A0A096LSI9_POEFO Loading...

tRNA pseudouridine synthase

AlphaFold DB , UniProt , Accession A0A096LSI9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 286 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	24	Very low	36.3	Very low	195 Å²	195	69.9 Å²	69.9	96%	0.961	41%	0.413	S	S	*	.				0	86.2	0	-72.3	-88.4	-88.6	0	0	107.7	F191	M1-F191 HydrophobicContact CE-CB 4.43Å; M1-F191 HydrophobicContact CE-CD1 3.34Å; M1-F191 HydrophobicContact CE-CD2 4.26Å; M1-F191 HydrophobicContact CE-CE1 3.49Å; M1-F191 VanDerWaalsContact CE-CE1 3.49Å; M1-F191 HydrophobicContact CE-CE2 4.37Å; M1-F191 HydrophobicContact CE-CG 3.76Å; M1-F191 HydrophobicContact CE-CZ 4.01Å
2	A	22.6	Very low	36.9	Very low	96 Å²	96	74.8 Å²	74.8	79%	0.793	43%	0.425	S	S	*	.			trans	-116.4	110.2	178.5	0	0	0	0	0	107.4
3	G	25	Very low	37.6	Very low	54 Å²	54	71.5 Å²	71.5	56%	0.557	41%	0.407	S	S	*	.			trans	-72.4	134.7	172.8	0	0	0	0	0	109.9
4	V	33.3	Very low	37.6	Very low	59 Å²	59	71.9 Å²	71.9	36%	0.358	41%	0.414	S	S	.	.			trans	-95.6	131.5	-164.2	171.1	0	0	0	0	110.5	V6 H53 Q89 L134	V4-V6 HydrophobicContact CG1-CG2 3.85Å; V4-H53 PolarHBondContact O-CE1 3.32Å; V4-H53 PolarHBondContact O-ND1 3.19Å; V4-Q89 HydrophobicContact CG1-CB 4.03Å; V4-Q89 WeakPolarHBondContact CG1-O 3.25Å; V4-L134 WeakPolarHBondContact O-CD2 3.46Å
5	V	28.6	Very low	37.8	Very low	41 Å²	41	75.5 Å²	75.5	25%	0.248	44%	0.441	C	S	.	.			trans	-98.5	102.6	166.1	173.6	0	0	0	0	108.8	E7 Q89 N133	V5-E7 HydrophobicContact CG1-CG 4.33Å; V5-E7 PolarHBondContact O-N 3.34Å; V5-Q89 PolarHBondContact O-OE1 2.87Å; V5-N133 VanDerWaalsContact CG1-ND2 3.29Å; V5-N133 WeakPolarHBondContact CG1-ND2 3.42Å; V5-N133 HydrophobicContact CG2-CB 4.15Å
6	V	34.4	Very low	37.8	Very low	22 Å²	22	82.4 Å²	82.4	13%	0.133	47%	0.468	C	S	.	.			trans	-78.5	103.6	166.6	179	0	0	0	0	108.5	V4 R8 V23 G51 H53	V4-V6 HydrophobicContact CG1-CG2 3.85Å; V6-R8 WeakPolarHBondContact CG1-O 3.37Å; V6-R8 PolarHBondContact O-N 3.07Å; V6-V23 HydrophobicContact CG1-CG2 4.24Å; V6-G51 WeakPolarHBondContact O-CA 3.28Å; V6-H53 PolarHBondContact N-ND1 3.07Å
7	E	31.7	Very low	37.9	Very low	156 Å²	156	84.9 Å²	84.9	73%	0.729	48%	0.475	S	S	*	.	S	Bend	trans	-65	-24.3	175.1	-74.5	-168.8	164	0	0	112.4	V5	V5-E7 HydrophobicContact CG1-CG 4.33Å; V5-E7 PolarHBondContact O-N 3.34Å
8	R	50.3	Low	37.6	Very low	69 Å²	69	90.1 Å²	90.1	26%	0.26	50%	0.5	S	S	.	.	S	Bend	trans	-149.6	150	-174.4	-64.3	179.6	-167	-115.2	-28.4	114.7	V6	V6-R8 WeakPolarHBondContact CG1-O 3.37Å; V6-R8 PolarHBondContact O-N 3.07Å
9	G	43.7	Very low	37.8	Very low	9 Å²	9	89.1 Å²	89.1	9%	0.093	51%	0.512	C	S	.	.			trans	-67.7	177.5	-175.1	0	0	0	0	0	113.9	V11 V23 T48 D49 A50	G9-V11 PolarHBondContact O-N 3.12Å; G9-V23 PolarHBondContact O-N 3.49Å; G9-T48 CarbonylContact C-O 3.58Å; G9-T48 WeakPolarHBondContact CA-O 3.48Å; G9-D49 VanDerWaalsContact CA-C 3.43Å; G9-D49 VanDerWaalsContact CA-O 3.24Å; G9-D49 WeakPolarHBondContact CA-O 3.24Å; G9-A50 VanDerWaalsContact N-CA 3.3Å
10	V	56.5	Low	38.6	Very low	7 Å²	7	89.9 Å²	89.9	4%	0.042	51%	0.511	C	S	.	.	S	Bend	trans	-77.7	4.9	-174.8	171.8	0	0	0	0	113.9	V23 Q24 V44 T48	V10-V23 HydrophobicContact CG2-CB 4Å; V10-V23 HydrophobicContact CG2-CG1 4.17Å; V10-V23 HydrophobicContact CG2-CG2 4.33Å; V10-Q24 VanDerWaalsContact O-CB 3.22Å; V10-Q24 WeakPolarHBondContact O-CB 3.34Å; V10-V44 HydrophobicContact CG1-CB 4.07Å; V10-V44 HydrophobicContact CG1-CG1 3.75Å; V10-V44 HydrophobicContact CG1-CG2 3.93Å; V10-T48 HydrophobicContact CG2-CG2 4.37Å; V10-T48 WeakPolarHBondContact CG2-OG1 3.27Å; V10-T48 PolarHBondContact N-O 3.19Å; V10-T48 PolarHBondContact N-OG1 3.01Å
11	V	49	Very low	40.1	Very low	61 Å²	61	87.8 Å²	87.8	37%	0.37	50%	0.502	S	S	.	.	S	Bend	trans	-90.8	142.8	-173.9	-164.5	0	0	0	0	112	G9 R47	G9-V11 PolarHBondContact O-N 3.12Å; V11-R47 HydrophobicContact CG2-CB 4.14Å; V11-R47 HydrophobicContact CG2-CG 4.32Å
12	K	43.1	Very low	43.2	Very low	128 Å²	128	78.6 Å²	78.6	56%	0.557	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-58.9	129.6	167	-163.9	175.6	-173.5	167.5	0	110.4	E25	K12-E25 WeakPolarHBondContact CA-OE1 3.29Å; K12-E25 HydrophobicContact CG-CG 4.1Å; K12-E25 WeakPolarHBondContact CG-OE1 3.44Å
13	V	46.1	Very low	46.6	Very low	32 Å²	32	75.2 Å²	75.2	19%	0.194	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-83.3	133.1	-176.9	-176	0	0	0	0	108.9	Q17 E25	V13-Q17 HydrophobicContact CG1-CB 3.79Å; V13-E25 PolarHBondContact N-OE1 3.46Å
14	P	38.3	Very low	49.9	Very low	78 Å²	78	74 Å²	74	51%	0.506	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-60.2	148.3	174.1	-21.9	32.2	0	0	0	111.7	Q16 Q17	P14-Q16 PolarHBondContact O-N 3.23Å; P14-Q17 PolarHBondContact O-N 3.36Å
15	P	40.4	Very low	52.9	Low	126 Å²	126	72.5 Å²	72.5	82%	0.818	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-3	-173.5	16	-24.3	0	0	0	116
16	Q	37.1	Very low	56.1	Low	185 Å²	185	72.1 Å²	72.1	86%	0.864	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-1.8	179.2	-71.4	173.9	-18.1	0	0	114.3	P14	P14-Q16 PolarHBondContact O-N 3.23Å
17	Q	40	Very low	59.1	Low	126 Å²	126	72.5 Å²	72.5	59%	0.589	39%	0.392	S	S	*	.	S	Bend	trans	-109.5	77.2	171	-74.4	-177.9	-8.8	0	0	110.3	V13 P14 G19	V13-Q17 HydrophobicContact CG1-CB 3.79Å; P14-Q17 PolarHBondContact O-N 3.36Å; Q17-G19 PolarHBondContact O-N 2.97Å; Q17-G19 VanDerWaalsContact O-N 3.07Å
18	L	32.3	Very low	62.2	Low	177 Å²	177	66 Å²	66	93%	0.927	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	109.5	174.1	-84.1	153.9	0	0	0	110.2
19	G	42.6	Very low	64.4	Low	71 Å²	71	66.6 Å²	66.6	73%	0.732	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	139.5	-8.9	159.3	0	0	0	0	0	117.7	Q17	Q17-G19 PolarHBondContact O-N 2.97Å; Q17-G19 VanDerWaalsContact O-N 3.07Å
20	Q	52.9	Low	67	Low	105 Å²	105	66.2 Å²	66.2	49%	0.491	36%	0.364	S	S	.	.			trans	-147.4	111.8	-166.4	-68.1	167.2	-32.8	0	0	113.6
21	S	71.1	Confident	69	Low	47 Å²	47	66.1 Å²	66.1	33%	0.329	36%	0.363	S	S	.	.			trans	-85.9	149.4	-174.7	-50.6	0	0	0	0	114	E25	S21-E25 WeakPolarHBondContact CA-OE2 3.43Å; S21-E25 WeakPolarHBondContact CB-OE2 3.08Å
22	G	88.4	Confident	71.3	Confident	1 Å²	1	68.8 Å²	68.8	1%	0.01	37%	0.369	C	S	.	.			trans	-86.6	170	174.1	0	0	0	0	0	113.7	Q24 E25 H26	G22-Q24 VanDerWaalsContact C-N 3.28Å; G22-Q24 PolarHBondContact O-N 2.88Å; G22-E25 PolarHBondContact N-OE2 2.62Å; G22-E25 PolarHBondContact O-N 3.08Å; G22-E25 VanDerWaalsContact O-N 3.09Å; G22-H26 PolarHBondContact O-N 3.4Å
23	V	93.9	Very high	73.9	Confident	25 Å²	25	70 Å²	70	15%	0.152	37%	0.371	C	S	.	.	H	α-helix	trans	-56.8	-41.7	179.5	173.2	0	0	0	0	112	V6 G9 V10 E25 H26 L27 I90	V6-V23 HydrophobicContact CG1-CG2 4.24Å; G9-V23 PolarHBondContact O-N 3.49Å; V10-V23 HydrophobicContact CG2-CB 4Å; V10-V23 HydrophobicContact CG2-CG1 4.17Å; V10-V23 HydrophobicContact CG2-CG2 4.33Å; V23-E25 VanDerWaalsContact C-N 3.33Å; V23-E25 PolarHBondContact O-N 2.92Å; V23-H26 PolarHBondContact O-N 2.86Å; V23-L27 HydrophobicContact CG1-CD1 4.04Å; V23-L27 WeakPolarHBondContact O-CG 3.35Å; V23-L27 PolarHBondContact O-N 3.29Å; V23-L27 VanDerWaalsContact O-N 3.1Å; V23-I90 HydrophobicContact CB-CD1 4.2Å; V23-I90 HydrophobicContact CG1-CD1 3.91Å; V23-I90 HydrophobicContact CG1-CG1 4.21Å; V23-I90 HydrophobicContact CG1-CG2 4.37Å; V23-I90 HydrophobicContact CG2-CD1 4.21Å; V23-I90 HydrophobicContact CG2-CG1 4.44Å
24	Q	94.8	Very high	76.3	Confident	30 Å²	30	69.9 Å²	69.9	14%	0.14	37%	0.369	C	S	.	.	H	α-helix	trans	-61.9	-39.9	178.3	169.9	164.9	-7.8	0	0	112.1	V10 G22 L27 E28 L42	V10-Q24 VanDerWaalsContact O-CB 3.22Å; V10-Q24 WeakPolarHBondContact O-CB 3.34Å; G22-Q24 VanDerWaalsContact C-N 3.28Å; G22-Q24 PolarHBondContact O-N 2.88Å; Q24-L27 PolarHBondContact O-N 2.86Å; Q24-E28 HydrophobicContact CG-CG 4.35Å; Q24-E28 PolarHBondContact NE2-OE1 2.92Å; Q24-E28 WeakPolarHBondContact O-CG 3.45Å; Q24-E28 PolarHBondContact O-N 3.15Å; Q24-L42 HydrophobicContact CG-CD2 4.28Å; Q24-L42 PolarHBondContact NE2-O 2.9Å
25	E	94.8	Very high	79	Confident	27 Å²	27	73.4 Å²	73.4	13%	0.126	38%	0.376	C	S	.	.	H	α-helix	trans	-67.1	-42.6	-179.2	-72.1	164.3	178.8	0	0	111.4	K12 V13 S21 G22 V23 L27 E28 E29	K12-E25 WeakPolarHBondContact CA-OE1 3.29Å; K12-E25 HydrophobicContact CG-CG 4.1Å; K12-E25 WeakPolarHBondContact CG-OE1 3.44Å; V13-E25 PolarHBondContact N-OE1 3.46Å; S21-E25 WeakPolarHBondContact CA-OE2 3.43Å; S21-E25 WeakPolarHBondContact CB-OE2 3.08Å; G22-E25 PolarHBondContact N-OE2 2.62Å; G22-E25 PolarHBondContact O-N 3.08Å; G22-E25 VanDerWaalsContact O-N 3.09Å; V23-E25 VanDerWaalsContact C-N 3.33Å; V23-E25 PolarHBondContact O-N 2.92Å; E25-L27 VanDerWaalsContact C-N 3.31Å; E25-L27 PolarHBondContact O-N 3.14Å; E25-E28 PolarHBondContact O-N 3.39Å; E25-E29 WeakPolarHBondContact O-CB 3.19Å; E25-E29 VanDerWaalsContact O-CG 3.29Å; E25-E29 WeakPolarHBondContact O-CG 3.13Å; E25-E29 PolarHBondContact O-N 3.26Å
26	H	96.4	Very high	81.7	Confident	33 Å²	33	68.5 Å²	68.5	15%	0.153	34%	0.344	C	S	.	.	H	α-helix	trans	-62.1	-37.8	174	-71.7	-45	0	0	0	112.9	G22 V23 E29 A30 L85 Q88 I90	G22-H26 PolarHBondContact O-N 3.4Å; V23-H26 PolarHBondContact O-N 2.86Å; H26-E29 IonicContact ND1-OE2 3.33Å; H26-E29 PolarHBondContact ND1-OE2 3.45Å; H26-E29 PolarHBondContact O-N 3.22Å; H26-A30 WeakPolarHBondContact O-CB 3.44Å; H26-A30 PolarHBondContact O-N 2.65Å; H26-L85 HydrophobicContact CB-CD2 4.2Å; H26-Q88 HydrophobicContact CB-CG 4.37Å; H26-Q88 PolarHBondContact NE2-OE1 3.27Å; H26-I90 HydrophobicContact CB-CD1 3.7Å
27	L	97.1	Very high	84.5	Confident	30 Å²	30	63.6 Å²	63.6	16%	0.157	33%	0.326	C	S	.	.	H	α-helix	trans	-66	-45.2	173.8	-70.3	170.6	0	0	0	111.3	V23 Q24 E25 E29 A30 I31 L42 L85 I90 V92	V23-L27 HydrophobicContact CG1-CD1 4.04Å; V23-L27 WeakPolarHBondContact O-CG 3.35Å; V23-L27 PolarHBondContact O-N 3.29Å; V23-L27 VanDerWaalsContact O-N 3.1Å; Q24-L27 PolarHBondContact O-N 2.86Å; E25-L27 VanDerWaalsContact C-N 3.31Å; E25-L27 PolarHBondContact O-N 3.14Å; L27-E29 VanDerWaalsContact C-N 3.33Å; L27-E29 PolarHBondContact O-N 3.05Å; L27-A30 PolarHBondContact O-N 3.24Å; L27-I31 WeakPolarHBondContact O-CD1 3.15Å; L27-I31 VanDerWaalsContact O-CG1 3.23Å; L27-I31 WeakPolarHBondContact O-CG1 3.39Å; L27-I31 PolarHBondContact O-N 3.02Å; L27-L42 HydrophobicContact CB-CD2 3.51Å; L27-L42 HydrophobicContact CD1-CD2 3.82Å; L27-L42 HydrophobicContact CG-CD2 4.32Å; L27-L85 HydrophobicContact CD2-CD1 3.81Å; L27-L85 HydrophobicContact CD2-CD2 4.36Å; L27-I90 HydrophobicContact CD2-CG2 3.94Å; L27-I90 HydrophobicContact CG-CG2 4.37Å; L27-V92 HydrophobicContact CD2-CG2 4.33Å
28	E	97.4	Very high	87.2	Confident	18 Å²	18	58.8 Å²	58.8	8%	0.084	31%	0.305	C	S	.	.	H	α-helix	trans	-61.2	-40.2	175.7	-73.7	176.7	-179.8	0	0	111.7	Q24 E25 I31 K32 V40 L42	Q24-E28 HydrophobicContact CG-CG 4.35Å; Q24-E28 PolarHBondContact NE2-OE1 2.92Å; Q24-E28 WeakPolarHBondContact O-CG 3.45Å; Q24-E28 PolarHBondContact O-N 3.15Å; E25-E28 PolarHBondContact O-N 3.39Å; E28-I31 PolarHBondContact O-N 3.33Å; E28-K32 VanDerWaalsContact O-CG 3.25Å; E28-K32 WeakPolarHBondContact O-CG 3.41Å; E28-K32 PolarHBondContact O-N 2.96Å; E28-V40 HydrophobicContact CB-CG1 4.09Å; E28-V40 HydrophobicContact CG-CG1 4.19Å; E28-L42 HydrophobicContact CG-CB 3.77Å
29	E	97.1	Very high	90.2	Very high	82 Å²	82	55.9 Å²	55.9	38%	0.383	30%	0.297	S	S	.	.	H	α-helix	trans	-62.4	-43.9	173.3	-74.3	172.7	167.4	0	0	112.3	E25 H26 L27 I31 K32 R33	E25-E29 WeakPolarHBondContact O-CB 3.19Å; E25-E29 VanDerWaalsContact O-CG 3.29Å; E25-E29 WeakPolarHBondContact O-CG 3.13Å; E25-E29 PolarHBondContact O-N 3.26Å; H26-E29 IonicContact ND1-OE2 3.33Å; H26-E29 PolarHBondContact ND1-OE2 3.45Å; H26-E29 PolarHBondContact O-N 3.22Å; L27-E29 VanDerWaalsContact C-N 3.33Å; L27-E29 PolarHBondContact O-N 3.05Å; E29-I31 VanDerWaalsContact C-N 3.34Å; E29-I31 PolarHBondContact O-N 3.34Å; E29-K32 WeakPolarHBondContact O-CB 3.03Å; E29-K32 PolarHBondContact O-N 3.06Å; E29-R33 WeakPolarHBondContact O-CG 3.14Å; E29-R33 PolarHBondContact O-N 3.04Å; E29-R33 VanDerWaalsContact O-N 3.17Å
30	A	97.6	Very high	92.8	Very high	2 Å²	2	54 Å²	54	2%	0.017	27%	0.271	C	S	.	.	H	α-helix	trans	-62.3	-42.2	175.8	0	0	0	0	0	111.6	H26 L27 R33 L81 N84 L85	H26-A30 WeakPolarHBondContact O-CB 3.44Å; H26-A30 PolarHBondContact O-N 2.65Å; L27-A30 PolarHBondContact O-N 3.24Å; A30-R33 PolarHBondContact O-N 3.26Å; A30-L81 HydrophobicContact CB-CD2 4.18Å; A30-N84 HydrophobicContact CB-CB 3.86Å; A30-L85 HydrophobicContact CB-CD1 4.44Å; A30-L85 HydrophobicContact CB-CD2 3.89Å; A30-L85 HydrophobicContact CB-CG 3.84Å
31	I	97.8	Very high	94.7	Very high	4 Å²	4	52.7 Å²	52.7	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-64.2	-42.6	176.1	-64.6	160.4	0	0	0	110.7	L27 E28 E29 R33 L34 P36 V40 L42 F61 L63 L81	L27-I31 WeakPolarHBondContact O-CD1 3.15Å; L27-I31 VanDerWaalsContact O-CG1 3.23Å; L27-I31 WeakPolarHBondContact O-CG1 3.39Å; L27-I31 PolarHBondContact O-N 3.02Å; E28-I31 PolarHBondContact O-N 3.33Å; E29-I31 VanDerWaalsContact C-N 3.34Å; E29-I31 PolarHBondContact O-N 3.34Å; I31-R33 PolarHBondContact O-N 3.29Å; I31-L34 VanDerWaalsContact O-CB 3.28Å; I31-L34 WeakPolarHBondContact O-CB 3.41Å; I31-L34 PolarHBondContact O-N 3.02Å; I31-P36 WeakPolarHBondContact O-CD 3.32Å; I31-V40 HydrophobicContact CB-CG1 3.9Å; I31-V40 HydrophobicContact CB-CG2 4.47Å; I31-V40 HydrophobicContact CD1-CG1 4.49Å; I31-V40 HydrophobicContact CG2-CB 4.4Å; I31-V40 HydrophobicContact CG2-CG1 3.73Å; I31-V40 HydrophobicContact CG2-CG2 3.79Å; I31-L42 HydrophobicContact CD1-CD1 3.86Å; I31-F61 HydrophobicContact CD1-CB 4.3Å; I31-F61 HydrophobicContact CD1-CD1 3.81Å; I31-F61 HydrophobicContact CD1-CD2 3.97Å; I31-F61 HydrophobicContact CD1-CE1 4.06Å; I31-F61 HydrophobicContact CD1-CE2 4.19Å; I31-F61 HydrophobicContact CD1-CG 3.76Å; I31-F61 HydrophobicContact CD1-CZ 4.25Å; I31-F61 HydrophobicContact CG1-CD2 4.25Å; I31-F61 HydrophobicContact CG1-CE1 4.4Å; I31-F61 HydrophobicContact CG1-CE2 4.05Å; I31-F61 HydrophobicContact CG1-CZ 4.13Å; I31-F61 HydrophobicContact CG2-CD2 3.85Å; I31-F61 HydrophobicContact CG2-CE2 3.91Å; I31-L63 HydrophobicContact CG2-CD1 4.23Å; I31-L81 HydrophobicContact CG1-CD2 3.8Å
32	K	97.7	Very high	95.9	Very high	117 Å²	117	50.9 Å²	50.9	51%	0.509	26%	0.26	S	S	.	.	H	α-helix	trans	-56.9	-35.9	175.8	-75.6	169.2	-173.2	168.9	0	112.2	E28 E29 L34 K35 V40	E28-K32 VanDerWaalsContact O-CG 3.25Å; E28-K32 WeakPolarHBondContact O-CG 3.41Å; E28-K32 PolarHBondContact O-N 2.96Å; E29-K32 WeakPolarHBondContact O-CB 3.03Å; E29-K32 PolarHBondContact O-N 3.06Å; K32-L34 PolarHBondContact O-N 3.24Å; K32-K35 WeakPolarHBondContact O-CA 3.5Å; K32-K35 PolarHBondContact O-N 3.05Å; K32-V40 HydrophobicContact CB-CG2 4.4Å; K32-V40 HydrophobicContact CG-CB 3.96Å; K32-V40 HydrophobicContact CG-CG1 4.35Å; K32-V40 HydrophobicContact CG-CG2 3.6Å
33	R	97.6	Very high	96.3	Very high	154 Å²	154	52.6 Å²	52.6	58%	0.581	27%	0.272	S	S	*	.	H	α-helix	trans	-68.6	-16.3	177.8	-68.8	-178.7	-176.2	-169.3	2.9	113.8	E29 A30 I31 K35 N84	E29-R33 WeakPolarHBondContact O-CG 3.14Å; E29-R33 PolarHBondContact O-N 3.04Å; E29-R33 VanDerWaalsContact O-N 3.17Å; A30-R33 PolarHBondContact O-N 3.26Å; I31-R33 PolarHBondContact O-N 3.29Å; R33-K35 PolarHBondContact O-N 2.93Å; R33-N84 WeakPolarHBondContact CB-OD1 3.37Å; R33-N84 WeakPolarHBondContact CD-OD1 3.32Å
34	L	96.7	Very high	96.4	Very high	29 Å²	29	52.2 Å²	52.2	15%	0.152	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-5.9	168.8	-51.4	-176.5	0	0	0	112.9	I31 K32 L63 F72 L77 A80 L81	I31-L34 VanDerWaalsContact O-CB 3.28Å; I31-L34 WeakPolarHBondContact O-CB 3.41Å; I31-L34 PolarHBondContact O-N 3.02Å; K32-L34 PolarHBondContact O-N 3.24Å; L34-L63 HydrophobicContact CB-CD1 4.33Å; L34-L63 HydrophobicContact CD1-CD1 4.33Å; L34-L63 HydrophobicContact CD1-CD2 4.23Å; L34-F72 HydrophobicContact CD1-CE2 4.48Å; L34-L77 HydrophobicContact CD1-CD1 3.58Å; L34-A80 HydrophobicContact CD2-CB 3.72Å; L34-L81 HydrophobicContact CD1-CD2 3.84Å; L34-L81 HydrophobicContact CD1-CG 4.29Å; L34-L81 HydrophobicContact CG-CD2 4.45Å
35	K	96.2	Very high	96.4	Very high	153 Å²	153	51 Å²	51	67%	0.665	26%	0.264	S	S	*	.			trans	55.9	52.7	177.4	-53.7	-179.1	-177	179.2	0	113.7	K32 R33	K32-K35 WeakPolarHBondContact O-CA 3.5Å; K32-K35 PolarHBondContact O-N 3.05Å; R33-K35 PolarHBondContact O-N 2.93Å
36	P	96.3	Very high	96.3	Very high	23 Å²	23	50.5 Å²	50.5	15%	0.149	26%	0.264	C	S	.	.			trans	-61.6	156.2	173.1	25.9	-31.1	0	0	0	111.8	I31 N38 V40 L63 Q64	I31-P36 WeakPolarHBondContact O-CD 3.32Å; P36-N38 WeakPolarHBondContact CB-OD1 3.31Å; P36-V40 HydrophobicContact CG-CG2 3.59Å; P36-L63 HydrophobicContact CB-CD1 3.78Å; P36-L63 HydrophobicContact CG-CD1 4.15Å; P36-Q64 CarbonylContact C-O 3.46Å; P36-Q64 VanDerWaalsContact CA-O 3.24Å; P36-Q64 WeakPolarHBondContact CA-O 3.43Å
37	V	96.3	Very high	96	Very high	81 Å²	81	53.1 Å²	53.1	49%	0.491	27%	0.272	S	S	.	.	S	Bend	trans	-81.8	-31.7	171.1	-62.7	0	0	0	0	112	Q64 K66	V37-Q64 HydrophobicContact CG2-CB 3.32Å; V37-Q64 HydrophobicContact CG2-CG 4.44Å; V37-Q64 PolarHBondContact N-O 2.86Å; V37-K66 HydrophobicContact CG1-CB 4.28Å; V37-K66 HydrophobicContact CG1-CG 3.42Å; V37-K66 VanDerWaalsContact CG1-CG 3.42Å
38	N	95.6	Very high	95.7	Very high	25 Å²	25	51.9 Å²	51.9	13%	0.134	27%	0.266	C	S	.	.	S	Bend	trans	-81.3	155.3	175.9	64.7	-66.3	0	0	0	111.6	P36 V40 D62 Q64	P36-N38 WeakPolarHBondContact CB-OD1 3.31Å; N38-V40 PolarHBondContact O-N 2.95Å; N38-D62 PolarHBondContact ND2-O 3.43Å; N38-Q64 HydrophobicContact CB-CB 4.38Å; N38-Q64 HydrophobicContact CB-CG 4.26Å; N38-Q64 VanDerWaalsContact OD1-CB 3.3Å; N38-Q64 WeakPolarHBondContact OD1-CB 3.28Å; N38-Q64 PolarHBondContact OD1-N 3.29Å
39	P	96.6	Very high	95.3	Very high	117 Å²	117	52.6 Å²	52.6	76%	0.76	27%	0.27	S	S	*	.	P	Polyproline II helix	trans	-58.2	137.5	171.6	-23.4	34.1	0	0	0	111.8	S41	P39-S41 PolarHBondContact O-N 3.49Å
40	V	96.3	Very high	95	Very high	31 Å²	31	51.7 Å²	51.7	19%	0.188	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-75.7	121.2	175.7	176.2	0	0	0	0	109.7	E28 I31 K32 P36 N38	E28-V40 HydrophobicContact CB-CG1 4.09Å; E28-V40 HydrophobicContact CG-CG1 4.19Å; I31-V40 HydrophobicContact CB-CG1 3.9Å; I31-V40 HydrophobicContact CB-CG2 4.47Å; I31-V40 HydrophobicContact CD1-CG1 4.49Å; I31-V40 HydrophobicContact CG2-CB 4.4Å; I31-V40 HydrophobicContact CG2-CG1 3.73Å; I31-V40 HydrophobicContact CG2-CG2 3.79Å; K32-V40 HydrophobicContact CB-CG2 4.4Å; K32-V40 HydrophobicContact CG-CB 3.96Å; K32-V40 HydrophobicContact CG-CG1 4.35Å; K32-V40 HydrophobicContact CG-CG2 3.6Å; P36-V40 HydrophobicContact CG-CG2 3.59Å; N38-V40 PolarHBondContact O-N 2.95Å
41	S	93.9	Very high	94.8	Very high	78 Å²	78	52.3 Å²	52.3	55%	0.545	28%	0.283	S	S	.	.			trans	-138.7	125.1	173.1	-179.3	0	0	0	0	108.7	P39 F61	P39-S41 PolarHBondContact O-N 3.49Å; S41-F61 VanDerWaalsContact O-CB 3.25Å; S41-F61 WeakPolarHBondContact O-CB 3.49Å
42	L	95.8	Very high	94.7	Very high	9 Å²	9	52.2 Å²	52.2	5%	0.047	28%	0.283	C	S	.	.			trans	-115.2	129.5	-179.1	-172.5	71.6	0	0	0	110.4	Q24 L27 E28 I31 V44 A59 F61	Q24-L42 HydrophobicContact CG-CD2 4.28Å; Q24-L42 PolarHBondContact NE2-O 2.9Å; L27-L42 HydrophobicContact CB-CD2 3.51Å; L27-L42 HydrophobicContact CD1-CD2 3.82Å; L27-L42 HydrophobicContact CG-CD2 4.32Å; E28-L42 HydrophobicContact CG-CB 3.77Å; I31-L42 HydrophobicContact CD1-CD1 3.86Å; L42-V44 HydrophobicContact CD2-CG1 4.44Å; L42-A59 HydrophobicContact CD1-CB 3.54Å; L42-A59 HydrophobicContact CD2-CB 4.26Å; L42-A59 HydrophobicContact CG-CB 3.89Å; L42-F61 HydrophobicContact CD1-CB 3.88Å; L42-F61 HydrophobicContact CD1-CD1 3.73Å; L42-F61 HydrophobicContact CD1-CG 4.17Å
