPolarHBondContact O-CG 3.48Å; V104-K108 PolarHBondContact O-N 3.39Å
105	C	94.5	Very high	90.2	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	34%	0.339	C	S	.	.	I	π-helix	trans	-60.1	-55	-168.1	-61.2	0	0	0	0	112.4	C41 F43 V50 A100 V101 Q107 K108 Y109	C41-C105 HydrophobicContact CB-CB 3.65Å; C41-C105 WeakPolarHBondContact CB-SG 3.26Å; C41-C105 WeakPolarHBondContact SG-CA 3.3Å; C41-C105 WeakPolarHBondContact SG-CB 3.17Å; C41-C105 CovalentContact SG-SG 2.04Å; C41-C105 PolarHBondContact SG-SG 3.35Å; F43-C105 HydrophobicContact CE1-CB 4.05Å; F43-C105 HydrophobicContact CZ-CB 3.85Å; F43-C105 WeakPolarHBondContact CZ-O 3.25Å; V50-C105 HydrophobicContact CG1-CB 3.6Å; A100-C105 PolarHBondContact O-N 3.37Å; A100-C105 VanDerWaalsContact O-N 3.15Å; V101-C105 VanDerWaalsContact O-CB 3.31Å; V101-C105 WeakPolarHBondContact O-CB 3.27Å; V101-C105 PolarHBondContact O-N 3.45Å; C105-Q107 PolarHBondContact O-N 3.4Å; C105-K108 PolarHBondContact O-N 3.15Å; C105-Y109 WeakPolarHBondContact O-CB 3.47Å; C105-Y109 PolarHBondContact O-N 3.33Å
106	R	93.1	Very high	89.8	Confident	69 Å²	69	63.6 Å²	63.6	26%	0.26	33%	0.328	S	S	.	.	I	π-helix	trans	-64.7	-40.2	-179.1	-67.2	178.2	-172.5	-90.1	-13	112.9	T47 E48 V50 V101 N102 V104 Y109 K110	T47-R106 PolarHBondContact O-NH1 3.06Å; T47-R106 PolarHBondContact O-NH2 2.82Å; T47-R106 VanDerWaalsContact O-NH2 3.15Å; E48-R106 PolarHBondContact O-NH2 2.77Å; V50-R106 HydrophobicContact CG2-CG 4.06Å; V101-R106 PolarHBondContact O-N 2.8Å; N102-R106 WeakPolarHBondContact OD1-CD 3.44Å; N102-R106 PolarHBondContact OD1-NE 2.89Å; V104-R106 PolarHBondContact O-N 3.42Å; R106-Y109 PolarHBondContact O-N 3.49Å; R106-K110 WeakPolarHBondContact O-CG 3.34Å; R106-K110 PolarHBondContact O-N 3.32Å; R106-K110 VanDerWaalsContact O-N 3.1Å
107	Q	86.4	Confident	89.5	Confident	89 Å²	89	60.7 Å²	60.7	42%	0.416	31%	0.31	S	S	.	.	H	α-helix	trans	-64.1	-45.7	177.1	-70.2	-62.5	-31.1	0	0	111.4	N102 M103 V104 C105 Y109 K110 L111	N102-Q107 WeakPolarHBondContact O-CG 3.23Å; M103-Q107 WeakPolarHBondContact O-CB 3.31Å; M103-Q107 WeakPolarHBondContact O-CG 3.14Å; V104-Q107 PolarHBondContact O-N 2.72Å; C105-Q107 PolarHBondContact O-N 3.4Å; Q107-Y109 VanDerWaalsContact C-N 3.34Å; Q107-K110 WeakPolarHBondContact O-CB 3.31Å; Q107-K110 PolarHBondContact O-N 3.1Å; Q107-L111 PolarHBondContact O-N 2.74Å
108	K	87.8	Confident	89.2	Confident	133 Å²	133	64.6 Å²	64.6	58%	0.578	33%	0.327	S	S	*	.	H	α-helix	trans	-67.6	-34.5	177.1	-66.9	-62.1	-174.5	-179.4	0	112	V104 C105 K110 L111 G112	V104-K108 HydrophobicContact CG1-CG 4.19Å; V104-K108 VanDerWaalsContact O-CB 3.25Å; V104-K108 WeakPolarHBondContact O-CB 3.24Å; V104-K108 WeakPolarHBondContact O-CG 3.48Å; V104-K108 PolarHBondContact O-N 3.39Å; C105-K108 PolarHBondContact O-N 3.15Å; K108-K110 PolarHBondContact O-N 3.06Å; K108-L111 HydrophobicContact CD-CD1 4.3Å; K108-L111 PolarHBondContact O-N 2.83Å; K108-G112 PolarHBondContact O-N 2.79Å
109	Y	87.6	Confident	88.9	Confident	79 Å²	79	64.9 Å²	64.9	31%	0.31	33%	0.328	S	S	.	.	H	α-helix	trans	-59.2	-46.4	172	-174.9	-84.8	0	0	0	111.4	F43 G46 T47 C105 R106 Q107 L111 G112 A113	F43-Y109 HydrophobicContact CB-CD2 4.23Å; F43-Y109 HydrophobicContact CB-CE2 4.11Å; F43-Y109 AromaticContact CD1-CD2 3.48Å; F43-Y109 HydrophobicContact CD1-CD2 3.48Å; F43-Y109 VanDerWaalsContact CD1-CD2 3.48Å; F43-Y109 HydrophobicContact CD1-CE2 4.14Å; F43-Y109 HydrophobicContact CD1-CG 4.06Å; F43-Y109 AromaticContact CD2-CD2 3.86Å; F43-Y109 HydrophobicContact CD2-CD2 3.86Å; F43-Y109 HydrophobicContact CD2-CE2 4.42Å; F43-Y109 AromaticContact CE1-CD2 3.71Å; F43-Y109 HydrophobicContact CE1-CD2 3.71Å; F43-Y109 AromaticContact CE1-CG 3.97Å; F43-Y109 HydrophobicContact CE1-CG 3.97Å; F43-Y109 HydrophobicContact CE2-CD2 4.04Å; F43-Y109 AromaticContact CG-CD2 3.57Å; F43-Y109 HydrophobicContact CG-CD2 3.57Å; F43-Y109 AromaticContact CG-CE2 3.97Å; F43-Y109 HydrophobicContact CG-CE2 3.97Å; F43-Y109 AromaticContact CZ-CD2 3.98Å; F43-Y109 HydrophobicContact CZ-CD2 3.98Å; F43-Y109 HydrophobicContact CZ-CG 4.35Å; G46-Y109 WeakPolarHBondContact CA-OH 3.4Å; T47-Y109 HydrophobicContact CG2-CD1 3.27Å; T47-Y109 HydrophobicContact CG2-CD2 4.37Å; T47-Y109 HydrophobicContact CG2-CE1 3.79Å; T47-Y109 HydrophobicContact CG2-CG 3.62Å; C105-Y109 WeakPolarHBondContact O-CB 3.47Å; C105-Y109 PolarHBondContact O-N 3.33Å; R106-Y109 PolarHBondContact O-N 3.49Å; Q107-Y109 VanDerWaalsContact C-N 3.34Å; Y109-L111 PolarHBondContact O-N 3.5Å; Y109-G112 PolarHBondContact O-N 3.02Å; Y109-A113 HydrophobicContact CD1-CB 3.84Å; Y109-A113 HydrophobicContact CD2-CB 4.24Å; Y109-A113 HydrophobicContact CE1-CB 3.53Å; Y109-A113 HydrophobicContact CE2-CB 3.97Å; Y109-A113 HydrophobicContact CG-CB 4.18Å; Y109-A113 WeakPolarHBondContact O-CB 3.45Å; Y109-A113 PolarHBondContact O-N 3.25Å
110	K	82.4	Confident	88.7	Confident	109 Å²	109	67.3 Å²	67.3	47%	0.474	33%	0.334	S	S	.	.	H	α-helix	trans	-59.3	-34.9	176.8	-71.8	178.8	173	-164.7	0	112.9	R106 Q107 K108 P114 E193	R106-K110 WeakPolarHBondContact O-CG 3.34Å; R106-K110 PolarHBondContact O-N 3.32Å; R106-K110 VanDerWaalsContact O-N 3.1Å; Q107-K110 WeakPolarHBondContact O-CB 3.31Å; Q107-K110 PolarHBondContact O-N 3.1Å; K108-K110 PolarHBondContact O-N 3.06Å; K110-P114 VanDerWaalsContact O-CD 3.3Å; K110-P114 WeakPolarHBondContact O-CD 3.45Å; K110-P114 WeakPolarHBondContact O-CG 3.4Å; K110-E193 IonicContact NZ-OE1 3.29Å
111	L	79.1	Confident	88.6	Confident	112 Å²	112	68.8 Å²	68.8	59%	0.586	35%	0.352	S	S	*	.	H	α-helix	trans	-77	-43.6	177.6	-66.7	170.2	0	0	0	111.8	Q107 K108 Y109 F115	Q107-L111 PolarHBondContact O-N 2.74Å; K108-L111 HydrophobicContact CD-CD1 4.3Å; K108-L111 PolarHBondContact O-N 2.83Å; Y109-L111 PolarHBondContact O-N 3.5Å; L111-F115 VanDerWaalsContact O-CD1 3.29Å; L111-F115 WeakPolarHBondContact O-CD1 3.11Å; L111-F115 WeakPolarHBondContact O-CE1 3.29Å
112	G	80.2	Confident	88.5	Confident	19 Å²	19	69 Å²	69	20%	0.196	35%	0.351	C	S	.	.	H	α-helix	trans	-89.2	-37.4	-168.8	0	0	0	0	0	116	K108 Y109 P114 F115 T116	K108-G112 PolarHBondContact O-N 2.79Å; Y109-G112 PolarHBondContact O-N 3.02Å; G112-P114 VanDerWaalsContact C-CD 3.43Å; G112-F115 VanDerWaalsContact CA-CE1 3.47Å; G112-F115 VanDerWaalsContact CA-CZ 3.49Å; G112-F115 PolarHBondContact O-N 2.76Å; G112-T116 PolarHBondContact O-N 3.3Å; G112-T116 PolarHBondContact O-OG1 3.49Å; G112-T116 VanDerWaalsContact O-OG1 3.1Å
113	A	82.4	Confident	88.5	Confident	31 Å²	31	71.7 Å²	71.7	26%	0.256	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-60.7	-37	-176.5	0	0	0	0	0	113.7	Y109 F115 T116	Y109-A113 HydrophobicContact CD1-CB 3.84Å; Y109-A113 HydrophobicContact CD2-CB 4.24Å; Y109-A113 HydrophobicContact CE1-CB 3.53Å; Y109-A113 HydrophobicContact CE2-CB 3.97Å; Y109-A113 HydrophobicContact CG-CB 4.18Å; Y109-A113 WeakPolarHBondContact O-CB 3.45Å; Y109-A113 PolarHBondContact O-N 3.25Å; A113-F115 PolarHBondContact O-N 2.88Å; A113-F115 VanDerWaalsContact O-N 3.17Å; A113-T116 PolarHBondContact O-N 2.86Å; A113-T116 VanDerWaalsContact O-O 3.09Å
114	P	83.1	Confident	88.7	Confident	23 Å²	23	68.1 Å²	68.1	15%	0.149	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-58.3	-28.9	179	-29.8	38.2	0	0	0	115.5	K110 G112 W131 W188	K110-P114 VanDerWaalsContact O-CD 3.3Å; K110-P114 WeakPolarHBondContact O-CD 3.45Å; K110-P114 WeakPolarHBondContact O-CG 3.4Å; G112-P114 VanDerWaalsContact C-CD 3.43Å; P114-W131 VanDerWaalsContact O-CH2 3.27Å; P114-W131 WeakPolarHBondContact O-CH2 3.07Å; P114-W188 HydrophobicContact CB-CD2 3.62Å; P114-W188 HydrophobicContact CB-CE3 3.94Å; P114-W188 HydrophobicContact CB-CG 4.08Å; P114-W188 HydrophobicContact CB-CH2 4.01Å; P114-W188 HydrophobicContact CB-CZ2 3.73Å; P114-W188 HydrophobicContact CB-CZ3 4.13Å; P114-W188 HydrophobicContact CG-CD2 4.26Å; P114-W188 HydrophobicContact CG-CH2 4.39Å; P114-W188 HydrophobicContact CG-CZ2 3.73Å
115	F	84.9	Confident	88.6	Confident	68 Å²	68	65.9 Å²	65.9	30%	0.298	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-109.2	6.1	-177.5	62	-106.5	0	0	0	113.3	L111 G112 A113 M160 L161 M163	L111-F115 VanDerWaalsContact O-CD1 3.29Å; L111-F115 WeakPolarHBondContact O-CD1 3.11Å; L111-F115 WeakPolarHBondContact O-CE1 3.29Å; G112-F115 VanDerWaalsContact CA-CE1 3.47Å; G112-F115 VanDerWaalsContact CA-CZ 3.49Å; G112-F115 PolarHBondContact O-N 2.76Å; A113-F115 PolarHBondContact O-N 2.88Å; A113-F115 VanDerWaalsContact O-N 3.17Å; F115-M160 CarbonylContact O-C 3.59Å; F115-M160 VanDerWaalsContact O-CA 3.25Å; F115-M160 WeakPolarHBondContact O-CA 3.36Å; F115-L161 HydrophobicContact CB-CB 4.49Å; F115-L161 WeakPolarHBondContact CB-O 3.43Å; F115-L161 PolarHBondContact O-N 2.76Å; F115-M163 HydrophobicContact CB-CG 4.05Å; F115-M163 HydrophobicContact CB-SD 3.92Å
116	T	88.4	Confident	88.6	Confident	47 Å²	47	71.6 Å²	71.6	29%	0.288	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	116.3	179.4	-56.3	0	0	0	0	110	G112 A113 T158 M160	G112-T116 PolarHBondContact O-N 3.3Å; G112-T116 PolarHBondContact O-OG1 3.49Å; G112-T116 VanDerWaalsContact O-OG1 3.1Å; A113-T116 PolarHBondContact O-N 2.86Å; A113-T116 VanDerWaalsContact O-O 3.09Å; T116-T158 HydrophobicContact CG2-CG2 3.68Å; T116-M160 HydrophobicContact CG2-CG 3.74Å; T116-M160 HydrophobicContact CG2-SD 4.28Å