43	S	96.3	Very high	94.7	Very high	36 Å²	36	46.9 Å²	46.9	25%	0.252	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	110.3	178.6	-82.8	0	0	0	0	110.8	A59 H60	S43-A59 VanDerWaalsContact O-CA 3.25Å; S43-A59 WeakPolarHBondContact O-CA 3.26Å; S43-H60 WeakPolarHBondContact CB-CE1 3.2Å; S43-H60 WeakPolarHBondContact CB-ND1 3.41Å; S43-H60 PolarHBondContact N-O 3.45Å; S43-H60 PolarHBondContact O-N 2.91Å; S43-H60 PolarHBondContact O-ND1 3.11Å
44	V	96.3	Very high	94.7	Very high	18 Å²	18	41.6 Å²	41.6	11%	0.109	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	148.7	-177.4	-62.4	0	0	0	0	112.8	V10 L42 S58 A59	V10-V44 HydrophobicContact CG1-CB 4.07Å; V10-V44 HydrophobicContact CG1-CG1 3.75Å; V10-V44 HydrophobicContact CG1-CG2 3.93Å; L42-V44 HydrophobicContact CD2-CG1 4.44Å; V44-S58 CarbonylContact C-O 3.58Å; V44-S58 WeakPolarHBondContact CA-O 3.43Å; V44-A59 HydrophobicContact CG1-CB 4.07Å
45	S	95.3	Very high	94.6	Very high	3 Å²	3	45.7 Å²	45.7	2%	0.021	27%	0.271	C	S	.	.	S	Bend	trans	-76.8	-34.6	-179.8	68.8	0	0	0	0	112.8	N57 S58 A104 R111 Y267	S45-N57 PolarHBondContact OG-OD1 3.39Å; S45-S58 WeakPolarHBondContact CB-O 3.5Å; S45-S58 PolarHBondContact N-O 2.98Å; S45-S58 PolarHBondContact OG-N 3.48Å; S45-S58 PolarHBondContact OG-O 3.03Å; S45-A104 WeakPolarHBondContact CB-O 3.24Å; S45-R111 PolarHBondContact O-NH2 3.47Å; S45-Y267 WeakPolarHBondContact CB-OH 3.37Å
46	S	92.3	Very high	94.5	Very high	17 Å²	17	40.6 Å²	40.6	12%	0.119	26%	0.255	C	S	.	.			trans	-139.9	141.2	173.9	-161.8	0	0	0	0	111.9	N57 Y113	S46-N57 PolarHBondContact N-OD1 3.37Å; S46-N57 PolarHBondContact O-ND2 2.84Å; S46-Y113 PolarHBondContact OG-OH 2.83Å
47	R	90.2	Very high	94.6	Very high	88 Å²	88	41.8 Å²	41.8	33%	0.332	26%	0.259	S	S	.	.			trans	-87.1	137.6	167.9	-58.4	-175.7	-48.3	168.8	9.7	108	V11	V11-R47 HydrophobicContact CG2-CB 4.14Å; V11-R47 HydrophobicContact CG2-CG 4.32Å
48	T	91.2	Very high	94.6	Very high	4 Å²	4	39.4 Å²	39.4	3%	0.025	25%	0.246	C	C	.	.			trans	-111.3	149.6	168	61.4	0	0	0	0	109.5	G9 V10 V52 L262	G9-T48 CarbonylContact C-O 3.58Å; G9-T48 WeakPolarHBondContact CA-O 3.48Å; V10-T48 HydrophobicContact CG2-CG2 4.37Å; V10-T48 WeakPolarHBondContact CG2-OG1 3.27Å; V10-T48 PolarHBondContact N-O 3.19Å; V10-T48 PolarHBondContact N-OG1 3.01Å; T48-V52 HydrophobicContact CG2-CG1 4Å; T48-L262 HydrophobicContact CG2-CB 4.41Å
49	D	89.2	Confident	94.6	Very high	33 Å²	33	40.2 Å²	40.2	18%	0.176	26%	0.257	C	S	.	.			trans	-78.6	166.3	176.9	-60.6	-20.6	0	0	0	110.8	G9 G51 V52 Y214 K215	G9-D49 VanDerWaalsContact CA-C 3.43Å; G9-D49 VanDerWaalsContact CA-O 3.24Å; G9-D49 WeakPolarHBondContact CA-O 3.24Å; D49-G51 PolarHBondContact O-N 3.2Å; D49-V52 HydrophobicContact CB-CG2 3.98Å; D49-V52 WeakPolarHBondContact O-CB 3.38Å; D49-V52 PolarHBondContact O-N 2.88Å; D49-Y214 WeakPolarHBondContact OD1-CE2 3.18Å; D49-K215 WeakPolarHBondContact OD2-CG 3.49Å
50	A	90.6	Very high	94.7	Very high	64 Å²	64	36.4 Å²	36.4	53%	0.529	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	132	170.7	0	0	0	0	0	111.9	G9 V52 A257	G9-A50 VanDerWaalsContact N-CA 3.3Å; A50-V52 VanDerWaalsContact C-N 3.29Å; A50-V52 PolarHBondContact O-N 3.26Å; A50-A257 WeakPolarHBondContact O-CB 3.13Å
51	G	92.7	Very high	94.7	Very high	14 Å²	14	37.3 Å²	37.3	14%	0.144	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.5	-3.7	-175.3	0	0	0	0	0	115.5	V6 D49 A257 Y258	V6-G51 WeakPolarHBondContact O-CA 3.28Å; D49-G51 PolarHBondContact O-N 3.2Å; G51-A257 CarbonylContact O-C 3.54Å; G51-A257 VanDerWaalsContact O-C 3.25Å; G51-Y258 WeakPolarHBondContact O-CA 3.42Å; G51-Y258 PolarHBondContact O-N 2.84Å
52	V	96.7	Very high	94.8	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.018	23%	0.232	C	C	.	.			trans	-89.4	134.4	176.1	175.4	0	0	0	0	110	T48 D49 A50 A257 L260	T48-V52 HydrophobicContact CG2-CG1 4Å; D49-V52 HydrophobicContact CB-CG2 3.98Å; D49-V52 WeakPolarHBondContact O-CB 3.38Å; D49-V52 PolarHBondContact O-N 2.88Å; A50-V52 VanDerWaalsContact C-N 3.29Å; A50-V52 PolarHBondContact O-N 3.26Å; V52-A257 HydrophobicContact CG2-CB 3.84Å; V52-L260 HydrophobicContact CG1-CB 4.06Å; V52-L260 HydrophobicContact CG1-CD2 3.91Å; V52-L260 HydrophobicContact CG1-CG 3.86Å; V52-L260 HydrophobicContact CG2-CB 4.32Å; V52-L260 HydrophobicContact CG2-CD2 4.08Å
53	H	96.9	Very high	94.8	Very high	4 Å²	4	40.2 Å²	40.2	2%	0.019	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	168.8	-178.1	-52.8	-63.2	0	0	0	112.2	V4 V6 N133 Y258 L260 F261 L262	V4-H53 PolarHBondContact O-CE1 3.32Å; V4-H53 PolarHBondContact O-ND1 3.19Å; V6-H53 PolarHBondContact N-ND1 3.07Å; H53-N133 PolarHBondContact NE2-O 3.08Å; H53-Y258 PolarHBondContact CD2-O 3.06Å; H53-Y258 VanDerWaalsContact CD2-O 3.25Å; H53-Y258 PolarHBondContact NE2-O 3.12Å; H53-Y258 VanDerWaalsContact NE2-O 3.11Å; H53-L260 PolarHBondContact N-O 3.2Å; H53-F261 HydrophobicContact CB-CD1 3.36Å; H53-F261 HydrophobicContact CB-CE1 3.42Å; H53-F261 VanDerWaalsContact CB-CE1 3.42Å; H53-F261 HydrophobicContact CB-CG 4.03Å; H53-F261 HydrophobicContact CB-CZ 4.14Å; H53-F261 AromaticContact CD2-CE1 3.6Å; H53-F261 AromaticContact CD2-CE2 3.95Å; H53-F261 AromaticContact CD2-CZ 3.42Å; H53-F261 VanDerWaalsContact CD2-CZ 3.42Å; H53-F261 WeakPolarHBondContact CD2-CZ 3.48Å; H53-F261 AromaticContact CG-CE1 3.69Å; H53-F261 WeakPolarHBondContact O-CA 3.43Å; H53-L262 PolarHBondContact O-N 2.95Å
54	A	97.1	Very high	94.7	Very high	44 Å²	44	44 Å²	44	36%	0.364	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	128.6	169.7	0	0	0	0	0	110.2	N57 L262	A54-N57 HydrophobicContact CB-CB 4.13Å; A54-L262 CarbonylContact C-O 3.56Å; A54-L262 WeakPolarHBondContact CA-O 3.32Å; A54-L262 HydrophobicContact CB-CB 4.03Å
55	L	95.8	Very high	94.7	Very high	115 Å²	115	46.6 Å²	46.6	60%	0.602	26%	0.261	S	S	*	.	S	Bend	trans	-83.1	-34.9	165.8	-59.9	175.3	0	0	0	110.3	F261 L262 K263	L55-F261 HydrophobicContact CD2-CD1 4.15Å; L55-F261 HydrophobicContact CG-CB 4.38Å; L55-F261 HydrophobicContact CG-CD1 4.13Å; L55-L262 PolarHBondContact N-O 3.15Å; L55-K263 HydrophobicContact CD1-CB 4.5Å; L55-K263 HydrophobicContact CD1-CG 4.3Å
56	S	94.2	Very high	94.5	Very high	46 Å²	46	52.2 Å²	52.2	32%	0.322	29%	0.285	S	S	.	.			trans	-147.5	108.9	175.7	-175.4	0	0	0	0	110	L262 K263	S56-L262 PolarHBondContact N-O 3.39Å; S56-L262 WeakPolarHBondContact O-CD2 3.47Å; S56-L262 VanDerWaalsContact O-CG 3.31Å; S56-L262 WeakPolarHBondContact O-CG 3.43Å; S56-K263 VanDerWaalsContact CB-O 3.29Å; S56-K263 WeakPolarHBondContact CB-O 3.45Å
57	N	96.7	Very high	94.5	Very high	47 Å²	47	58.2 Å²	58.2	25%	0.251	32%	0.316	S	S	.	.			trans	-116.5	150.2	163.2	-158.6	-9.2	0	0	0	107.2	S45 S46 A54 L262	S45-N57 PolarHBondContact OG-OD1 3.39Å; S46-N57 PolarHBondContact N-OD1 3.37Å; S46-N57 PolarHBondContact O-ND2 2.84Å; A54-N57 HydrophobicContact CB-CB 4.13Å; N57-L262 HydrophobicContact CB-CD2 3.81Å
58	S	96.5	Very high	94.2	Very high	31 Å²	31	61.8 Å²	61.8	22%	0.217	34%	0.342	C	S	.	.			trans	-115.6	151.6	178.4	-29	0	0	0	0	109.5	V44 S45 Y267	V44-S58 CarbonylContact C-O 3.58Å; V44-S58 WeakPolarHBondContact CA-O 3.43Å; S45-S58 WeakPolarHBondContact CB-O 3.5Å; S45-S58 PolarHBondContact N-O 2.98Å; S45-S58 PolarHBondContact OG-N 3.48Å; S45-S58 PolarHBondContact OG-O 3.03Å; S58-Y267 WeakPolarHBondContact CB-OH 3.2Å; S58-Y267 WeakPolarHBondContact OG-CE2 3.33Å; S58-Y267 PolarHBondContact OG-OH 3.35Å; S58-Y267 VanDerWaalsContact OG-OH 3.12Å
59	A	97.1	Very high	94.2	Very high	43 Å²	43	67 Å²	67	36%	0.355	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	155.8	170.7	0	0	0	0	0	109.4	L42 S43 V44	L42-A59 HydrophobicContact CD1-CB 3.54Å; L42-A59 HydrophobicContact CD2-CB 4.26Å; L42-A59 HydrophobicContact CG-CB 3.89Å; S43-A59 VanDerWaalsContact O-CA 3.25Å; S43-A59 WeakPolarHBondContact O-CA 3.26Å; V44-A59 HydrophobicContact CG1-CB 4.07Å
60	H	97.4	Very high	94.3	Very high	37 Å²	37	70 Å²	70	17%	0.171	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	150.8	169.1	73.5	-77.2	0	0	0	109.7	S43 F102 H103 A104	S43-H60 WeakPolarHBondContact CB-CE1 3.2Å; S43-H60 WeakPolarHBondContact CB-ND1 3.41Å; S43-H60 PolarHBondContact N-O 3.45Å; S43-H60 PolarHBondContact O-N 2.91Å; S43-H60 PolarHBondContact O-ND1 3.11Å; H60-F102 HydrophobicContact CB-CD1 4.1Å; H60-F102 HydrophobicContact CB-CE1 4.15Å; H60-H103 AromaticContact CE1-CD2 3.51Å; H60-H103 AromaticContact CE1-CE1 3.84Å; H60-H103 AromaticContact CE1-CG 3.52Å; H60-H103 AromaticContact CE1-ND1 3.73Å; H60-H103 AromaticContact CE1-NE2 3.74Å; H60-H103 AromaticContact NE2-CD2 3.83Å; H60-A104 HydrophobicContact CB-CB 4.4Å; H60-A104 WeakPolarHBondContact ND1-CB 3.25Å; H60-A104 PolarHBondContact ND1-N 3.29Å; H60-A104 VanDerWaalsContact ND1-N 3.12Å
61	F	97.4	Very high	94.4	Very high	49 Å²	49	70 Å²	70	22%	0.215	38%	0.38	C	S	.	.			trans	-156.3	153	176.4	63.6	-82.7	0	0	0	109.1	I31 S41 L42 L63 L77 L81	I31-F61 HydrophobicContact CD1-CB 4.3Å; I31-F61 HydrophobicContact CD1-CD1 3.81Å; I31-F61 HydrophobicContact CD1-CD2 3.97Å; I31-F61 HydrophobicContact CD1-CE1 4.06Å; I31-F61 HydrophobicContact CD1-CE2 4.19Å; I31-F61 HydrophobicContact CD1-CG 3.76Å; I31-F61 HydrophobicContact CD1-CZ 4.25Å; I31-F61 HydrophobicContact CG1-CD2 4.25Å; I31-F61 HydrophobicContact CG1-CE1 4.4Å; I31-F61 HydrophobicContact CG1-CE2 4.05Å; I31-F61 HydrophobicContact CG1-CZ 4.13Å; I31-F61 HydrophobicContact CG2-CD2 3.85Å; I31-F61 HydrophobicContact CG2-CE2 3.91Å; S41-F61 VanDerWaalsContact O-CB 3.25Å; S41-F61 WeakPolarHBondContact O-CB 3.49Å; L42-F61 HydrophobicContact CD1-CB 3.88Å; L42-F61 HydrophobicContact CD1-CD1 3.73Å; L42-F61 HydrophobicContact CD1-CG 4.17Å; F61-L63 HydrophobicContact CD2-CB 4.15Å; F61-L63 HydrophobicContact CE2-CB 3.85Å; F61-L63 HydrophobicContact CE2-CD1 4.15Å; F61-L63 HydrophobicContact CE2-CD2 4.35Å; F61-L63 HydrophobicContact CE2-CG 4.34Å; F61-L77 HydrophobicContact CZ-CD1 4.39Å; F61-L77 HydrophobicContact CZ-CD2 4.21Å; F61-L81 HydrophobicContact CZ-CD1 4.32Å
62	D	96.2	Very high	94.4	Very high	111 Å²	111	71.4 Å²	71.4	59%	0.594	38%	0.382	S	S	*	.			trans	-90.4	138.2	174.1	-59.6	-39.1	0	0	0	110.5	N38	N38-D62 PolarHBondContact ND2-O 3.43Å
63	L	95.4	Very high	94.3	Very high	38 Å²	38	75.3 Å²	75.3	20%	0.199	41%	0.406	C	S	.	.			trans	-136.1	98.9	-178.5	-171.3	78.3	0	0	0	111.3	I31 L34 P36 F61 F72 L77	I31-L63 HydrophobicContact CG2-CD1 4.23Å; L34-L63 HydrophobicContact CB-CD1 4.33Å; L34-L63 HydrophobicContact CD1-CD1 4.33Å; L34-L63 HydrophobicContact CD1-CD2 4.23Å; P36-L63 HydrophobicContact CB-CD1 3.78Å; P36-L63 HydrophobicContact CG-CD1 4.15Å; F61-L63 HydrophobicContact CD2-CB 4.15Å; F61-L63 HydrophobicContact CE2-CB 3.85Å; F61-L63 HydrophobicContact CE2-CD1 4.15Å; F61-L63 HydrophobicContact CE2-CD2 4.35Å; F61-L63 HydrophobicContact CE2-CG 4.34Å; L63-F72 HydrophobicContact CD2-CD2 3.63Å; L63-F72 HydrophobicContact CD2-CE2 3.91Å; L63-L77 HydrophobicContact CD2-CD1 4.11Å
64	Q	94.4	Very high	94.2	Very high	116 Å²	116	77.2 Å²	77.2	54%	0.542	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-96	125.7	173.3	-62.1	179.9	-6.7	0	0	109.9	P36 V37 N38	P36-Q64 CarbonylContact C-O 3.46Å; P36-Q64 VanDerWaalsContact CA-O 3.24Å; P36-Q64 WeakPolarHBondContact CA-O 3.43Å; V37-Q64 HydrophobicContact CG2-CB 3.32Å; V37-Q64 HydrophobicContact CG2-CG 4.44Å; V37-Q64 PolarHBondContact N-O 2.86Å; N38-Q64 HydrophobicContact CB-CB 4.38Å; N38-Q64 HydrophobicContact CB-CG 4.26Å; N38-Q64 VanDerWaalsContact OD1-CB 3.3Å; N38-Q64 WeakPolarHBondContact OD1-CB 3.28Å; N38-Q64 PolarHBondContact OD1-N 3.29Å
65	R	94.7	Very high	94.2	Very high	72 Å²	72	80.7 Å²	80.7	27%	0.272	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-92.8	148.9	-179.4	-58.6	-175.4	74.7	-164.3	3.3	110.8	K69 P70 F72	R65-K69 HydrophobicContact CB-CB 3.98Å; R65-P70 WeakPolarHBondContact CD-O 3.49Å; R65-P70 PolarHBondContact NH1-O 3.29Å; R65-F72 HydrophobicContact CG-CE2 4.46Å; R65-F72 VanDerWaalsContact CZ-CE1 3.47Å
66	K	92.3	Very high	94.3	Very high	120 Å²	120	78.3 Å²	78.3	52%	0.522	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-63.4	152.7	174.7	-68.9	-176.3	178.8	-166.5	0	112.2	V37 D68 K69	V37-K66 HydrophobicContact CG1-CB 4.28Å; V37-K66 HydrophobicContact CG1-CG 3.42Å; V37-K66 VanDerWaalsContact CG1-CG 3.42Å; K66-D68 VanDerWaalsContact C-N 3.27Å; K66-D68 PolarHBondContact O-N 3.18Å; K66-K69 WeakPolarHBondContact O-CG 3.41Å; K66-K69 PolarHBondContact O-N 2.89Å
67	N	91	Very high	94.4	Very high	143 Å²	143	77.4 Å²	77.4	77%	0.765	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	54.9	39.1	173.1	-51.7	-6.3	0	0	0	113	K69	N67-K69 PolarHBondContact O-N 3.3Å
68	D	84.2	Confident	94.5	Very high	163 Å²	163	76.1 Å²	76.1	87%	0.872	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	51.9	28.4	178.1	-52.2	-43.4	0	0	0	114.5	K66	K66-D68 VanDerWaalsContact C-N 3.27Å; K66-D68 PolarHBondContact O-N 3.18Å
69	K	91.9	Very high	94.6	Very high	114 Å²	114	81.1 Å²	81.1	50%	0.496	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-60.7	139.9	176.5	-74.8	-179.5	-178	-172.9	0	109.7	R65 K66 N67	R65-K69 HydrophobicContact CB-CB 3.98Å; K66-K69 WeakPolarHBondContact O-CG 3.41Å; K66-K69 PolarHBondContact O-N 2.89Å; N67-K69 PolarHBondContact O-N 3.3Å
70	P	92.2	Very high	94.6	Very high	96 Å²	96	80.3 Å²	80.3	62%	0.623	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-58.8	145.8	177.8	26	-35	0	0	0	109.8	R65	R65-P70 WeakPolarHBondContact CD-O 3.49Å; R65-P70 PolarHBondContact NH1-O 3.29Å
71	P	91.5	Very high	94.7	Very high	64 Å²	64	78.9 Å²	78.9	42%	0.416	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-62.4	152.3	178.9	-10.5	21.3	0	0	0	110.4	R97	P71-R97 VanDerWaalsContact CD-NH2 3.33Å; P71-R97 VanDerWaalsContact CG-CZ 3.49Å; P71-R97 PolarHBondContact O-NH2 3.18Å
72	F	93.5	Very high	94.7	Very high	44 Å²	44	78.2 Å²	78.2	19%	0.193	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-56.2	147.9	179.8	-65.9	-70.6	0	0	0	111.3	L34 L63 R65 V76 L77	L34-F72 HydrophobicContact CD1-CE2 4.48Å; L63-F72 HydrophobicContact CD2-CD2 3.63Å; L63-F72 HydrophobicContact CD2-CE2 3.91Å; R65-F72 HydrophobicContact CG-CE2 4.46Å; R65-F72 VanDerWaalsContact CZ-CE1 3.47Å; F72-V76 HydrophobicContact CD1-CB 4.45Å; F72-V76 HydrophobicContact CD1-CG1 3.57Å; F72-V76 HydrophobicContact CE1-CG1 4.13Å; F72-V76 HydrophobicContact CG-CG1 4.4Å; F72-L77 HydrophobicContact CB-CB 3.96Å; F72-L77 HydrophobicContact CD2-CD1 4.16Å
73	T	94.6	Very high	94.8	Very high	85 Å²	85	79.3 Å²	79.3	52%	0.521	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-66	159.7	161.4	61.4	0	0	0	0	109	D75 V76 L77	T73-D75 VanDerWaalsContact C-N 3.34Å; T73-D75 PolarHBondContact O-N 3.31Å; T73-V76 PolarHBondContact O-N 2.91Å; T73-V76 WeakPolarHBondContact OG1-CB 3.43Å; T73-V76 VanDerWaalsContact OG1-CG2 3.24Å; T73-V76 WeakPolarHBondContact OG1-CG2 2.99Å; T73-V76 PolarHBondContact OG1-N 3.47Å; T73-L77 WeakPolarHBondContact O-CB 3.44Å; T73-L77 PolarHBondContact O-N 3.32Å
74	A	94.6	Very high	94.9	Very high	43 Å²	43	79.2 Å²	79.2	36%	0.355	42%	0.415	S	S	.	.	H	α-helix	trans	-52.8	-51.5	178.8	0	0	0	0	0	111.8	V76 L77 V78 A95	A74-V76 PolarHBondContact O-N 3.23Å; A74-L77 PolarHBondContact O-N 3.26Å; A74-V78 WeakPolarHBondContact O-CG2 3.45Å; A74-V78 PolarHBondContact O-N 2.86Å; A74-A95 WeakPolarHBondContact CB-O 3.33Å
75	D	96.6	Very high	95	Very high	118 Å²	118	73.8 Å²	73.8	63%	0.631	39%	0.39	S	S	*	.	H	α-helix	trans	-63.5	-45.2	-176	-57	-33.1	0	0	0	112.2	T73 L77 V78 E79	T73-D75 VanDerWaalsContact C-N 3.34Å; T73-D75 PolarHBondContact O-N 3.31Å; D75-L77 VanDerWaalsContact C-N 3.3Å; D75-L77 PolarHBondContact O-N 2.71Å; D75-V78 PolarHBondContact O-N 3.38Å; D75-E79 WeakPolarHBondContact O-CG 3.32Å; D75-E79 PolarHBondContact O-N 3.39Å
76	V	97.3	Very high	95	Very high	65 Å²	65	75.8 Å²	75.8	39%	0.394	40%	0.4	S	S	.	.	H	α-helix	trans	-63.7	-37.9	178.5	174.3	0	0	0	0	111.1	F72 T73 A74 A80	F72-V76 HydrophobicContact CD1-CB 4.45Å; F72-V76 HydrophobicContact CD1-CG1 3.57Å; F72-V76 HydrophobicContact CE1-CG1 4.13Å; F72-V76 HydrophobicContact CG-CG1 4.4Å; T73-V76 PolarHBondContact O-N 2.91Å; T73-V76 WeakPolarHBondContact OG1-CB 3.43Å; T73-V76 VanDerWaalsContact OG1-CG2 3.24Å; T73-V76 WeakPolarHBondContact OG1-CG2 2.99Å; T73-V76 PolarHBondContact OG1-N 3.47Å; A74-V76 PolarHBondContact O-N 3.23Å; V76-A80 WeakPolarHBondContact O-CB 3.49Å; V76-A80 PolarHBondContact O-N 2.79Å
77	L	97.4	Very high	95.1	Very high	26 Å²	26	77.1 Å²	77.1	14%	0.136	41%	0.409	C	S	.	.	H	α-helix	trans	-65.8	-44.2	176.2	-177.8	58.9	0	0	0	111.3	L34 F61 L63 F72 T73 A74 D75 A80 L81 A95	L34-L77 HydrophobicContact CD1-CD1 3.58Å; F61-L77 HydrophobicContact CZ-CD1 4.39Å; F61-L77 HydrophobicContact CZ-CD2 4.21Å; L63-L77 HydrophobicContact CD2-CD1 4.11Å; F72-L77 HydrophobicContact CB-CB 3.96Å; F72-L77 HydrophobicContact CD2-CD1 4.16Å; T73-L77 WeakPolarHBondContact O-CB 3.44Å; T73-L77 PolarHBondContact O-N 3.32Å; A74-L77 PolarHBondContact O-N 3.26Å; D75-L77 VanDerWaalsContact C-N 3.3Å; D75-L77 PolarHBondContact O-N 2.71Å; L77-A80 PolarHBondContact O-N 2.9Å; L77-L81 HydrophobicContact CD1-CD1 3.97Å; L77-L81 HydrophobicContact CD1-CG 4.11Å; L77-L81 HydrophobicContact CG-CD1 3.97Å; L77-L81 HydrophobicContact CG-CG 4.49Å; L77-L81 WeakPolarHBondContact O-CB 3.37Å; L77-L81 VanDerWaalsContact O-CG 3.27Å; L77-L81 WeakPolarHBondContact O-CG 3.21Å; L77-L81 PolarHBondContact O-N 2.85Å; L77-A95 HydrophobicContact CD2-CB 4.07Å; L77-A95 HydrophobicContact CG-CB 4.48Å
78	V	98.2	Very high	95.3	Very high	21 Å²	21	73.4 Å²	73.4	13%	0.127	39%	0.387	C	S	.	.	H	α-helix	trans	-60.4	-49.5	177.1	170.7	0	0	0	0	110.8	A74 D75 A80 L81 N82 V92 A95	A74-V78 WeakPolarHBondContact O-CG2 3.45Å; A74-V78 PolarHBondContact O-N 2.86Å; D75-V78 PolarHBondContact O-N 3.38Å; V78-A80 PolarHBondContact O-N 3.46Å; V78-L81 PolarHBondContact O-N 3.34Å; V78-N82 WeakPolarHBondContact CG1-ND2 3.38Å; V78-N82 WeakPolarHBondContact O-CB 3.34Å; V78-N82 PolarHBondContact O-N 3.03Å; V78-N82 PolarHBondContact O-ND2 2.89Å; V78-V92 WeakPolarHBondContact CG1-O 3.33Å; V78-V92 HydrophobicContact CG2-CG1 4.07Å; V78-A95 HydrophobicContact CG2-CB 3.76Å
79	E	98.3	Very high	95.7	Very high	136 Å²	136	71 Å²	71	64%	0.636	37%	0.37	S	S	*	.	H	α-helix	trans	-59.9	-47.4	177.7	-73.9	-179.4	-177.5	0	0	111.9	D75 L81 N82 F83	D75-E79 WeakPolarHBondContact O-CG 3.32Å; D75-E79 PolarHBondContact O-N 3.39Å; E79-L81 PolarHBondContact O-N 3.46Å; E79-N82 PolarHBondContact O-N 3.45Å; E79-F83 WeakPolarHBondContact O-CB 3.5Å; E79-F83 PolarHBondContact O-N 2.88Å
80	A	98.1	Very high	95.9	Very high	26 Å²	26	66.7 Å²	66.7	22%	0.215	35%	0.352	C	S	.	.	H	α-helix	trans	-64.6	-41.4	-178.9	0	0	0	0	0	112.2	L34 V76 L77 V78 N84	L34-A80 HydrophobicContact CD2-CB 3.72Å; V76-A80 WeakPolarHBondContact O-CB 3.49Å; V76-A80 PolarHBondContact O-N 2.79Å; L77-A80 PolarHBondContact O-N 2.9Å; V78-A80 PolarHBondContact O-N 3.46Å; A80-N84 PolarHBondContact O-N 3.3Å; A80-N84 PolarHBondContact O-ND2 3.3Å
81	L	98.2	Very high	96.1	Very high	7 Å²	7	68.8 Å²	68.8	4%	0.037	35%	0.348	C	S	.	.	H	α-helix	trans	-65.1	-47.2	175.2	-71.5	172	0	0	0	110.8	A30 I31 L34 F61 L77 V78 E79 F83 N84 L85 V92	A30-L81 HydrophobicContact CB-CD2 4.18Å; I31-L81 HydrophobicContact CG1-CD2 3.8Å; L34-L81 HydrophobicContact CD1-CD2 3.84Å; L34-L81 HydrophobicContact CD1-CG 4.29Å; L34-L81 HydrophobicContact CG-CD2 4.45Å; F61-L81 HydrophobicContact CZ-CD1 4.32Å; L77-L81 HydrophobicContact CD1-CD1 3.97Å; L77-L81 HydrophobicContact CD1-CG 4.11Å; L77-L81 HydrophobicContact CG-CD1 3.97Å; L77-L81 HydrophobicContact CG-CG 4.49Å; L77-L81 WeakPolarHBondContact O-CB 3.37Å; L77-L81 VanDerWaalsContact O-CG 3.27Å; L77-L81 WeakPolarHBondContact O-CG 3.21Å; L77-L81 PolarHBondContact O-N 2.85Å; V78-L81 PolarHBondContact O-N 3.34Å; E79-L81 PolarHBondContact O-N 3.46Å; L81-F83 VanDerWaalsContact C-N 3.35Å; L81-F83 PolarHBondContact O-N 3.38Å; L81-N84 CarbonylContact O-C 3.52Å; L81-N84 PolarHBondContact O-N 3.33Å; L81-N84 VanDerWaalsContact O-N 3.09Å; L81-L85 VanDerWaalsContact O-CG 3.28Å; L81-L85 WeakPolarHBondContact O-CG 3.49Å; L81-L85 PolarHBondContact O-N 2.97Å; L81-V92 HydrophobicContact CB-CG2 3.94Å; L81-V92 HydrophobicContact CD1-CG1 4.47Å; L81-V92 HydrophobicContact CD1-CG2 4.1Å
82	N	98.4	Very high	96.4	Very high	34 Å²	34	67 Å²	67	18%	0.182	34%	0.336	C	S	.	.	H	α-helix	trans	-64.1	-36.7	179.7	-77.6	-31.6	0	0	0	113.1	V78 E79 N84 L85 K86 R91 V92	V78-N82 WeakPolarHBondContact CG1-ND2 3.38Å; V78-N82 WeakPolarHBondContact O-CB 3.34Å; V78-N82 PolarHBondContact O-N 3.03Å; V78-N82 PolarHBondContact O-ND2 2.89Å; E79-N82 PolarHBondContact O-N 3.45Å; N82-N84 VanDerWaalsContact C-N 3.25Å; N82-N84 PolarHBondContact O-N 3.24Å; N82-L85 CarbonylContact O-C 3.56Å; N82-L85 PolarHBondContact O-N 2.86Å; N82-L85 VanDerWaalsContact O-N 3.12Å; N82-K86 PolarHBondContact O-N 2.98Å; N82-R91 WeakPolarHBondContact OD1-CA 3.48Å; N82-V92 PolarHBondContact ND2-O 3.06Å; N82-V92 PolarHBondContact OD1-N 2.85Å
83	F	98.2	Very high	96.6	Very high	135 Å²	135	69.2 Å²	69.2	59%	0.592	35%	0.353	S	S	*	.	H	α-helix	trans	-58.1	-40.7	172.6	177.3	-94.8	0	0	0	111.5	E79 L81 L85 K86	E79-F83 WeakPolarHBondContact O-CB 3.5Å; E79-F83 PolarHBondContact O-N 2.88Å; L81-F83 VanDerWaalsContact C-N 3.35Å; L81-F83 PolarHBondContact O-N 3.38Å; F83-L85 VanDerWaalsContact C-N 3.33Å; F83-K86 WeakPolarHBondContact O-CD 3.28Å; F83-K86 WeakPolarHBondContact O-CG 3.23Å
84	N	97.7	Very high	96.6	Very high	35 Å²	35	71 Å²	71	19%	0.187	36%	0.355	C	S	.	.	H	α-helix	trans	-77.2	-18.5	178.1	-73.7	-67	0	0	0	113.6	A30 R33 A80 L81 N82	A30-N84 HydrophobicContact CB-CB 3.86Å; R33-N84 WeakPolarHBondContact CB-OD1 3.37Å; R33-N84 WeakPolarHBondContact CD-OD1 3.32Å; A80-N84 PolarHBondContact O-N 3.3Å; A80-N84 PolarHBondContact O-ND2 3.3Å; L81-N84 CarbonylContact O-C 3.52Å; L81-N84 PolarHBondContact O-N 3.33Å; L81-N84 VanDerWaalsContact O-N 3.09Å; N82-N84 VanDerWaalsContact C-N 3.25Å; N82-N84 PolarHBondContact O-N 3.24Å
85	L	96.9	Very high	96.6	Very high	2 Å²	2	69.8 Å²	69.8	1%	0.01	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	6.8	176.6	-65.6	164.1	0	0	0	113.4	H26 L27 A30 L81 N82 F83 E87 Q88 I90 R91 V92	H26-L85 HydrophobicContact CB-CD2 4.2Å; L27-L85 HydrophobicContact CD2-CD1 3.81Å; L27-L85 HydrophobicContact CD2-CD2 4.36Å; A30-L85 HydrophobicContact CB-CD1 4.44Å; A30-L85 HydrophobicContact CB-CD2 3.89Å; A30-L85 HydrophobicContact CB-CG 3.84Å; L81-L85 VanDerWaalsContact O-CG 3.28Å; L81-L85 WeakPolarHBondContact O-CG 3.49Å; L81-L85 PolarHBondContact O-N 2.97Å; N82-L85 CarbonylContact O-C 3.56Å; N82-L85 PolarHBondContact O-N 2.86Å; N82-L85 VanDerWaalsContact O-N 3.12Å; F83-L85 VanDerWaalsContact C-N 3.33Å; L85-E87 VanDerWaalsContact C-N 3.27Å; L85-E87 PolarHBondContact O-N 3.28Å; L85-E87 VanDerWaalsContact O-N 3.14Å; L85-Q88 WeakPolarHBondContact O-CA 3.34Å; L85-Q88 WeakPolarHBondContact O-CB 3.37Å; L85-Q88 PolarHBondContact O-N 2.91Å; L85-I90 HydrophobicContact CD1-CG2 4.2Å; L85-I90 HydrophobicContact CD2-CB 4.45Å; L85-I90 HydrophobicContact CD2-CG2 4.47Å; L85-R91 PolarHBondContact O-NH1 3.15Å; L85-R91 VanDerWaalsContact O-NH1 3.11Å; L85-V92 HydrophobicContact CD1-CG2 4.01Å
86	K	95.1	Very high	96.4	Very high	114 Å²	114	72 Å²	72	50%	0.496	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-37.1	-168.7	65.7	-176.2	-178.8	176.7	0	114.8	N82 F83 Q88 R91	N82-K86 PolarHBondContact O-N 2.98Å; F83-K86 WeakPolarHBondContact O-CD 3.28Å; F83-K86 WeakPolarHBondContact O-CG 3.23Å; K86-Q88 VanDerWaalsContact C-N 3.28Å; K86-Q88 PolarHBondContact O-N 3.08Å; K86-R91 PolarHBondContact O-NH2 3.03Å
87	E	93.7	Very high	96.3	Very high	149 Å²	149	74 Å²	74	70%	0.696	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-12.7	178.2	-52.2	-54.9	152.8	0	0	113.1	L85	L85-E87 VanDerWaalsContact C-N 3.27Å; L85-E87 PolarHBondContact O-N 3.28Å; L85-E87 VanDerWaalsContact O-N 3.14Å
88	Q	93.9	Very high	96.1	Very high	65 Å²	65	74.6 Å²	74.6	30%	0.304	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	153.3	-177.6	-50.4	-50.4	-34.1	0	0	110.7	H26 L85 K86 I90 R91	H26-Q88 HydrophobicContact CB-CG 4.37Å; H26-Q88 PolarHBondContact NE2-OE1 3.27Å; L85-Q88 WeakPolarHBondContact O-CA 3.34Å; L85-Q88 WeakPolarHBondContact O-CB 3.37Å; L85-Q88 PolarHBondContact O-N 2.91Å; K86-Q88 VanDerWaalsContact C-N 3.28Å; K86-Q88 PolarHBondContact O-N 3.08Å; Q88-I90 HydrophobicContact CB-CB 4.33Å; Q88-I90 HydrophobicContact CB-CD1 4.11Å; Q88-I90 HydrophobicContact CB-CG1 4.25Å; Q88-I90 PolarHBondContact O-N 3.38Å; Q88-R91 PolarHBondContact O-NH1 3.23Å
89	Q	92.7	Very high	96	Very high	111 Å²	111	75 Å²	75	52%	0.519	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	44.7	172	-53.1	-166	21.4	0	0	111.9	V4 V5	V4-Q89 HydrophobicContact CG1-CB 4.03Å; V4-Q89 WeakPolarHBondContact CG1-O 3.25Å; V5-Q89 PolarHBondContact O-OE1 2.87Å
90	I	96	Very high	95.7	Very high	25 Å²	25	76.4 Å²	76.4	13%	0.128	37%	0.366	C	S	.	.			trans	-129.8	130.1	-175.9	-57.9	164	0	0	0	107.9	V23 H26 L27 L85 Q88	V23-I90 HydrophobicContact CB-CD1 4.2Å; V23-I90 HydrophobicContact CG1-CD1 3.91Å; V23-I90 HydrophobicContact CG1-CG1 4.21Å; V23-I90 HydrophobicContact CG1-CG2 4.37Å; V23-I90 HydrophobicContact CG2-CD1 4.21Å; V23-I90 HydrophobicContact CG2-CG1 4.44Å; H26-I90 HydrophobicContact CB-CD1 3.7Å; L27-I90 HydrophobicContact CD2-CG2 3.94Å; L27-I90 HydrophobicContact CG-CG2 4.37Å; L85-I90 HydrophobicContact CD1-CG2 4.2Å; L85-I90 HydrophobicContact CD2-CB 4.45Å; L85-I90 HydrophobicContact CD2-CG2 4.47Å; Q88-I90 HydrophobicContact CB-CB 4.33Å; Q88-I90 HydrophobicContact CB-CD1 4.11Å; Q88-I90 HydrophobicContact CB-CG1 4.25Å; Q88-I90 PolarHBondContact O-N 3.38Å
91	R	97.3	Very high	95.4	Very high	139 Å²	139	80.1 Å²	80.1	53%	0.525	38%	0.382	S	S	.	.			trans	-131.9	129	176.8	-63.4	-66.2	177	-95.9	1.8	110.3	N82 L85 K86 Q88	N82-R91 WeakPolarHBondContact OD1-CA 3.48Å; L85-R91 PolarHBondContact O-NH1 3.15Å; L85-R91 VanDerWaalsContact O-NH1 3.11Å; K86-R91 PolarHBondContact O-NH2 3.03Å; Q88-R91 PolarHBondContact O-NH1 3.23Å
92	V	97.8	Very high	95.3	Very high	27 Å²	27	80.7 Å²	80.7	16%	0.164	38%	0.384	C	S	.	.			trans	-78.9	122.7	165.5	-176.6	0	0	0	0	106.7	L27 V78 L81 N82 L85	L27-V92 HydrophobicContact CD2-CG2 4.33Å; V78-V92 WeakPolarHBondContact CG1-O 3.33Å; V78-V92 HydrophobicContact CG2-CG1 4.07Å; L81-V92 HydrophobicContact CB-CG2 3.94Å; L81-V92 HydrophobicContact CD1-CG1 4.47Å; L81-V92 HydrophobicContact CD1-CG2 4.1Å; N82-V92 PolarHBondContact ND2-O 3.06Å; N82-V92 PolarHBondContact OD1-N 2.85Å; L85-V92 HydrophobicContact CD1-CG2 4.01Å
93	T	96.9	Very high	95.2	Very high	91 Å²	91	81.5 Å²	81.5	56%	0.558	39%	0.387	S	S	*	.			trans	-96.4	-33.1	-177.4	57	0	0	0	0	112.2
94	H	95.3	Very high	95.2	Very high	121 Å²	121	75 Å²	75	56%	0.56	36%	0.359	S	S	*	.			trans	-149	155.6	-178.2	-58.6	82.1	0	0	0	110.2	Y96	H94-Y96 HydrophobicContact CB-CE2 3.6Å; H94-Y96 WeakPolarHBondContact CB-OH 3.44Å; H94-Y96 PolarHBondContact CD2-OH 3.33Å; H94-Y96 VanDerWaalsContact CD2-OH 3.28Å
95	A	95.8	Very high	95	Very high	18 Å²	18	77.7 Å²	77.7	15%	0.149	37%	0.366	C	S	.	.			trans	-141.4	145.5	170.1	0	0	0	0	0	109.6	A74 L77 V78	A74-A95 WeakPolarHBondContact CB-O 3.33Å; L77-A95 HydrophobicContact CD2-CB 4.07Å; L77-A95 HydrophobicContact CG-CB 4.48Å; V78-A95 HydrophobicContact CG2-CB 3.76Å
96	Y	92.1	Very high	94.9	Very high	164 Å²	164	85.7 Å²	85.7	64%	0.643	40%	0.397	S	S	*	.			trans	-142.4	151.6	177.6	-48.4	-86.2	0	0	0	108.5	H94	H94-Y96 HydrophobicContact CB-CE2 3.6Å; H94-Y96 WeakPolarHBondContact CB-OH 3.44Å; H94-Y96 PolarHBondContact CD2-OH 3.33Å; H94-Y96 VanDerWaalsContact CD2-OH 3.28Å
97	R	93.8	Very high	95	Very high	107 Å²	107	84.6 Å²	84.6	40%	0.404	39%	0.39	S	S	.	.			trans	-78	143.4	164	-68.4	-167.6	-171.3	170.7	11.3	108.8	P71 F274	P71-R97 VanDerWaalsContact CD-NH2 3.33Å; P71-R97 VanDerWaalsContact CG-CZ 3.49Å; P71-R97 PolarHBondContact O-NH2 3.18Å; R97-F274 HydrophobicContact CB-CB 4Å; R97-F274 HydrophobicContact CB-CD1 4.13Å; R97-F274 HydrophobicContact CB-CD2 4.35Å; R97-F274 HydrophobicContact CB-CG 3.89Å
98	V	94.8	Very high	95.1	Very high	40 Å²	40	77.6 Å²	77.6	24%	0.242	36%	0.358	C	S	.	.			trans	-131.9	158.4	-179.1	-65.8	0	0	0	0	109	F102 L272 F274	V98-F102 HydrophobicContact CB-CB 3.81Å; V98-F102 HydrophobicContact CB-CD1 4.05Å; V98-F102 HydrophobicContact CB-CG 3.88Å; V98-F102 HydrophobicContact CG1-CD1 4.22Å; V98-F102 HydrophobicContact CG1-CE1 4.5Å; V98-F102 HydrophobicContact CG1-CG 4.26Å; V98-F102 HydrophobicContact CG2-CB 3.77Å; V98-F102 HydrophobicContact CG2-CD1 3.66Å; V98-F102 HydrophobicContact CG2-CG 3.9Å; V98-L272 HydrophobicContact CG1-CD2 4.16Å; V98-F274 WeakPolarHBondContact O-CD2 3.26Å
99	P	94.5	Very high	95.3	Very high	30 Å²	30	78.8 Å²	78.8	20%	0.195	36%	0.363	C	S	.	.			trans	-55.1	152.4	172.2	-27.6	37.2	0	0	0	113.3	D101 F102 D271 L273	P99-D101 VanDerWaalsContact CB-OD1 3.24Å; P99-D101 WeakPolarHBondContact CB-OD1 3.47Å; P99-D101 PolarHBondContact O-N 3.4Å; P99-D101 VanDerWaalsContact O-N 3.13Å; P99-F102 WeakPolarHBondContact O-CB 3.14Å; P99-F102 PolarHBondContact O-N 3.26Å; P99-D271 WeakPolarHBondContact CD-O 3.37Å; P99-L273 WeakPolarHBondContact CG-O 3.24Å
100	D	92.4	Very high	95.6	Very high	164 Å²	164	74 Å²	74	88%	0.877	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-20.4	-179.3	-61.2	-19	0	0	0	113.3
101	D	92.8	Very high	95.7	Very high	105 Å²	105	73.7 Å²	73.7	56%	0.561	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	5.2	176.6	77.8	-41.1	0	0	0	113.4	P99 R107	P99-D101 VanDerWaalsContact CB-OD1 3.24Å; P99-D101 WeakPolarHBondContact CB-OD1 3.47Å; P99-D101 PolarHBondContact O-N 3.4Å; P99-D101 VanDerWaalsContact O-N 3.13Å; D101-R107 IonicContact OD2-CZ 3.92Å; D101-R107 IonicContact OD2-NH2 2.81Å; D101-R107 PolarHBondContact OD2-NH2 2.98Å
102	F	95.8	Very high	95.8	Very high	18 Å²	18	67.8 Å²	67.8	8%	0.079	32%	0.318	C	S	.	.			trans	-69.9	136.5	174.1	178.3	-97.4	0	0	0	110.8	H60 V98 P99 A104 R107 Y267 D271 L272	H60-F102 HydrophobicContact CB-CD1 4.1Å; H60-F102 HydrophobicContact CB-CE1 4.15Å; V98-F102 HydrophobicContact CB-CB 3.81Å; V98-F102 HydrophobicContact CB-CD1 4.05Å; V98-F102 HydrophobicContact CB-CG 3.88Å; V98-F102 HydrophobicContact CG1-CD1 4.22Å; V98-F102 HydrophobicContact CG1-CE1 4.5Å; V98-F102 HydrophobicContact CG1-CG 4.26Å; V98-F102 HydrophobicContact CG2-CB 3.77Å; V98-F102 HydrophobicContact CG2-CD1 3.66Å; V98-F102 HydrophobicContact CG2-CG 3.9Å; P99-F102 WeakPolarHBondContact O-CB 3.14Å; P99-F102 PolarHBondContact O-N 3.26Å; F102-A104 HydrophobicContact CE1-CB 3.97Å; F102-A104 HydrophobicContact CZ-CB 4.4Å; F102-R107 HydrophobicContact CD2-CB 4.15Å; F102-R107 HydrophobicContact CD2-CG 4.04Å; F102-R107 HydrophobicContact CE2-CB 3.93Å; F102-R107 HydrophobicContact CE2-CG 4.33Å; F102-Y267 AromaticContact CE2-CD1 3.73Å; F102-Y267 HydrophobicContact CE2-CD1 3.73Å; F102-Y267 AromaticContact CE2-CE1 3.94Å; F102-Y267 HydrophobicContact CE2-CE1 3.94Å; F102-Y267 HydrophobicContact CE2-CG 4.4Å; F102-Y267 AromaticContact CZ-CD1 3.87Å; F102-Y267 HydrophobicContact CZ-CD1 3.87Å; F102-Y267 AromaticContact CZ-CE1 3.62Å; F102-Y267 HydrophobicContact CZ-CE1 3.62Å; F102-D271 HydrophobicContact CD2-CB 4.28Å; F102-D271 VanDerWaalsContact CD2-O 3.3Å; F102-D271 WeakPolarHBondContact CD2-O 3.19Å; F102-D271 HydrophobicContact CE2-CB 4.47Å; F102-L272 HydrophobicContact CD2-CD2 4.28Å; F102-L272 HydrophobicContact CE2-CD2 3.61Å; F102-L272 HydrophobicContact CZ-CD2 3.95Å
103	H	96.8	Very high	95.8	Very high	51 Å²	51	67.3 Å²	67.3	24%	0.236	31%	0.314	C	S	.	.			trans	-137	111.7	171.9	-168.8	-64.2	0	0	0	111	H60 R105 Y106 R107	H60-H103 AromaticContact CE1-CD2 3.51Å; H60-H103 AromaticContact CE1-CE1 3.84Å; H60-H103 AromaticContact CE1-CG 3.52Å; H60-H103 AromaticContact CE1-ND1 3.73Å; H60-H103 AromaticContact CE1-NE2 3.74Å; H60-H103 AromaticContact NE2-CD2 3.83Å; H103-R105 VanDerWaalsContact CE1-CB 3.5Å; H103-R105 WeakPolarHBondContact CE1-CB 3.4Å; H103-R105 WeakPolarHBondContact ND1-CB 3.49Å; H103-R105 PolarHBondContact ND1-N 2.96Å; H103-R105 VanDerWaalsContact ND1-N 3.19Å; H103-R105 PolarHBondContact O-N 3.18Å; H103-Y106 HydrophobicContact CB-CD2 4.11Å; H103-Y106 AromaticContact CD2-CD2 3.69Å; H103-Y106 AromaticContact CD2-CE2 3.95Å; H103-Y106 AromaticContact CE1-CD2 3.44Å; H103-Y106 VanDerWaalsContact CE1-CD2 3.44Å; H103-Y106 WeakPolarHBondContact CE1-CD2 3.16Å; H103-Y106 AromaticContact CE1-CE2 3.48Å; H103-Y106 VanDerWaalsContact CE1-CE2 3.48Å; H103-Y106 WeakPolarHBondContact CE1-CE2 3.5Å; H103-Y106 AromaticContact CG-CD2 3.42Å; H103-Y106 VanDerWaalsContact CG-CD2 3.42Å; H103-Y106 AromaticContact ND1-CD2 3.26Å; H103-Y106 VanDerWaalsContact ND1-CD2 3.26Å; H103-Y106 WeakPolarHBondContact ND1-CD2 3.41Å; H103-Y106 AromaticContact ND1-CE2 3.83Å; H103-Y106 AromaticContact ND1-CG 3.92Å; H103-Y106 PolarHBondContact ND1-N 3.32Å; H103-Y106 AromaticContact NE2-CD2 3.69Å; H103-Y106 AromaticContact NE2-CE2 3.54Å; H103-Y106 PolarHBondContact O-N 2.96Å; H103-R107 WeakPolarHBondContact O-CB 3.3Å; H103-R107 PolarHBondContact O-N 3.39Å
104	A	96.5	Very high	95.9	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.5	-37.4	-175.4	0	0	0	0	0	113.7	S45 H60 F102 Y267	S45-A104 WeakPolarHBondContact CB-O 3.24Å; H60-A104 HydrophobicContact CB-CB 4.4Å; H60-A104 WeakPolarHBondContact ND1-CB 3.25Å; H60-A104 PolarHBondContact ND1-N 3.29Å; H60-A104 VanDerWaalsContact ND1-N 3.12Å; F102-A104 HydrophobicContact CE1-CB 3.97Å; F102-A104 HydrophobicContact CZ-CB 4.4Å; A104-Y267 VanDerWaalsContact O-CE1 3.25Å; A104-Y267 WeakPolarHBondContact O-CE1 3.44Å; A104-Y267 PolarHBondContact O-OH 2.85Å
105	R	95.3	Very high	96.1	Very high	90 Å²	90	57.5 Å²	57.5	34%	0.34	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-48.6	175.3	-167.2	-174.8	-176.2	149.7	15.4	114.5	H103 R111	H103-R105 VanDerWaalsContact CE1-CB 3.5Å; H103-R105 WeakPolarHBondContact CE1-CB 3.4Å; H103-R105 WeakPolarHBondContact ND1-CB 3.49Å; H103-R105 PolarHBondContact ND1-N 2.96Å; H103-R105 VanDerWaalsContact ND1-N 3.19Å; H103-R105 PolarHBondContact O-N 3.18Å; R105-R111 PolarHBondContact O-NH2 2.93Å
106	Y	94.8	Very high	96.2	Very high	171 Å²	171	57.8 Å²	57.8	67%	0.671	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-24.2	-165.3	-61.1	-58	0	0	0	112.5	H103	H103-Y106 HydrophobicContact CB-CD2 4.11Å; H103-Y106 AromaticContact CD2-CD2 3.69Å; H103-Y106 AromaticContact CD2-CE2 3.95Å; H103-Y106 AromaticContact CE1-CD2 3.44Å; H103-Y106 VanDerWaalsContact CE1-CD2 3.44Å; H103-Y106 WeakPolarHBondContact CE1-CD2 3.16Å; H103-Y106 AromaticContact CE1-CE2 3.48Å; H103-Y106 VanDerWaalsContact CE1-CE2 3.48Å; H103-Y106 WeakPolarHBondContact CE1-CE2 3.5Å; H103-Y106 AromaticContact CG-CD2 3.42Å; H103-Y106 VanDerWaalsContact CG-CD2 3.42Å; H103-Y106 AromaticContact ND1-CD2 3.26Å; H103-Y106 VanDerWaalsContact ND1-CD2 3.26Å; H103-Y106 WeakPolarHBondContact ND1-CD2 3.41Å; H103-Y106 AromaticContact ND1-CE2 3.83Å; H103-Y106 AromaticContact ND1-CG 3.92Å; H103-Y106 PolarHBondContact ND1-N 3.32Å; H103-Y106 AromaticContact NE2-CD2 3.69Å; H103-Y106 AromaticContact NE2-CE2 3.54Å; H103-Y106 PolarHBondContact O-N 2.96Å
107	R	96.3	Very high	96.4	Very high	90 Å²	90	50 Å²	50	34%	0.34	23%	0.229	S	C	.	.	S	Bend	trans	-83.6	-14.7	174.6	-65	-66.5	-172.7	160.5	-5.4	114	D101 F102 H103 Q109 Y267 D271	D101-R107 IonicContact OD2-CZ 3.92Å; D101-R107 IonicContact OD2-NH2 2.81Å; D101-R107 PolarHBondContact OD2-NH2 2.98Å; F102-R107 HydrophobicContact CD2-CB 4.15Å; F102-R107 HydrophobicContact CD2-CG 4.04Å; F102-R107 HydrophobicContact CE2-CB 3.93Å; F102-R107 HydrophobicContact CE2-CG 4.33Å; H103-R107 WeakPolarHBondContact O-CB 3.3Å; H103-R107 PolarHBondContact O-N 3.39Å; R107-Q109 PolarHBondContact O-N 3Å; R107-Y267 HydrophobicContact CB-CD1 4.04Å; R107-Y267 HydrophobicContact CB-CE1 4.4Å; R107-D271 IonicContact CZ-OD1 3.59Å; R107-D271 IonicContact NE-OD1 3.85Å; R107-D271 IonicContact NH1-OD1 2.85Å; R107-D271 PolarHBondContact NH1-OD1 2.95Å
108	A	96.9	Very high	96.6	Very high	2 Å²	2	44.9 Å²	44.9	2%	0.017	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	121.7	179.8	0	0	0	0	0	111.5	R111 V265 D266 Y267	A108-R111 VanDerWaalsContact CB-NH1 3.27Å; A108-R111 VanDerWaalsContact CB-NH2 3.35Å; A108-R111 PolarHBondContact O-NH1 3.22Å; A108-R111 VanDerWaalsContact O-NH1 3.09Å; A108-V265 HydrophobicContact CB-CG1 3.55Å; A108-D266 CarbonylContact C-O 3.59Å; A108-D266 WeakPolarHBondContact CA-O 3.21Å; A108-Y267 HydrophobicContact CB-CD1 4.14Å; A108-Y267 HydrophobicContact CB-CE1 3.6Å
109	Q	97.8	Very high	96.6	Very high	91 Å²	91	43.2 Å²	43.2	43%	0.425	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	-38.6	179.8	-61.3	-169.8	-64.1	0	0	112.1	R107 Q210 D266 K268	R107-Q109 PolarHBondContact O-N 3Å; Q109-Q210 WeakPolarHBondContact O-CA 3.41Å; Q109-Q210 WeakPolarHBondContact O-CG 3.3Å; Q109-D266 PolarHBondContact N-O 2.89Å; Q109-K268 VanDerWaalsContact CD-CG 3.45Å; Q109-K268 HydrophobicContact CG-CG 4.12Å
110	S	98	Very high	96.6	Very high	10 Å²	10	42 Å²	42	7%	0.07	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	155.6	178.5	39.8	0	0	0	0	112.5	K208 S209 V265 D266	S110-K208 VanDerWaalsContact CB-CE 3.42Å; S110-K208 WeakPolarHBondContact OG-CE 2.93Å; S110-S209 WeakPolarHBondContact CA-O 3.24Å; S110-V265 WeakPolarHBondContact O-CA 3.4Å; S110-D266 PolarHBondContact O-N 3.34Å; S110-D266 WeakPolarHBondContact OG-CB 3.46Å; S110-D266 PolarHBondContact OG-OD2 2.87Å
111	R	98.4	Very high	96.6	Very high	19 Å²	19	34.6 Å²	34.6	7%	0.072	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	131.1	164.2	-68.3	82.8	172	152.6	6.7	107.5	S45 R105 A108 Y113 K208 S209 Q210 F212 L262 S264 V265	S45-R111 PolarHBondContact O-NH2 3.47Å; R105-R111 PolarHBondContact O-NH2 2.93Å; A108-R111 VanDerWaalsContact CB-NH1 3.27Å; A108-R111 VanDerWaalsContact CB-NH2 3.35Å; A108-R111 PolarHBondContact O-NH1 3.22Å; A108-R111 VanDerWaalsContact O-NH1 3.09Å; R111-Y113 HydrophobicContact CB-CD2 4.42Å; R111-Y113 HydrophobicContact CB-CE2 3.96Å; R111-K208 WeakPolarHBondContact O-CA 3.39Å; R111-S209 PolarHBondContact N-O 3.12Å; R111-S209 PolarHBondContact O-N 3.32Å; R111-Q210 WeakPolarHBondContact CD-O 3.42Å; R111-Q210 PolarHBondContact NH1-O 2.8Å; R111-F212 HydrophobicContact CB-CE2 4.31Å; R111-L262 HydrophobicContact CB-CD1 3.98Å; R111-L262 HydrophobicContact CG-CD1 4.24Å; R111-S264 WeakPolarHBondContact CA-O 3.32Å; R111-V265 HydrophobicContact CG-CG1 4.45Å; R111-V265 HydrophobicContact CG-CG2 4.23Å
112	T	98.8	Very high	96.5	Very high	14 Å²	14	33.6 Å²	33.6	9%	0.086	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	123.1	173.3	-53.6	0	0	0	0	108.5	T206 F207 K263 S264	T112-T206 HydrophobicContact CG2-CG2 3.6Å; T112-F207 CarbonylContact C-O 3.25Å; T112-F207 WeakPolarHBondContact CA-O 3.48Å; T112-K263 WeakPolarHBondContact O-CA 3.26Å; T112-K263 WeakPolarHBondContact O-CB 3.28Å; T112-K263 PolarHBondContact O-N 2.8Å; T112-S264 WeakPolarHBondContact CB-OG 3.44Å; T112-S264 PolarHBondContact N-O 2.9Å; T112-S264 PolarHBondContact O-N 2.85Å; T112-S264 PolarHBondContact OG1-OG 3.25Å