117	V	89.8	Confident	88.6	Confident	19 Å²	19	70.1 Å²	70.1	12%	0.115	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	111.1	177.1	176.2	0	0	0	0	109.4	R119 W131 T158 V159 C173	V117-R119 HydrophobicContact CG1-CG 4.36Å; V117-W131 HydrophobicContact CB-CZ2 4.32Å; V117-W131 HydrophobicContact CG2-CH2 3.75Å; V117-W131 HydrophobicContact CG2-CZ2 3.41Å; V117-W131 VanDerWaalsContact CG2-CZ2 3.41Å; V117-T158 WeakPolarHBondContact O-CA 3.25Å; V117-V159 PolarHBondContact N-O 2.67Å; V117-V159 PolarHBondContact O-N 2.91Å; V117-C173 HydrophobicContact CG2-CB 3.71Å; V117-C173 VanDerWaalsContact CG2-SG 3.55Å
118	E	89.2	Confident	89	Confident	103 Å²	103	69.2 Å²	69.2	48%	0.481	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	130.6	170.9	-174.5	-178.7	160.9	0	0	110.3
119	R	91.5	Very high	89.3	Confident	116 Å²	116	64 Å²	64	44%	0.438	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	126.9	169.2	-65.2	-66	123.7	-129.6	-4.5	108	V117 F122 I127 Q156 T157	V117-R119 HydrophobicContact CG1-CG 4.36Å; R119-F122 HydrophobicContact CB-CD1 4.03Å; R119-F122 HydrophobicContact CB-CE1 3.93Å; R119-F122 WeakPolarHBondContact O-CE1 3.48Å; R119-I127 HydrophobicContact CB-CD1 4.07Å; R119-I127 HydrophobicContact CG-CD1 4.1Å; R119-Q156 CarbonylContact O-C 3.42Å; R119-Q156 WeakPolarHBondContact O-CA 3.48Å; R119-T157 HydrophobicContact CB-CG2 4.3Å; R119-T157 PolarHBondContact N-O 3Å; R119-T157 PolarHBondContact O-N 3.45Å
120	N	92.1	Very high	89.6	Confident	93 Å²	93	62.5 Å²	62.5	50%	0.497	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	153.7	-179.6	-170.7	10.1	0	0	0	109.5	N150 Q156	N120-N150 PolarHBondContact OD1-ND2 3.22Å; N120-Q156 HydrophobicContact CB-CB 4.15Å; N120-Q156 WeakPolarHBondContact OD1-CB 3.31Å
121	G	93.4	Very high	90.2	Very high	49 Å²	49	57.6 Å²	57.6	51%	0.505	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	75.5	23.7	173.2	0	0	0	0	0	115	F155	G121-F155 PolarHBondContact N-O 3.18Å
122	F	94.1	Very high	90.9	Very high	22 Å²	22	54.3 Å²	54.3	10%	0.096	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	153.3	-178.9	64.7	-91.2	0	0	0	113	R119 I127 L147 F155 T157 H177	R119-F122 HydrophobicContact CB-CD1 4.03Å; R119-F122 HydrophobicContact CB-CE1 3.93Å; R119-F122 WeakPolarHBondContact O-CE1 3.48Å; F122-I127 HydrophobicContact CD1-CD1 4.21Å; F122-I127 HydrophobicContact CD2-CB 4.36Å; F122-I127 HydrophobicContact CD2-CD1 4.26Å; F122-I127 HydrophobicContact CE1-CD1 4Å; F122-I127 HydrophobicContact CE2-CB 3.79Å; F122-I127 HydrophobicContact CE2-CD1 4.06Å; F122-I127 HydrophobicContact CE2-CG2 3.69Å; F122-I127 HydrophobicContact CG-CD1 4.34Å; F122-I127 HydrophobicContact CZ-CB 4.19Å; F122-I127 HydrophobicContact CZ-CD1 3.94Å; F122-I127 HydrophobicContact CZ-CG2 3.7Å; F122-L147 HydrophobicContact CE2-CD2 3.88Å; F122-L147 HydrophobicContact CZ-CD2 3.69Å; F122-F155 VanDerWaalsContact CD1-O 3.23Å; F122-F155 WeakPolarHBondContact CD1-O 3.4Å; F122-F155 HydrophobicContact CD2-CB 4.17Å; F122-F155 HydrophobicContact CE1-CB 4.3Å; F122-F155 VanDerWaalsContact CE1-O 3.31Å; F122-F155 WeakPolarHBondContact CE1-O 3.36Å; F122-F155 HydrophobicContact CE2-CB 3.69Å; F122-F155 HydrophobicContact CZ-CB 3.75Å; F122-F155 PolarHBondContact N-O 2.82Å; F122-F155 PolarHBondContact O-N 2.98Å; F122-T157 HydrophobicContact CE1-CG2 4.06Å; F122-T157 HydrophobicContact CZ-CG2 3.97Å; F122-H177 AromaticContact CD2-CD2 3.92Å; F122-H177 AromaticContact CD2-NE2 3.67Å
123	Y	94.1	Very high	91.5	Very high	150 Å²	150	57 Å²	57	59%	0.588	29%	0.293	S	S	*	.	S	Bend	trans	-154	137.7	175.4	-177.4	-89.7	0	0	0	110.4	W153 F155 H177	Y123-W153 WeakPolarHBondContact CD2-O 3.24Å; Y123-F155 HydrophobicContact CD2-CD2 4.31Å; Y123-F155 AromaticContact CD2-CE2 3.86Å; Y123-F155 HydrophobicContact CD2-CE2 3.86Å; Y123-F155 HydrophobicContact CE2-CE2 4.21Å; Y123-H177 PolarHBondContact O-CE1 2.95Å
124	P	95	Very high	91.9	Very high	39 Å²	39	59.9 Å²	59.9	25%	0.253	30%	0.304	S	S	.	.	S	Bend	cis	-72.4	175.4	2.2	31.9	-36.7	0	0	0	112.5	D126 H177 P178	P124-D126 PolarHBondContact O-N 3.3Å; P124-H177 PolarHBondContact O-NE2 3.26Å; P124-P178 HydrophobicContact CG-CB 4.14Å; P124-P178 HydrophobicContact CG-CG 4.03Å
125	G	92.5	Very high	92.3	Very high	13 Å²	13	61.7 Å²	61.7	13%	0.134	33%	0.327	C	S	.	.	S	Bend	trans	-68.1	-15.5	-177.3	0	0	0	0	0	114.6	I127 L147	G125-I127 PolarHBondContact O-N 2.74Å; G125-L147 WeakPolarHBondContact O-CD1 3.33Å; G125-L147 VanDerWaalsContact O-CD2 3.29Å; G125-L147 WeakPolarHBondContact O-CD2 3.32Å
126	D	92.9	Very high	92.7	Very high	120 Å²	120	65.9 Å²	65.9	64%	0.642	35%	0.347	S	S	*	.			trans	-66.7	97.1	178.5	-57.4	-77.2	0	0	0	111.1	P124 H177 P178	P124-D126 PolarHBondContact O-N 3.3Å; D126-H177 PolarHBondContact O-CD2 2.96Å; D126-P178 HydrophobicContact CB-CG 4.33Å; D126-P178 WeakPolarHBondContact O-CD 3.48Å
127	I	94.6	Very high	93	Very high	39 Å²	39	67.4 Å²	67.4	20%	0.2	35%	0.352	C	S	.	.			trans	-127.9	140.1	176.9	-166.7	170.3	0	0	0	109.5	R119 F122 G125 V129 L147 T157 V175 H177	R119-I127 HydrophobicContact CB-CD1 4.07Å; R119-I127 HydrophobicContact CG-CD1 4.1Å; F122-I127 HydrophobicContact CD1-CD1 4.21Å; F122-I127 HydrophobicContact CD2-CB 4.36Å; F122-I127 HydrophobicContact CD2-CD1 4.26Å; F122-I127 HydrophobicContact CE1-CD1 4Å; F122-I127 HydrophobicContact CE2-CB 3.79Å; F122-I127 HydrophobicContact CE2-CD1 4.06Å; F122-I127 HydrophobicContact CE2-CG2 3.69Å; F122-I127 HydrophobicContact CG-CD1 4.34Å; F122-I127 HydrophobicContact CZ-CB 4.19Å; F122-I127 HydrophobicContact CZ-CD1 3.94Å; F122-I127 HydrophobicContact CZ-CG2 3.7Å; G125-I127 PolarHBondContact O-N 2.74Å; I127-V129 HydrophobicContact CD1-CG2 4.19Å; I127-V129 HydrophobicContact CG1-CG2 4.07Å; I127-L147 HydrophobicContact CG2-CD2 4.09Å; I127-T157 HydrophobicContact CD1-CG2 4.36Å; I127-T157 HydrophobicContact CG2-CG2 4.01Å; I127-V175 HydrophobicContact CD1-CG1 3.94Å; I127-V175 HydrophobicContact CG1-CG1 4.04Å; I127-H177 HydrophobicContact CG1-CB 4.41Å
128	N	94	Very high	93.1	Very high	70 Å²	70	69 Å²	69	37%	0.374	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	118.1	175.5	-172.5	20.8	0	0	0	109.3	K130 V175 E176	N128-K130 WeakPolarHBondContact ND2-CE 3.43Å; N128-V175 WeakPolarHBondContact O-CA 3.46Å; N128-E176 HydrophobicContact CB-CB 4.19Å; N128-E176 PolarHBondContact N-O 3.36Å; N128-E176 PolarHBondContact ND2-OE2 2.95Å; N128-E176 PolarHBondContact O-N 3.45Å
129	V	94.5	Very high	93.3	Very high	23 Å²	23	72.9 Å²	72.9	14%	0.139	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	116.2	-177.3	-175.8	0	0	0	0	108	I127 V159 C173 L174 V175	I127-V129 HydrophobicContact CD1-CG2 4.19Å; I127-V129 HydrophobicContact CG1-CG2 4.07Å; V129-V159 HydrophobicContact CB-CB 4.43Å; V129-V159 HydrophobicContact CB-CG2 3.91Å; V129-V159 HydrophobicContact CG1-CB 3.96Å; V129-V159 HydrophobicContact CG1-CG1 4.14Å; V129-V159 HydrophobicContact CG1-CG2 3.96Å; V129-V159 HydrophobicContact CG2-CG2 4.17Å; V129-C173 VanDerWaalsContact CG1-SG 3.5Å; V129-L174 WeakPolarHBondContact CA-O 3.42Å; V129-V175 HydrophobicContact CG1-CG2 4.44Å; V129-V175 HydrophobicContact CG2-CG2 4.39Å
130	K	94.4	Very high	93.1	Very high	47 Å²	47	72.9 Å²	72.9	20%	0.204	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	140.8	-179.6	-62.1	175.9	-168.9	150.1	0	110.5	N128 F132 C173 L174 E176	N128-K130 WeakPolarHBondContact ND2-CE 3.43Å; K130-F132 HydrophobicContact CB-CD2 4.41Å; K130-F132 HydrophobicContact CB-CE2 3.71Å; K130-F132 HydrophobicContact CB-CZ 4.39Å; K130-F132 HydrophobicContact CD-CE2 4.42Å; K130-F132 HydrophobicContact CD-CZ 4.38Å; K130-C173 WeakPolarHBondContact O-CA 3.45Å; K130-L174 HydrophobicContact CB-CB 4.44Å; K130-L174 PolarHBondContact N-O 3.23Å; K130-L174 PolarHBondContact O-N 3.37Å; K130-E176 IonicContact NZ-OE1 2.73Å; K130-E176 PolarHBondContact NZ-OE1 2.94Å; K130-E176 IonicContact NZ-OE2 3.68Å; K130-E176 PolarHBondContact NZ-OE2 3.48Å
131	W	94.4	Very high	92.9	Very high	7 Å²	7	68.9 Å²	68.9	3%	0.027	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	144.6	170.5	-81.8	102.6	0	0	0	110.7	P114 V117 E137 E138 V142 L161 S172 C173	P114-W131 VanDerWaalsContact O-CH2 3.27Å; P114-W131 WeakPolarHBondContact O-CH2 3.07Å; V117-W131 HydrophobicContact CB-CZ2 4.32Å; V117-W131 HydrophobicContact CG2-CH2 3.75Å; V117-W131 HydrophobicContact CG2-CZ2 3.41Å; V117-W131 VanDerWaalsContact CG2-CZ2 3.41Å; W131-E137 WeakPolarHBondContact O-CA 3.2Å; W131-E138 HydrophobicContact CB-CB 4.4Å; W131-E138 PolarHBondContact O-N 3.38Å; W131-V142 HydrophobicContact CB-CG2 3.99Å; W131-V142 HydrophobicContact CG-CG2 4.23Å; W131-L161 HydrophobicContact CB-CD2 4.22Å; W131-L161 HydrophobicContact CD2-CB 3.92Å; W131-L161 HydrophobicContact CD2-CD2 4.04Å; W131-L161 HydrophobicContact CE3-CB 4.48Å; W131-L161 HydrophobicContact CE3-CD2 3.98Å; W131-L161 HydrophobicContact CG-CB 4.04Å; W131-L161 HydrophobicContact CG-CD2 4.17Å; W131-L161 HydrophobicContact CZ2-CB 4.38Å; W131-S172 CarbonylContact C-O 3.51Å; W131-C173 HydrophobicContact CD2-CB 4.31Å; W131-C173 HydrophobicContact CE3-CB 4.12Å; W131-C173 HydrophobicContact CH2-CB 4.04Å; W131-C173 HydrophobicContact CZ2-CB 4.25Å; W131-C173 HydrophobicContact CZ3-CB 3.98Å
132	F	93.4	Very high	92.8	Very high	42 Å²	42	68.8 Å²	68.8	18%	0.184	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	137.7	173.4	-65.4	-100.5	0	0	0	109.9	K130 Q136 E137 Y171 S172 L174	K130-F132 HydrophobicContact CB-CD2 4.41Å; K130-F132 HydrophobicContact CB-CE2 3.71Å; K130-F132 HydrophobicContact CB-CZ 4.39Å; K130-F132 HydrophobicContact CD-CE2 4.42Å; K130-F132 HydrophobicContact CD-CZ 4.38Å; F132-Q136 CarbonylContact C-O 3.47Å; F132-Q136 WeakPolarHBondContact CA-O 3.29Å; F132-E137 HydrophobicContact CD1-CB 4.06Å; F132-E137 HydrophobicContact CE1-CB 3.81Å; F132-E137 HydrophobicContact CE1-CG 4.33Å; F132-E137 HydrophobicContact CZ-CB 4.36Å; F132-E137 HydrophobicContact CZ-CG 4.4Å; F132-Y171 CarbonylContact O-C 3.51Å; F132-Y171 VanDerWaalsContact O-CA 3.3Å; F132-Y171 WeakPolarHBondContact O-CA 3.35Å; F132-S172 WeakPolarHBondContact CB-OG 3.25Å; F132-S172 PolarHBondContact N-O 2.88Å; F132-S172 PolarHBondContact O-N 2.91Å; F132-L174 HydrophobicContact CD2-CB 4.31Å; F132-L174 HydrophobicContact CE2-CB 3.81Å; F132-L174 HydrophobicContact CE2-CD2 3.96Å; F132-L174 HydrophobicContact CZ-CD2 4.32Å
133	R	92.1	Very high	92.7	Very high	77 Å²	77	73.3 Å²	73.3	29%	0.291	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	121.5	169.1	-178.4	-179.5	-177.8	-177.1	2.9	108.5	G135 Q136 D169 Y171	R133-G135 PolarHBondContact O-N 3.35Å; R133-G135 VanDerWaalsContact O-N 3.09Å; R133-Q136 PolarHBondContact N-O 2.82Å; R133-Q136 PolarHBondContact O-N 2.88Å; R133-D169 IonicContact CZ-OD2 3.31Å; R133-D169 VanDerWaalsContact CZ-OD2 3.29Å; R133-D169 IonicContact NE-OD1 3.18Å; R133-D169 IonicContact NE-OD2 2.86Å; R133-D169 PolarHBondContact NE-OD2 2.96Å; R133-D169 VanDerWaalsContact NE-OD2 3.12Å; R133-D169 IonicContact NH2-OD1 3.97Å; R133-D169 IonicContact NH2-OD2 3.89Å; R133-D169 PolarHBondContact NH2-OD2 3.5Å; R133-Y171 HydrophobicContact CB-CD1 4.12Å; R133-Y171 HydrophobicContact CB-CE1 3.9Å; R133-Y171 HydrophobicContact CG-CD1 4.17Å; R133-Y171 HydrophobicContact CG-CE1 3.59Å; R133-Y171 PolarHBondContact NE-OH 3.24Å; R133-Y171 VanDerWaalsContact NE-OH 3.09Å
134	N	91.6	Very high	92.6	Very high	90 Å²	90	69.5 Å²	69.5	48%	0.481	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	35.1	-178.7	-58	-32.3	0	0	0	113.1	Q136 D169 I170	N134-Q136 VanDerWaalsContact C-N 3.34Å; N134-Q136 PolarHBondContact O-N 2.91Å; N134-D169 PolarHBondContact ND2-OD1 3Å; N134-D169 WeakPolarHBondContact OD1-CA 3.42Å; N134-I170 PolarHBondContact N-O 3.36Å; N134-I170 PolarHBondContact OD1-N 3.31Å
135	G	90.9	Very high	92.5	Very high	61 Å²	61	71.2 Å²	71.2	63%	0.629	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.5	-3.9	-178.9	0	0	0	0	0	115.7	R133	R133-G135 PolarHBondContact O-N 3.35Å; R133-G135 VanDerWaalsContact O-N 3.09Å
136	Q	93.2	Very high	92.4	Very high	156 Å²	156	72.2 Å²	72.2	73%	0.729	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.3	135.5	174.6	-64.8	-170.9	-29.9	0	0	110.8	F132 R133 N134 E138	F132-Q136 CarbonylContact C-O 3.47Å; F132-Q136 WeakPolarHBondContact CA-O 3.29Å; R133-Q136 PolarHBondContact N-O 2.82Å; R133-Q136 PolarHBondContact O-N 2.88Å; N134-Q136 VanDerWaalsContact C-N 3.34Å; N134-Q136 PolarHBondContact O-N 2.91Å; Q136-E138 PolarHBondContact O-N 2.84Å
137	E	94.8	Very high	92.5	Very high	80 Å²	80	71.2 Å²	71.2	37%	0.374	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	126.9	179.8	-170.3	-177.7	156.6	0	0	110.5	W131 F132 R139	W131-E137 WeakPolarHBondContact O-CA 3.2Å; F132-E137 HydrophobicContact CD1-CB 4.06Å; F132-E137 HydrophobicContact CE1-CB 3.81Å; F132-E137 HydrophobicContact CE1-CG 4.33Å; F132-E137 HydrophobicContact CZ-CB 4.36Å; F132-E137 HydrophobicContact CZ-CG 4.4Å; E137-R139 HydrophobicContact CG-CG 4.42Å; E137-R139 IonicContact OE1-CZ 3.37Å; E137-R139 IonicContact OE1-NE 3.56Å; E137-R139 PolarHBondContact OE1-NE 3.29Å; E137-R139 IonicContact OE1-NH2 3.7Å; E137-R139 PolarHBondContact OE1-NH2 2.87Å; E137-R139 IonicContact OE2-NH2 3.3Å; E137-R139 PolarHBondContact OE2-NH2 3Å
138	E	93.2	Very high	92.5	Very high	53 Å²	53	72.9 Å²	72.9	25%	0.248	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	128.1	179.9	-173.4	57.9	-118.4	0	0	109.4	W131 Q136 S140 V142 L161	W131-E138 HydrophobicContact CB-CB 4.4Å; W131-E138 PolarHBondContact O-N 3.38Å; Q136-E138 PolarHBondContact O-N 2.84Å; E138-S140 PolarHBondContact OE1-N 2.98Å; E138-S140 PolarHBondContact OE1-OG 3.31Å; E138-V142 WeakPolarHBondContact O-CG2 3.43Å; E138-L161 HydrophobicContact CB-CD1 4.39Å; E138-L161 HydrophobicContact CG-CD1 3.56Å; E138-L161 HydrophobicContact CG-CD2 4.49Å
139	R	92.1	Very high	92.5	Very high	183 Å²	183	77.1 Å²	77.1	69%	0.691	41%	0.408	S	S	*	.			trans	-126.4	-32.5	-177.4	-66.6	-172.9	177.1	-165.7	2.5	113.4	E137 G141 V142	E137-R139 HydrophobicContact CG-CG 4.42Å; E137-R139 IonicContact OE1-CZ 3.37Å; E137-R139 IonicContact OE1-NE 3.56Å; E137-R139 PolarHBondContact OE1-NE 3.29Å; E137-R139 IonicContact OE1-NH2 3.7Å; E137-R139 PolarHBondContact OE1-NH2 2.87Å; E137-R139 IonicContact OE2-NH2 3.3Å; E137-R139 PolarHBondContact OE2-NH2 3Å; R139-G141 VanDerWaalsContact C-N 3.34Å; R139-G141 PolarHBondContact O-N 2.78Å; R139-V142 PolarHBondContact O-N 2.85Å
140	S	87.9	Confident	92.5	Very high	116 Å²	116	78.4 Å²	78.4	81%	0.811	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-40.1	-172.5	8.4	0	0	0	0	113	E138	E138-S140 PolarHBondContact OE1-N 2.98Å; E138-S140 PolarHBondContact OE1-OG 3.31Å
141	G	87.1	Confident	92.4	Very high	10 Å²	10	79.5 Å²	79.5	10%	0.103	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	5.7	-179	0	0	0	0	0	114.5	R139 M143 L161 E162	R139-G141 VanDerWaalsContact C-N 3.34Å; R139-G141 PolarHBondContact O-N 2.78Å; G141-M143 PolarHBondContact O-N 3.12Å; G141-L161 WeakPolarHBondContact O-CA 3.3Å; G141-E162 PolarHBondContact O-N 2.9Å
142	V	92.3	Very high	92.4	Very high	46 Å²	46	83.8 Å²	83.8	28%	0.279	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	117.7	-174.2	-179	0	0	0	0	110.4	W131 E138 R139 V159 M160 L161	W131-V142 HydrophobicContact CB-CG2 3.99Å; W131-V142 HydrophobicContact CG-CG2 4.23Å; E138-V142 WeakPolarHBondContact O-CG2 3.43Å; R139-V142 PolarHBondContact O-N 2.85Å; V142-V159 HydrophobicContact CG1-CG1 3.53Å; V142-M160 CarbonylContact C-O 3.6Å; V142-M160 WeakPolarHBondContact CA-O 3.28Å; V142-L161 HydrophobicContact CG2-CD1 3.98Å
143	M	92.4	Very high	92.4	Very high	118 Å²	118	91.2 Å²	91.2	58%	0.581	49%	0.489	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.5	132.8	175	-60.8	-170.4	73.3	0	0	109.9	G141 V159 M160	G141-M143 PolarHBondContact O-N 3.12Å; M143-V159 CarbonylContact O-C 3.56Å; M143-V159 WeakPolarHBondContact O-CA 3.43Å; M143-M160 PolarHBondContact N-O 2.93Å; M143-M160 PolarHBondContact O-N 2.85Å
144	S	91.9	Very high	92.6	Very high	69 Å²	69	88.7 Å²	88.7	48%	0.483	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	141	174.9	179.7	0	0	0	0	110.1	G146 T157 T158	S144-G146 PolarHBondContact O-N 2.86Å; S144-G146 PolarHBondContact OG-N 2.83Å; S144-T157 PolarHBondContact OG-OG1 3.42Å; S144-T158 WeakPolarHBondContact CA-O 3.48Å
145	T	91.9	Very high	92.8	Very high	76 Å²	76	85.7 Å²	85.7	47%	0.466	47%	0.465	S	S	.	.			trans	-66.5	-13.1	168.6	57.6	0	0	0	0	112.5	T158	T145-T158 PolarHBondContact N-O 3.39Å; T145-T158 PolarHBondContact OG1-N 3.11Å; T145-T158 PolarHBondContact OG1-O 2.85Å
146	G	91.6	Very high	93	Very high	33 Å²	33	85.2 Å²	85.2	34%	0.34	45%	0.446	S	S	.	.			trans	75.3	179.6	-166.6	0	0	0	0	0	112.2	S144 T157	S144-G146 PolarHBondContact O-N 2.86Å; S144-G146 PolarHBondContact OG-N 2.83Å; G146-T157 PolarHBondContact O-OG1 2.74Å
147	L	94	Very high	93	Very high	99 Å²	99	78 Å²	78	52%	0.518	41%	0.413	S	S	.	.			trans	-76.4	123.6	178.9	-77.6	164.2	0	0	0	111.1	F122 G125 I127 F155	F122-L147 HydrophobicContact CE2-CD2 3.88Å; F122-L147 HydrophobicContact CZ-CD2 3.69Å; G125-L147 WeakPolarHBondContact O-CD1 3.33Å; G125-L147 VanDerWaalsContact O-CD2 3.29Å; G125-L147 WeakPolarHBondContact O-CD2 3.32Å; I127-L147 HydrophobicContact CG2-CD2 4.09Å; L147-F155 HydrophobicContact CD2-CB 4.19Å
148	I	94.8	Very high	93	Very high	74 Å²	74	75.5 Å²	75.5	38%	0.379	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	136.3	174.6	-56.9	167.3	0	0	0	108.1	F155 Q156	I148-F155 CarbonylContact O-C 3.53Å; I148-F155 VanDerWaalsContact O-CA 3.3Å; I148-F155 WeakPolarHBondContact O-CA 3.36Å; I148-Q156 HydrophobicContact CB-CG 3.61Å; I148-Q156 HydrophobicContact CD1-CG 4.36Å; I148-Q156 HydrophobicContact CG1-CG 4.5Å; I148-Q156 HydrophobicContact CG2-CG 3.99Å; I148-Q156 PolarHBondContact N-O 2.89Å; I148-Q156 PolarHBondContact O-N 2.85Å
149	R	94.4	Very high	93	Very high	160 Å²	160	73.2 Å²	73.2	60%	0.604	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	129.6	177.8	-174.8	-177.2	-67.2	-93.8	0.7	110	F155	R149-F155 HydrophobicContact CB-CD1 4.44Å; R149-F155 HydrophobicContact CB-CE1 4.39Å; R149-F155 HydrophobicContact CG-CE1 4.49Å