113	Y	98.8	Very high	96.2	Very high	17 Å²	17	37.2 Å²	37.2	7%	0.067	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	145.3	171.9	-74.6	-92.2	0	0	0	110.3	S46 R111 T206 F207 F212 V217 L260 F261 L262	S46-Y113 PolarHBondContact OG-OH 2.83Å; R111-Y113 HydrophobicContact CB-CD2 4.42Å; R111-Y113 HydrophobicContact CB-CE2 3.96Å; Y113-T206 CarbonylContact O-C 3.57Å; Y113-T206 WeakPolarHBondContact O-CA 3.29Å; Y113-F207 PolarHBondContact N-O 2.96Å; Y113-F207 PolarHBondContact O-N 3.13Å; Y113-F212 AromaticContact CD2-CD2 3.83Å; Y113-F212 HydrophobicContact CD2-CD2 3.83Å; Y113-F212 AromaticContact CD2-CE2 3.57Å; Y113-F212 HydrophobicContact CD2-CE2 3.57Å; Y113-F212 HydrophobicContact CD2-CZ 4.31Å; Y113-F212 AromaticContact CE2-CD2 3.63Å; Y113-F212 HydrophobicContact CE2-CD2 3.63Å; Y113-F212 AromaticContact CE2-CE2 3.82Å; Y113-F212 HydrophobicContact CE2-CE2 3.82Å; Y113-V217 HydrophobicContact CD2-CG2 4.03Å; Y113-V217 HydrophobicContact CG-CG2 4.15Å; Y113-L260 HydrophobicContact CD1-CD1 3.71Å; Y113-L260 HydrophobicContact CD1-CD2 4.12Å; Y113-L260 HydrophobicContact CD1-CG 3.91Å; Y113-L260 HydrophobicContact CE1-CD2 4.42Å; Y113-L260 HydrophobicContact CG-CD1 4.16Å; Y113-F261 CarbonylContact C-O 3.54Å; Y113-F261 VanDerWaalsContact CA-O 3.24Å; Y113-F261 WeakPolarHBondContact CA-O 3.4Å; Y113-F261 WeakPolarHBondContact CD1-O 3.28Å; Y113-L262 HydrophobicContact CD1-CB 4.18Å; Y113-L262 HydrophobicContact CD1-CD1 4.34Å; Y113-L262 HydrophobicContact CD2-CD1 4.21Å; Y113-L262 HydrophobicContact CE1-CB 3.79Å; Y113-L262 HydrophobicContact CE1-CD1 3.93Å; Y113-L262 HydrophobicContact CE1-CG 4.44Å; Y113-L262 HydrophobicContact CE2-CD1 3.76Å; Y113-L262 HydrophobicContact CG-CD1 4.48Å
114	V	98.7	Very high	95.6	Very high	7 Å²	7	39.4 Å²	39.4	4%	0.042	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	134.8	167.2	165.8	0	0	0	0	108.9	R116 E204 L205 T206 F261 K263	V114-R116 HydrophobicContact CG1-CG 4.18Å; V114-E204 HydrophobicContact CG1-CB 4.14Å; V114-E204 HydrophobicContact CG1-CG 4.37Å; V114-L205 CarbonylContact C-O 3.6Å; V114-L205 WeakPolarHBondContact CA-O 3.45Å; V114-T206 HydrophobicContact CG2-CG2 4.36Å; V114-F261 PolarHBondContact N-O 3.01Å; V114-F261 PolarHBondContact O-N 3.27Å; V114-K263 HydrophobicContact CG2-CB 4.26Å; V114-K263 HydrophobicContact CG2-CD 3.56Å
115	Y	98.8	Very high	95.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	126.7	171.6	-162.5	-74.4	0	0	0	110	V117 W136 E204 L205 T221 A255 P256 G259 L260	Y115-V117 HydrophobicContact CD1-CG2 3.87Å; Y115-V117 HydrophobicContact CE1-CG2 3.99Å; Y115-W136 HydrophobicContact CE1-CB 3.65Å; Y115-W136 AromaticContact CE1-CE3 3.98Å; Y115-W136 HydrophobicContact CE1-CE3 3.98Å; Y115-W136 HydrophobicContact CE1-CG 4.49Å; Y115-W136 WeakPolarHBondContact OH-CB 3.49Å; Y115-E204 WeakPolarHBondContact O-CA 3.02Å; Y115-L205 PolarHBondContact N-O 2.85Å; Y115-L205 PolarHBondContact O-N 2.84Å; Y115-T221 HydrophobicContact CD1-CG2 3.48Å; Y115-T221 VanDerWaalsContact CD1-CG2 3.48Å; Y115-T221 HydrophobicContact CD2-CG2 3.85Å; Y115-T221 HydrophobicContact CE1-CG2 3.78Å; Y115-T221 HydrophobicContact CE2-CG2 4.13Å; Y115-T221 HydrophobicContact CG-CG2 3.54Å; Y115-A255 HydrophobicContact CE1-CB 4.37Å; Y115-A255 HydrophobicContact CE2-CB 3.73Å; Y115-A255 WeakPolarHBondContact OH-CB 3.39Å; Y115-P256 VanDerWaalsContact CE2-O 3.25Å; Y115-P256 WeakPolarHBondContact CE2-O 3.43Å; Y115-P256 WeakPolarHBondContact OH-CD 3.38Å; Y115-P256 VanDerWaalsContact OH-CG 3.26Å; Y115-P256 WeakPolarHBondContact OH-CG 3.41Å; Y115-P256 PolarHBondContact OH-O 3.48Å; Y115-G259 CarbonylContact C-O 3.51Å; Y115-G259 VanDerWaalsContact CA-O 3.3Å; Y115-G259 WeakPolarHBondContact CA-O 3.33Å; Y115-L260 HydrophobicContact CD2-CB 3.7Å; Y115-L260 HydrophobicContact CD2-CD1 4Å; Y115-L260 HydrophobicContact CD2-CG 4.4Å; Y115-L260 HydrophobicContact CE2-CB 3.97Å
116	R	97.9	Very high	94.9	Very high	23 Å²	23	41.8 Å²	41.8	9%	0.087	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	132.5	-179.5	-60	-177.7	73.4	-133.9	2	111.2	V114 D131 C135 W136 S189 E204 G259 F261	V114-R116 HydrophobicContact CG1-CG 4.18Å; R116-D131 IonicContact CZ-OD1 3.33Å; R116-D131 IonicContact NH1-OD1 2.88Å; R116-D131 PolarHBondContact NH1-OD1 3.02Å; R116-D131 IonicContact NH2-OD1 3.37Å; R116-D131 PolarHBondContact NH2-OD1 3.34Å; R116-C135 HydrophobicContact CB-CB 3.73Å; R116-C135 CarbonylContact O-C 3.57Å; R116-C135 WeakPolarHBondContact O-CA 3.36Å; R116-W136 PolarHBondContact O-N 3.26Å; R116-S189 PolarHBondContact NH2-O 2.77Å; R116-E204 HydrophobicContact CG-CG 4.26Å; R116-E204 IonicContact NE-OE1 2.84Å; R116-E204 PolarHBondContact NE-OE1 3.09Å; R116-G259 PolarHBondContact N-O 3.37Å; R116-F261 HydrophobicContact CG-CE2 4.36Å
117	V	97.7	Very high	94.7	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.006	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	139.4	176.7	179.2	0	0	0	0	108.9	Y115 L119 W136 L138 F202 W203 L205 V225	Y115-V117 HydrophobicContact CD1-CG2 3.87Å; Y115-V117 HydrophobicContact CE1-CG2 3.99Å; V117-L119 HydrophobicContact CG1-CD2 4.05Å; V117-W136 WeakPolarHBondContact CA-O 3.12Å; V117-W136 HydrophobicContact CG2-CE3 4.47Å; V117-L138 HydrophobicContact CG1-CD1 3.45Å; V117-L138 VanDerWaalsContact CG1-CD1 3.45Å; V117-L138 HydrophobicContact CG1-CG 3.85Å; V117-F202 CarbonylContact O-C 3.58Å; V117-F202 VanDerWaalsContact O-CA 3.24Å; V117-F202 WeakPolarHBondContact O-CA 3.39Å; V117-W203 HydrophobicContact CB-CB 4.39Å; V117-W203 PolarHBondContact N-O 3.06Å; V117-W203 PolarHBondContact O-N 3.1Å; V117-L205 HydrophobicContact CG2-CD1 4.06Å; V117-V225 HydrophobicContact CG2-CG2 4.29Å
118	A	96.4	Very high	94.4	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	133.6	174.3	0	0	0	0	0	109.9	V121 L127 W136 G137 L138 Q201 F202	A118-V121 HydrophobicContact CB-CG2 4.02Å; A118-L127 HydrophobicContact CB-CD2 3.79Å; A118-W136 PolarHBondContact N-O 3.12Å; A118-G137 CarbonylContact O-C 3.57Å; A118-G137 WeakPolarHBondContact O-CA 3.25Å; A118-L138 PolarHBondContact O-N 3.45Å; A118-Q201 WeakPolarHBondContact CA-O 3.37Å; A118-F202 HydrophobicContact CB-CD1 3.81Å; A118-F202 HydrophobicContact CB-CE1 3.59Å; A118-F202 HydrophobicContact CB-CZ 4.15Å
119	L	95.8	Very high	94	Very high	5 Å²	5	37.9 Å²	37.9	3%	0.026	20%	0.197	C	C	.	.	S	Bend	trans	-97.6	156.5	-177.5	-58.2	-169.6	0	0	0	112.2	V117 V121 L138 N140 L143 L200 Q201	V117-L119 HydrophobicContact CG1-CD2 4.05Å; L119-V121 VanDerWaalsContact C-N 3.32Å; L119-V121 PolarHBondContact O-N 2.57Å; L119-L138 HydrophobicContact CD2-CB 4Å; L119-L138 HydrophobicContact CD2-CD1 3.83Å; L119-L138 HydrophobicContact CD2-CG 4.41Å; L119-N140 CarbonylContact C-O 3.5Å; L119-N140 WeakPolarHBondContact CA-O 3.05Å; L119-N140 VanDerWaalsContact CB-O 3.3Å; L119-N140 WeakPolarHBondContact CB-O 3.14Å; L119-L143 HydrophobicContact CD1-CD1 4.49Å; L119-L143 HydrophobicContact CD1-CG 4.17Å; L119-L143 HydrophobicContact CD2-CD1 3.85Å; L119-L143 HydrophobicContact CD2-CG 3.95Å; L119-L200 WeakPolarHBondContact O-CD2 3.49Å; L119-Q201 HydrophobicContact CB-CB 4.29Å; L119-Q201 HydrophobicContact CD1-CB 4.43Å; L119-Q201 PolarHBondContact N-O 3.38Å
120	G	93.8	Very high	93.6	Very high	4 Å²	4	36.3 Å²	36.3	4%	0.041	19%	0.194	C	C	.	.	S	Bend	trans	75.5	15.7	178.3	0	0	0	0	0	114.5	T122 L138 N140 R198	G120-T122 PolarHBondContact O-N 2.81Å; G120-L138 PolarHBondContact N-O 2.92Å; G120-N140 PolarHBondContact N-O 2.76Å; G120-R198 PolarHBondContact O-NH1 3.31Å; G120-R198 PolarHBondContact O-NH2 3.2Å
121	V	93.6	Very high	93.3	Very high	9 Å²	9	35.9 Å²	35.9	6%	0.055	19%	0.191	C	C	.	.			trans	-92.6	91.5	-176.5	-174	0	0	0	0	109.7	A118 L119 H123 L127 L138 L200	A118-V121 HydrophobicContact CB-CG2 4.02Å; L119-V121 VanDerWaalsContact C-N 3.32Å; L119-V121 PolarHBondContact O-N 2.57Å; V121-H123 VanDerWaalsContact CG1-O 3.29Å; V121-H123 WeakPolarHBondContact CG1-O 3.21Å; V121-L127 HydrophobicContact CG1-CD1 4.34Å; V121-L127 HydrophobicContact CG1-CD2 4.4Å; V121-L127 HydrophobicContact CG1-CG 3.95Å; V121-L127 HydrophobicContact CG2-CD2 3.73Å; V121-L127 HydrophobicContact CG2-CG 4.19Å; V121-L138 PolarHBondContact N-O 3.48Å; V121-L138 CarbonylContact O-C 3.45Å; V121-L200 HydrophobicContact CG2-CD1 4.49Å
122	T	90.3	Very high	92.9	Very high	84 Å²	84	39.8 Å²	39.8	52%	0.515	21%	0.206	S	C	.	.	S	Bend	trans	-78.6	-27	176.2	54.4	0	0	0	0	113.2	G120 L126	G120-T122 PolarHBondContact O-N 2.81Å; T122-L126 WeakPolarHBondContact OG1-CD1 3.38Å
123	H	89.3	Confident	92.5	Very high	94 Å²	94	41.3 Å²	41.3	44%	0.435	21%	0.213	S	C	.	.	S	Bend	trans	-141.4	147.8	176	-167.4	-101.4	0	0	0	109.8	V121 T125 L126	V121-H123 VanDerWaalsContact CG1-O 3.29Å; V121-H123 WeakPolarHBondContact CG1-O 3.21Å; H123-T125 PolarHBondContact ND1-N 2.95Å; H123-T125 PolarHBondContact ND1-OG1 3.01Å; H123-T125 PolarHBondContact O-N 2.81Å; H123-T125 VanDerWaalsContact O-N 3.14Å; H123-L126 HydrophobicContact CB-CG 4.45Å; H123-L126 WeakPolarHBondContact O-CB 3.24Å; H123-L126 WeakPolarHBondContact O-CG 3.13Å; H123-L126 PolarHBondContact O-N 3.21Å
124	H	83.6	Confident	92.3	Very high	97 Å²	97	41.1 Å²	41.1	45%	0.449	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-60	-27.9	-175.2	56.2	-126	0	0	0	113.2	L126 L127 W132	H124-L126 PolarHBondContact O-N 3.15Å; H124-L126 VanDerWaalsContact O-N 3.1Å; H124-L127 WeakPolarHBondContact O-CB 3.26Å; H124-L127 PolarHBondContact O-N 3.3Å; H124-L127 VanDerWaalsContact O-N 3.09Å; H124-W132 HydrophobicContact CB-CE3 4.18Å; H124-W132 HydrophobicContact CB-CH2 3.6Å; H124-W132 HydrophobicContact CB-CZ2 4.47Å; H124-W132 HydrophobicContact CB-CZ3 3.4Å; H124-W132 AromaticContact CD2-CH2 2.93Å; H124-W132 WeakPolarHBondContact CD2-CH2 3.42Å; H124-W132 AromaticContact CD2-CZ3 3.14Å; H124-W132 WeakPolarHBondContact CD2-CZ3 3.48Å; H124-W132 AromaticContact CG-CH2 3.23Å; H124-W132 AromaticContact CG-CZ3 3.45Å; H124-W132 VanDerWaalsContact CG-CZ3 3.45Å; H124-W132 AromaticContact ND1-CH2 3.95Å; H124-W132 AromaticContact NE2-CH2 3.52Å; H124-W132 VanDerWaalsContact O-CZ3 3.23Å; H124-W132 WeakPolarHBondContact O-CZ3 3.16Å
125	T	87.8	Confident	92.2	Very high	92 Å²	92	40.8 Å²	40.8	56%	0.564	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	-68.4	-9.9	-179.5	53.9	0	0	0	0	112.7	H123 L127	H123-T125 PolarHBondContact ND1-N 2.95Å; H123-T125 PolarHBondContact ND1-OG1 3.01Å; H123-T125 PolarHBondContact O-N 2.81Å; H123-T125 VanDerWaalsContact O-N 3.14Å; T125-L127 VanDerWaalsContact C-N 3.31Å
126	L	89.7	Confident	92.1	Very high	47 Å²	47	42.7 Å²	42.7	25%	0.246	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-84.4	-6.8	176.4	-56	179.3	0	0	0	112.7	T122 H123 H124 F196	T122-L126 WeakPolarHBondContact OG1-CD1 3.38Å; H123-L126 HydrophobicContact CB-CG 4.45Å; H123-L126 WeakPolarHBondContact O-CB 3.24Å; H123-L126 WeakPolarHBondContact O-CG 3.13Å; H123-L126 PolarHBondContact O-N 3.21Å; H124-L126 PolarHBondContact O-N 3.15Å; H124-L126 VanDerWaalsContact O-N 3.1Å; L126-F196 VanDerWaalsContact O-CE1 3.31Å; L126-F196 WeakPolarHBondContact O-CE1 3.22Å; L126-F196 WeakPolarHBondContact O-CZ 3.4Å
127	L	91.1	Very high	91.9	Very high	16 Å²	16	42.7 Å²	42.7	8%	0.084	23%	0.225	C	C	.	.	S	Bend	trans	-83.1	144.1	171.4	-71.8	170.2	0	0	0	110.6	A118 V121 H124 T125 L200	A118-L127 HydrophobicContact CB-CD2 3.79Å; V121-L127 HydrophobicContact CG1-CD1 4.34Å; V121-L127 HydrophobicContact CG1-CD2 4.4Å; V121-L127 HydrophobicContact CG1-CG 3.95Å; V121-L127 HydrophobicContact CG2-CD2 3.73Å; V121-L127 HydrophobicContact CG2-CG 4.19Å; H124-L127 WeakPolarHBondContact O-CB 3.26Å; H124-L127 PolarHBondContact O-N 3.3Å; H124-L127 VanDerWaalsContact O-N 3.09Å; T125-L127 VanDerWaalsContact C-N 3.31Å; L127-L200 HydrophobicContact CD2-CD1 4.06Å
128	P	89.4	Confident	91.9	Very high	5 Å²	5	43 Å²	43	3%	0.032	23%	0.227	C	C	.	.			trans	-56.5	147.4	165.2	-21.3	31.6	0	0	0	111.2	T130 D131 W132 A192 F196	P128-T130 PolarHBondContact O-N 3.24Å; P128-T130 VanDerWaalsContact O-N 3.11Å; P128-D131 PolarHBondContact O-N 2.86Å; P128-W132 PolarHBondContact O-N 2.76Å; P128-W132 VanDerWaalsContact O-N 3.09Å; P128-A192 HydrophobicContact CB-CB 3.78Å; P128-A192 HydrophobicContact CG-CB 4.32Å; P128-F196 HydrophobicContact CB-CD2 4.38Å; P128-F196 HydrophobicContact CG-CB 4.41Å; P128-F196 HydrophobicContact CG-CD1 3.88Å; P128-F196 HydrophobicContact CG-CD2 4.22Å; P128-F196 HydrophobicContact CG-CE1 4.14Å; P128-F196 HydrophobicContact CG-CE2 4.47Å; P128-F196 HydrophobicContact CG-CG 3.93Å; P128-F196 HydrophobicContact CG-CZ 4.43Å
129	L	89.1	Confident	91.8	Very high	161 Å²	161	51.9 Å²	51.9	84%	0.843	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-34.5	176.9	-177.9	64.2	0	0	0	112.2	D131 W132	L129-D131 PolarHBondContact O-N 3.05Å; L129-W132 WeakPolarHBondContact O-CB 3.3Å; L129-W132 PolarHBondContact O-N 3.19Å
130	T	89.7	Confident	91.7	Very high	58 Å²	58	54.5 Å²	54.5	36%	0.356	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-8.2	178.8	52.8	0	0	0	0	114.8	P128 L134 A192	P128-T130 PolarHBondContact O-N 3.24Å; P128-T130 VanDerWaalsContact O-N 3.11Å; T130-L134 WeakPolarHBondContact O-CD1 3.07Å; T130-A192 WeakPolarHBondContact OG1-CB 3.48Å
131	D	91.6	Very high	91.6	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.8	-3.9	177.7	-63.9	-74.3	0	0	0	112.3	R116 P128 L129 N133 L134 C135 S190 F202	R116-D131 IonicContact CZ-OD1 3.33Å; R116-D131 IonicContact NH1-OD1 2.88Å; R116-D131 PolarHBondContact NH1-OD1 3.02Å; R116-D131 IonicContact NH2-OD1 3.37Å; R116-D131 PolarHBondContact NH2-OD1 3.34Å; P128-D131 PolarHBondContact O-N 2.86Å; L129-D131 PolarHBondContact O-N 3.05Å; D131-N133 PolarHBondContact O-N 3.35Å; D131-L134 PolarHBondContact O-N 3.46Å; D131-C135 PolarHBondContact O-SG 3.26Å; D131-C135 VanDerWaalsContact O-SG 3.42Å; D131-S190 VanDerWaalsContact OD2-CB 3.25Å; D131-S190 WeakPolarHBondContact OD2-CB 3.46Å; D131-S190 PolarHBondContact OD2-OG 2.82Å; D131-F202 HydrophobicContact CB-CE1 4.33Å
132	W	89.1	Confident	91.6	Very high	102 Å²	102	65.6 Å²	65.6	39%	0.386	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	125.1	176.1	178.5	-90.1	0	0	0	111	H124 P128 L129 L134	H124-W132 HydrophobicContact CB-CE3 4.18Å; H124-W132 HydrophobicContact CB-CH2 3.6Å; H124-W132 HydrophobicContact CB-CZ2 4.47Å; H124-W132 HydrophobicContact CB-CZ3 3.4Å; H124-W132 AromaticContact CD2-CH2 2.93Å; H124-W132 WeakPolarHBondContact CD2-CH2 3.42Å; H124-W132 AromaticContact CD2-CZ3 3.14Å; H124-W132 WeakPolarHBondContact CD2-CZ3 3.48Å; H124-W132 AromaticContact CG-CH2 3.23Å; H124-W132 AromaticContact CG-CZ3 3.45Å; H124-W132 VanDerWaalsContact CG-CZ3 3.45Å; H124-W132 AromaticContact ND1-CH2 3.95Å; H124-W132 AromaticContact NE2-CH2 3.52Å; H124-W132 VanDerWaalsContact O-CZ3 3.23Å; H124-W132 WeakPolarHBondContact O-CZ3 3.16Å; P128-W132 PolarHBondContact O-N 2.76Å; P128-W132 VanDerWaalsContact O-N 3.09Å; L129-W132 WeakPolarHBondContact O-CB 3.3Å; L129-W132 PolarHBondContact O-N 3.19Å; W132-L134 PolarHBondContact O-N 3.01Å; W132-L134 VanDerWaalsContact O-N 3.16Å
133	N	91	Very high	92	Very high	45 Å²	45	62.5 Å²	62.5	24%	0.241	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	23.6	-177.8	-155.3	42.7	0	0	0	113.5	V5 H53 D131 Y258	V5-N133 VanDerWaalsContact CG1-ND2 3.29Å; V5-N133 WeakPolarHBondContact CG1-ND2 3.42Å; V5-N133 HydrophobicContact CG2-CB 4.15Å; H53-N133 PolarHBondContact NE2-O 3.08Å; D131-N133 PolarHBondContact O-N 3.35Å; N133-Y258 VanDerWaalsContact O-O 3.12Å; N133-Y258 WeakPolarHBondContact OD1-CB 3.46Å; N133-Y258 VanDerWaalsContact OD1-CG 3.25Å
134	L	94.4	Very high	92.4	Very high	13 Å²	13	62.1 Å²	62.1	7%	0.068	31%	0.313	C	S	.	.	S	Bend	trans	-126.6	4.2	177.5	-59.6	178.1	0	0	0	112.9	V4 T130 D131 W132 Y258 F261	V4-L134 WeakPolarHBondContact O-CD2 3.46Å; T130-L134 WeakPolarHBondContact O-CD1 3.07Å; D131-L134 PolarHBondContact O-N 3.46Å; W132-L134 PolarHBondContact O-N 3.01Å; W132-L134 VanDerWaalsContact O-N 3.16Å; L134-Y258 CarbonylContact C-O 3.51Å; L134-Y258 WeakPolarHBondContact CA-O 3.46Å; L134-F261 HydrophobicContact CB-CZ 3.87Å; L134-F261 HydrophobicContact CD2-CE1 4.08Å; L134-F261 HydrophobicContact CD2-CZ 3.76Å; L134-F261 HydrophobicContact CG-CZ 4.35Å; L134-F261 VanDerWaalsContact O-CE2 3.28Å; L134-F261 WeakPolarHBondContact O-CE2 3.46Å
135	C	95.4	Very high	93.1	Very high	1 Å²	1	59 Å²	59	1%	0.007	30%	0.299	C	S	.	.	S	Bend	trans	-156.1	155.9	174.5	65.1	0	0	0	0	110.1	R116 D131 G137 Y258	R116-C135 HydrophobicContact CB-CB 3.73Å; R116-C135 CarbonylContact O-C 3.57Å; R116-C135 WeakPolarHBondContact O-CA 3.36Å; D131-C135 PolarHBondContact O-SG 3.26Å; D131-C135 VanDerWaalsContact O-SG 3.42Å; C135-G137 PolarHBondContact O-N 2.92Å; C135-Y258 WeakPolarHBondContact O-CD2 3.43Å; C135-Y258 WeakPolarHBondContact O-CE2 3.5Å
136	W	96.7	Very high	93.6	Very high	40 Å²	40	60.2 Å²	60.2	15%	0.152	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	108.5	171.7	-175.4	15.2	0	0	0	110.9	Y115 R116 V117 A118 L138 V225 A255 P256	Y115-W136 HydrophobicContact CE1-CB 3.65Å; Y115-W136 AromaticContact CE1-CE3 3.98Å; Y115-W136 HydrophobicContact CE1-CE3 3.98Å; Y115-W136 HydrophobicContact CE1-CG 4.49Å; Y115-W136 WeakPolarHBondContact OH-CB 3.49Å; R116-W136 PolarHBondContact O-N 3.26Å; V117-W136 WeakPolarHBondContact CA-O 3.12Å; V117-W136 HydrophobicContact CG2-CE3 4.47Å; A118-W136 PolarHBondContact N-O 3.12Å; W136-L138 HydrophobicContact CD2-CD2 3.82Å; W136-L138 HydrophobicContact CD2-CG 4.45Å; W136-L138 HydrophobicContact CE3-CD2 4.33Å; W136-L138 HydrophobicContact CG-CD2 4.33Å; W136-L138 HydrophobicContact CH2-CD2 4.09Å; W136-L138 HydrophobicContact CZ2-CD2 3.53Å; W136-L138 HydrophobicContact CZ3-CD2 4.46Å; W136-L138 PolarHBondContact O-N 2.8Å; W136-V225 HydrophobicContact CE3-CG1 4.5Å; W136-V225 HydrophobicContact CE3-CG2 4.23Å; W136-V225 HydrophobicContact CH2-CB 4.19Å; W136-V225 HydrophobicContact CH2-CG1 3.78Å; W136-V225 HydrophobicContact CZ3-CB 3.76Å; W136-V225 HydrophobicContact CZ3-CG1 3.69Å; W136-V225 HydrophobicContact CZ3-CG2 3.74Å; W136-A255 HydrophobicContact CE3-CB 3.98Å; W136-A255 HydrophobicContact CZ3-CB 3.83Å; W136-P256 HydrophobicContact CB-CG 4.03Å; W136-P256 HydrophobicContact CD2-CG 3.84Å; W136-P256 HydrophobicContact CG-CG 3.52Å
137	G	95.6	Very high	94	Very high	22 Å²	22	58.8 Å²	58.8	23%	0.227	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	118.5	171.1	0	0	0	0	0	111.7	A118 C135	A118-G137 CarbonylContact O-C 3.57Å; A118-G137 WeakPolarHBondContact O-CA 3.25Å; C135-G137 PolarHBondContact O-N 2.92Å
138	L	96.3	Very high	94.4	Very high	7 Å²	7	58 Å²	58	4%	0.037	29%	0.293	C	S	.	.			trans	-102.6	142.3	172.6	-64.8	179.4	0	0	0	110.4	V117 A118 L119 G120 V121 W136 N140 L143 V225	V117-L138 HydrophobicContact CG1-CD1 3.45Å; V117-L138 VanDerWaalsContact CG1-CD1 3.45Å; V117-L138 HydrophobicContact CG1-CG 3.85Å; A118-L138 PolarHBondContact O-N 3.45Å; L119-L138 HydrophobicContact CD2-CB 4Å; L119-L138 HydrophobicContact CD2-CD1 3.83Å; L119-L138 HydrophobicContact CD2-CG 4.41Å; G120-L138 PolarHBondContact N-O 2.92Å; V121-L138 PolarHBondContact N-O 3.48Å; V121-L138 CarbonylContact O-C 3.45Å; W136-L138 HydrophobicContact CD2-CD2 3.82Å; W136-L138 HydrophobicContact CD2-CG 4.45Å; W136-L138 HydrophobicContact CE3-CD2 4.33Å; W136-L138 HydrophobicContact CG-CD2 4.33Å; W136-L138 HydrophobicContact CH2-CD2 4.09Å; W136-L138 HydrophobicContact CZ2-CD2 3.53Å; W136-L138 HydrophobicContact CZ3-CD2 4.46Å; W136-L138 PolarHBondContact O-N 2.8Å; L138-N140 VanDerWaalsContact C-N 3.27Å; L138-N140 PolarHBondContact O-N 2.87Å; L138-L143 HydrophobicContact CD1-CD1 4.14Å; L138-L143 HydrophobicContact CD1-CD2 4.31Å; L138-V225 HydrophobicContact CD1-CG1 3.61Å; L138-V225 HydrophobicContact CD2-CG1 4.24Å