150	N	93.6	Very high	93	Very high	50 Å²	50	68 Å²	68	27%	0.267	38%	0.377	S	S	.	.			trans	-81.6	-18.4	-176.3	-70.7	-21.3	0	0	0	114.2	N120 D152 T154 Q156	N120-N150 PolarHBondContact OD1-ND2 3.22Å; N150-D152 VanDerWaalsContact C-N 3.34Å; N150-D152 WeakPolarHBondContact CB-OD1 3.34Å; N150-T154 PolarHBondContact N-O 2.86Å; N150-T154 VanDerWaalsContact N-O 3.07Å; N150-T154 PolarHBondContact ND2-OG1 3.25Å; N150-Q156 WeakPolarHBondContact OD1-CG 3.4Å; N150-Q156 PolarHBondContact OD1-NE2 3.02Å
151	G	92.6	Very high	93.2	Very high	70 Å²	70	62.7 Å²	62.7	72%	0.722	34%	0.339	S	S	*	.	S	Bend	trans	89.5	-3.5	-176.2	0	0	0	0	0	114.3
152	D	95.3	Very high	93.2	Very high	97 Å²	97	69.5 Å²	69.5	52%	0.519	37%	0.368	S	S	.	.	S	Bend	trans	-110.8	26.5	177.5	67.6	-9.5	0	0	0	112.5	N150 T154	N150-D152 VanDerWaalsContact C-N 3.34Å; N150-D152 WeakPolarHBondContact CB-OD1 3.34Å; D152-T154 VanDerWaalsContact CG-OG1 3.31Å; D152-T154 PolarHBondContact O-N 3.34Å; D152-T154 WeakPolarHBondContact OD1-CB 3.24Å; D152-T154 PolarHBondContact OD1-N 3.41Å; D152-T154 PolarHBondContact OD1-OG1 3.47Å; D152-T154 PolarHBondContact OD2-OG1 3.31Å
153	W	91.9	Very high	92.6	Very high	197 Å²	197	69.1 Å²	69.1	75%	0.746	36%	0.364	S	S	*	.	S	Bend	trans	67.9	1.1	-170.9	-57	85.3	0	0	0	116	Y123	Y123-W153 WeakPolarHBondContact CD2-O 3.24Å
154	T	96.6	Very high	92	Very high	25 Å²	25	70.6 Å²	70.6	15%	0.153	37%	0.373	C	S	.	.			trans	-101.4	168	175.1	74.8	0	0	0	0	112.6	N150 D152	N150-T154 PolarHBondContact N-O 2.86Å; N150-T154 VanDerWaalsContact N-O 3.07Å; N150-T154 PolarHBondContact ND2-OG1 3.25Å; D152-T154 VanDerWaalsContact CG-OG1 3.31Å; D152-T154 PolarHBondContact O-N 3.34Å; D152-T154 WeakPolarHBondContact OD1-CB 3.24Å; D152-T154 PolarHBondContact OD1-N 3.41Å; D152-T154 PolarHBondContact OD1-OG1 3.47Å; D152-T154 PolarHBondContact OD2-OG1 3.31Å
155	F	95.7	Very high	91.3	Very high	26 Å²	26	70.6 Å²	70.6	11%	0.114	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	159.3	178.6	-61.8	-90.3	0	0	0	111.6	G121 F122 Y123 L147 I148 R149	G121-F155 PolarHBondContact N-O 3.18Å; F122-F155 VanDerWaalsContact CD1-O 3.23Å; F122-F155 WeakPolarHBondContact CD1-O 3.4Å; F122-F155 HydrophobicContact CD2-CB 4.17Å; F122-F155 HydrophobicContact CE1-CB 4.3Å; F122-F155 VanDerWaalsContact CE1-O 3.31Å; F122-F155 WeakPolarHBondContact CE1-O 3.36Å; F122-F155 HydrophobicContact CE2-CB 3.69Å; F122-F155 HydrophobicContact CZ-CB 3.75Å; F122-F155 PolarHBondContact N-O 2.82Å; F122-F155 PolarHBondContact O-N 2.98Å; Y123-F155 HydrophobicContact CD2-CD2 4.31Å; Y123-F155 AromaticContact CD2-CE2 3.86Å; Y123-F155 HydrophobicContact CD2-CE2 3.86Å; Y123-F155 HydrophobicContact CE2-CE2 4.21Å; L147-F155 HydrophobicContact CD2-CB 4.19Å; I148-F155 CarbonylContact O-C 3.53Å; I148-F155 VanDerWaalsContact O-CA 3.3Å; I148-F155 WeakPolarHBondContact O-CA 3.36Å; R149-F155 HydrophobicContact CB-CD1 4.44Å; R149-F155 HydrophobicContact CB-CE1 4.39Å; R149-F155 HydrophobicContact CG-CE1 4.49Å
156	Q	95.8	Very high	90.8	Very high	51 Å²	51	72.9 Å²	72.9	24%	0.238	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	152.3	169.6	69.7	179.2	-59.5	0	0	111.2	R119 N120 I148 N150	R119-Q156 CarbonylContact O-C 3.42Å; R119-Q156 WeakPolarHBondContact O-CA 3.48Å; N120-Q156 HydrophobicContact CB-CB 4.15Å; N120-Q156 WeakPolarHBondContact OD1-CB 3.31Å; I148-Q156 HydrophobicContact CB-CG 3.61Å; I148-Q156 HydrophobicContact CD1-CG 4.36Å; I148-Q156 HydrophobicContact CG1-CG 4.5Å; I148-Q156 HydrophobicContact CG2-CG 3.99Å; I148-Q156 PolarHBondContact N-O 2.89Å; I148-Q156 PolarHBondContact O-N 2.85Å; N150-Q156 WeakPolarHBondContact OD1-CG 3.4Å; N150-Q156 PolarHBondContact OD1-NE2 3.02Å
157	T	94.3	Very high	90.4	Very high	6 Å²	6	78.6 Å²	78.6	4%	0.037	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	143.1	172.3	-172	0	0	0	0	109.4	R119 F122 I127 S144 G146	R119-T157 HydrophobicContact CB-CG2 4.3Å; R119-T157 PolarHBondContact N-O 3Å; R119-T157 PolarHBondContact O-N 3.45Å; F122-T157 HydrophobicContact CE1-CG2 4.06Å; F122-T157 HydrophobicContact CZ-CG2 3.97Å; I127-T157 HydrophobicContact CD1-CG2 4.36Å; I127-T157 HydrophobicContact CG2-CG2 4.01Å; S144-T157 PolarHBondContact OG-OG1 3.42Å; G146-T157 PolarHBondContact O-OG1 2.74Å
158	T	94.1	Very high	89.8	Confident	26 Å²	26	75.9 Å²	75.9	16%	0.16	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	125.8	172.7	-59.5	0	0	0	0	109	T116 V117 S144 T145 M160	T116-T158 HydrophobicContact CG2-CG2 3.68Å; V117-T158 WeakPolarHBondContact O-CA 3.25Å; S144-T158 WeakPolarHBondContact CA-O 3.48Å; T145-T158 PolarHBondContact N-O 3.39Å; T145-T158 PolarHBondContact OG1-N 3.11Å; T145-T158 PolarHBondContact OG1-O 2.85Å; T158-M160 HydrophobicContact CG2-CG 4.3Å
159	V	93.8	Very high	89.5	Confident	6 Å²	6	73 Å²	73	4%	0.036	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	119.6	-179.5	-173.8	0	0	0	0	109	V117 V129 V142 M143	V117-V159 PolarHBondContact N-O 2.67Å; V117-V159 PolarHBondContact O-N 2.91Å; V129-V159 HydrophobicContact CB-CB 4.43Å; V129-V159 HydrophobicContact CB-CG2 3.91Å; V129-V159 HydrophobicContact CG1-CB 3.96Å; V129-V159 HydrophobicContact CG1-CG1 4.14Å; V129-V159 HydrophobicContact CG1-CG2 3.96Å; V129-V159 HydrophobicContact CG2-CG2 4.17Å; V142-V159 HydrophobicContact CG1-CG1 3.53Å; M143-V159 CarbonylContact O-C 3.56Å; M143-V159 WeakPolarHBondContact O-CA 3.43Å
160	M	91.8	Very high	89.3	Confident	74 Å²	74	69.2 Å²	69.2	37%	0.365	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	144.9	-178.6	-64.5	-177.4	-63.6	0	0	110.4	F115 T116 V142 M143 T158	F115-M160 CarbonylContact O-C 3.59Å; F115-M160 VanDerWaalsContact O-CA 3.25Å; F115-M160 WeakPolarHBondContact O-CA 3.36Å; T116-M160 HydrophobicContact CG2-CG 3.74Å; T116-M160 HydrophobicContact CG2-SD 4.28Å; V142-M160 CarbonylContact C-O 3.6Å; V142-M160 WeakPolarHBondContact CA-O 3.28Å; M143-M160 PolarHBondContact N-O 2.93Å; M143-M160 PolarHBondContact O-N 2.85Å; T158-M160 HydrophobicContact CG2-CG 4.3Å
161	L	91.3	Very high	89.1	Confident	3 Å²	3	67 Å²	67	2%	0.016	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	120.3	169.7	176.4	61.4	0	0	0	109.1	F115 W131 E138 G141 V142 M163 Y171	F115-L161 HydrophobicContact CB-CB 4.49Å; F115-L161 WeakPolarHBondContact CB-O 3.43Å; F115-L161 PolarHBondContact O-N 2.76Å; W131-L161 HydrophobicContact CB-CD2 4.22Å; W131-L161 HydrophobicContact CD2-CB 3.92Å; W131-L161 HydrophobicContact CD2-CD2 4.04Å; W131-L161 HydrophobicContact CE3-CB 4.48Å; W131-L161 HydrophobicContact CE3-CD2 3.98Å; W131-L161 HydrophobicContact CG-CB 4.04Å; W131-L161 HydrophobicContact CG-CD2 4.17Å; W131-L161 HydrophobicContact CZ2-CB 4.38Å; E138-L161 HydrophobicContact CB-CD1 4.39Å; E138-L161 HydrophobicContact CG-CD1 3.56Å; E138-L161 HydrophobicContact CG-CD2 4.49Å; G141-L161 WeakPolarHBondContact O-CA 3.3Å; V142-L161 HydrophobicContact CG2-CD1 3.98Å; L161-M163 HydrophobicContact CD2-CG 4.37Å; L161-M163 HydrophobicContact CD2-SD 3.75Å; L161-M163 HydrophobicContact CG-CB 4.3Å; L161-M163 HydrophobicContact CG-CG 4.14Å; L161-M163 HydrophobicContact CG-SD 4.13Å; L161-M163 PolarHBondContact O-N 3.18Å; L161-Y171 HydrophobicContact CD2-CD1 3.84Å; L161-Y171 HydrophobicContact CD2-CE1 4.15Å
162	E	87.5	Confident	89.1	Confident	153 Å²	153	65 Å²	65	72%	0.715	33%	0.329	S	S	*	.			trans	-72.9	120.8	168.2	-172.9	178.5	-173.8	0	0	109.4	G141	G141-E162 PolarHBondContact O-N 2.9Å
163	M	78.8	Confident	89	Confident	38 Å²	38	60.7 Å²	60.7	19%	0.187	31%	0.307	C	S	.	.			trans	-160.6	154.5	-176.9	51.9	173.4	-78.1	0	0	113.3	F115 L161 P165 Y171 W188	F115-M163 HydrophobicContact CB-CG 4.05Å; F115-M163 HydrophobicContact CB-SD 3.92Å; L161-M163 HydrophobicContact CD2-CG 4.37Å; L161-M163 HydrophobicContact CD2-SD 3.75Å; L161-M163 HydrophobicContact CG-CB 4.3Å; L161-M163 HydrophobicContact CG-CG 4.14Å; L161-M163 HydrophobicContact CG-SD 4.13Å; L161-M163 PolarHBondContact O-N 3.18Å; M163-P165 HydrophobicContact CE-CB 3.59Å; M163-P165 HydrophobicContact CE-CG 4.19Å; M163-Y171 HydrophobicContact CB-CE1 4.49Å; M163-Y171 HydrophobicContact CE-CD1 3.87Å; M163-Y171 HydrophobicContact CE-CD2 3.66Å; M163-Y171 HydrophobicContact CE-CE1 3.43Å; M163-Y171 VanDerWaalsContact CE-CE1 3.43Å; M163-Y171 HydrophobicContact CE-CE2 3.21Å; M163-Y171 HydrophobicContact CE-CG 3.98Å; M163-Y171 HydrophobicContact SD-CD1 3.57Å; M163-Y171 VanDerWaalsContact SD-CD1 3.57Å; M163-Y171 HydrophobicContact SD-CD2 4.33Å; M163-Y171 HydrophobicContact SD-CE1 3.43Å; M163-Y171 WeakPolarHBondContact SD-CE1 3.27Å; M163-Y171 HydrophobicContact SD-CE2 4.24Å; M163-Y171 HydrophobicContact SD-CG 4.02Å; M163-W188 HydrophobicContact CE-CZ3 4.23Å
164	I	80.3	Confident	89.1	Confident	150 Å²	150	52.9 Å²	52.9	77%	0.769	28%	0.28	S	S	*	.			trans	-111.7	102.7	166.3	-57.5	173.8	0	0	0	106.2	E166	I164-E166 PolarHBondContact O-N 3.43Å
165	P	78	Confident	89	Confident	69 Å²	69	52.4 Å²	52.4	45%	0.448	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-65.4	124.3	-174.2	22.3	-30.1	0	0	0	111.4	M163 Y171 W188 A190	M163-P165 HydrophobicContact CE-CB 3.59Å; M163-P165 HydrophobicContact CE-CG 4.19Å; P165-Y171 HydrophobicContact CB-CE2 4.49Å; P165-W188 HydrophobicContact CB-CH2 4.12Å; P165-W188 HydrophobicContact CB-CZ3 4.25Å; P165-A190 HydrophobicContact CB-CB 3.71Å
166	E	81.4	Confident	89	Confident	124 Å²	124	54 Å²	54	58%	0.579	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-92	149.5	170.5	-64	-171.6	170.2	0	0	111	I164 G168 D169 A190	I164-E166 PolarHBondContact O-N 3.43Å; E166-G168 PolarHBondContact O-N 2.94Å; E166-D169 PolarHBondContact N-OD2 3.19Å; E166-D169 WeakPolarHBondContact O-CB 3.32Å; E166-D169 PolarHBondContact O-N 3.4Å; E166-D169 VanDerWaalsContact O-N 3.12Å; E166-A190 WeakPolarHBondContact O-CB 3.49Å
167	H	81.9	Confident	89	Confident	153 Å²	153	52.7 Å²	52.7	71%	0.708	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	123.4	-177.8	-175.8	35.7	0	0	0	111.1	A190	H167-A190 PolarHBondContact ND1-O 2.88Å
168	G	82.8	Confident	89.1	Confident	42 Å²	42	56.7 Å²	56.7	43%	0.433	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.4	-7.7	179.5	0	0	0	0	0	114.2	E166 A190	E166-G168 PolarHBondContact O-N 2.94Å; G168-A190 PolarHBondContact N-O 2.9Å
169	D	88	Confident	88.9	Confident	13 Å²	13	58.1 Å²	58.1	7%	0.07	32%	0.324	C	S	.	.			trans	-63.6	140.9	170.4	-80.5	-27.1	0	0	0	111.3	R133 N134 E166 Y171 M189 A190	R133-D169 IonicContact CZ-OD2 3.31Å; R133-D169 VanDerWaalsContact CZ-OD2 3.29Å; R133-D169 IonicContact NE-OD1 3.18Å; R133-D169 IonicContact NE-OD2 2.86Å; R133-D169 PolarHBondContact NE-OD2 2.96Å; R133-D169 VanDerWaalsContact NE-OD2 3.12Å; R133-D169 IonicContact NH2-OD1 3.97Å; R133-D169 IonicContact NH2-OD2 3.89Å; R133-D169 PolarHBondContact NH2-OD2 3.5Å; N134-D169 PolarHBondContact ND2-OD1 3Å; N134-D169 WeakPolarHBondContact OD1-CA 3.42Å; E166-D169 PolarHBondContact N-OD2 3.19Å; E166-D169 WeakPolarHBondContact O-CB 3.32Å; E166-D169 PolarHBondContact O-N 3.4Å; E166-D169 VanDerWaalsContact O-N 3.12Å; D169-Y171 HydrophobicContact CB-CD2 4.1Å; D169-Y171 HydrophobicContact CB-CE2 3.3Å; D169-Y171 PolarHBondContact OD2-OH 2.87Å; D169-M189 WeakPolarHBondContact O-CA 3.34Å; D169-A190 HydrophobicContact CB-CB 4.11Å; D169-A190 PolarHBondContact O-N 3.4Å
170	I	89.2	Confident	88.9	Confident	80 Å²	80	61.3 Å²	61.3	41%	0.41	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	117	172.9	-58.1	173.8	0	0	0	108.2	N134 A187 M189	N134-I170 PolarHBondContact N-O 3.36Å; N134-I170 PolarHBondContact OD1-N 3.31Å; I170-A187 HydrophobicContact CG2-CB 4.3Å; I170-M189 HydrophobicContact CG1-CG 4.26Å
171	Y	90.3	Very high	89	Confident	3 Å²	3	66.5 Å²	66.5	1%	0.012	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	142.4	174.2	-63.3	-91.9	0	0	0	109	F132 R133 L161 M163 P165 D169 A187 W188 A190	F132-Y171 CarbonylContact O-C 3.51Å; F132-Y171 VanDerWaalsContact O-CA 3.3Å; F132-Y171 WeakPolarHBondContact O-CA 3.35Å; R133-Y171 HydrophobicContact CB-CD1 4.12Å; R133-Y171 HydrophobicContact CB-CE1 3.9Å; R133-Y171 HydrophobicContact CG-CD1 4.17Å; R133-Y171 HydrophobicContact CG-CE1 3.59Å; R133-Y171 PolarHBondContact NE-OH 3.24Å; R133-Y171 VanDerWaalsContact NE-OH 3.09Å; L161-Y171 HydrophobicContact CD2-CD1 3.84Å; L161-Y171 HydrophobicContact CD2-CE1 4.15Å; M163-Y171 HydrophobicContact CB-CE1 4.49Å; M163-Y171 HydrophobicContact CE-CD1 3.87Å; M163-Y171 HydrophobicContact CE-CD2 3.66Å; M163-Y171 HydrophobicContact CE-CE1 3.43Å; M163-Y171 VanDerWaalsContact CE-CE1 3.43Å; M163-Y171 HydrophobicContact CE-CE2 3.21Å; M163-Y171 HydrophobicContact CE-CG 3.98Å; M163-Y171 HydrophobicContact SD-CD1 3.57Å; M163-Y171 VanDerWaalsContact SD-CD1 3.57Å; M163-Y171 HydrophobicContact SD-CD2 4.33Å; M163-Y171 HydrophobicContact SD-CE1 3.43Å; M163-Y171 WeakPolarHBondContact SD-CE1 3.27Å; M163-Y171 HydrophobicContact SD-CE2 4.24Å; M163-Y171 HydrophobicContact SD-CG 4.02Å; P165-Y171 HydrophobicContact CB-CE2 4.49Å; D169-Y171 HydrophobicContact CB-CD2 4.1Å; D169-Y171 HydrophobicContact CB-CE2 3.3Å; D169-Y171 PolarHBondContact OD2-OH 2.87Å; Y171-A187 CarbonylContact O-C 3.57Å; Y171-A187 VanDerWaalsContact O-CA 3.31Å; Y171-A187 WeakPolarHBondContact O-CA 3.32Å; Y171-W188 AromaticContact CD2-CE3 3.81Å; Y171-W188 HydrophobicContact CD2-CE3 3.81Å; Y171-W188 AromaticContact CD2-CZ3 3.76Å; Y171-W188 HydrophobicContact CD2-CZ3 3.76Å; Y171-W188 HydrophobicContact CE2-CZ3 4.24Å; Y171-W188 HydrophobicContact CG-CE3 4.43Å; Y171-W188 PolarHBondContact N-O 2.96Å; Y171-W188 PolarHBondContact O-N 2.87Å; Y171-W188 VanDerWaalsContact O-O 3.12Å; Y171-A190 HydrophobicContact CE2-CB 4.33Å
172	S	92.3	Very high	89.2	Confident	28 Å²	28	76.1 Å²	76.1	20%	0.196	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	140.4	173.1	52.6	0	0	0	0	111.3	W131 F132 V186	W131-S172 CarbonylContact C-O 3.51Å; F132-S172 WeakPolarHBondContact CB-OG 3.25Å; F132-S172 PolarHBondContact N-O 2.88Å; F132-S172 PolarHBondContact O-N 2.91Å; S172-V186 VanDerWaalsContact CA-O 3.27Å; S172-V186 WeakPolarHBondContact CA-O 3.36Å
173	C	92.6	Very high	89.4	Confident	8 Å²	8	72.5 Å²	72.5	5%	0.054	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	122.9	174.3	176.1	0	0	0	0	108.3	V117 V129 K130 W131 S185 V186	V117-C173 HydrophobicContact CG2-CB 3.71Å; V117-C173 VanDerWaalsContact CG2-SG 3.55Å; V129-C173 VanDerWaalsContact CG1-SG 3.5Å; K130-C173 WeakPolarHBondContact O-CA 3.45Å; W131-C173 HydrophobicContact CD2-CB 4.31Å; W131-C173 HydrophobicContact CE3-CB 4.12Å; W131-C173 HydrophobicContact CH2-CB 4.04Å; W131-C173 HydrophobicContact CZ2-CB 4.25Å; W131-C173 HydrophobicContact CZ3-CB 3.98Å; C173-S185 VanDerWaalsContact O-CA 3.23Å; C173-S185 WeakPolarHBondContact O-CA 3.43Å; C173-V186 PolarHBondContact N-O 3.15Å; C173-V186 PolarHBondContact O-N 3.25Å; C173-V186 VanDerWaalsContact O-N 3.1Å
174	L	94.6	Very high	90.1	Very high	33 Å²	33	74.1 Å²	74.1	17%	0.173	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	123.3	177.6	-177.8	73.1	0	0	0	109	V129 K130 F132 P183	V129-L174 WeakPolarHBondContact CA-O 3.42Å; K130-L174 HydrophobicContact CB-CB 4.44Å; K130-L174 PolarHBondContact N-O 3.23Å; K130-L174 PolarHBondContact O-N 3.37Å; F132-L174 HydrophobicContact CD2-CB 4.31Å; F132-L174 HydrophobicContact CE2-CB 3.81Å; F132-L174 HydrophobicContact CE2-CD2 3.96Å; F132-L174 HydrophobicContact CZ-CD2 4.32Å; L174-P183 HydrophobicContact CD1-CB 3.62Å; L174-P183 HydrophobicContact CG-CB 4.3Å
175	V	95.1	Very high	90.6	Very high	14 Å²	14	70.8 Å²	70.8	9%	0.085	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	119.9	176.8	-177.2	0	0	0	0	109.4	I127 N128 V129 L180 P183 V184	I127-V175 HydrophobicContact CD1-CG1 3.94Å; I127-V175 HydrophobicContact CG1-CG1 4.04Å; N128-V175 WeakPolarHBondContact O-CA 3.46Å; V129-V175 HydrophobicContact CG1-CG2 4.44Å; V129-V175 HydrophobicContact CG2-CG2 4.39Å; V175-L180 HydrophobicContact CG1-CD1 4.43Å; V175-P183 WeakPolarHBondContact O-CA 3.42Å; V175-V184 PolarHBondContact N-O 3.47Å; V175-V184 PolarHBondContact O-N 2.92Å
176	E	96	Very high	91	Very high	61 Å²	61	72.4 Å²	72.4	29%	0.285	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	129.5	170.7	-55.7	164.6	176.2	0	0	108.2	N128 K130 P183	N128-E176 HydrophobicContact CB-CB 4.19Å; N128-E176 PolarHBondContact N-O 3.36Å; N128-E176 PolarHBondContact ND2-OE2 2.95Å; N128-E176 PolarHBondContact O-N 3.45Å; K130-E176 IonicContact NZ-OE1 2.73Å; K130-E176 PolarHBondContact NZ-OE1 2.94Å; K130-E176 IonicContact NZ-OE2 3.68Å; K130-E176 PolarHBondContact NZ-OE2 3.48Å; E176-P183 HydrophobicContact CG-CB 4.08Å; E176-P183 HydrophobicContact CG-CG 4.12Å
177	H	95.9	Very high	91.4	Very high	23 Å²	23	69.9 Å²	69.9	11%	0.106	41%	0.405	C	S	.	.			trans	-153.4	139.9	-178.9	-178.1	-95	0	0	0	110.1	F122 Y123 P124 D126 I127 G179 L180	F122-H177 AromaticContact CD2-CD2 3.92Å; F122-H177 AromaticContact CD2-NE2 3.67Å; Y123-H177 PolarHBondContact O-CE1 2.95Å; P124-H177 PolarHBondContact O-NE2 3.26Å; D126-H177 PolarHBondContact O-CD2 2.96Å; I127-H177 HydrophobicContact CG1-CB 4.41Å; H177-G179 PolarHBondContact CE1-N 2.8Å; H177-G179 WeakPolarHBondContact ND1-CA 3.46Å; H177-G179 PolarHBondContact ND1-N 3.46Å; H177-G179 PolarHBondContact O-N 3.17Å; H177-G179 VanDerWaalsContact O-N 3.15Å; H177-L180 HydrophobicContact CB-CD1 3.93Å; H177-L180 HydrophobicContact CB-CG 4.11Å; H177-L180 WeakPolarHBondContact O-CB 3.46Å; H177-L180 PolarHBondContact O-N 2.86Å
178	P	94.7	Very high	91.5	Very high	90 Å²	90	66.6 Å²	66.6	58%	0.584	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-24.8	-178.8	-27.5	35.6	0	0	0	115.1	P124 D126 L180	P124-P178 HydrophobicContact CG-CB 4.14Å; P124-P178 HydrophobicContact CG-CG 4.03Å; D126-P178 HydrophobicContact CB-CG 4.33Å; D126-P178 WeakPolarHBondContact O-CD 3.48Å; P178-L180 PolarHBondContact O-N 2.85Å
179	G	91.8	Very high	91.5	Very high	56 Å²	56	69 Å²	69	58%	0.577	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-8.4	174.7	0	0	0	0	0	113.9	H177	H177-G179 PolarHBondContact CE1-N 2.8Å; H177-G179 WeakPolarHBondContact ND1-CA 3.46Å; H177-G179 PolarHBondContact ND1-N 3.46Å; H177-G179 PolarHBondContact O-N 3.17Å; H177-G179 VanDerWaalsContact O-N 3.15Å