139	R	94.5	Very high	94.9	Very high	187 Å²	187	61.7 Å²	61.7	71%	0.706	31%	0.309	S	S	*	.	S	Bend	trans	-67.9	-30.1	174.4	-58.2	-164.1	170.4	-172	-1.5	112.3
140	N	93.8	Very high	95.3	Very high	61 Å²	61	59.6 Å²	59.6	33%	0.326	30%	0.296	S	S	.	.			trans	-56.7	136.9	177	-57.8	78.5	0	0	0	110.7	L119 G120 L138 E142 L143 Q229	L119-N140 CarbonylContact C-O 3.5Å; L119-N140 WeakPolarHBondContact CA-O 3.05Å; L119-N140 VanDerWaalsContact CB-O 3.3Å; L119-N140 WeakPolarHBondContact CB-O 3.14Å; G120-N140 PolarHBondContact N-O 2.76Å; L138-N140 VanDerWaalsContact C-N 3.27Å; L138-N140 PolarHBondContact O-N 2.87Å; N140-E142 WeakPolarHBondContact CB-O 3.25Å; N140-L143 HydrophobicContact CB-CD2 4.45Å; N140-Q229 PolarHBondContact OD1-NE2 2.8Å
141	T	90.9	Very high	95.8	Very high	96 Å²	96	56.9 Å²	56.9	59%	0.589	28%	0.279	S	S	*	.	S	Bend	trans	-86.2	-20.6	173.4	47.5	0	0	0	0	112.7	Q201	T141-Q201 PolarHBondContact O-OE1 2.77Å
142	E	94.9	Very high	96.1	Very high	149 Å²	149	56.9 Å²	56.9	70%	0.696	28%	0.279	S	S	*	.			trans	-140.4	158.8	-179.2	-63.3	-178.9	169.9	0	0	110	N140	N140-E142 WeakPolarHBondContact CB-O 3.25Å
143	L	97.7	Very high	96.5	Very high	20 Å²	20	55.3 Å²	55.3	11%	0.105	29%	0.287	C	S	.	.			trans	-133.5	146.9	171.3	-67	175.8	0	0	0	108.2	L119 L138 N140 I145 M148 G228 Q229	L119-L143 HydrophobicContact CD1-CD1 4.49Å; L119-L143 HydrophobicContact CD1-CG 4.17Å; L119-L143 HydrophobicContact CD2-CD1 3.85Å; L119-L143 HydrophobicContact CD2-CG 3.95Å; L138-L143 HydrophobicContact CD1-CD1 4.14Å; L138-L143 HydrophobicContact CD1-CD2 4.31Å; N140-L143 HydrophobicContact CB-CD2 4.45Å; L143-I145 HydrophobicContact CB-CD1 3.91Å; L143-I145 PolarHBondContact O-N 2.77Å; L143-M148 HydrophobicContact CB-SD 3.97Å; L143-M148 HydrophobicContact CD1-CE 4.45Å; L143-M148 HydrophobicContact CD1-SD 3.84Å; L143-M148 HydrophobicContact CG-SD 4.47Å; L143-G228 WeakPolarHBondContact CA-O 3.06Å; L143-Q229 HydrophobicContact CD2-CG 3.6Å
144	D	98.4	Very high	96.9	Very high	86 Å²	86	55.3 Å²	55.3	46%	0.46	29%	0.287	S	S	.	.			trans	-72.6	93.3	167.8	-174	-20.9	0	0	0	109.3	D146 A147 M148 G228	D144-D146 VanDerWaalsContact C-N 3.31Å; D144-D146 PolarHBondContact OD1-N 3.07Å; D144-A147 HydrophobicContact CB-CB 4.02Å; D144-A147 VanDerWaalsContact CG-CB 3.42Å; D144-A147 WeakPolarHBondContact OD1-CB 3.38Å; D144-A147 PolarHBondContact OD1-N 2.81Å; D144-M148 VanDerWaalsContact O-CG 3.26Å; D144-M148 WeakPolarHBondContact O-CG 3.49Å; D144-M148 PolarHBondContact O-N 2.96Å; D144-M148 VanDerWaalsContact O-N 3.15Å; D144-G228 PolarHBondContact N-O 3.46Å; D144-G228 WeakPolarHBondContact O-CA 3.44Å
145	I	98.3	Very high	97.1	Very high	31 Å²	31	54.7 Å²	54.7	16%	0.159	28%	0.284	C	S	.	.	H	α-helix	trans	-70.9	-30.1	-175.7	-58.3	-57.8	0	0	0	111.6	L143 M148 H149 W203	L143-I145 HydrophobicContact CB-CD1 3.91Å; L143-I145 PolarHBondContact O-N 2.77Å; I145-M148 HydrophobicContact CD1-SD 3.89Å; I145-M148 WeakPolarHBondContact O-CB 3.04Å; I145-M148 PolarHBondContact O-N 2.98Å; I145-H149 PolarHBondContact O-CD2 2.66Å; I145-H149 PolarHBondContact O-N 3.27Å; I145-W203 HydrophobicContact CB-CH2 4.48Å; I145-W203 HydrophobicContact CD1-CD2 3.85Å; I145-W203 HydrophobicContact CD1-CE3 4.08Å; I145-W203 HydrophobicContact CD1-CH2 3.85Å; I145-W203 HydrophobicContact CD1-CZ2 3.59Å; I145-W203 HydrophobicContact CD1-CZ3 4.08Å; I145-W203 HydrophobicContact CG1-CH2 3.64Å; I145-W203 HydrophobicContact CG1-CZ2 3.59Å; I145-W203 HydrophobicContact CG1-CZ3 4.22Å; I145-W203 HydrophobicContact CG2-CH2 4.12Å; I145-W203 HydrophobicContact CG2-CZ3 4.09Å
146	D	98.6	Very high	97.3	Very high	118 Å²	118	57.4 Å²	57.4	63%	0.631	30%	0.3	S	S	*	.	H	α-helix	trans	-68.5	-46	177.9	-67.8	-29.1	0	0	0	110.2	D144 M148 H149 E150	D144-D146 VanDerWaalsContact C-N 3.31Å; D144-D146 PolarHBondContact OD1-N 3.07Å; D146-M148 VanDerWaalsContact C-N 3.26Å; D146-M148 PolarHBondContact O-N 2.93Å; D146-H149 WeakPolarHBondContact O-CB 3.48Å; D146-H149 PolarHBondContact O-N 2.75Å; D146-E150 WeakPolarHBondContact O-CG 3.45Å; D146-E150 PolarHBondContact O-N 3.19Å
147	A	98.7	Very high	97.4	Very high	16 Å²	16	56.7 Å²	56.7	13%	0.132	31%	0.305	C	S	.	.	H	α-helix	trans	-59.6	-37.1	172.6	0	0	0	0	0	112.2	D144 A151	D144-A147 HydrophobicContact CB-CB 4.02Å; D144-A147 VanDerWaalsContact CG-CB 3.42Å; D144-A147 WeakPolarHBondContact OD1-CB 3.38Å; D144-A147 PolarHBondContact OD1-N 2.81Å; A147-A151 VanDerWaalsContact O-CB 3.28Å; A147-A151 WeakPolarHBondContact O-CB 3.34Å; A147-A151 PolarHBondContact O-N 2.84Å
148	M	98.8	Very high	97.5	Very high	1 Å²	1	59.7 Å²	59.7	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-65.5	-40.5	174	-67.6	178.3	62.6	0	0	112.1	L143 D144 I145 D146 A152 I185 L205 L224 G228	L143-M148 HydrophobicContact CB-SD 3.97Å; L143-M148 HydrophobicContact CD1-CE 4.45Å; L143-M148 HydrophobicContact CD1-SD 3.84Å; L143-M148 HydrophobicContact CG-SD 4.47Å; D144-M148 VanDerWaalsContact O-CG 3.26Å; D144-M148 WeakPolarHBondContact O-CG 3.49Å; D144-M148 PolarHBondContact O-N 2.96Å; D144-M148 VanDerWaalsContact O-N 3.15Å; I145-M148 HydrophobicContact CD1-SD 3.89Å; I145-M148 WeakPolarHBondContact O-CB 3.04Å; I145-M148 PolarHBondContact O-N 2.98Å; D146-M148 VanDerWaalsContact C-N 3.26Å; D146-M148 PolarHBondContact O-N 2.93Å; M148-A152 VanDerWaalsContact O-CB 3.23Å; M148-A152 WeakPolarHBondContact O-CB 3.45Å; M148-A152 PolarHBondContact O-N 2.98Å; M148-I185 VanDerWaalsContact C-CD1 3.49Å; M148-I185 HydrophobicContact CB-CD1 3.6Å; M148-I185 HydrophobicContact CE-CD1 4.34Å; M148-I185 HydrophobicContact CE-CG1 4.23Å; M148-I185 HydrophobicContact CE-CG2 4.18Å; M148-I185 WeakPolarHBondContact O-CD1 3.38Å; M148-L205 HydrophobicContact CE-CD1 4.5Å; M148-L205 HydrophobicContact CE-CD2 4.18Å; M148-L224 HydrophobicContact CE-CB 4.49Å; M148-L224 WeakPolarHBondContact CG-O 3.29Å; M148-G228 VanDerWaalsContact CG-CA 3.47Å
149	H	98.8	Very high	97.6	Very high	81 Å²	81	61.9 Å²	61.9	38%	0.375	33%	0.33	S	S	.	.	H	α-helix	trans	-65.9	-44.3	176.6	-82.1	-60.7	0	0	0	112.2	I145 D146 A152 A153 I185	I145-H149 PolarHBondContact O-CD2 2.66Å; I145-H149 PolarHBondContact O-N 3.27Å; D146-H149 WeakPolarHBondContact O-CB 3.48Å; D146-H149 PolarHBondContact O-N 2.75Å; H149-A152 PolarHBondContact O-N 3.09Å; H149-A153 PolarHBondContact O-N 2.82Å; H149-I185 PolarHBondContact CE1-O 3.47Å
150	E	98.8	Very high	97.8	Very high	118 Å²	118	54.8 Å²	54.8	55%	0.551	31%	0.306	S	S	*	.	H	α-helix	trans	-60.2	-46.5	175	-71.8	-176.7	-156.1	0	0	111.3	D146 A152 A153 L154 V234	D146-E150 WeakPolarHBondContact O-CG 3.45Å; D146-E150 PolarHBondContact O-N 3.19Å; E150-A152 VanDerWaalsContact C-N 3.34Å; E150-A152 PolarHBondContact O-N 2.74Å; E150-A153 PolarHBondContact O-N 2.86Å; E150-L154 PolarHBondContact O-N 3.2Å; E150-V234 HydrophobicContact CB-CG1 4.05Å; E150-V234 HydrophobicContact CB-CG2 3.8Å
151	A	98.8	Very high	98	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-63.6	-37.8	175.8	0	0	0	0	0	112.5	A147 L154 L224 A227 V237	A147-A151 VanDerWaalsContact O-CB 3.28Å; A147-A151 WeakPolarHBondContact O-CB 3.34Å; A147-A151 PolarHBondContact O-N 2.84Å; A151-L154 WeakPolarHBondContact O-CB 3.34Å; A151-L154 PolarHBondContact O-N 2.83Å; A151-L224 HydrophobicContact CB-CD2 3.65Å; A151-A227 HydrophobicContact CB-CB 4.15Å; A151-V237 HydrophobicContact CB-CB 4.36Å; A151-V237 HydrophobicContact CB-CG1 4.21Å; A151-V237 HydrophobicContact CB-CG2 4.03Å
152	A	98.8	Very high	98.3	Very high	1 Å²	1	48 Å²	48	1%	0.008	27%	0.267	C	S	.	.	H	α-helix	trans	-64.5	-40	176.8	0	0	0	0	0	112.1	M148 H149 E150 L154 L155 V156 V183 I185 L224	M148-A152 VanDerWaalsContact O-CB 3.23Å; M148-A152 WeakPolarHBondContact O-CB 3.45Å; M148-A152 PolarHBondContact O-N 2.98Å; H149-A152 PolarHBondContact O-N 3.09Å; E150-A152 VanDerWaalsContact C-N 3.34Å; E150-A152 PolarHBondContact O-N 2.74Å; A152-L154 PolarHBondContact O-N 2.9Å; A152-L155 PolarHBondContact O-N 2.95Å; A152-V156 PolarHBondContact O-N 3.25Å; A152-V183 HydrophobicContact CB-CB 4.15Å; A152-V183 HydrophobicContact CB-CG1 3.6Å; A152-I185 HydrophobicContact CB-CD1 3.95Å; A152-L224 HydrophobicContact CB-CD1 4.35Å; A152-L224 HydrophobicContact CB-CD2 3.96Å; A152-L224 VanDerWaalsContact N-CD2 3.35Å
153	A	98.8	Very high	98.4	Very high	68 Å²	68	40.9 Å²	40.9	56%	0.562	23%	0.234	S	C	*	.	H	α-helix	trans	-59.9	-34.8	178.3	0	0	0	0	0	112.4	H149 E150 L155 V156	H149-A153 PolarHBondContact O-N 2.82Å; E150-A153 PolarHBondContact O-N 2.86Å; A153-L155 PolarHBondContact O-N 3.34Å; A153-V156 PolarHBondContact O-N 3.24Å
154	L	98.7	Very high	98.3	Very high	46 Å²	46	40 Å²	40	24%	0.241	23%	0.229	C	C	.	.	H	α-helix	trans	-64.2	-28.5	175.8	-60.6	174.7	0	0	0	113.4	E150 A151 A152 H159 V234 V237 K238 L241	E150-L154 PolarHBondContact O-N 3.2Å; A151-L154 WeakPolarHBondContact O-CB 3.34Å; A151-L154 PolarHBondContact O-N 2.83Å; A152-L154 PolarHBondContact O-N 2.9Å; L154-H159 PolarHBondContact O-NE2 3.22Å; L154-V234 HydrophobicContact CD1-CG1 3.67Å; L154-V234 WeakPolarHBondContact CD1-O 3.47Å; L154-V234 HydrophobicContact CG-CG1 4.47Å; L154-V237 HydrophobicContact CD1-CB 4.43Å; L154-V237 HydrophobicContact CD1-CG1 4.41Å; L154-K238 HydrophobicContact CD1-CB 3.85Å; L154-K238 HydrophobicContact CD2-CD 4.33Å; L154-L241 WeakPolarHBondContact O-CD2 3.24Å
155	L	98.6	Very high	98.1	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-86.5	-14	-176.5	-58.9	176.1	0	0	0	112.8	A152 A153 F161 F164 V183 M220 L224 L241	A152-L155 PolarHBondContact O-N 2.95Å; A153-L155 PolarHBondContact O-N 3.34Å; L155-F161 HydrophobicContact CD2-CE1 4.36Å; L155-F161 WeakPolarHBondContact O-CZ 3.44Å; L155-F164 HydrophobicContact CD2-CE1 4.4Å; L155-F164 HydrophobicContact CD2-CE2 4.04Å; L155-F164 HydrophobicContact CD2-CZ 3.76Å; L155-V183 HydrophobicContact CB-CG2 4.22Å; L155-M220 HydrophobicContact CD1-CB 4.05Å; L155-M220 HydrophobicContact CD1-CG 4.07Å; L155-M220 HydrophobicContact CD1-SD 4.33Å; L155-L224 HydrophobicContact CD1-CD1 4.38Å; L155-L224 HydrophobicContact CD1-CD2 4.03Å; L155-L224 HydrophobicContact CD1-CG 4.22Å; L155-L241 HydrophobicContact CD2-CD1 4.47Å; L155-L241 HydrophobicContact CD2-CD2 4.39Å
156	V	98.8	Very high	97.8	Very high	57 Å²	57	36.2 Å²	36.2	35%	0.345	21%	0.208	S	C	.	.	S	Bend	trans	-76.2	142.8	176.3	176.3	0	0	0	0	109.9	A152 A153 H159 V183	A152-V156 PolarHBondContact O-N 3.25Å; A153-V156 PolarHBondContact O-N 3.24Å; V156-H159 PolarHBondContact O-NE2 2.78Å; V156-V183 HydrophobicContact CG2-CB 3.93Å; V156-V183 HydrophobicContact CG2-CG2 3.88Å
157	G	98.6	Very high	97.2	Very high	25 Å²	25	35.9 Å²	35.9	26%	0.258	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	103.8	-164.9	-179.7	0	0	0	0	0	113.5	T179 V180	G157-T179 CarbonylContact O-C 3.56Å; G157-T179 WeakPolarHBondContact O-CA 3.15Å; G157-V180 PolarHBondContact N-O 2.95Å; G157-V180 PolarHBondContact O-N 3.44Å
158	T	98.7	Very high	96.3	Very high	86 Å²	86	37.4 Å²	37.4	53%	0.528	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	113.1	-175.2	-57.3	0	0	0	0	110.6	V177 K178 T179	T158-V177 HydrophobicContact CG2-CG1 3.61Å; T158-K178 WeakPolarHBondContact CA-O 3.28Å; T158-T179 WeakPolarHBondContact OG1-CG2 3.35Å; T158-T179 PolarHBondContact OG1-OG1 3.27Å
159	H	98.5	Very high	95	Very high	53 Å²	53	42.8 Å²	42.8	25%	0.245	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	159.6	-177.1	-53.8	-77.6	0	0	0	111.3	L154 V156 F161 V177 K178 L241	L154-H159 PolarHBondContact O-NE2 3.22Å; V156-H159 PolarHBondContact O-NE2 2.78Å; H159-F161 HydrophobicContact CB-CD2 4.06Å; H159-F161 HydrophobicContact CB-CE2 3.68Å; H159-F161 HydrophobicContact CB-CZ 3.99Å; H159-F161 AromaticContact CD2-CZ 3.88Å; H159-F161 VanDerWaalsContact O-CD2 3.28Å; H159-F161 WeakPolarHBondContact O-CD2 3.47Å; H159-F161 PolarHBondContact O-N 2.88Å; H159-V177 VanDerWaalsContact O-CA 3.24Å; H159-V177 WeakPolarHBondContact O-CA 3.43Å; H159-K178 PolarHBondContact N-O 2.79Å; H159-K178 PolarHBondContact O-N 3.36Å; H159-L241 HydrophobicContact CB-CD1 3.98Å; H159-L241 HydrophobicContact CB-CD2 4.43Å; H159-L241 HydrophobicContact CB-CG 4.48Å
160	D	98.2	Very high	93.6	Very high	38 Å²	38	45 Å²	45	20%	0.203	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	111.8	162.5	-175	-33.8	0	0	0	109	S162 P176 V177 R244	D160-S162 VanDerWaalsContact C-N 3.35Å; D160-S162 WeakPolarHBondContact OD1-CB 3.46Å; D160-S162 PolarHBondContact OD1-N 2.86Å; D160-S162 PolarHBondContact OD1-OG 3.33Å; D160-P176 WeakPolarHBondContact OD1-CB 3.45Å; D160-V177 HydrophobicContact CB-CG2 4.39Å; D160-R244 HydrophobicContact CB-CB 4.48Å; D160-R244 HydrophobicContact CB-CG 3.87Å
161	F	98	Very high	92.2	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	25%	0.25	C	C	.	.			trans	-95.7	26	-177.9	-75	-84.6	0	0	0	113.4	L155 H159 S163 F164 R165 P176 K178 V180 L213 Q216 M220 L241	L155-F161 HydrophobicContact CD2-CE1 4.36Å; L155-F161 WeakPolarHBondContact O-CZ 3.44Å; H159-F161 HydrophobicContact CB-CD2 4.06Å; H159-F161 HydrophobicContact CB-CE2 3.68Å; H159-F161 HydrophobicContact CB-CZ 3.99Å; H159-F161 AromaticContact CD2-CZ 3.88Å; H159-F161 VanDerWaalsContact O-CD2 3.28Å; H159-F161 WeakPolarHBondContact O-CD2 3.47Å; H159-F161 PolarHBondContact O-N 2.88Å; F161-S163 VanDerWaalsContact C-N 3.27Å; F161-S163 PolarHBondContact O-N 2.92Å; F161-F164 HydrophobicContact CB-CB 4.36Å; F161-F164 HydrophobicContact CD1-CB 4.21Å; F161-F164 AromaticContact CD1-CD2 3.83Å; F161-F164 HydrophobicContact CD1-CD2 3.83Å; F161-F164 HydrophobicContact CD1-CG 4.2Å; F161-F164 CarbonylContact O-C 3.46Å; F161-F164 WeakPolarHBondContact O-CA 3.33Å; F161-F164 PolarHBondContact O-N 3.23Å; F161-R165 PolarHBondContact O-N 2.8Å; F161-P176 PolarHBondContact N-O 2.84Å; F161-K178 HydrophobicContact CD2-CB 3.74Å; F161-K178 HydrophobicContact CD2-CG 4.39Å; F161-K178 HydrophobicContact CE2-CB 4.06Å; F161-K178 WeakPolarHBondContact CE2-O 3.31Å; F161-V180 HydrophobicContact CE1-CG2 4.39Å; F161-V180 HydrophobicContact CE2-CG2 3.8Å; F161-V180 HydrophobicContact CZ-CB 4.38Å; F161-V180 HydrophobicContact CZ-CG2 3.57Å; F161-L213 HydrophobicContact CB-CD1 3.78Å; F161-Q216 HydrophobicContact CB-CG 4.47Å; F161-Q216 VanDerWaalsContact CD1-NE2 3.27Å; F161-M220 HydrophobicContact CD1-SD 4.45Å; F161-M220 HydrophobicContact CE1-SD 3.99Å; F161-L241 HydrophobicContact CD1-CD1 3.88Å; F161-L241 HydrophobicContact CE1-CD1 3.85Å
162	S	96.4	Very high	90.8	Very high	14 Å²	14	45.2 Å²	45.2	10%	0.098	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-53.7	-41.7	179.2	-69.1	0	0	0	0	112.6	D160 F164 R165 P176 R244 T246	D160-S162 VanDerWaalsContact C-N 3.35Å; D160-S162 WeakPolarHBondContact OD1-CB 3.46Å; D160-S162 PolarHBondContact OD1-N 2.86Å; D160-S162 PolarHBondContact OD1-OG 3.33Å; S162-F164 PolarHBondContact O-N 2.98Å; S162-R165 WeakPolarHBondContact O-CB 3.42Å; S162-R165 PolarHBondContact O-N 2.86Å; S162-P176 WeakPolarHBondContact OG-CB 3.3Å; S162-P176 WeakPolarHBondContact OG-CG 3.33Å; S162-R244 VanDerWaalsContact CB-O 3.25Å; S162-R244 WeakPolarHBondContact CB-O 3.28Å; S162-T246 VanDerWaalsContact O-CG2 3.32Å; S162-T246 WeakPolarHBondContact O-CG2 3.25Å
163	S	97.2	Very high	89.4	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-62.5	-29.4	174.9	-43.1	0	0	0	0	113.2	F161 R165 R219 I240 R244 D245 F249	F161-S163 VanDerWaalsContact C-N 3.27Å; F161-S163 PolarHBondContact O-N 2.92Å; S163-R165 VanDerWaalsContact C-N 3.33Å; S163-R219 PolarHBondContact O-NH1 2.88Å; S163-I240 WeakPolarHBondContact CB-O 3.3Å; S163-I240 PolarHBondContact OG-O 3.11Å; S163-R244 PolarHBondContact OG-N 2.94Å; S163-D245 WeakPolarHBondContact CA-O 3.42Å; S163-D245 WeakPolarHBondContact CB-O 3.32Å; S163-D245 PolarHBondContact OG-N 3.26Å; S163-D245 VanDerWaalsContact OG-N 3.12Å; S163-D245 PolarHBondContact OG-O 3.07Å; S163-F249 VanDerWaalsContact O-CB 3.32Å; S163-F249 WeakPolarHBondContact O-CB 3.24Å; S163-F249 WeakPolarHBondContact O-CD2 3.34Å
164	F	96.9	Very high	88.4	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-90.2	6.1	177.6	-66	-90.6	0	0	0	113.1	L155 F161 S162 Q216 R219 M220 V223 I240 L241 F249	L155-F164 HydrophobicContact CD2-CE1 4.4Å; L155-F164 HydrophobicContact CD2-CE2 4.04Å; L155-F164 HydrophobicContact CD2-CZ 3.76Å; F161-F164 HydrophobicContact CB-CB 4.36Å; F161-F164 HydrophobicContact CD1-CB 4.21Å; F161-F164 AromaticContact CD1-CD2 3.83Å; F161-F164 HydrophobicContact CD1-CD2 3.83Å; F161-F164 HydrophobicContact CD1-CG 4.2Å; F161-F164 CarbonylContact O-C 3.46Å; F161-F164 WeakPolarHBondContact O-CA 3.33Å; F161-F164 PolarHBondContact O-N 3.23Å; S162-F164 PolarHBondContact O-N 2.98Å; F164-Q216 HydrophobicContact CB-CG 3.91Å; F164-Q216 VanDerWaalsContact O-CA 3.25Å; F164-Q216 WeakPolarHBondContact O-CA 3.42Å; F164-R219 HydrophobicContact CB-CB 4.39Å; F164-R219 HydrophobicContact CD1-CB 3.97Å; F164-R219 WeakPolarHBondContact O-CD 3.47Å; F164-M220 HydrophobicContact CD1-CB 4.4Å; F164-M220 HydrophobicContact CD1-CG 3.62Å; F164-M220 HydrophobicContact CE1-CG 4.02Å; F164-M220 HydrophobicContact CG-CG 4.17Å; F164-V223 HydrophobicContact CE1-CB 4.2Å; F164-V223 HydrophobicContact CE1-CG2 3.9Å; F164-I240 HydrophobicContact CE2-CG2 4.05Å; F164-I240 HydrophobicContact CZ-CG2 3.95Å; F164-L241 HydrophobicContact CD2-CD1 4.13Å; F164-L241 HydrophobicContact CE2-CB 4.08Å; F164-L241 HydrophobicContact CE2-CD1 3.82Å; F164-F249 HydrophobicContact CD1-CD2 4.42Å; F164-F249 HydrophobicContact CD1-CE2 4.12Å; F164-F249 HydrophobicContact CE1-CE2 4.27Å
165	R	94.2	Very high	88	Confident	30 Å²	30	56 Å²	56	11%	0.113	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-95.3	129.2	174.7	175.4	179.8	170	-172.3	-4.2	110.7	F161 S162 S163 L213 R219 T246	F161-R165 PolarHBondContact O-N 2.8Å; S162-R165 WeakPolarHBondContact O-CB 3.42Å; S162-R165 PolarHBondContact O-N 2.86Å; S163-R165 VanDerWaalsContact C-N 3.33Å; R165-L213 HydrophobicContact CB-CB 4.17Å; R165-L213 HydrophobicContact CB-CD1 3.94Å; R165-L213 HydrophobicContact CG-CB 4.34Å; R165-R219 PolarHBondContact O-NH1 3.3Å; R165-T246 HydrophobicContact CB-CG2 4.46Å
166	A	90.9	Very high	87.8	Confident	8 Å²	8	56.7 Å²	56.7	7%	0.066	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-77.4	144.8	164.9	0	0	0	0	0	111.4	Y214 K215	A166-Y214 HydrophobicContact CB-CD1 3.73Å; A166-Y214 HydrophobicContact CB-CE1 3.97Å; A166-Y214 PolarHBondContact N-O 3.37Å; A166-Y214 WeakPolarHBondContact O-CD1 3.42Å; A166-K215 HydrophobicContact CB-CB 3.88Å; A166-K215 HydrophobicContact CB-CD 3.65Å; A166-K215 HydrophobicContact CB-CG 4.12Å
167	V	85.4	Confident	87.8	Confident	112 Å²	112	56.8 Å²	56.8	68%	0.679	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-78.6	137.9	174.9	-175.9	0	0	0	0	109.6	T246	V167-T246 HydrophobicContact CG2-CG2 4.23Å
168	N	80.5	Confident	87.8	Confident	48 Å²	48	56.9 Å²	56.9	26%	0.257	31%	0.313	S	S	.	.			trans	-152.2	123.9	172.9	-177.7	-36.5	0	0	0	107.4	D170 L171 Y214	N168-D170 PolarHBondContact O-N 2.82Å; N168-D170 WeakPolarHBondContact OD1-CB 3.22Å; N168-D170 PolarHBondContact OD1-N 2.94Å; N168-L171 HydrophobicContact CB-CB 4.33Å; N168-L171 HydrophobicContact CB-CD1 3.93Å; N168-L171 HydrophobicContact CB-CG 3.99Å; N168-L171 PolarHBondContact O-N 2.97Å; N168-Y214 HydrophobicContact CB-CD1 4.05Å; N168-Y214 HydrophobicContact CB-CE1 3.83Å
169	S	70.9	Confident	87.8	Confident	113 Å²	113	55.9 Å²	55.9	79%	0.79	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-29.6	-177.5	48.8	0	0	0	0	113.3	L171	S169-L171 VanDerWaalsContact C-N 3.31Å; S169-L171 PolarHBondContact O-N 2.95Å
170	D	69.7	Low	87.8	Confident	129 Å²	129	53.4 Å²	53.4	69%	0.69	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-0.9	-172.2	-50.1	-24.2	0	0	0	111.9	N168	N168-D170 PolarHBondContact O-N 2.82Å; N168-D170 WeakPolarHBondContact OD1-CB 3.22Å; N168-D170 PolarHBondContact OD1-N 2.94Å
171	L	69.5	Low	87.8	Confident	30 Å²	30	55.4 Å²	55.4	16%	0.157	31%	0.306	C	S	.	.	S	Bend	trans	-105.4	120	179.9	-64.6	-175.1	0	0	0	110.7	N168 S169 Y214	N168-L171 HydrophobicContact CB-CB 4.33Å; N168-L171 HydrophobicContact CB-CD1 3.93Å; N168-L171 HydrophobicContact CB-CG 3.99Å; N168-L171 PolarHBondContact O-N 2.97Å; S169-L171 VanDerWaalsContact C-N 3.31Å; S169-L171 PolarHBondContact O-N 2.95Å; L171-Y214 HydrophobicContact CD1-CD1 3.87Å; L171-Y214 HydrophobicContact CD1-CD2 3.75Å; L171-Y214 HydrophobicContact CD1-CE1 4.44Å; L171-Y214 HydrophobicContact CD1-CE2 4.28Å; L171-Y214 HydrophobicContact CD1-CG 3.51Å
172	P	70.2	Confident	87.8	Confident	91 Å²	91	57.6 Å²	57.6	59%	0.591	32%	0.32	S	S	*	.			trans	-59.1	148.1	176.8	24.4	-32.8	0	0	0	110.3	K174	P172-K174 PolarHBondContact O-N 2.89Å
173	F	68	Low	87.9	Confident	154 Å²	154	57.6 Å²	57.6	68%	0.675	32%	0.319	S	S	*	.			trans	-60	122.3	173	-170.5	-90.6	0	0	0	109.2	P176	F173-P176 HydrophobicContact CZ-CG 4.45Å
174	K	78.3	Confident	88	Confident	86 Å²	86	59.8 Å²	59.8	37%	0.374	33%	0.333	S	S	.	.			trans	-111.4	150.9	175.3	-66.9	-174	-178.8	-176.8	0	108.5	P172 P176	P172-K174 PolarHBondContact O-N 2.89Å; K174-P176 WeakPolarHBondContact O-CD 3.24Å
175	N	91.1	Very high	88.1	Confident	103 Å²	103	60 Å²	60	55%	0.551	33%	0.334	S	S	*	.			trans	-46.7	115.6	171.7	-178.9	-4.8	0	0	0	109.2	V177 K178	N175-V177 PolarHBondContact O-N 2.86Å; N175-V177 VanDerWaalsContact OD1-CB 3.27Å; N175-V177 WeakPolarHBondContact OD1-CB 3.07Å; N175-V177 WeakPolarHBondContact OD1-CG2 3.36Å; N175-V177 PolarHBondContact OD1-N 2.88Å; N175-K178 PolarHBondContact O-NZ 3.09Å
176	P	94.8	Very high	88.3	Confident	13 Å²	13	64.1 Å²	64.1	8%	0.084	35%	0.354	C	S	.	.			trans	-76.9	-12.5	-177.5	33.3	-36.7	0	0	0	112.4	D160 F161 S162 F173 K174 K178 L213	D160-P176 WeakPolarHBondContact OD1-CB 3.45Å; F161-P176 PolarHBondContact N-O 2.84Å; S162-P176 WeakPolarHBondContact OG-CB 3.3Å; S162-P176 WeakPolarHBondContact OG-CG 3.33Å; F173-P176 HydrophobicContact CZ-CG 4.45Å; K174-P176 WeakPolarHBondContact O-CD 3.24Å; P176-K178 PolarHBondContact O-N 3.44Å; P176-L213 HydrophobicContact CB-CD1 4.16Å
177	V	97.8	Very high	88.6	Confident	59 Å²	59	68.5 Å²	68.5	36%	0.358	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	124.4	175.2	-175.8	0	0	0	0	109.5	T158 H159 D160 N175	T158-V177 HydrophobicContact CG2-CG1 3.61Å; H159-V177 VanDerWaalsContact O-CA 3.24Å; H159-V177 WeakPolarHBondContact O-CA 3.43Å; D160-V177 HydrophobicContact CB-CG2 4.39Å; N175-V177 PolarHBondContact O-N 2.86Å; N175-V177 VanDerWaalsContact OD1-CB 3.27Å; N175-V177 WeakPolarHBondContact OD1-CB 3.07Å; N175-V177 WeakPolarHBondContact OD1-CG2 3.36Å; N175-V177 PolarHBondContact OD1-N 2.88Å
178	K	97.8	Very high	89	Confident	28 Å²	28	64.2 Å²	64.2	12%	0.122	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	150	178	-59.9	-76	158.2	-92.6	0	109.1	T158 H159 F161 N175 P176 S211 L213	T158-K178 WeakPolarHBondContact CA-O 3.28Å; H159-K178 PolarHBondContact N-O 2.79Å; H159-K178 PolarHBondContact O-N 3.36Å; F161-K178 HydrophobicContact CD2-CB 3.74Å; F161-K178 HydrophobicContact CD2-CG 4.39Å; F161-K178 HydrophobicContact CE2-CB 4.06Å; F161-K178 WeakPolarHBondContact CE2-O 3.31Å; N175-K178 PolarHBondContact O-NZ 3.09Å; P176-K178 PolarHBondContact O-N 3.44Å; K178-S211 WeakPolarHBondContact CD-O 2.84Å; K178-S211 WeakPolarHBondContact CD-OG 3.2Å; K178-S211 WeakPolarHBondContact CE-OG 3.44Å; K178-L213 HydrophobicContact CG-CG 4.18Å
179	T	98.5	Very high	89.4	Confident	64 Å²	64	65.8 Å²	65.8	39%	0.393	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	111.1	170.8	-53.2	0	0	0	0	107.9	G157 T158 S209	G157-T179 CarbonylContact O-C 3.56Å; G157-T179 WeakPolarHBondContact O-CA 3.15Å; T158-T179 WeakPolarHBondContact OG1-CG2 3.35Å; T158-T179 PolarHBondContact OG1-OG1 3.27Å; T179-S209 WeakPolarHBondContact O-CB 3.32Å; T179-S209 PolarHBondContact O-OG 3Å
180	V	98.8	Very high	90.2	Very high	1 Å²	1	60.9 Å²	60.9	1%	0.006	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	114.7	173.9	178.3	0	0	0	0	107.7	G157 F161 V183 F212	G157-V180 PolarHBondContact N-O 2.95Å; G157-V180 PolarHBondContact O-N 3.44Å; F161-V180 HydrophobicContact CE1-CG2 4.39Å; F161-V180 HydrophobicContact CE2-CG2 3.8Å; F161-V180 HydrophobicContact CZ-CB 4.38Å; F161-V180 HydrophobicContact CZ-CG2 3.57Å; V180-V183 HydrophobicContact CG1-CG2 3.47Å; V180-V183 VanDerWaalsContact CG1-CG2 3.47Å; V180-F212 HydrophobicContact CG2-CE1 4.46Å
181	D	98.6	Very high	90.5	Very high	81 Å²	81	61.8 Å²	61.8	43%	0.433	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	-34.8	-174.6	-51.5	-55.8	0	0	0	111.6	K208 S209	D181-K208 PolarHBondContact N-O 3.44Å; D181-S209 WeakPolarHBondContact OD2-CA 3.42Å
182	V	98.7	Very high	91.2	Very high	46 Å²	46	61.3 Å²	61.3	28%	0.279	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	131.9	-175.2	-177.1	0	0	0	0	109.9	T184 F207 K208	V182-T184 HydrophobicContact CG1-CG2 3.63Å; V182-F207 CarbonylContact O-C 3.58Å; V182-F207 VanDerWaalsContact O-CA 3.28Å; V182-F207 WeakPolarHBondContact O-CA 3.23Å; V182-K208 HydrophobicContact CB-CB 3.69Å; V182-K208 HydrophobicContact CG2-CB 3.85Å; V182-K208 HydrophobicContact CG2-CD 4.31Å; V182-K208 PolarHBondContact N-O 3.12Å; V182-K208 PolarHBondContact O-N 3.33Å
183	V	98.8	Very high	91.6	Very high	14 Å²	14	61 Å²	61	9%	0.085	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	108.6	159.2	-172.1	0	0	0	0	107.4	A152 L155 V156 V180 T206 F207 L224	A152-V183 HydrophobicContact CB-CB 4.15Å; A152-V183 HydrophobicContact CB-CG1 3.6Å; L155-V183 HydrophobicContact CB-CG2 4.22Å; V156-V183 HydrophobicContact CG2-CB 3.93Å; V156-V183 HydrophobicContact CG2-CG2 3.88Å; V180-V183 HydrophobicContact CG1-CG2 3.47Å; V180-V183 VanDerWaalsContact CG1-CG2 3.47Å; V183-T206 VanDerWaalsContact CA-O 3.28Å; V183-T206 WeakPolarHBondContact CA-O 3.14Å; V183-F207 HydrophobicContact CB-CD1 4.47Å; V183-F207 HydrophobicContact CG1-CD1 3.91Å; V183-F207 HydrophobicContact CG1-CE1 3.63Å; V183-F207 HydrophobicContact CG1-CZ 4.42Å; V183-F207 HydrophobicContact CG2-CD1 4Å; V183-F207 HydrophobicContact CG2-CE1 4.41Å; V183-L224 HydrophobicContact CG1-CD1 3.86Å
184	T	98.6	Very high	92.1	Very high	46 Å²	46	58.2 Å²	58.2	28%	0.282	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	144.3	-178.7	58	0	0	0	0	110.9	V182 L205 T206	V182-T184 HydrophobicContact CG1-CG2 3.63Å; T184-L205 CarbonylContact O-C 3.53Å; T184-L205 VanDerWaalsContact O-CA 3.28Å; T184-L205 WeakPolarHBondContact O-CA 3.42Å; T184-T206 PolarHBondContact N-O 2.95Å; T184-T206 PolarHBondContact O-N 3.2Å; T184-T206 WeakPolarHBondContact OG1-CB 3.29Å
185	I	98.8	Very high	92.1	Very high	5 Å²	5	62 Å²	62	3%	0.026	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	128.8	173.9	-58.8	131.4	0	0	0	107.1	M148 H149 A152 W203 E204 L205	M148-I185 VanDerWaalsContact C-CD1 3.49Å; M148-I185 HydrophobicContact CB-CD1 3.6Å; M148-I185 HydrophobicContact CE-CD1 4.34Å; M148-I185 HydrophobicContact CE-CG1 4.23Å; M148-I185 HydrophobicContact CE-CG2 4.18Å; M148-I185 WeakPolarHBondContact O-CD1 3.38Å; H149-I185 PolarHBondContact CE1-O 3.47Å; A152-I185 HydrophobicContact CB-CD1 3.95Å; I185-W203 HydrophobicContact CG2-CE3 3.8Å; I185-W203 HydrophobicContact CG2-CZ3 4.36Å; I185-E204 WeakPolarHBondContact CA-O 3.42Å; I185-L205 HydrophobicContact CG1-CD2 4.13Å; I185-L205 HydrophobicContact CG1-CG 3.83Å
186	Q	98.1	Very high	91.5	Very high	115 Å²	115	59.5 Å²	59.5	54%	0.537	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	152.8	-179.1	-65.9	-179.3	-9.3	0	0	110.6	G188 W203 E204	Q186-G188 PolarHBondContact O-N 3.19Å; Q186-W203 WeakPolarHBondContact O-CA 3.18Å; Q186-E204 PolarHBondContact N-O 3.42Å; Q186-E204 PolarHBondContact O-N 3.14Å
187	P	97.3	Very high	90.6	Very high	101 Å²	101	66.9 Å²	66.9	66%	0.656	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56.1	131	171.5	-23.9	34.1	0	0	0	110.7	W203	P187-W203 HydrophobicContact CB-CZ3 4.4Å; P187-W203 HydrophobicContact CG-CE3 4.44Å; P187-W203 HydrophobicContact CG-CH2 4.02Å; P187-W203 HydrophobicContact CG-CZ3 3.75Å
188	G	93.8	Very high	89.9	Confident	22 Å²	22	67.9 Å²	67.9	23%	0.227	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	177.4	173.5	0	0	0	0	0	111.9	Q186 F202	Q186-G188 PolarHBondContact O-N 3.19Å; G188-F202 PolarHBondContact N-O 3.11Å
189	S	89.3	Confident	89.1	Confident	81 Å²	81	77 Å²	77	57%	0.566	40%	0.396	S	S	*	.			trans	-141.2	160.5	173.7	64.3	0	0	0	0	112	R116	R116-S189 PolarHBondContact NH2-O 2.77Å
190	S	87.5	Confident	88.7	Confident	9 Å²	9	74.3 Å²	74.3	6%	0.063	38%	0.379	C	S	.	.			trans	-101.6	139.5	170	168	0	0	0	0	109.4	D131 A192 H193	D131-S190 VanDerWaalsContact OD2-CB 3.25Å; D131-S190 WeakPolarHBondContact OD2-CB 3.46Å; D131-S190 PolarHBondContact OD2-OG 2.82Å; S190-A192 PolarHBondContact O-N 3.42Å; S190-A192 PolarHBondContact OG-N 2.89Å; S190-H193 VanDerWaalsContact O-CB 3.32Å; S190-H193 WeakPolarHBondContact O-CB 3.43Å; S190-H193 PolarHBondContact O-N 3.25Å; S190-H193 VanDerWaalsContact O-N 3.16Å
191	F	76.8	Confident	88.4	Confident	149 Å²	149	79.4 Å²	79.4	65%	0.654	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-21	171.2	-66.1	-66.2	0	0	0	113.1	M1	M1-F191 HydrophobicContact CE-CB 4.43Å; M1-F191 HydrophobicContact CE-CD1 3.34Å; M1-F191 HydrophobicContact CE-CD2 4.26Å; M1-F191 HydrophobicContact CE-CE1 3.49Å; M1-F191 VanDerWaalsContact CE-CE1 3.49Å; M1-F191 HydrophobicContact CE-CE2 4.37Å; M1-F191 HydrophobicContact CE-CG 3.76Å; M1-F191 HydrophobicContact CE-CZ 4.01Å
192	A	83.8	Confident	88.2	Confident	19 Å²	19	76 Å²	76	16%	0.157	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	7.6	178.8	0	0	0	0	0	113.2	P128 T130 S190 S194 H195 F196	P128-A192 HydrophobicContact CB-CB 3.78Å; P128-A192 HydrophobicContact CG-CB 4.32Å; T130-A192 WeakPolarHBondContact OG1-CB 3.48Å; S190-A192 PolarHBondContact O-N 3.42Å; S190-A192 PolarHBondContact OG-N 2.89Å; A192-S194 VanDerWaalsContact C-N 3.29Å; A192-S194 PolarHBondContact O-N 3.49Å; A192-H195 CarbonylContact O-C 3.5Å; A192-H195 PolarHBondContact O-N 2.85Å; A192-F196 WeakPolarHBondContact O-CB 3.47Å; A192-F196 PolarHBondContact O-N 3.33Å
193	H	78.8	Confident	88.2	Confident	86 Å²	86	75.7 Å²	75.7	40%	0.398	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-54.4	-41.5	-173	-173.4	90.5	0	0	0	113.4	S190 H195	S190-H193 VanDerWaalsContact O-CB 3.32Å; S190-H193 WeakPolarHBondContact O-CB 3.43Å; S190-H193 PolarHBondContact O-N 3.25Å; S190-H193 VanDerWaalsContact O-N 3.16Å; H193-H195 VanDerWaalsContact C-N 3.28Å; H193-H195 PolarHBondContact O-N 3.06Å
194	S	78.1	Confident	88.2	Confident	95 Å²	95	77.8 Å²	77.8	66%	0.664	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-73.5	-15.5	178.1	50.2	0	0	0	0	114.5	A192	A192-S194 VanDerWaalsContact C-N 3.29Å; A192-S194 PolarHBondContact O-N 3.49Å
195	H	78.6	Confident	88.2	Confident	164 Å²	164	75.6 Å²	75.6	76%	0.759	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-116.2	4.5	-172.8	-58.6	-66.6	0	0	0	112.7	A192 H193	A192-H195 CarbonylContact O-C 3.5Å; A192-H195 PolarHBondContact O-N 2.85Å; H193-H195 VanDerWaalsContact C-N 3.28Å; H193-H195 PolarHBondContact O-N 3.06Å
196	F	79.3	Confident	88.2	Confident	51 Å²	51	76.4 Å²	76.4	22%	0.224	38%	0.379	C	S	.	.	S	Bend	trans	-110.9	132.8	-179.6	-161.8	-118.5	0	0	0	110	L126 P128 A192 R198 L200	L126-F196 VanDerWaalsContact O-CE1 3.31Å; L126-F196 WeakPolarHBondContact O-CE1 3.22Å; L126-F196 WeakPolarHBondContact O-CZ 3.4Å; P128-F196 HydrophobicContact CB-CD2 4.38Å; P128-F196 HydrophobicContact CG-CB 4.41Å; P128-F196 HydrophobicContact CG-CD1 3.88Å; P128-F196 HydrophobicContact CG-CD2 4.22Å; P128-F196 HydrophobicContact CG-CE1 4.14Å; P128-F196 HydrophobicContact CG-CE2 4.47Å; P128-F196 HydrophobicContact CG-CG 3.93Å; P128-F196 HydrophobicContact CG-CZ 4.43Å; A192-F196 WeakPolarHBondContact O-CB 3.47Å; A192-F196 PolarHBondContact O-N 3.33Å; F196-R198 HydrophobicContact CD1-CB 4.01Å; F196-R198 WeakPolarHBondContact CD1-O 3.01Å; F196-R198 HydrophobicContact CE1-CB 3.92Å; F196-R198 PolarHBondContact O-N 3.3Å; F196-L200 HydrophobicContact CE1-CD1 4.41Å
197	H	75.9	Confident	88.2	Confident	168 Å²	168	71 Å²	71	78%	0.778	35%	0.353	S	S	*	.	S	Bend	trans	-62.9	-15.2	-174.7	68.8	-82	0	0	0	113.9
198	R	81.2	Confident	88.3	Confident	80 Å²	80	69.2 Å²	69.2	30%	0.302	34%	0.336	S	S	.	.	S	Bend	trans	-117.1	132.1	-177.8	-172.7	173.9	-175.2	-159.9	-0.6	111.3	G120 F196 L200	G120-R198 PolarHBondContact O-NH1 3.31Å; G120-R198 PolarHBondContact O-NH2 3.2Å; F196-R198 HydrophobicContact CD1-CB 4.01Å; F196-R198 WeakPolarHBondContact CD1-O 3.01Å; F196-R198 HydrophobicContact CE1-CB 3.92Å; F196-R198 PolarHBondContact O-N 3.3Å; R198-L200 HydrophobicContact CG-CD2 4.07Å; R198-L200 HydrophobicContact CG-CG 4.48Å; R198-L200 PolarHBondContact O-N 2.78Å
199	R	82.5	Confident	88.5	Confident	219 Å²	219	68.2 Å²	68.2	83%	0.826	33%	0.325	S	S	*	.			trans	-80.1	104	168.1	-66.3	-175	-174.7	176.9	1.7	109.3
200	L	89.4	Confident	88.9	Confident	9 Å²	9	70.1 Å²	70.1	5%	0.047	33%	0.325	C	S	.	.			trans	-92.7	142	168.4	-61.4	177.9	0	0	0	109.4	L119 V121 L127 F196 R198 F202	L119-L200 WeakPolarHBondContact O-CD2 3.49Å; V121-L200 HydrophobicContact CG2-CD1 4.49Å; L127-L200 HydrophobicContact CD2-CD1 4.06Å; F196-L200 HydrophobicContact CE1-CD1 4.41Å; R198-L200 HydrophobicContact CG-CD2 4.07Å; R198-L200 HydrophobicContact CG-CG 4.48Å; R198-L200 PolarHBondContact O-N 2.78Å; L200-F202 HydrophobicContact CB-CD2 4.28Å; L200-F202 HydrophobicContact CB-CE2 3.63Å; L200-F202 HydrophobicContact CB-CZ 4.2Å; L200-F202 HydrophobicContact CD1-CE2 4.43Å; L200-F202 HydrophobicContact CD1-CZ 4.23Å
201	Q	92.1	Very high	89.3	Confident	108 Å²	108	71.7 Å²	71.7	51%	0.505	34%	0.336	S	S	.	.			trans	-88.9	137.4	169	-69.1	-176.8	-21.4	0	0	109.4	A118 L119 T141	A118-Q201 WeakPolarHBondContact CA-O 3.37Å; L119-Q201 HydrophobicContact CB-CB 4.29Å; L119-Q201 HydrophobicContact CD1-CB 4.43Å; L119-Q201 PolarHBondContact N-O 3.38Å; T141-Q201 PolarHBondContact O-OE1 2.77Å
202	F	95.4	Very high	90.2	Very high	10 Å²	10	66.5 Å²	66.5	4%	0.044	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	149.4	178	-70.7	-98.4	0	0	0	110	V117 A118 D131 G188 L200	V117-F202 CarbonylContact O-C 3.58Å; V117-F202 VanDerWaalsContact O-CA 3.24Å; V117-F202 WeakPolarHBondContact O-CA 3.39Å; A118-F202 HydrophobicContact CB-CD1 3.81Å; A118-F202 HydrophobicContact CB-CE1 3.59Å; A118-F202 HydrophobicContact CB-CZ 4.15Å; D131-F202 HydrophobicContact CB-CE1 4.33Å; G188-F202 PolarHBondContact N-O 3.11Å; L200-F202 HydrophobicContact CB-CD2 4.28Å; L200-F202 HydrophobicContact CB-CE2 3.63Å; L200-F202 HydrophobicContact CB-CZ 4.2Å; L200-F202 HydrophobicContact CD1-CE2 4.43Å; L200-F202 HydrophobicContact CD1-CZ 4.23Å
203	W	97.9	Very high	90.8	Very high	39 Å²	39	66.3 Å²	66.3	15%	0.148	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	140.4	173.6	-67.5	97.5	0	0	0	109.7	V117 I145 I185 Q186 P187	V117-W203 HydrophobicContact CB-CB 4.39Å; V117-W203 PolarHBondContact N-O 3.06Å; V117-W203 PolarHBondContact O-N 3.1Å; I145-W203 HydrophobicContact CB-CH2 4.48Å; I145-W203 HydrophobicContact CD1-CD2 3.85Å; I145-W203 HydrophobicContact CD1-CE3 4.08Å; I145-W203 HydrophobicContact CD1-CH2 3.85Å; I145-W203 HydrophobicContact CD1-CZ2 3.59Å; I145-W203 HydrophobicContact CD1-CZ3 4.08Å; I145-W203 HydrophobicContact CG1-CH2 3.64Å; I145-W203 HydrophobicContact CG1-CZ2 3.59Å; I145-W203 HydrophobicContact CG1-CZ3 4.22Å; I145-W203 HydrophobicContact CG2-CH2 4.12Å; I145-W203 HydrophobicContact CG2-CZ3 4.09Å; I185-W203 HydrophobicContact CG2-CE3 3.8Å; I185-W203 HydrophobicContact CG2-CZ3 4.36Å; Q186-W203 WeakPolarHBondContact O-CA 3.18Å; P187-W203 HydrophobicContact CB-CZ3 4.4Å; P187-W203 HydrophobicContact CG-CE3 4.44Å; P187-W203 HydrophobicContact CG-CH2 4.02Å; P187-W203 HydrophobicContact CG-CZ3 3.75Å
204	E	98.4	Very high	91.5	Very high	58 Å²	58	64.7 Å²	64.7	27%	0.271	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	124.6	174	-61.8	-161	159.4	0	0	110	V114 Y115 R116 I185 Q186	V114-E204 HydrophobicContact CG1-CB 4.14Å; V114-E204 HydrophobicContact CG1-CG 4.37Å; Y115-E204 WeakPolarHBondContact O-CA 3.02Å; R116-E204 HydrophobicContact CG-CG 4.26Å; R116-E204 IonicContact NE-OE1 2.84Å; R116-E204 PolarHBondContact NE-OE1 3.09Å; I185-E204 WeakPolarHBondContact CA-O 3.42Å; Q186-E204 PolarHBondContact N-O 3.42Å; Q186-E204 PolarHBondContact O-N 3.14Å
205	L	98.8	Very high	92.3	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	117.1	174.9	-69.2	78.4	0	0	0	108.5	V114 Y115 V117 M148 T184 I185 F207 T221 L224	V114-L205 CarbonylContact C-O 3.6Å; V114-L205 WeakPolarHBondContact CA-O 3.45Å; Y115-L205 PolarHBondContact N-O 2.85Å; Y115-L205 PolarHBondContact O-N 2.84Å; V117-L205 HydrophobicContact CG2-CD1 4.06Å; M148-L205 HydrophobicContact CE-CD1 4.5Å; M148-L205 HydrophobicContact CE-CD2 4.18Å; T184-L205 CarbonylContact O-C 3.53Å; T184-L205 VanDerWaalsContact O-CA 3.28Å; T184-L205 WeakPolarHBondContact O-CA 3.42Å; I185-L205 HydrophobicContact CG1-CD2 4.13Å; I185-L205 HydrophobicContact CG1-CG 3.83Å; L205-F207 HydrophobicContact CB-CE2 3.63Å; L205-F207 HydrophobicContact CB-CZ 4.03Å; L205-F207 HydrophobicContact CD2-CZ 4.24Å; L205-T221 HydrophobicContact CD2-CG2 4.34Å; L205-L224 HydrophobicContact CD2-CB 4.09Å; L205-L224 HydrophobicContact CD2-CD1 3.82Å
206	T	98.9	Very high	93.2	Very high	22 Å²	22	55.7 Å²	55.7	14%	0.135	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	134	179.1	-59.1	0	0	0	0	110.4	T112 Y113 V114 V183 T184	T112-T206 HydrophobicContact CG2-CG2 3.6Å; Y113-T206 CarbonylContact O-C 3.57Å; Y113-T206 WeakPolarHBondContact O-CA 3.29Å; V114-T206 HydrophobicContact CG2-CG2 4.36Å; V183-T206 VanDerWaalsContact CA-O 3.28Å; V183-T206 WeakPolarHBondContact CA-O 3.14Å; T184-T206 PolarHBondContact N-O 2.95Å; T184-T206 PolarHBondContact O-N 3.2Å; T184-T206 WeakPolarHBondContact OG1-CB 3.29Å