180	L	93.2	Very high	91	Very high	72 Å²	72	68.6 Å²	68.6	38%	0.377	39%	0.386	S	S	.	.			trans	-103.6	128.4	179	-60.7	174	0	0	0	110.4	V175 H177 P178 R182 V184	V175-L180 HydrophobicContact CG1-CD1 4.43Å; H177-L180 HydrophobicContact CB-CD1 3.93Å; H177-L180 HydrophobicContact CB-CG 4.11Å; H177-L180 WeakPolarHBondContact O-CB 3.46Å; H177-L180 PolarHBondContact O-N 2.86Å; P178-L180 PolarHBondContact O-N 2.85Å; L180-R182 WeakPolarHBondContact CB-O 3.2Å; L180-R182 PolarHBondContact O-N 2.81Å; L180-V184 HydrophobicContact CD1-CB 4.46Å; L180-V184 HydrophobicContact CD1-CG2 3.99Å; L180-V184 HydrophobicContact CD2-CG2 4.35Å
181	L	94.4	Very high	89.8	Confident	184 Å²	184	71.4 Å²	71.4	96%	0.963	40%	0.397	S	S	*	.	S	Bend	trans	-63	-29.1	175.3	-70.5	173.1	0	0	0	112.9
182	R	94.2	Very high	88.1	Confident	205 Å²	205	74.3 Å²	74.3	77%	0.774	42%	0.418	S	S	*	.	S	Bend	trans	-143.7	150.7	178.7	-65.6	-176.4	-180	172.6	-0.2	109.3	L180 V184	L180-R182 WeakPolarHBondContact CB-O 3.2Å; L180-R182 PolarHBondContact O-N 2.81Å; R182-V184 PolarHBondContact O-N 3.35Å
183	P	93.1	Very high	86.3	Confident	76 Å²	76	80.2 Å²	80.2	49%	0.494	44%	0.443	S	S	.	.			trans	-56.1	139.2	172.4	-23.6	34.3	0	0	0	111.1	L174 V175 E176	L174-P183 HydrophobicContact CD1-CB 3.62Å; L174-P183 HydrophobicContact CG-CB 4.3Å; V175-P183 WeakPolarHBondContact O-CA 3.42Å; E176-P183 HydrophobicContact CG-CB 4.08Å; E176-P183 HydrophobicContact CG-CG 4.12Å
184	V	93.5	Very high	84.5	Confident	73 Å²	73	87.3 Å²	87.3	44%	0.442	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	124.7	177	174.4	0	0	0	0	108.1	V175 L180 R182	V175-V184 PolarHBondContact N-O 3.47Å; V175-V184 PolarHBondContact O-N 2.92Å; L180-V184 HydrophobicContact CD1-CB 4.46Å; L180-V184 HydrophobicContact CD1-CG2 3.99Å; L180-V184 HydrophobicContact CD2-CG2 4.35Å; R182-V184 PolarHBondContact O-N 3.35Å
185	S	90.1	Very high	82.6	Confident	79 Å²	79	88.3 Å²	88.3	55%	0.552	48%	0.479	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.6	134.4	175.5	63.3	0	0	0	0	111.5	C173	C173-S185 VanDerWaalsContact O-CA 3.23Å; C173-S185 WeakPolarHBondContact O-CA 3.43Å
186	V	87.1	Confident	80.9	Confident	104 Å²	104	95.7 Å²	95.7	63%	0.63	51%	0.506	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.6	127.3	169.7	-179.4	0	0	0	0	108.1	S172 C173	S172-V186 VanDerWaalsContact CA-O 3.27Å; S172-V186 WeakPolarHBondContact CA-O 3.36Å; C173-V186 PolarHBondContact N-O 3.15Å; C173-V186 PolarHBondContact O-N 3.25Å; C173-V186 VanDerWaalsContact O-N 3.1Å
187	A	87.9	Confident	79.1	Confident	70 Å²	70	101.5 Å²	101.5	58%	0.579	53%	0.53	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.6	140.1	175.9	0	0	0	0	0	110.5	I170 Y171	I170-A187 HydrophobicContact CG2-CB 4.3Å; Y171-A187 CarbonylContact O-C 3.57Å; Y171-A187 VanDerWaalsContact O-CA 3.31Å; Y171-A187 WeakPolarHBondContact O-CA 3.32Å
188	W	85.3	Confident	77.6	Confident	84 Å²	84	108.2 Å²	108.2	32%	0.318	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-129.9	136	174.2	175	87	0	0	0	109.1	P114 M163 P165 Y171 A190	P114-W188 HydrophobicContact CB-CD2 3.62Å; P114-W188 HydrophobicContact CB-CE3 3.94Å; P114-W188 HydrophobicContact CB-CG 4.08Å; P114-W188 HydrophobicContact CB-CH2 4.01Å; P114-W188 HydrophobicContact CB-CZ2 3.73Å; P114-W188 HydrophobicContact CB-CZ3 4.13Å; P114-W188 HydrophobicContact CG-CD2 4.26Å; P114-W188 HydrophobicContact CG-CH2 4.39Å; P114-W188 HydrophobicContact CG-CZ2 3.73Å; M163-W188 HydrophobicContact CE-CZ3 4.23Å; P165-W188 HydrophobicContact CB-CH2 4.12Å; P165-W188 HydrophobicContact CB-CZ3 4.25Å; Y171-W188 AromaticContact CD2-CE3 3.81Å; Y171-W188 HydrophobicContact CD2-CE3 3.81Å; Y171-W188 AromaticContact CD2-CZ3 3.76Å; Y171-W188 HydrophobicContact CD2-CZ3 3.76Å; Y171-W188 HydrophobicContact CE2-CZ3 4.24Å; Y171-W188 HydrophobicContact CG-CE3 4.43Å; Y171-W188 PolarHBondContact N-O 2.96Å; Y171-W188 PolarHBondContact O-N 2.87Å; Y171-W188 VanDerWaalsContact O-O 3.12Å; W188-A190 VanDerWaalsContact CH2-CA 3.45Å; W188-A190 HydrophobicContact CH2-CB 3.92Å; W188-A190 HydrophobicContact CZ3-CB 3.79Å
189	M	83	Confident	76.3	Confident	94 Å²	94	107.2 Å²	107.2	46%	0.463	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	133.1	177.8	-173.9	171.5	61.7	0	0	109.5	D169 I170 Q191	D169-M189 WeakPolarHBondContact O-CA 3.34Å; I170-M189 HydrophobicContact CG1-CG 4.26Å; M189-Q191 VanDerWaalsContact C-N 3.33Å; M189-Q191 HydrophobicContact CE-CG 4.38Å; M189-Q191 PolarHBondContact O-N 3.33Å
190	A	76.9	Confident	75.5	Confident	4 Å²	4	109 Å²	109	3%	0.033	54%	0.544	C	S	.	.			trans	-64.6	93.1	173.4	0	0	0	0	0	110.6	P165 E166 H167 G168 D169 Y171 W188	P165-A190 HydrophobicContact CB-CB 3.71Å; E166-A190 WeakPolarHBondContact O-CB 3.49Å; H167-A190 PolarHBondContact ND1-O 2.88Å; G168-A190 PolarHBondContact N-O 2.9Å; D169-A190 HydrophobicContact CB-CB 4.11Å; D169-A190 PolarHBondContact O-N 3.4Å; Y171-A190 HydrophobicContact CE2-CB 4.33Å; W188-A190 VanDerWaalsContact CH2-CA 3.45Å; W188-A190 HydrophobicContact CH2-CB 3.92Å; W188-A190 HydrophobicContact CZ3-CB 3.79Å
191	Q	64.9	Low	74.8	Confident	138 Å²	138	109.5 Å²	109.5	65%	0.645	55%	0.553	S	S	*	*			trans	-86.3	116.2	171.5	-70	179.9	-15.9	0	0	108.1	M189 E193	M189-Q191 VanDerWaalsContact C-N 3.33Å; M189-Q191 HydrophobicContact CE-CG 4.38Å; M189-Q191 PolarHBondContact O-N 3.33Å; Q191-E193 PolarHBondContact O-N 2.85Å
192	S	52.9	Low	74.2	Confident	64 Å²	64	102.8 Å²	102.8	45%	0.448	53%	0.528	S	S	.	.			trans	-70.5	115.1	161	59.4	0	0	0	0	106.9	Y194	S192-Y194 PolarHBondContact O-N 3.31Å
193	E	54.1	Low	73.7	Confident	153 Å²	153	95.2 Å²	95.2	72%	0.715	51%	0.51	S	S	*	.			trans	-71	40.4	161.7	-82.2	-162.6	170.8	0	0	110.1	K110 Q191 S195	K110-E193 IonicContact NZ-OE1 3.29Å; Q191-E193 PolarHBondContact O-N 2.85Å; E193-S195 PolarHBondContact O-N 3.09Å
194	Y	55.4	Low	73.4	Confident	156 Å²	156	94.1 Å²	94.1	61%	0.612	51%	0.507	S	S	*	.			trans	-74.2	84.4	160.6	-164.9	-106.7	0	0	0	106.5	S192 W196 I199	S192-Y194 PolarHBondContact O-N 3.31Å; Y194-W196 HydrophobicContact CD1-CE3 4.39Å; Y194-W196 AromaticContact CE1-CE3 3.9Å; Y194-W196 HydrophobicContact CE1-CE3 3.9Å; Y194-W196 HydrophobicContact CE1-CZ3 4.3Å; Y194-W196 PolarHBondContact O-N 3.05Å; Y194-I199 HydrophobicContact CD1-CD1 4.22Å; Y194-I199 HydrophobicContact CD2-CD1 4.48Å; Y194-I199 HydrophobicContact CE1-CD1 3.42Å; Y194-I199 VanDerWaalsContact CE1-CD1 3.42Å; Y194-I199 HydrophobicContact CE2-CD1 3.73Å; Y194-I199 WeakPolarHBondContact OH-CD1 3.49Å
195	S	54.2	Low	73.2	Confident	54 Å²	54	93.6 Å²	93.6	38%	0.378	51%	0.51	S	S	.	.			trans	-68	79.6	-178.3	175.4	0	0	0	0	109.9	E193 K197 K198 I199	E193-S195 PolarHBondContact O-N 3.09Å; S195-K197 PolarHBondContact O-N 3.46Å; S195-K198 WeakPolarHBondContact O-CB 3.33Å; S195-K198 PolarHBondContact O-N 3.37Å; S195-K198 WeakPolarHBondContact OG-CG 3.4Å; S195-K198 PolarHBondContact OG-N 2.74Å; S195-I199 PolarHBondContact O-N 3.09Å
196	W	59.8	Low	73.3	Confident	169 Å²	169	96.6 Å²	96.6	64%	0.64	51%	0.514	S	S	*	.	H	α-helix	trans	-48	-34	170.6	-170.1	-118.6	0	0	0	111	Y194 K198 I199 L200	Y194-W196 HydrophobicContact CD1-CE3 4.39Å; Y194-W196 AromaticContact CE1-CE3 3.9Å; Y194-W196 HydrophobicContact CE1-CE3 3.9Å; Y194-W196 HydrophobicContact CE1-CZ3 4.3Å; Y194-W196 PolarHBondContact O-N 3.05Å; W196-K198 VanDerWaalsContact C-N 3.3Å; W196-K198 PolarHBondContact O-N 2.97Å; W196-I199 PolarHBondContact O-N 3.44Å; W196-L200 HydrophobicContact CD2-CD1 3.87Å; W196-L200 HydrophobicContact CG-CD1 3.58Å; W196-L200 HydrophobicContact CZ2-CD1 4.33Å; W196-L200 VanDerWaalsContact O-CD1 3.23Å; W196-L200 WeakPolarHBondContact O-CD1 3.29Å; W196-L200 PolarHBondContact O-N 3.12Å
197	K	59	Low	73.6	Confident	183 Å²	183	96.7 Å²	96.7	80%	0.796	51%	0.51	S	S	*	.	H	α-helix	trans	-58.1	-35.2	174.4	-64	-175.1	178.5	-179.9	0	113.9	S195 S201	S195-K197 PolarHBondContact O-N 3.46Å; K197-S201 PolarHBondContact O-N 3.35Å
198	K	63.9	Low	73.9	Confident	165 Å²	165	98.9 Å²	98.9	72%	0.717	51%	0.511	S	S	*	.	H	α-helix	trans	-78.3	-37.1	178.5	-67.8	-105.4	-178.5	170.2	0	111.1	S195 W196 S201 G202	S195-K198 WeakPolarHBondContact O-CB 3.33Å; S195-K198 PolarHBondContact O-N 3.37Å; S195-K198 WeakPolarHBondContact OG-CG 3.4Å; S195-K198 PolarHBondContact OG-N 2.74Å; W196-K198 VanDerWaalsContact C-N 3.3Å; W196-K198 PolarHBondContact O-N 2.97Å; K198-S201 PolarHBondContact O-N 3.26Å; K198-G202 PolarHBondContact O-N 2.99Å
199	I	66.9	Low	74.4	Confident	69 Å²	69	96.9 Å²	96.9	35%	0.354	52%	0.516	S	S	.	.	H	α-helix	trans	-70	-43.6	178.2	-62.4	172.6	0	0	0	110.8	Y194 S195 W196 S201 G202 A203	Y194-I199 HydrophobicContact CD1-CD1 4.22Å; Y194-I199 HydrophobicContact CD2-CD1 4.48Å; Y194-I199 HydrophobicContact CE1-CD1 3.42Å; Y194-I199 VanDerWaalsContact CE1-CD1 3.42Å; Y194-I199 HydrophobicContact CE2-CD1 3.73Å; Y194-I199 WeakPolarHBondContact OH-CD1 3.49Å; S195-I199 PolarHBondContact O-N 3.09Å; W196-I199 PolarHBondContact O-N 3.44Å; I199-S201 VanDerWaalsContact C-N 3.31Å; I199-S201 PolarHBondContact O-N 3.02Å; I199-G202 PolarHBondContact O-N 2.96Å; I199-A203 VanDerWaalsContact O-CB 3.32Å; I199-A203 WeakPolarHBondContact O-CB 3.14Å; I199-A203 PolarHBondContact O-N 3.49Å