207	F	98.9	Very high	94.1	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	124.3	176.4	-55.6	-96.2	0	0	0	109.4	T112 Y113 V182 V183 L205 F212 V217 M220 T221 L224	T112-F207 CarbonylContact C-O 3.25Å; T112-F207 WeakPolarHBondContact CA-O 3.48Å; Y113-F207 PolarHBondContact N-O 2.96Å; Y113-F207 PolarHBondContact O-N 3.13Å; V182-F207 CarbonylContact O-C 3.58Å; V182-F207 VanDerWaalsContact O-CA 3.28Å; V182-F207 WeakPolarHBondContact O-CA 3.23Å; V183-F207 HydrophobicContact CB-CD1 4.47Å; V183-F207 HydrophobicContact CG1-CD1 3.91Å; V183-F207 HydrophobicContact CG1-CE1 3.63Å; V183-F207 HydrophobicContact CG1-CZ 4.42Å; V183-F207 HydrophobicContact CG2-CD1 4Å; V183-F207 HydrophobicContact CG2-CE1 4.41Å; L205-F207 HydrophobicContact CB-CE2 3.63Å; L205-F207 HydrophobicContact CB-CZ 4.03Å; L205-F207 HydrophobicContact CD2-CZ 4.24Å; F207-F212 HydrophobicContact CB-CE1 4.2Å; F207-F212 HydrophobicContact CB-CZ 4.03Å; F207-V217 HydrophobicContact CB-CG1 4.25Å; F207-V217 HydrophobicContact CD2-CG1 3.46Å; F207-V217 VanDerWaalsContact CD2-CG1 3.46Å; F207-V217 HydrophobicContact CE2-CG1 3.85Å; F207-V217 HydrophobicContact CG-CG1 3.83Å; F207-M220 HydrophobicContact CD1-CB 4.46Å; F207-M220 HydrophobicContact CD1-CE 3.57Å; F207-M220 HydrophobicContact CD1-SD 4.43Å; F207-M220 HydrophobicContact CE1-CB 3.77Å; F207-M220 HydrophobicContact CE1-CE 4.03Å; F207-M220 HydrophobicContact CG-CE 4.3Å; F207-M220 HydrophobicContact CZ-CB 4.35Å; F207-T221 WeakPolarHBondContact CE2-OG1 3.25Å; F207-T221 WeakPolarHBondContact CZ-OG1 3.37Å; F207-L224 HydrophobicContact CE1-CD1 4.01Å; F207-L224 HydrophobicContact CZ-CD1 3.95Å
208	K	98.8	Very high	95.2	Very high	65 Å²	65	47.4 Å²	47.4	28%	0.283	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	131.8	176	-170.8	173	176.5	165.8	0	110.6	S110 R111 D181 V182 D266	S110-K208 VanDerWaalsContact CB-CE 3.42Å; S110-K208 WeakPolarHBondContact OG-CE 2.93Å; R111-K208 WeakPolarHBondContact O-CA 3.39Å; D181-K208 PolarHBondContact N-O 3.44Å; V182-K208 HydrophobicContact CB-CB 3.69Å; V182-K208 HydrophobicContact CG2-CB 3.85Å; V182-K208 HydrophobicContact CG2-CD 4.31Å; V182-K208 PolarHBondContact N-O 3.12Å; V182-K208 PolarHBondContact O-N 3.33Å; K208-D266 IonicContact NZ-OD2 3.35Å; K208-D266 PolarHBondContact NZ-OD2 3.36Å
209	S	98.5	Very high	96	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	157.9	173.6	-179.9	0	0	0	0	109.9	S110 R111 T179 D181 S211	S110-S209 WeakPolarHBondContact CA-O 3.24Å; R111-S209 PolarHBondContact N-O 3.12Å; R111-S209 PolarHBondContact O-N 3.32Å; T179-S209 WeakPolarHBondContact O-CB 3.32Å; T179-S209 PolarHBondContact O-OG 3Å; D181-S209 WeakPolarHBondContact OD2-CA 3.42Å; S209-S211 PolarHBondContact O-N 2.82Å; S209-S211 PolarHBondContact OG-N 3.49Å; S209-S211 PolarHBondContact OG-O 3.2Å
210	Q	96.9	Very high	96.8	Very high	121 Å²	121	35 Å²	35	57%	0.565	16%	0.161	S	C	*	.	S	Bend	trans	-54.8	-39.2	166.1	-170.1	-177.7	27.8	0	0	112.1	Q109 R111	Q109-Q210 WeakPolarHBondContact O-CA 3.41Å; Q109-Q210 WeakPolarHBondContact O-CG 3.3Å; R111-Q210 WeakPolarHBondContact CD-O 3.42Å; R111-Q210 PolarHBondContact NH1-O 2.8Å
211	S	95.3	Very high	97.2	Very high	43 Å²	43	34.6 Å²	34.6	30%	0.301	16%	0.159	S	C	.	.			trans	-156.2	159.4	179.1	65.5	0	0	0	0	112.2	K178 S209	K178-S211 WeakPolarHBondContact CD-O 2.84Å; K178-S211 WeakPolarHBondContact CD-OG 3.2Å; K178-S211 WeakPolarHBondContact CE-OG 3.44Å; S209-S211 PolarHBondContact O-N 2.82Å; S209-S211 PolarHBondContact OG-N 3.49Å; S209-S211 PolarHBondContact OG-O 3.2Å
212	F	96.4	Very high	97.5	Very high	40 Å²	40	29.4 Å²	29.4	18%	0.175	14%	0.135	C	C	.	.			trans	-127.8	150.8	175.2	-63.2	-85.4	0	0	0	110.7	R111 Y113 V180 F207 Q216 V217 M220	R111-F212 HydrophobicContact CB-CE2 4.31Å; Y113-F212 AromaticContact CD2-CD2 3.83Å; Y113-F212 HydrophobicContact CD2-CD2 3.83Å; Y113-F212 AromaticContact CD2-CE2 3.57Å; Y113-F212 HydrophobicContact CD2-CE2 3.57Å; Y113-F212 HydrophobicContact CD2-CZ 4.31Å; Y113-F212 AromaticContact CE2-CD2 3.63Å; Y113-F212 HydrophobicContact CE2-CD2 3.63Å; Y113-F212 AromaticContact CE2-CE2 3.82Å; Y113-F212 HydrophobicContact CE2-CE2 3.82Å; V180-F212 HydrophobicContact CG2-CE1 4.46Å; F207-F212 HydrophobicContact CB-CE1 4.2Å; F207-F212 HydrophobicContact CB-CZ 4.03Å; F212-Q216 HydrophobicContact CB-CB 4.32Å; F212-V217 HydrophobicContact CB-CG2 4.34Å; F212-V217 HydrophobicContact CD1-CG2 3.58Å; F212-V217 HydrophobicContact CD2-CG2 4.19Å; F212-V217 HydrophobicContact CE1-CG2 3.81Å; F212-V217 HydrophobicContact CE2-CG2 4.4Å; F212-V217 HydrophobicContact CG-CG2 3.77Å; F212-V217 HydrophobicContact CZ-CG2 4.2Å; F212-M220 HydrophobicContact CD1-CE 4.12Å; F212-M220 HydrophobicContact CE1-CE 3.96Å
213	L	95.4	Very high	97.7	Very high	15 Å²	15	29 Å²	29	8%	0.079	13%	0.133	C	C	.	.			trans	-73.9	165.9	169.5	-56.3	174.4	0	0	0	110.8	F161 R165 P176 K178 K215 Q216	F161-L213 HydrophobicContact CB-CD1 3.78Å; R165-L213 HydrophobicContact CB-CB 4.17Å; R165-L213 HydrophobicContact CB-CD1 3.94Å; R165-L213 HydrophobicContact CG-CB 4.34Å; P176-L213 HydrophobicContact CB-CD1 4.16Å; K178-L213 HydrophobicContact CG-CG 4.18Å; L213-K215 PolarHBondContact O-N 3.4Å; L213-Q216 HydrophobicContact CB-CB 4.06Å; L213-Q216 WeakPolarHBondContact O-CB 3.44Å; L213-Q216 PolarHBondContact O-N 2.86Å; L213-Q216 VanDerWaalsContact O-N 3.08Å
214	Y	94.3	Very high	97.7	Very high	52 Å²	52	27.1 Å²	27.1	20%	0.204	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	123.7	178.5	-178.2	-122.8	0	0	0	111.2	D49 A166 N168 L171 Q216	D49-Y214 WeakPolarHBondContact OD1-CE2 3.18Å; A166-Y214 HydrophobicContact CB-CD1 3.73Å; A166-Y214 HydrophobicContact CB-CE1 3.97Å; A166-Y214 PolarHBondContact N-O 3.37Å; A166-Y214 WeakPolarHBondContact O-CD1 3.42Å; N168-Y214 HydrophobicContact CB-CD1 4.05Å; N168-Y214 HydrophobicContact CB-CE1 3.83Å; L171-Y214 HydrophobicContact CD1-CD1 3.87Å; L171-Y214 HydrophobicContact CD1-CD2 3.75Å; L171-Y214 HydrophobicContact CD1-CE1 4.44Å; L171-Y214 HydrophobicContact CD1-CE2 4.28Å; L171-Y214 HydrophobicContact CD1-CG 3.51Å; Y214-Q216 PolarHBondContact O-N 2.84Å
215	K	95.1	Very high	97.7	Very high	69 Å²	69	24.3 Å²	24.3	30%	0.3	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	11.4	-174.4	-65	179.7	178.8	169.7	0	116.3	D49 A166 L213 V217 R218 R219	D49-K215 WeakPolarHBondContact OD2-CG 3.49Å; A166-K215 HydrophobicContact CB-CB 3.88Å; A166-K215 HydrophobicContact CB-CD 3.65Å; A166-K215 HydrophobicContact CB-CG 4.12Å; L213-K215 PolarHBondContact O-N 3.4Å; K215-V217 PolarHBondContact O-N 2.83Å; K215-R218 PolarHBondContact O-N 2.88Å; K215-R219 PolarHBondContact O-N 3.1Å
216	Q	97.4	Very high	97.7	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-55.3	-49.8	-175.3	-167.7	-174.1	-17.6	0	0	112.9	F161 F164 F212 L213 Y214 R218 R219 M220	F161-Q216 HydrophobicContact CB-CG 4.47Å; F161-Q216 VanDerWaalsContact CD1-NE2 3.27Å; F164-Q216 HydrophobicContact CB-CG 3.91Å; F164-Q216 VanDerWaalsContact O-CA 3.25Å; F164-Q216 WeakPolarHBondContact O-CA 3.42Å; F212-Q216 HydrophobicContact CB-CB 4.32Å; L213-Q216 HydrophobicContact CB-CB 4.06Å; L213-Q216 WeakPolarHBondContact O-CB 3.44Å; L213-Q216 PolarHBondContact O-N 2.86Å; L213-Q216 VanDerWaalsContact O-N 3.08Å; Y214-Q216 PolarHBondContact O-N 2.84Å; Q216-R218 PolarHBondContact O-N 3.44Å; Q216-R219 PolarHBondContact O-N 3.5Å; Q216-M220 HydrophobicContact CG-CE 4.06Å; Q216-M220 HydrophobicContact CG-CG 4.44Å; Q216-M220 HydrophobicContact CG-SD 4.23Å; Q216-M220 WeakPolarHBondContact O-CG 3.45Å; Q216-M220 PolarHBondContact O-N 3.19Å
217	V	98.4	Very high	97.7	Very high	7 Å²	7	23.4 Å²	23.4	4%	0.042	11%	0.108	C	C	.	.	H	α-helix	trans	-60.3	-45.2	-178.6	-176.9	0	0	0	0	111.4	Y113 F207 F212 K215 R219 M220 T221 L260	Y113-V217 HydrophobicContact CD2-CG2 4.03Å; Y113-V217 HydrophobicContact CG-CG2 4.15Å; F207-V217 HydrophobicContact CB-CG1 4.25Å; F207-V217 HydrophobicContact CD2-CG1 3.46Å; F207-V217 VanDerWaalsContact CD2-CG1 3.46Å; F207-V217 HydrophobicContact CE2-CG1 3.85Å; F207-V217 HydrophobicContact CG-CG1 3.83Å; F212-V217 HydrophobicContact CB-CG2 4.34Å; F212-V217 HydrophobicContact CD1-CG2 3.58Å; F212-V217 HydrophobicContact CD2-CG2 4.19Å; F212-V217 HydrophobicContact CE1-CG2 3.81Å; F212-V217 HydrophobicContact CE2-CG2 4.4Å; F212-V217 HydrophobicContact CG-CG2 3.77Å; F212-V217 HydrophobicContact CZ-CG2 4.2Å; K215-V217 PolarHBondContact O-N 2.83Å; V217-R219 VanDerWaalsContact C-N 3.31Å; V217-R219 PolarHBondContact O-N 2.9Å; V217-M220 HydrophobicContact CB-CE 4.48Å; V217-M220 HydrophobicContact CG2-CE 4.23Å; V217-M220 PolarHBondContact O-N 3.38Å; V217-T221 WeakPolarHBondContact O-CB 3.25Å; V217-T221 PolarHBondContact O-N 3.38Å; V217-T221 PolarHBondContact O-OG1 3.23Å; V217-L260 HydrophobicContact CB-CD1 4.35Å; V217-L260 HydrophobicContact CB-CD2 4.28Å; V217-L260 HydrophobicContact CG1-CD1 3.59Å; V217-L260 HydrophobicContact CG1-CD2 4.36Å
218	R	98.4	Very high	97.7	Very high	38 Å²	38	23.7 Å²	23.7	14%	0.143	11%	0.111	C	C	.	.	H	α-helix	trans	-63.6	-36.7	178.1	-65.8	174.7	54.5	-165.5	-2.6	112.6	K215 Q216 G222 A255 L260	K215-R218 PolarHBondContact O-N 2.88Å; Q216-R218 PolarHBondContact O-N 3.44Å; R218-G222 PolarHBondContact O-N 3.41Å; R218-A255 VanDerWaalsContact CZ-O 3.29Å; R218-A255 PolarHBondContact NE-O 2.99Å; R218-A255 PolarHBondContact NH2-O 3.41Å; R218-A255 VanDerWaalsContact O-CB 3.3Å; R218-A255 WeakPolarHBondContact O-CB 3.25Å; R218-A255 PolarHBondContact O-N 3.3Å; R218-L260 HydrophobicContact CG-CD2 3.76Å
219	R	98.4	Very high	97.7	Very high	38 Å²	38	22.8 Å²	22.8	14%	0.143	11%	0.107	C	C	.	.	H	α-helix	trans	-69.3	-43.2	176.1	-79.5	-171.2	165.9	-150.7	1.1	111.4	S163 F164 R165 K215 Q216 V217 G222 V223 F249 A254	S163-R219 PolarHBondContact O-NH1 2.88Å; F164-R219 HydrophobicContact CB-CB 4.39Å; F164-R219 HydrophobicContact CD1-CB 3.97Å; F164-R219 WeakPolarHBondContact O-CD 3.47Å; R165-R219 PolarHBondContact O-NH1 3.3Å; K215-R219 PolarHBondContact O-N 3.1Å; Q216-R219 PolarHBondContact O-N 3.5Å; V217-R219 VanDerWaalsContact C-N 3.31Å; V217-R219 PolarHBondContact O-N 2.9Å; R219-G222 PolarHBondContact O-N 2.96Å; R219-V223 WeakPolarHBondContact O-CG2 3.43Å; R219-V223 PolarHBondContact O-N 3.44Å; R219-V223 VanDerWaalsContact O-N 3.08Å; R219-F249 HydrophobicContact CB-CD2 4.13Å; R219-F249 HydrophobicContact CB-CE1 4.46Å; R219-F249 HydrophobicContact CB-CE2 3.41Å; R219-F249 VanDerWaalsContact CB-CE2 3.41Å; R219-F249 HydrophobicContact CB-CZ 3.62Å; R219-F249 HydrophobicContact CG-CD1 4.34Å; R219-F249 HydrophobicContact CG-CD2 4.14Å; R219-F249 HydrophobicContact CG-CE1 3.89Å; R219-F249 HydrophobicContact CG-CE2 3.68Å; R219-F249 HydrophobicContact CG-CG 4.46Å; R219-F249 HydrophobicContact CG-CZ 3.54Å; R219-A254 HydrophobicContact CG-CB 4.15Å
220	M	98.8	Very high	97.6	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.5	-51.5	173.6	-68.7	-174.3	-58.2	0	0	111.1	L155 F161 F164 F207 F212 Q216 V217 G222 V223 L224	L155-M220 HydrophobicContact CD1-CB 4.05Å; L155-M220 HydrophobicContact CD1-CG 4.07Å; L155-M220 HydrophobicContact CD1-SD 4.33Å; F161-M220 HydrophobicContact CD1-SD 4.45Å; F161-M220 HydrophobicContact CE1-SD 3.99Å; F164-M220 HydrophobicContact CD1-CB 4.4Å; F164-M220 HydrophobicContact CD1-CG 3.62Å; F164-M220 HydrophobicContact CE1-CG 4.02Å; F164-M220 HydrophobicContact CG-CG 4.17Å; F207-M220 HydrophobicContact CD1-CB 4.46Å; F207-M220 HydrophobicContact CD1-CE 3.57Å; F207-M220 HydrophobicContact CD1-SD 4.43Å; F207-M220 HydrophobicContact CE1-CB 3.77Å; F207-M220 HydrophobicContact CE1-CE 4.03Å; F207-M220 HydrophobicContact CG-CE 4.3Å; F207-M220 HydrophobicContact CZ-CB 4.35Å; F212-M220 HydrophobicContact CD1-CE 4.12Å; F212-M220 HydrophobicContact CE1-CE 3.96Å; Q216-M220 HydrophobicContact CG-CE 4.06Å; Q216-M220 HydrophobicContact CG-CG 4.44Å; Q216-M220 HydrophobicContact CG-SD 4.23Å; Q216-M220 WeakPolarHBondContact O-CG 3.45Å; Q216-M220 PolarHBondContact O-N 3.19Å; V217-M220 HydrophobicContact CB-CE 4.48Å; V217-M220 HydrophobicContact CG2-CE 4.23Å; V217-M220 PolarHBondContact O-N 3.38Å; M220-G222 VanDerWaalsContact C-N 3.25Å; M220-G222 PolarHBondContact O-N 2.88Å; M220-V223 PolarHBondContact O-N 3.27Å; M220-L224 WeakPolarHBondContact O-CG 3.29Å; M220-L224 PolarHBondContact O-N 3.33Å
221	T	98.8	Very high	97.6	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-51.4	-46.4	173.7	-61.8	0	0	0	0	111.7	Y115 L205 F207 V217 V223 L224 V225 A255	Y115-T221 HydrophobicContact CD1-CG2 3.48Å; Y115-T221 VanDerWaalsContact CD1-CG2 3.48Å; Y115-T221 HydrophobicContact CD2-CG2 3.85Å; Y115-T221 HydrophobicContact CE1-CG2 3.78Å; Y115-T221 HydrophobicContact CE2-CG2 4.13Å; Y115-T221 HydrophobicContact CG-CG2 3.54Å; L205-T221 HydrophobicContact CD2-CG2 4.34Å; F207-T221 WeakPolarHBondContact CE2-OG1 3.25Å; F207-T221 WeakPolarHBondContact CZ-OG1 3.37Å; V217-T221 WeakPolarHBondContact O-CB 3.25Å; V217-T221 PolarHBondContact O-N 3.38Å; V217-T221 PolarHBondContact O-OG1 3.23Å; T221-V223 PolarHBondContact O-N 2.93Å; T221-L224 PolarHBondContact O-N 3.05Å; T221-V225 HydrophobicContact CG2-CG2 4.38Å; T221-V225 WeakPolarHBondContact O-CG2 3.28Å; T221-V225 PolarHBondContact O-N 3.47Å; T221-A255 HydrophobicContact CG2-CB 3.61Å
222	G	98.6	Very high	97.8	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-58.2	-46.9	-179.7	0	0	0	0	0	113.3	R218 R219 M220 V225 A226 V253	R218-G222 PolarHBondContact O-N 3.41Å; R219-G222 PolarHBondContact O-N 2.96Å; M220-G222 VanDerWaalsContact C-N 3.25Å; M220-G222 PolarHBondContact O-N 2.88Å; G222-V225 PolarHBondContact O-N 3.31Å; G222-A226 WeakPolarHBondContact O-CB 3.45Å; G222-A226 PolarHBondContact O-N 2.91Å; G222-V253 CarbonylContact C-O 3.57Å; G222-V253 WeakPolarHBondContact CA-O 3.39Å; G222-V253 WeakPolarHBondContact O-CG1 3.43Å
223	V	98.6	Very high	97.9	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-67.2	-40.4	178.2	170.8	0	0	0	0	111.5	F164 R219 M220 T221 A226 A227 L232 V237 I240 F249 V253	F164-V223 HydrophobicContact CE1-CB 4.2Å; F164-V223 HydrophobicContact CE1-CG2 3.9Å; R219-V223 WeakPolarHBondContact O-CG2 3.43Å; R219-V223 PolarHBondContact O-N 3.44Å; R219-V223 VanDerWaalsContact O-N 3.08Å; M220-V223 PolarHBondContact O-N 3.27Å; T221-V223 PolarHBondContact O-N 2.93Å; V223-A226 PolarHBondContact O-N 3.16Å; V223-A227 PolarHBondContact O-N 3.47Å; V223-L232 HydrophobicContact CG1-CD1 4.03Å; V223-L232 HydrophobicContact CG2-CD1 4.35Å; V223-V237 HydrophobicContact CG1-CB 4Å; V223-V237 HydrophobicContact CG1-CG1 3.62Å; V223-V237 HydrophobicContact CG1-CG2 3.44Å; V223-V237 VanDerWaalsContact CG1-CG2 3.44Å; V223-I240 HydrophobicContact CG2-CD1 4.42Å; V223-F249 HydrophobicContact CG2-CD2 4.48Å; V223-F249 HydrophobicContact CG2-CE2 3.59Å; V223-F249 HydrophobicContact CG2-CZ 4.03Å; V223-V253 HydrophobicContact CG2-CG1 3.91Å
224	L	98.9	Very high	98	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.3	-47.9	175	-64.6	175.7	0	0	0	111.3	M148 A151 A152 L155 V183 L205 F207 M220 T221 A226 A227 G228	M148-L224 HydrophobicContact CE-CB 4.49Å; M148-L224 WeakPolarHBondContact CG-O 3.29Å; A151-L224 HydrophobicContact CB-CD2 3.65Å; A152-L224 HydrophobicContact CB-CD1 4.35Å; A152-L224 HydrophobicContact CB-CD2 3.96Å; A152-L224 VanDerWaalsContact N-CD2 3.35Å; L155-L224 HydrophobicContact CD1-CD1 4.38Å; L155-L224 HydrophobicContact CD1-CD2 4.03Å; L155-L224 HydrophobicContact CD1-CG 4.22Å; V183-L224 HydrophobicContact CG1-CD1 3.86Å; L205-L224 HydrophobicContact CD2-CB 4.09Å; L205-L224 HydrophobicContact CD2-CD1 3.82Å; F207-L224 HydrophobicContact CE1-CD1 4.01Å; F207-L224 HydrophobicContact CZ-CD1 3.95Å; M220-L224 WeakPolarHBondContact O-CG 3.29Å; M220-L224 PolarHBondContact O-N 3.33Å; T221-L224 PolarHBondContact O-N 3.05Å; L224-A226 VanDerWaalsContact C-N 3.31Å; L224-A226 PolarHBondContact O-N 3.45Å; L224-A227 WeakPolarHBondContact O-CB 3.37Å; L224-A227 PolarHBondContact O-N 3.31Å; L224-A227 VanDerWaalsContact O-N 3.11Å; L224-G228 PolarHBondContact O-N 3.09Å
225	V	98.6	Very high	98.2	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.6	-38.6	175.9	170.3	0	0	0	0	111.4	V117 W136 L138 T221 G222 A227 G228 Q229	V117-V225 HydrophobicContact CG2-CG2 4.29Å; W136-V225 HydrophobicContact CE3-CG1 4.5Å; W136-V225 HydrophobicContact CE3-CG2 4.23Å; W136-V225 HydrophobicContact CH2-CB 4.19Å; W136-V225 HydrophobicContact CH2-CG1 3.78Å; W136-V225 HydrophobicContact CZ3-CB 3.76Å; W136-V225 HydrophobicContact CZ3-CG1 3.69Å; W136-V225 HydrophobicContact CZ3-CG2 3.74Å; L138-V225 HydrophobicContact CD1-CG1 3.61Å; L138-V225 HydrophobicContact CD2-CG1 4.24Å; T221-V225 HydrophobicContact CG2-CG2 4.38Å; T221-V225 WeakPolarHBondContact O-CG2 3.28Å; T221-V225 PolarHBondContact O-N 3.47Å; G222-V225 PolarHBondContact O-N 3.31Å; V225-A227 VanDerWaalsContact C-N 3.29Å; V225-A227 PolarHBondContact O-N 3.45Å; V225-G228 PolarHBondContact O-N 3.26Å; V225-Q229 HydrophobicContact CG1-CG 4.33Å; V225-Q229 WeakPolarHBondContact O-CB 3.38Å; V225-Q229 VanDerWaalsContact O-CG 3.24Å; V225-Q229 WeakPolarHBondContact O-CG 3.47Å; V225-Q229 PolarHBondContact O-N 2.94Å
226	A	98.6	Very high	98.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63	-35.5	174.8	0	0	0	0	0	112.3	G222 V223 L224 Q229 G230 R231 L232 V253	G222-A226 WeakPolarHBondContact O-CB 3.45Å; G222-A226 PolarHBondContact O-N 2.91Å; V223-A226 PolarHBondContact O-N 3.16Å; L224-A226 VanDerWaalsContact C-N 3.31Å; L224-A226 PolarHBondContact O-N 3.45Å; A226-Q229 PolarHBondContact O-N 3.11Å; A226-G230 PolarHBondContact O-N 2.87Å; A226-R231 HydrophobicContact CB-CB 4.36Å; A226-R231 PolarHBondContact O-N 2.95Å; A226-L232 HydrophobicContact CB-CB 4.38Å; A226-L232 HydrophobicContact CB-CD1 3.81Å; A226-L232 HydrophobicContact CB-CG 3.97Å; A226-L232 PolarHBondContact O-N 3.28Å; A226-V253 HydrophobicContact CB-CG1 4.16Å
227	A	98.6	Very high	98.4	Very high	3 Å²	3	28.1 Å²	28.1	3%	0.025	16%	0.16	C	C	.	.	H	α-helix	trans	-65.5	-47.5	172.3	0	0	0	0	0	111.9	A151 V223 L224 V225 Q229 G230 L232 V237	A151-A227 HydrophobicContact CB-CB 4.15Å; V223-A227 PolarHBondContact O-N 3.47Å; L224-A227 WeakPolarHBondContact O-CB 3.37Å; L224-A227 PolarHBondContact O-N 3.31Å; L224-A227 VanDerWaalsContact O-N 3.11Å; V225-A227 VanDerWaalsContact C-N 3.29Å; V225-A227 PolarHBondContact O-N 3.45Å; A227-Q229 PolarHBondContact O-N 3.23Å; A227-G230 PolarHBondContact O-N 2.98Å; A227-L232 VanDerWaalsContact CA-O 3.28Å; A227-L232 WeakPolarHBondContact CA-O 3.47Å; A227-V237 HydrophobicContact CB-CG2 4.37Å
228	G	98.5	Very high	98.4	Very high	6 Å²	6	31.7 Å²	31.7	6%	0.062	18%	0.175	C	C	.	.	H	α-helix	trans	-63.5	-21.7	175.1	0	0	0	0	0	114.3	L143 D144 M148 L224 V225	L143-G228 WeakPolarHBondContact CA-O 3.06Å; D144-G228 PolarHBondContact N-O 3.46Å; D144-G228 WeakPolarHBondContact O-CA 3.44Å; M148-G228 VanDerWaalsContact CG-CA 3.47Å; L224-G228 PolarHBondContact O-N 3.09Å; V225-G228 PolarHBondContact O-N 3.26Å
229	Q	98.1	Very high	98.4	Very high	45 Å²	45	36 Å²	36	21%	0.21	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-1.1	172.8	-70.8	174.1	-33.5	0	0	113.3	N140 L143 V225 A226 A227 R231	N140-Q229 PolarHBondContact OD1-NE2 2.8Å; L143-Q229 HydrophobicContact CD2-CG 3.6Å; V225-Q229 HydrophobicContact CG1-CG 4.33Å; V225-Q229 WeakPolarHBondContact O-CB 3.38Å; V225-Q229 VanDerWaalsContact O-CG 3.24Å; V225-Q229 WeakPolarHBondContact O-CG 3.47Å; V225-Q229 PolarHBondContact O-N 2.94Å; A226-Q229 PolarHBondContact O-N 3.11Å; A227-Q229 PolarHBondContact O-N 3.23Å; Q229-R231 HydrophobicContact CB-CG 4.14Å; Q229-R231 PolarHBondContact O-N 2.95Å
230	G	97.6	Very high	98.4	Very high	67 Å²	67	35 Å²	35	69%	0.691	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.5	11.1	-174	0	0	0	0	0	114.6	A226 A227	A226-G230 PolarHBondContact O-N 2.87Å; A227-G230 PolarHBondContact O-N 2.98Å
231	R	97.8	Very high	98.4	Very high	125 Å²	125	35.1 Å²	35.1	47%	0.472	20%	0.195	S	C	.	.	S	Bend	trans	-80.3	-22.2	178.1	-66.1	-169.7	-63.9	114.2	-2.6	112.8	A226 Q229	A226-R231 HydrophobicContact CB-CB 4.36Å; A226-R231 PolarHBondContact O-N 2.95Å; Q229-R231 HydrophobicContact CB-CG 4.14Å; Q229-R231 PolarHBondContact O-N 2.95Å