200	L	75.8	Confident	75	Confident	93 Å²	93	96 Å²	96	49%	0.487	51%	0.513	S	S	.	.	H	α-helix	trans	-59.4	-42.5	174	-95.4	115.3	0	0	0	112.4	W196 A203 A204	W196-L200 HydrophobicContact CD2-CD1 3.87Å; W196-L200 HydrophobicContact CG-CD1 3.58Å; W196-L200 HydrophobicContact CZ2-CD1 4.33Å; W196-L200 VanDerWaalsContact O-CD1 3.23Å; W196-L200 WeakPolarHBondContact O-CD1 3.29Å; W196-L200 PolarHBondContact O-N 3.12Å; L200-A203 PolarHBondContact O-N 3.36Å; L200-A204 VanDerWaalsContact O-CB 3.32Å; L200-A204 WeakPolarHBondContact O-CB 3.19Å; L200-A204 PolarHBondContact O-N 3.05Å
201	S	78.8	Confident	75.9	Confident	83 Å²	83	100.6 Å²	100.6	58%	0.58	54%	0.536	S	S	*	.	H	α-helix	trans	-64.4	-41.5	177.3	-173.9	0	0	0	0	111.8	K197 K198 I199 A205	K197-S201 PolarHBondContact O-N 3.35Å; K198-S201 PolarHBondContact O-N 3.26Å; I199-S201 VanDerWaalsContact C-N 3.31Å; I199-S201 PolarHBondContact O-N 3.02Å; S201-A205 PolarHBondContact O-N 2.9Å; S201-A205 VanDerWaalsContact O-N 3.15Å
202	G	80.5	Confident	77.3	Confident	42 Å²	42	99.2 Å²	99.2	43%	0.433	54%	0.537	S	S	.	.	H	α-helix	trans	-66.5	-42.9	176.2	0	0	0	0	0	112.6	K198 I199 A205 F206	K198-G202 PolarHBondContact O-N 2.99Å; I199-G202 PolarHBondContact O-N 2.96Å; G202-A205 PolarHBondContact O-N 3.13Å; G202-F206 WeakPolarHBondContact O-CB 3.2Å; G202-F206 PolarHBondContact O-N 3.42Å
203	A	85.2	Confident	79.4	Confident	47 Å²	47	102.7 Å²	102.7	39%	0.388	54%	0.544	S	S	.	.	H	α-helix	trans	-64.8	-41.6	177.5	0	0	0	0	0	111.9	I199 L200 F206 L207	I199-A203 VanDerWaalsContact O-CB 3.32Å; I199-A203 WeakPolarHBondContact O-CB 3.14Å; I199-A203 PolarHBondContact O-N 3.49Å; L200-A203 PolarHBondContact O-N 3.36Å; A203-F206 PolarHBondContact O-N 2.8Å; A203-L207 WeakPolarHBondContact O-CB 3.22Å; A203-L207 VanDerWaalsContact O-CG 3.27Å; A203-L207 WeakPolarHBondContact O-CG 3.25Å; A203-L207 PolarHBondContact O-N 3.44Å
204	A	85.6	Confident	81.3	Confident	52 Å²	52	100.5 Å²	100.5	43%	0.43	54%	0.537	S	S	.	.	H	α-helix	trans	-62.4	-43.8	175.7	0	0	0	0	0	111.9	L200 L207 L208	L200-A204 VanDerWaalsContact O-CB 3.32Å; L200-A204 WeakPolarHBondContact O-CB 3.19Å; L200-A204 PolarHBondContact O-N 3.05Å; A204-L207 PolarHBondContact O-N 3.3Å; A204-L208 WeakPolarHBondContact O-CG 3.44Å; A204-L208 PolarHBondContact O-N 3.46Å
205	A	89.8	Confident	83.2	Confident	62 Å²	62	96.9 Å²	96.9	51%	0.512	53%	0.531	S	S	.	.	H	α-helix	trans	-64.9	-40.5	176.7	0	0	0	0	0	112.3	S201 G202 L208 G209	S201-A205 PolarHBondContact O-N 2.9Å; S201-A205 VanDerWaalsContact O-N 3.15Å; G202-A205 PolarHBondContact O-N 3.13Å; A205-L208 PolarHBondContact O-N 3.42Å; A205-G209 PolarHBondContact O-N 3.37Å
206	F	91.8	Very high	85.1	Confident	143 Å²	143	96 Å²	96	63%	0.627	53%	0.531	S	S	*	.	H	α-helix	trans	-65.2	-43.1	177.3	-171.4	-103.6	0	0	0	112.1	G202 A203 G209 L210	G202-F206 WeakPolarHBondContact O-CB 3.2Å; G202-F206 PolarHBondContact O-N 3.42Å; A203-F206 PolarHBondContact O-N 2.8Å; F206-G209 PolarHBondContact O-N 3.27Å; F206-L210 HydrophobicContact CD1-CD1 3.89Å; F206-L210 HydrophobicContact CD1-CG 4.34Å; F206-L210 HydrophobicContact CE1-CD1 3.53Å; F206-L210 HydrophobicContact CE1-CG 4.07Å; F206-L210 HydrophobicContact CZ-CD1 4.24Å; F206-L210 HydrophobicContact CZ-CD2 4.44Å; F206-L210 HydrophobicContact CZ-CG 4.38Å; F206-L210 WeakPolarHBondContact O-CG 3.32Å; F206-L210 PolarHBondContact O-N 3.43Å
207	L	94.2	Very high	86.8	Confident	106 Å²	106	90.6 Å²	90.6	56%	0.555	52%	0.516	S	S	*	.	H	α-helix	trans	-62.9	-42.4	176.1	-73	170.9	0	0	0	112.1	A203 A204 G209 L210 I211	A203-L207 WeakPolarHBondContact O-CB 3.22Å; A203-L207 VanDerWaalsContact O-CG 3.27Å; A203-L207 WeakPolarHBondContact O-CG 3.25Å; A203-L207 PolarHBondContact O-N 3.44Å; A204-L207 PolarHBondContact O-N 3.3Å; L207-G209 VanDerWaalsContact C-N 3.34Å; L207-G209 PolarHBondContact O-N 3.3Å; L207-L210 PolarHBondContact O-N 3.4Å; L207-I211 WeakPolarHBondContact O-CG1 3.41Å; L207-I211 PolarHBondContact O-N 3.47Å; L207-I211 VanDerWaalsContact O-N 3.12Å
208	L	94.6	Very high	88.4	Confident	116 Å²	116	85.5 Å²	85.5	61%	0.607	50%	0.5	S	S	*	.	H	α-helix	trans	-62.2	-42	174.7	-72.9	170.4	0	0	0	111.8	A204 A205 I211 V212	A204-L208 WeakPolarHBondContact O-CG 3.44Å; A204-L208 PolarHBondContact O-N 3.46Å; A205-L208 PolarHBondContact O-N 3.42Å; L208-I211 PolarHBondContact O-N 2.96Å; L208-V212 WeakPolarHBondContact O-CG2 3.45Å; L208-V212 PolarHBondContact O-N 3.37Å; L208-V212 VanDerWaalsContact O-N 3.13Å
209	G	94.6	Very high	89.7	Confident	41 Å²	41	82.8 Å²	82.8	42%	0.423	49%	0.492	S	S	.	.	H	α-helix	trans	-61.1	-43.6	175.7	0	0	0	0	0	113.1	A205 F206 L207 I211 V212 F213	A205-G209 PolarHBondContact O-N 3.37Å; F206-G209 PolarHBondContact O-N 3.27Å; L207-G209 VanDerWaalsContact C-N 3.34Å; L207-G209 PolarHBondContact O-N 3.3Å; G209-I211 VanDerWaalsContact C-N 3.35Å; G209-I211 PolarHBondContact O-N 3.38Å; G209-V212 PolarHBondContact O-N 3.13Å; G209-F213 WeakPolarHBondContact O-CB 3.43Å; G209-F213 PolarHBondContact O-N 2.93Å
210	L	96.1	Very high	90.8	Very high	75 Å²	75	84.8 Å²	84.8	39%	0.393	50%	0.5	S	S	.	.	H	α-helix	trans	-62.3	-40.3	176.6	-74.2	177.9	0	0	0	112.3	F206 L207 F213 L214	F206-L210 HydrophobicContact CD1-CD1 3.89Å; F206-L210 HydrophobicContact CD1-CG 4.34Å; F206-L210 HydrophobicContact CE1-CD1 3.53Å; F206-L210 HydrophobicContact CE1-CG 4.07Å; F206-L210 HydrophobicContact CZ-CD1 4.24Å; F206-L210 HydrophobicContact CZ-CD2 4.44Å; F206-L210 HydrophobicContact CZ-CG 4.38Å; F206-L210 WeakPolarHBondContact O-CG 3.32Å; F206-L210 PolarHBondContact O-N 3.43Å; L207-L210 PolarHBondContact O-N 3.4Å; L210-F213 PolarHBondContact O-N 3.37Å; L210-L214 WeakPolarHBondContact O-CB 3.26Å; L210-L214 VanDerWaalsContact O-CG 3.26Å; L210-L214 WeakPolarHBondContact O-CG 3.4Å; L210-L214 PolarHBondContact O-N 3.19Å
211	I	95.7	Very high	91.4	Very high	102 Å²	102	85.1 Å²	85.1	52%	0.523	50%	0.502	S	S	.	.	H	α-helix	trans	-63.1	-47.4	177.8	-67.3	164.5	0	0	0	110.5	L207 L208 G209 F213 L214 V215	L207-I211 WeakPolarHBondContact O-CG1 3.41Å; L207-I211 PolarHBondContact O-N 3.47Å; L207-I211 VanDerWaalsContact O-N 3.12Å; L208-I211 PolarHBondContact O-N 2.96Å; G209-I211 VanDerWaalsContact C-N 3.35Å; G209-I211 PolarHBondContact O-N 3.38Å; I211-F213 VanDerWaalsContact C-N 3.32Å; I211-F213 PolarHBondContact O-N 3Å; I211-L214 PolarHBondContact O-N 3.46Å; I211-V215 VanDerWaalsContact O-CG2 3.31Å; I211-V215 WeakPolarHBondContact O-CG2 3.35Å; I211-V215 PolarHBondContact O-N 3.44Å
212	V	95.6	Very high	91.7	Very high	108 Å²	108	88.4 Å²	88.4	66%	0.655	51%	0.505	S	S	*	.	H	α-helix	trans	-61.6	-42.2	178.2	174	0	0	0	0	111.1	L208 G209 V215 G216	L208-V212 WeakPolarHBondContact O-CG2 3.45Å; L208-V212 PolarHBondContact O-N 3.37Å; L208-V212 VanDerWaalsContact O-N 3.13Å; G209-V212 PolarHBondContact O-N 3.13Å; V212-V215 PolarHBondContact O-N 3.46Å; V212-G216 PolarHBondContact O-N 3.34Å
213	F	95.1	Very high	91.8	Very high	138 Å²	138	89 Å²	89	61%	0.605	51%	0.506	S	S	*	.	H	α-helix	trans	-62.3	-48.1	177.5	-177.9	-100.1	0	0	0	112.2	G209 L210 I211 V215 G216 V217	G209-F213 WeakPolarHBondContact O-CB 3.43Å; G209-F213 PolarHBondContact O-N 2.93Å; L210-F213 PolarHBondContact O-N 3.37Å; I211-F213 VanDerWaalsContact C-N 3.32Å; I211-F213 PolarHBondContact O-N 3Å; F213-V215 PolarHBondContact O-N 2.95Å; F213-G216 PolarHBondContact O-N 3.48Å; F213-V217 HydrophobicContact CD1-CG2 4.21Å; F213-V217 HydrophobicContact CE1-CG2 3.81Å; F213-V217 HydrophobicContact CE2-CG2 4.39Å; F213-V217 HydrophobicContact CZ-CG2 3.91Å; F213-V217 WeakPolarHBondContact O-CG2 3.31Å; F213-V217 PolarHBondContact O-N 2.91Å
214	L	95.2	Very high	91.6	Very high	107 Å²	107	91.6 Å²	91.6	56%	0.56	51%	0.511	S	S	*	.	H	α-helix	trans	-62.4	-42.3	179.1	-71.4	172.9	0	0	0	112	L210 I211 G216 V217 V218	L210-L214 WeakPolarHBondContact O-CB 3.26Å; L210-L214 VanDerWaalsContact O-CG 3.26Å; L210-L214 WeakPolarHBondContact O-CG 3.4Å; L210-L214 PolarHBondContact O-N 3.19Å; I211-L214 PolarHBondContact O-N 3.46Å; L214-G216 VanDerWaalsContact C-N 3.34Å; L214-G216 PolarHBondContact O-N 2.97Å; L214-V217 PolarHBondContact O-N 3.28Å; L214-V218 WeakPolarHBondContact O-CG2 3.46Å; L214-V218 PolarHBondContact O-N 3.48Å
215	V	95.6	Very high	91.1	Very high	79 Å²	79	96.2 Å²	96.2	48%	0.479	52%	0.521	S	S	.	.	H	α-helix	trans	-61.5	-44.1	174.6	171.8	0	0	0	0	110.6	I211 V212 F213 V217 V218 I219	I211-V215 VanDerWaalsContact O-CG2 3.31Å; I211-V215 WeakPolarHBondContact O-CG2 3.35Å; I211-V215 PolarHBondContact O-N 3.44Å; V212-V215 PolarHBondContact O-N 3.46Å; F213-V215 PolarHBondContact O-N 2.95Å; V215-V217 PolarHBondContact O-N 2.98Å; V215-V218 PolarHBondContact O-N 3.34Å; V215-I219 HydrophobicContact CG1-CD1 3.91Å; V215-I219 HydrophobicContact CG1-CG1 4.47Å; V215-I219 VanDerWaalsContact O-CG1 3.31Å; V215-I219 WeakPolarHBondContact O-CG1 3.31Å; V215-I219 PolarHBondContact O-N 3.5Å
216	G	93.8	Very high	90.2	Very high	37 Å²	37	95.9 Å²	95.9	38%	0.381	52%	0.518	S	S	.	.	H	α-helix	trans	-58.8	-45.2	175.6	0	0	0	0	0	113	V212 F213 L214 I219 H220	V212-G216 PolarHBondContact O-N 3.34Å; F213-G216 PolarHBondContact O-N 3.48Å; L214-G216 VanDerWaalsContact C-N 3.34Å; L214-G216 PolarHBondContact O-N 2.97Å; G216-I219 PolarHBondContact O-N 2.9Å; G216-H220 WeakPolarHBondContact O-CB 3.48Å; G216-H220 PolarHBondContact O-N 3.35Å
217	V	94.9	Very high	88.5	Confident	55 Å²	55	93 Å²	93	33%	0.333	52%	0.516	S	S	.	.	H	α-helix	trans	-61.9	-44.4	176.2	171.7	0	0	0	0	111.1	F213 L214 V215 I219 H220 L221	F213-V217 HydrophobicContact CD1-CG2 4.21Å; F213-V217 HydrophobicContact CE1-CG2 3.81Å; F213-V217 HydrophobicContact CE2-CG2 4.39Å; F213-V217 HydrophobicContact CZ-CG2 3.91Å; F213-V217 WeakPolarHBondContact O-CG2 3.31Å; F213-V217 PolarHBondContact O-N 2.91Å; L214-V217 PolarHBondContact O-N 3.28Å; V215-V217 PolarHBondContact O-N 2.98Å; V217-I219 PolarHBondContact O-N 3.25Å; V217-H220 PolarHBondContact O-N 3.46Å; V217-L221 HydrophobicContact CG1-CD1 3.76Å; V217-L221 HydrophobicContact CG1-CG 4.18Å; V217-L221 WeakPolarHBondContact O-CB 3.26Å; V217-L221 VanDerWaalsContact O-CG 3.26Å; V217-L221 WeakPolarHBondContact O-CG 3.42Å; V217-L221 PolarHBondContact O-N 2.99Å
218	V	93	Very high	86.8	Confident	76 Å²	76	93.4 Å²	93.4	46%	0.461	52%	0.522	S	S	.	.	H	α-helix	trans	-62.1	-43.3	177.9	170.7	0	0	0	0	111.5	L214 V215 K222	L214-V218 WeakPolarHBondContact O-CG2 3.46Å; L214-V218 PolarHBondContact O-N 3.48Å; V215-V218 PolarHBondContact O-N 3.34Å; V218-K222 HydrophobicContact CG1-CD 4.45Å; V218-K222 WeakPolarHBondContact O-CB 3.38Å; V218-K222 WeakPolarHBondContact O-CG 3.46Å; V218-K222 PolarHBondContact O-N 3.46Å
219	I	91.8	Very high	85	Confident	108 Å²	108	94.8 Å²	94.8	55%	0.554	53%	0.526	S	S	*	.	H	α-helix	trans	-63.5	-43.8	176.4	-65.9	172.3	0	0	0	110.3	V215 G216 V217 K222 A223	V215-I219 HydrophobicContact CG1-CD1 3.91Å; V215-I219 HydrophobicContact CG1-CG1 4.47Å; V215-I219 VanDerWaalsContact O-CG1 3.31Å; V215-I219 WeakPolarHBondContact O-CG1 3.31Å; V215-I219 PolarHBondContact O-N 3.5Å; G216-I219 PolarHBondContact O-N 2.9Å; V217-I219 PolarHBondContact O-N 3.25Å; I219-K222 PolarHBondContact O-N 2.93Å; I219-A223 WeakPolarHBondContact O-CB 3.4Å; I219-A223 PolarHBondContact O-N 3.32Å
220	H	89.6	Confident	82.9	Confident	111 Å²	111	98.5 Å²	98.5	51%	0.514	54%	0.54	S	S	.	.	H	α-helix	trans	-64.1	-44.1	179.4	-171.7	50.4	0	0	0	112.5	G216 V217 K222 A223 Q224	G216-H220 WeakPolarHBondContact O-CB 3.48Å; G216-H220 PolarHBondContact O-N 3.35Å; V217-H220 PolarHBondContact O-N 3.46Å; H220-K222 VanDerWaalsContact C-N 3.35Å; H220-K222 PolarHBondContact O-N 3.14Å; H220-A223 PolarHBondContact O-N 2.86Å; H220-Q224 PolarHBondContact NE2-NE2 3.06Å; H220-Q224 VanDerWaalsContact NE2-NE2 3.14Å; H220-Q224 PolarHBondContact O-N 3.2Å
221	L	88.1	Confident	80.7	Confident	99 Å²	99	103 Å²	103	52%	0.518	56%	0.559	S	S	.	*	H	α-helix	trans	-64.2	-38.4	176	-69.6	173.8	0	0	0	111.9	V217 Q224 K225	V217-L221 HydrophobicContact CG1-CD1 3.76Å; V217-L221 HydrophobicContact CG1-CG 4.18Å; V217-L221 WeakPolarHBondContact O-CB 3.26Å; V217-L221 VanDerWaalsContact O-CG 3.26Å; V217-L221 WeakPolarHBondContact O-CG 3.42Å; V217-L221 PolarHBondContact O-N 2.99Å; L221-Q224 PolarHBondContact O-N 3.48Å; L221-K225 PolarHBondContact O-N 3Å
222	K	86.2	Confident	78.2	Confident	152 Å²	152	103.7 Å²	103.7	66%	0.661	57%	0.571	S	S	*	*	H	α-helix	trans	-63.9	-40.4	172.8	-77.6	-175	176.7	-174.8	0	112	V218 I219 H220 K225 A226	V218-K222 HydrophobicContact CG1-CD 4.45Å; V218-K222 WeakPolarHBondContact O-CB 3.38Å; V218-K222 WeakPolarHBondContact O-CG 3.46Å; V218-K222 PolarHBondContact O-N 3.46Å; I219-K222 PolarHBondContact O-N 2.93Å; H220-K222 VanDerWaalsContact C-N 3.35Å; H220-K222 PolarHBondContact O-N 3.14Å; K222-K225 PolarHBondContact O-N 3.47Å; K222-A226 PolarHBondContact O-N 3Å
223	A	82.4	Confident	75.7	Confident	55 Å²	55	101.5 Å²	101.5	46%	0.455	57%	0.57	S	S	.	*	H	α-helix	trans	-66.8	-41	176.7	0	0	0	0	0	112.3	I219 H220 A226 S227	I219-A223 WeakPolarHBondContact O-CB 3.4Å; I219-A223 PolarHBondContact O-N 3.32Å; H220-A223 PolarHBondContact O-N 2.86Å; A223-A226 PolarHBondContact O-N 3.06Å; A223-S227 PolarHBondContact O-N 2.89Å
224	Q	80.2	Confident	73.3	Confident	102 Å²	102	103 Å²	103	48%	0.477	58%	0.584	S	S	.	*	H	α-helix	trans	-61.8	-42.6	173.4	-75.2	-167.9	-4.4	0	0	111.7	H220 L221 A226 S227 V228	H220-Q224 PolarHBondContact NE2-NE2 3.06Å; H220-Q224 VanDerWaalsContact NE2-NE2 3.14Å; H220-Q224 PolarHBondContact O-N 3.2Å; L221-Q224 PolarHBondContact O-N 3.48Å; Q224-A226 PolarHBondContact O-N 3.3Å; Q224-S227 PolarHBondContact O-N 3.31Å; Q224-V228 WeakPolarHBondContact O-CG2 3.37Å; Q224-V228 PolarHBondContact O-N 3.38Å
225	K	75.9	Confident	70.8	Confident	148 Å²	148	106.8 Å²	106.8	64%	0.643	60%	0.599	S	S	*	*	H	α-helix	trans	-62.5	-42.3	177.5	-164.2	176.1	-179.4	-176.7	0	112.2	L221 K222 S227 V228 E229	L221-K225 PolarHBondContact O-N 3Å; K222-K225 PolarHBondContact O-N 3.47Å; K225-S227 VanDerWaalsContact C-N 3.34Å; K225-S227 PolarHBondContact O-N 2.77Å; K225-V228 PolarHBondContact O-N 3.39Å; K225-E229 WeakPolarHBondContact O-CB 3.48Å; K225-E229 PolarHBondContact O-N 3.02Å
226	A	69.1	Low	68.5	Low	56 Å²	56	106.7 Å²	106.7	46%	0.463	61%	0.606	S	S	.	*	H	α-helix	trans	-64.6	-35.3	175.6	0	0	0	0	0	113.2	K222 A223 Q224 T230	K222-A226 PolarHBondContact O-N 3Å; A223-A226 PolarHBondContact O-N 3.06Å; Q224-A226 PolarHBondContact O-N 3.3Å; A226-T230 PolarHBondContact O-N 3.46Å; A226-T230 PolarHBondContact O-OG1 3.24Å
227	S	57.2	Low	66.1	Low	83 Å²	83	110.5 Å²	110.5	58%	0.58	63%	0.627	S	S	*	*	H	α-helix	trans	-68.6	-37.2	174.6	168.3	0	0	0	0	112.8	A223 Q224 K225	A223-S227 PolarHBondContact O-N 2.89Å; Q224-S227 PolarHBondContact O-N 3.31Å; K225-S227 VanDerWaalsContact C-N 3.34Å; K225-S227 PolarHBondContact O-N 2.77Å
228	V	58.8	Low	63.9	Low	113 Å²	113	119 Å²	119	69%	0.685	65%	0.653	S	S	*	*	H	α-helix	trans	-71.9	-34.5	177.9	171.4	0	0	0	0	111.1	Q224 K225 T230	Q224-V228 WeakPolarHBondContact O-CG2 3.37Å; Q224-V228 PolarHBondContact O-N 3.38Å; K225-V228 PolarHBondContact O-N 3.39Å; V228-T230 VanDerWaalsContact C-N 3.28Å; V228-T230 PolarHBondContact O-N 3.43Å
229	E	56	Low	61.8	Low	146 Å²	146	124.3 Å²	124.3	68%	0.682	67%	0.67	S	S	*	*	H	α-helix	trans	-76.6	-13.9	179.3	-148.6	151.6	-163.7	0	0	113	K225	K225-E229 WeakPolarHBondContact O-CB 3.48Å; K225-E229 PolarHBondContact O-N 3.02Å
230	T	50.7	Low	59.8	Low	118 Å²	118	126.4 Å²	126.4	72%	0.724	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	4	178.2	-51.6	0	0	0	0	113.8	A226 V228	A226-T230 PolarHBondContact O-N 3.46Å; A226-T230 PolarHBondContact O-OG1 3.24Å; V228-T230 VanDerWaalsContact C-N 3.28Å; V228-T230 PolarHBondContact O-N 3.43Å
231	Q	49.4	Very low	58	Low	169 Å²	169	128.8 Å²	128.8	79%	0.79	70%	0.697	S	S	*	*			trans	-115.8	80.5	166.8	-88.3	-166.3	-32.9	0	0	111.2
232	P	44.5	Very low	56.2	Low	118 Å²	118	132.9 Å²	132.9	77%	0.766	71%	0.713	S	S	*	*	S	Bend		-143.3	107.5	124.2	32.3	-14.9	0	0	0	110.9
233	G	41.7	Very low	54	Low	61 Å²	61	130.3 Å²	130.3	63%	0.629	71%	0.714	S	S	*	*			trans	176.5	12.8	178.1	0	0	0	0	0	118.3	E235	G233-E235 VanDerWaalsContact C-N 3.29Å; G233-E235 PolarHBondContact O-N 3.31Å
234	N	44.8	Very low	51.8	Low	171 Å²	171	136.7 Å²	136.7	91%	0.914	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	44	176.3	-85.5	-2.5	0	0	0	113
235	E	43.9	Very low	50.4	Low	186 Å²	186	141.1 Å²	141.1	87%	0.869	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126	7.6	173.7	-148.3	164.9	-165.4	0	0	113.7	G233	G233-E235 VanDerWaalsContact C-N 3.29Å; G233-E235 PolarHBondContact O-N 3.31Å
236	A	45.5	Very low	49.2	Very low	76 Å²	76	140.8 Å²	140.8	63%	0.628	78%	0.779	S	S	*	*	S	Bend	trans	-101	-11.5	179.5	0	0	0	0	0	115.3
237	S	44.6	Very low	48.1	Very low	117 Å²	117	145.3 Å²	145.3	82%	0.818	80%	0.796	S	S	*	*	S	Bend	trans	-94	0.7	-177.5	-77.3	0	0	0	0	115.9
238	R	48.5	Very low	47.6	Very low	235 Å²	235	148.7 Å²	148.7	89%	0.887	81%	0.808	S	S	*	*	S	Bend	trans	-96.9	-4.5	175.9	-156.8	179.3	-77.2	158.9	-3.6	114
239	K	48.2	Very low	46.9	Very low	187 Å²	187	150.8 Å²	150.8	81%	0.813	82%	0.815	S	S	*	*	S	Bend	trans	-104	6.9	-179.1	-77.8	-171	178.4	-178	0	115.8
240	L	51.1	Low	46.4	Very low	152 Å²	152	151.1 Å²	151.1	80%	0.796	82%	0.823	S	S	*	*	S	Bend	trans	-114.4	26.4	176.5	-77.3	169.8	0	0	0	113.9
241	L	50.3	Low	46.1	Very low	161 Å²	161	153.3 Å²	153.3	84%	0.843	83%	0.83	S	S	*	*	S	Bend	trans	-111.7	15.7	170.5	-110.9	144.9	0	0	0	113
242	H	52.1	Low	45.9	Very low	185 Å²	185	152.2 Å²	152.2	86%	0.856	83%	0.833	S	S	*	*	S	Bend	trans	-135.2	71.5	175	-118.9	-29.7	0	0	0	111.3
243	S	38.5	Very low	46	Very low	98 Å²	98	154.8 Å²	154.8	69%	0.685	84%	0.838	S	S	*	*			trans	-173.5	91	151.7	58.2	0	0	0	0	111.2
244	Q	37.8	Very low	46.3	Very low	188 Å²	188	162.7 Å²	162.7	88%	0.879	86%	0.855	S	S	*	*				160.6	148.6	122.2	-91.8	-178.8	-85	0	0	110.8
245	P	50.6	Low	46.5	Very low	196 Å²	196	161.9 Å²	161.9	100%	1.273	85%	0.85	S	S	*	*			cis	-97.3	0	-23.9	23.2	-7.1	0	0	0	112.9

Retrieved 245 of 245 residues in 192.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).