232	L	98.1	Very high	98.4	Very high	25 Å²	25	39.1 Å²	39.1	13%	0.131	22%	0.216	C	C	.	.	S	Bend	trans	-130.6	136.6	170.8	-67.5	177.2	0	0	0	108.7	V223 A226 A227 Q236 V237 I240 P250	V223-L232 HydrophobicContact CG1-CD1 4.03Å; V223-L232 HydrophobicContact CG2-CD1 4.35Å; A226-L232 HydrophobicContact CB-CB 4.38Å; A226-L232 HydrophobicContact CB-CD1 3.81Å; A226-L232 HydrophobicContact CB-CG 3.97Å; A226-L232 PolarHBondContact O-N 3.28Å; A227-L232 VanDerWaalsContact CA-O 3.28Å; A227-L232 WeakPolarHBondContact CA-O 3.47Å; L232-Q236 HydrophobicContact CD2-CB 4.27Å; L232-V237 HydrophobicContact CB-CG2 4.45Å; L232-I240 HydrophobicContact CD1-CD1 4Å; L232-P250 HydrophobicContact CD1-CG 4.36Å
233	S	98.5	Very high	98.4	Very high	49 Å²	49	41.4 Å²	41.4	34%	0.343	24%	0.235	S	C	.	.			trans	-78.7	157.5	166	57.7	0	0	0	0	110.8	S235 Q236 V237	S233-S235 PolarHBondContact O-N 3.23Å; S233-S235 PolarHBondContact OG-OG 3.25Å; S233-S235 VanDerWaalsContact OG-OG 3.06Å; S233-Q236 WeakPolarHBondContact O-CB 3.38Å; S233-Q236 PolarHBondContact O-N 3.17Å; S233-Q236 VanDerWaalsContact OG-CG 3.26Å; S233-Q236 WeakPolarHBondContact OG-CG 3.49Å; S233-Q236 PolarHBondContact OG-N 3.31Å; S233-Q236 PolarHBondContact OG-OE1 2.98Å; S233-V237 WeakPolarHBondContact O-CG2 3.31Å; S233-V237 PolarHBondContact O-N 3.5Å
234	V	98.5	Very high	98.3	Very high	33 Å²	33	49 Å²	49	20%	0.2	26%	0.263	C	S	.	.	H	α-helix	trans	-55.4	-37.2	174.6	176.9	0	0	0	0	111.5	E150 L154 V237 K238	E150-V234 HydrophobicContact CB-CG1 4.05Å; E150-V234 HydrophobicContact CB-CG2 3.8Å; L154-V234 HydrophobicContact CD1-CG1 3.67Å; L154-V234 WeakPolarHBondContact CD1-O 3.47Å; L154-V234 HydrophobicContact CG-CG1 4.47Å; V234-V237 WeakPolarHBondContact O-CB 3.4Å; V234-V237 PolarHBondContact O-N 2.92Å; V234-K238 PolarHBondContact O-N 3.23Å
235	S	98.5	Very high	98.1	Very high	74 Å²	74	52.3 Å²	52.3	52%	0.517	28%	0.282	S	S	.	.	H	α-helix	trans	-66	-38.1	175.8	61.6	0	0	0	0	112.6	S233 V237 K238 Q239	S233-S235 PolarHBondContact O-N 3.23Å; S233-S235 PolarHBondContact OG-OG 3.25Å; S233-S235 VanDerWaalsContact OG-OG 3.06Å; S235-V237 VanDerWaalsContact C-N 3.34Å; S235-K238 WeakPolarHBondContact O-CB 3.36Å; S235-K238 PolarHBondContact O-N 3.02Å; S235-Q239 WeakPolarHBondContact O-CG 3.48Å; S235-Q239 PolarHBondContact O-N 3.22Å
236	Q	98.4	Very high	97.8	Very high	80 Å²	80	54.4 Å²	54.4	37%	0.374	29%	0.294	S	S	.	.	H	α-helix	trans	-66.2	-36.3	173	-73.6	167.7	-53.2	0	0	111.9	L232 S233 K238 Q239 I240	L232-Q236 HydrophobicContact CD2-CB 4.27Å; S233-Q236 WeakPolarHBondContact O-CB 3.38Å; S233-Q236 PolarHBondContact O-N 3.17Å; S233-Q236 VanDerWaalsContact OG-CG 3.26Å; S233-Q236 WeakPolarHBondContact OG-CG 3.49Å; S233-Q236 PolarHBondContact OG-N 3.31Å; S233-Q236 PolarHBondContact OG-OE1 2.98Å; Q236-K238 VanDerWaalsContact C-N 3.3Å; Q236-K238 PolarHBondContact O-N 3.03Å; Q236-Q239 PolarHBondContact O-N 2.54Å; Q236-I240 VanDerWaalsContact O-CG1 3.31Å; Q236-I240 WeakPolarHBondContact O-CG1 3.5Å; Q236-I240 PolarHBondContact O-N 2.84Å
237	V	98.5	Very high	97.5	Very high	1 Å²	1	61.3 Å²	61.3	1%	0.006	33%	0.33	C	S	.	.	H	α-helix	trans	-58.7	-44.7	171.5	178.6	0	0	0	0	110.6	A151 L154 V223 A227 L232 S233 V234 S235 I240 L241	A151-V237 HydrophobicContact CB-CB 4.36Å; A151-V237 HydrophobicContact CB-CG1 4.21Å; A151-V237 HydrophobicContact CB-CG2 4.03Å; L154-V237 HydrophobicContact CD1-CB 4.43Å; L154-V237 HydrophobicContact CD1-CG1 4.41Å; V223-V237 HydrophobicContact CG1-CB 4Å; V223-V237 HydrophobicContact CG1-CG1 3.62Å; V223-V237 HydrophobicContact CG1-CG2 3.44Å; V223-V237 VanDerWaalsContact CG1-CG2 3.44Å; A227-V237 HydrophobicContact CB-CG2 4.37Å; L232-V237 HydrophobicContact CB-CG2 4.45Å; S233-V237 WeakPolarHBondContact O-CG2 3.31Å; S233-V237 PolarHBondContact O-N 3.5Å; V234-V237 WeakPolarHBondContact O-CB 3.4Å; V234-V237 PolarHBondContact O-N 2.92Å; S235-V237 VanDerWaalsContact C-N 3.34Å; V237-I240 PolarHBondContact O-N 3.49Å; V237-L241 PolarHBondContact O-N 2.73Å; V237-L241 VanDerWaalsContact O-N 3.15Å
238	K	98.6	Very high	97.4	Very high	82 Å²	82	62.8 Å²	62.8	36%	0.357	34%	0.343	S	S	.	.	H	α-helix	trans	-61.8	-44.6	175.8	-173.8	51.9	176.9	-65.8	0	112.1	L154 V234 S235 Q236 I240 L241 D242	L154-K238 HydrophobicContact CD1-CB 3.85Å; L154-K238 HydrophobicContact CD2-CD 4.33Å; V234-K238 PolarHBondContact O-N 3.23Å; S235-K238 WeakPolarHBondContact O-CB 3.36Å; S235-K238 PolarHBondContact O-N 3.02Å; Q236-K238 VanDerWaalsContact C-N 3.3Å; Q236-K238 PolarHBondContact O-N 3.03Å; K238-I240 VanDerWaalsContact C-N 3.32Å; K238-I240 PolarHBondContact O-N 3.14Å; K238-L241 WeakPolarHBondContact O-CB 3.5Å; K238-L241 PolarHBondContact O-N 3.03Å; K238-L241 VanDerWaalsContact O-N 3.14Å; K238-D242 VanDerWaalsContact CE-CG 3.46Å; K238-D242 WeakPolarHBondContact CE-OD1 3.45Å; K238-D242 WeakPolarHBondContact CE-OD2 3.5Å; K238-D242 WeakPolarHBondContact CG-OD2 3.47Å; K238-D242 WeakPolarHBondContact O-CB 3.23Å; K238-D242 PolarHBondContact O-N 3.19Å
239	Q	98.4	Very high	97.3	Very high	129 Å²	129	63.2 Å²	63.2	60%	0.603	34%	0.343	S	S	*	.	H	α-helix	trans	-59.2	-41.2	177.1	-72	170.2	-9.6	0	0	112.3	S235 Q236 L241 D242 A243	S235-Q239 WeakPolarHBondContact O-CG 3.48Å; S235-Q239 PolarHBondContact O-N 3.22Å; Q236-Q239 PolarHBondContact O-N 2.54Å; Q239-L241 VanDerWaalsContact C-N 3.35Å; Q239-L241 PolarHBondContact O-N 3.16Å; Q239-D242 PolarHBondContact O-N 3.42Å; Q239-A243 WeakPolarHBondContact O-CB 3.44Å; Q239-A243 PolarHBondContact O-N 3.28Å
240	I	98.4	Very high	97.1	Very high	16 Å²	16	62.8 Å²	62.8	8%	0.082	34%	0.344	C	S	.	.	H	α-helix	trans	-60.9	-45.4	175.6	-66.8	161.9	0	0	0	110.3	S163 F164 V223 L232 Q236 V237 K238 P250	S163-I240 WeakPolarHBondContact CB-O 3.3Å; S163-I240 PolarHBondContact OG-O 3.11Å; F164-I240 HydrophobicContact CE2-CG2 4.05Å; F164-I240 HydrophobicContact CZ-CG2 3.95Å; V223-I240 HydrophobicContact CG2-CD1 4.42Å; L232-I240 HydrophobicContact CD1-CD1 4Å; Q236-I240 VanDerWaalsContact O-CG1 3.31Å; Q236-I240 WeakPolarHBondContact O-CG1 3.5Å; Q236-I240 PolarHBondContact O-N 2.84Å; V237-I240 PolarHBondContact O-N 3.49Å; K238-I240 VanDerWaalsContact C-N 3.32Å; K238-I240 PolarHBondContact O-N 3.14Å; I240-P250 HydrophobicContact CD1-CG 4.04Å
241	L	98.4	Very high	96.8	Very high	3 Å²	3	67.7 Å²	67.7	2%	0.016	35%	0.349	C	S	.	.	H	α-helix	trans	-63.4	-46.7	177.7	-176.5	64	0	0	0	111.8	L154 L155 H159 F161 F164 V237 K238 Q239 A243 R244	L154-L241 WeakPolarHBondContact O-CD2 3.24Å; L155-L241 HydrophobicContact CD2-CD1 4.47Å; L155-L241 HydrophobicContact CD2-CD2 4.39Å; H159-L241 HydrophobicContact CB-CD1 3.98Å; H159-L241 HydrophobicContact CB-CD2 4.43Å; H159-L241 HydrophobicContact CB-CG 4.48Å; F161-L241 HydrophobicContact CD1-CD1 3.88Å; F161-L241 HydrophobicContact CE1-CD1 3.85Å; F164-L241 HydrophobicContact CD2-CD1 4.13Å; F164-L241 HydrophobicContact CE2-CB 4.08Å; F164-L241 HydrophobicContact CE2-CD1 3.82Å; V237-L241 PolarHBondContact O-N 2.73Å; V237-L241 VanDerWaalsContact O-N 3.15Å; K238-L241 WeakPolarHBondContact O-CB 3.5Å; K238-L241 PolarHBondContact O-N 3.03Å; K238-L241 VanDerWaalsContact O-N 3.14Å; Q239-L241 VanDerWaalsContact C-N 3.35Å; Q239-L241 PolarHBondContact O-N 3.16Å; L241-A243 VanDerWaalsContact C-N 3.28Å; L241-A243 PolarHBondContact O-N 3.44Å; L241-R244 PolarHBondContact O-N 2.82Å
242	D	98.4	Very high	96.3	Very high	83 Å²	83	69.6 Å²	69.6	44%	0.444	37%	0.368	S	S	.	.	H	α-helix	trans	-70.9	-21.6	-176.4	-70.3	-16.9	0	0	0	113.4	K238 Q239 R244	K238-D242 VanDerWaalsContact CE-CG 3.46Å; K238-D242 WeakPolarHBondContact CE-OD1 3.45Å; K238-D242 WeakPolarHBondContact CE-OD2 3.5Å; K238-D242 WeakPolarHBondContact CG-OD2 3.47Å; K238-D242 WeakPolarHBondContact O-CB 3.23Å; K238-D242 PolarHBondContact O-N 3.19Å; Q239-D242 PolarHBondContact O-N 3.42Å; D242-R244 VanDerWaalsContact C-N 3.25Å; D242-R244 PolarHBondContact O-N 3.17Å
243	A	98	Very high	96.2	Very high	49 Å²	49	68.8 Å²	68.8	41%	0.405	36%	0.364	S	S	.	.	H	α-helix	trans	-64	-28.9	178.6	0	0	0	0	0	113.3	Q239 L241 D245 A248	Q239-A243 WeakPolarHBondContact O-CB 3.44Å; Q239-A243 PolarHBondContact O-N 3.28Å; L241-A243 VanDerWaalsContact C-N 3.28Å; L241-A243 PolarHBondContact O-N 3.44Å; A243-D245 PolarHBondContact O-N 2.82Å; A243-D245 VanDerWaalsContact O-N 3.07Å; A243-A248 HydrophobicContact CB-CB 3.48Å; A243-A248 VanDerWaalsContact CB-CB 3.48Å
244	R	96.9	Very high	96.1	Very high	158 Å²	158	68.4 Å²	68.4	60%	0.596	36%	0.364	S	S	*	.			trans	49.4	35.2	-179.8	-53.7	177.4	-169.8	175.5	2.4	113.3	D160 S162 S163 L241 D242	D160-R244 HydrophobicContact CB-CB 4.48Å; D160-R244 HydrophobicContact CB-CG 3.87Å; S162-R244 VanDerWaalsContact CB-O 3.25Å; S162-R244 WeakPolarHBondContact CB-O 3.28Å; S163-R244 PolarHBondContact OG-N 2.94Å; L241-R244 PolarHBondContact O-N 2.82Å; D242-R244 VanDerWaalsContact C-N 3.25Å; D242-R244 PolarHBondContact O-N 3.17Å
245	D	94.9	Very high	96.1	Very high	71 Å²	71	66.9 Å²	66.9	38%	0.38	36%	0.355	S	S	.	.			trans	-132.8	124.7	-175.3	-178.5	-3.2	0	0	0	109.8	S163 A243 L247 A248	S163-D245 WeakPolarHBondContact CA-O 3.42Å; S163-D245 WeakPolarHBondContact CB-O 3.32Å; S163-D245 PolarHBondContact OG-N 3.26Å; S163-D245 VanDerWaalsContact OG-N 3.12Å; S163-D245 PolarHBondContact OG-O 3.07Å; A243-D245 PolarHBondContact O-N 2.82Å; A243-D245 VanDerWaalsContact O-N 3.07Å; D245-L247 PolarHBondContact O-N 2.93Å; D245-L247 VanDerWaalsContact O-N 3.08Å; D245-L247 PolarHBondContact OD1-N 3.5Å; D245-A248 HydrophobicContact CB-CB 4.24Å; D245-A248 VanDerWaalsContact O-CB 3.29Å; D245-A248 WeakPolarHBondContact O-CB 2.93Å; D245-A248 PolarHBondContact O-N 3.44Å
246	T	91.8	Very high	96	Very high	43 Å²	43	64.5 Å²	64.5	26%	0.264	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-53.2	-27.7	175.6	52.1	0	0	0	0	114.2	S162 R165 V167	S162-T246 VanDerWaalsContact O-CG2 3.32Å; S162-T246 WeakPolarHBondContact O-CG2 3.25Å; R165-T246 HydrophobicContact CB-CG2 4.46Å; V167-T246 HydrophobicContact CG2-CG2 4.23Å
247	L	93.1	Very high	96	Very high	145 Å²	145	61.3 Å²	61.3	76%	0.759	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-81.2	-17.4	178.2	-59.4	-179.7	0	0	0	113.2	D245 F249	D245-L247 PolarHBondContact O-N 2.93Å; D245-L247 VanDerWaalsContact O-N 3.08Å; D245-L247 PolarHBondContact OD1-N 3.5Å; L247-F249 PolarHBondContact O-N 3.36Å
248	A	95.1	Very high	95.9	Very high	35 Å²	35	65 Å²	65	29%	0.289	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-73	-11.3	178.5	0	0	0	0	0	113.2	A243 D245	A243-A248 HydrophobicContact CB-CB 3.48Å; A243-A248 VanDerWaalsContact CB-CB 3.48Å; D245-A248 HydrophobicContact CB-CB 4.24Å; D245-A248 VanDerWaalsContact O-CB 3.29Å; D245-A248 WeakPolarHBondContact O-CB 2.93Å; D245-A248 PolarHBondContact O-N 3.44Å
249	F	97	Very high	95.8	Very high	15 Å²	15	61.1 Å²	61.1	7%	0.066	32%	0.322	C	S	.	.	S	Bend	trans	-72.7	126.9	178.4	-166	-93.9	0	0	0	111.2	S163 F164 R219 V223 L247 V253 A254	S163-F249 VanDerWaalsContact O-CB 3.32Å; S163-F249 WeakPolarHBondContact O-CB 3.24Å; S163-F249 WeakPolarHBondContact O-CD2 3.34Å; F164-F249 HydrophobicContact CD1-CD2 4.42Å; F164-F249 HydrophobicContact CD1-CE2 4.12Å; F164-F249 HydrophobicContact CE1-CE2 4.27Å; R219-F249 HydrophobicContact CB-CD2 4.13Å; R219-F249 HydrophobicContact CB-CE1 4.46Å; R219-F249 HydrophobicContact CB-CE2 3.41Å; R219-F249 VanDerWaalsContact CB-CE2 3.41Å; R219-F249 HydrophobicContact CB-CZ 3.62Å; R219-F249 HydrophobicContact CG-CD1 4.34Å; R219-F249 HydrophobicContact CG-CD2 4.14Å; R219-F249 HydrophobicContact CG-CE1 3.89Å; R219-F249 HydrophobicContact CG-CE2 3.68Å; R219-F249 HydrophobicContact CG-CG 4.46Å; R219-F249 HydrophobicContact CG-CZ 3.54Å; V223-F249 HydrophobicContact CG2-CD2 4.48Å; V223-F249 HydrophobicContact CG2-CE2 3.59Å; V223-F249 HydrophobicContact CG2-CZ 4.03Å; L247-F249 PolarHBondContact O-N 3.36Å; F249-V253 HydrophobicContact CE1-CB 4.05Å; F249-V253 HydrophobicContact CE1-CG1 4.45Å; F249-V253 HydrophobicContact CZ-CB 4.16Å; F249-V253 HydrophobicContact CZ-CG1 4.04Å; F249-A254 HydrophobicContact CE1-CB 4.01Å; F249-A254 HydrophobicContact CZ-CB 4.35Å
250	P	94.4	Very high	95.8	Very high	35 Å²	35	55.3 Å²	55.3	23%	0.227	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-64.2	138.7	-178.8	23.5	-31.8	0	0	0	112.2	L232 I240 V253	L232-P250 HydrophobicContact CD1-CG 4.36Å; I240-P250 HydrophobicContact CD1-CG 4.04Å; P250-V253 HydrophobicContact CB-CB 4.3Å; P250-V253 HydrophobicContact CB-CG2 3.66Å; P250-V253 HydrophobicContact CG-CB 3.84Å; P250-V253 HydrophobicContact CG-CG1 4.13Å; P250-V253 HydrophobicContact CG-CG2 3.59Å
251	H	90.3	Very high	95.8	Very high	171 Å²	171	55.4 Å²	55.4	79%	0.792	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	145.1	175.9	-66.7	-77.6	0	0	0	111.3	V253	H251-V253 PolarHBondContact O-N 2.77Å
252	D	88.2	Confident	95.8	Very high	165 Å²	165	55.3 Å²	55.3	88%	0.882	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	17.1	175.7	-54	-41.5	0	0	0	116.5
253	V	95.3	Very high	95.8	Very high	7 Å²	7	56.1 Å²	56.1	4%	0.042	30%	0.295	C	S	.	.			trans	-89.1	-24.8	175	171.8	0	0	0	0	112.2	G222 V223 A226 F249 P250 H251 A255	G222-V253 CarbonylContact C-O 3.57Å; G222-V253 WeakPolarHBondContact CA-O 3.39Å; G222-V253 WeakPolarHBondContact O-CG1 3.43Å; V223-V253 HydrophobicContact CG2-CG1 3.91Å; A226-V253 HydrophobicContact CB-CG1 4.16Å; F249-V253 HydrophobicContact CE1-CB 4.05Å; F249-V253 HydrophobicContact CE1-CG1 4.45Å; F249-V253 HydrophobicContact CZ-CB 4.16Å; F249-V253 HydrophobicContact CZ-CG1 4.04Å; P250-V253 HydrophobicContact CB-CB 4.3Å; P250-V253 HydrophobicContact CB-CG2 3.66Å; P250-V253 HydrophobicContact CG-CB 3.84Å; P250-V253 HydrophobicContact CG-CG1 4.13Å; P250-V253 HydrophobicContact CG-CG2 3.59Å; H251-V253 PolarHBondContact O-N 2.77Å; V253-A255 PolarHBondContact O-N 3.09Å
254	A	96.9	Very high	95.8	Very high	42 Å²	42	55.2 Å²	55.2	35%	0.347	29%	0.285	S	S	.	.	S	Bend	trans	-61.4	129.3	-175.4	0	0	0	0	0	111.9	R219 F249	R219-A254 HydrophobicContact CG-CB 4.15Å; F249-A254 HydrophobicContact CE1-CB 4.01Å; F249-A254 HydrophobicContact CZ-CB 4.35Å
255	A	98.1	Very high	95.8	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-64.5	148.3	-178.4	0	0	0	0	0	111.6	Y115 W136 R218 T221 V253	Y115-A255 HydrophobicContact CE1-CB 4.37Å; Y115-A255 HydrophobicContact CE2-CB 3.73Å; Y115-A255 WeakPolarHBondContact OH-CB 3.39Å; W136-A255 HydrophobicContact CE3-CB 3.98Å; W136-A255 HydrophobicContact CZ3-CB 3.83Å; R218-A255 VanDerWaalsContact CZ-O 3.29Å; R218-A255 PolarHBondContact NE-O 2.99Å; R218-A255 PolarHBondContact NH2-O 3.41Å; R218-A255 VanDerWaalsContact O-CB 3.3Å; R218-A255 WeakPolarHBondContact O-CB 3.25Å; R218-A255 PolarHBondContact O-N 3.3Å; T221-A255 HydrophobicContact CG2-CB 3.61Å; V253-A255 PolarHBondContact O-N 3.09Å
256	P	97.3	Very high	96	Very high	25 Å²	25	47.3 Å²	47.3	16%	0.162	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-59.4	162.7	174.8	16.9	-24.7	0	0	0	112.9	Y115 W136 Y258	Y115-P256 VanDerWaalsContact CE2-O 3.25Å; Y115-P256 WeakPolarHBondContact CE2-O 3.43Å; Y115-P256 WeakPolarHBondContact OH-CD 3.38Å; Y115-P256 VanDerWaalsContact OH-CG 3.26Å; Y115-P256 WeakPolarHBondContact OH-CG 3.41Å; Y115-P256 PolarHBondContact OH-O 3.48Å; W136-P256 HydrophobicContact CB-CG 4.03Å; W136-P256 HydrophobicContact CD2-CG 3.84Å; W136-P256 HydrophobicContact CG-CG 3.52Å; P256-Y258 HydrophobicContact CB-CD1 3.89Å; P256-Y258 HydrophobicContact CB-CE1 3.37Å; P256-Y258 HydrophobicContact CB-CE2 4.12Å; P256-Y258 HydrophobicContact CB-CG 4.46Å; P256-Y258 VanDerWaalsContact CB-CZ 3.49Å; P256-Y258 HydrophobicContact CG-CE1 4.06Å; P256-Y258 HydrophobicContact CG-CE2 4.03Å
257	A	97.6	Very high	96.2	Very high	13 Å²	13	46.9 Å²	46.9	11%	0.107	25%	0.249	C	C	.	.	S	Bend	trans	-75.7	-39.6	-176	0	0	0	0	0	113	A50 G51 V52 G259 L260	A50-A257 WeakPolarHBondContact O-CB 3.13Å; G51-A257 CarbonylContact O-C 3.54Å; G51-A257 VanDerWaalsContact O-C 3.25Å; V52-A257 HydrophobicContact CG2-CB 3.84Å; A257-G259 PolarHBondContact O-N 3.31Å; A257-G259 VanDerWaalsContact O-N 3.12Å; A257-L260 WeakPolarHBondContact O-CB 3.27Å; A257-L260 PolarHBondContact O-N 3.34Å
258	Y	96.1	Very high	96.3	Very high	78 Å²	78	45.2 Å²	45.2	31%	0.306	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-10.9	-169.2	56.3	-108.3	0	0	0	115.5	G51 H53 N133 L134 C135 P256	G51-Y258 WeakPolarHBondContact O-CA 3.42Å; G51-Y258 PolarHBondContact O-N 2.84Å; H53-Y258 PolarHBondContact CD2-O 3.06Å; H53-Y258 VanDerWaalsContact CD2-O 3.25Å; H53-Y258 PolarHBondContact NE2-O 3.12Å; H53-Y258 VanDerWaalsContact NE2-O 3.11Å; N133-Y258 VanDerWaalsContact O-O 3.12Å; N133-Y258 WeakPolarHBondContact OD1-CB 3.46Å; N133-Y258 VanDerWaalsContact OD1-CG 3.25Å; L134-Y258 CarbonylContact C-O 3.51Å; L134-Y258 WeakPolarHBondContact CA-O 3.46Å; C135-Y258 WeakPolarHBondContact O-CD2 3.43Å; C135-Y258 WeakPolarHBondContact O-CE2 3.5Å; P256-Y258 HydrophobicContact CB-CD1 3.89Å; P256-Y258 HydrophobicContact CB-CE1 3.37Å; P256-Y258 HydrophobicContact CB-CE2 4.12Å; P256-Y258 HydrophobicContact CB-CG 4.46Å; P256-Y258 VanDerWaalsContact CB-CZ 3.49Å; P256-Y258 HydrophobicContact CG-CE1 4.06Å; P256-Y258 HydrophobicContact CG-CE2 4.03Å
259	G	97.4	Very high	96.1	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-11	171.1	0	0	0	0	0	113.7	Y115 R116 A257 F261	Y115-G259 CarbonylContact C-O 3.51Å; Y115-G259 VanDerWaalsContact CA-O 3.3Å; Y115-G259 WeakPolarHBondContact CA-O 3.33Å; R116-G259 PolarHBondContact N-O 3.37Å; A257-G259 PolarHBondContact O-N 3.31Å; A257-G259 VanDerWaalsContact O-N 3.12Å; G259-F261 WeakPolarHBondContact O-CD2 3.28Å
260	L	98.6	Very high	95.8	Very high	8 Å²	8	54 Å²	54	4%	0.042	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	134.7	-172	-176.5	62.4	0	0	0	112	V52 H53 Y113 Y115 V217 R218 A257	V52-L260 HydrophobicContact CG1-CB 4.06Å; V52-L260 HydrophobicContact CG1-CD2 3.91Å; V52-L260 HydrophobicContact CG1-CG 3.86Å; V52-L260 HydrophobicContact CG2-CB 4.32Å; V52-L260 HydrophobicContact CG2-CD2 4.08Å; H53-L260 PolarHBondContact N-O 3.2Å; Y113-L260 HydrophobicContact CD1-CD1 3.71Å; Y113-L260 HydrophobicContact CD1-CD2 4.12Å; Y113-L260 HydrophobicContact CD1-CG 3.91Å; Y113-L260 HydrophobicContact CE1-CD2 4.42Å; Y113-L260 HydrophobicContact CG-CD1 4.16Å; Y115-L260 HydrophobicContact CD2-CB 3.7Å; Y115-L260 HydrophobicContact CD2-CD1 4Å; Y115-L260 HydrophobicContact CD2-CG 4.4Å; Y115-L260 HydrophobicContact CE2-CB 3.97Å; V217-L260 HydrophobicContact CB-CD1 4.35Å; V217-L260 HydrophobicContact CB-CD2 4.28Å; V217-L260 HydrophobicContact CG1-CD1 3.59Å; V217-L260 HydrophobicContact CG1-CD2 4.36Å; R218-L260 HydrophobicContact CG-CD2 3.76Å; A257-L260 WeakPolarHBondContact O-CB 3.27Å; A257-L260 PolarHBondContact O-N 3.34Å
261	F	98.5	Very high	95.6	Very high	18 Å²	18	53.4 Å²	53.4	8%	0.079	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	130.1	176.8	-62.4	-102.2	0	0	0	109.8	H53 L55 Y113 V114 R116 L134 G259 K263	H53-F261 HydrophobicContact CB-CD1 3.36Å; H53-F261 HydrophobicContact CB-CE1 3.42Å; H53-F261 VanDerWaalsContact CB-CE1 3.42Å; H53-F261 HydrophobicContact CB-CG 4.03Å; H53-F261 HydrophobicContact CB-CZ 4.14Å; H53-F261 AromaticContact CD2-CE1 3.6Å; H53-F261 AromaticContact CD2-CE2 3.95Å; H53-F261 AromaticContact CD2-CZ 3.42Å; H53-F261 VanDerWaalsContact CD2-CZ 3.42Å; H53-F261 WeakPolarHBondContact CD2-CZ 3.48Å; H53-F261 AromaticContact CG-CE1 3.69Å; H53-F261 WeakPolarHBondContact O-CA 3.43Å; L55-F261 HydrophobicContact CD2-CD1 4.15Å; L55-F261 HydrophobicContact CG-CB 4.38Å; L55-F261 HydrophobicContact CG-CD1 4.13Å; Y113-F261 CarbonylContact C-O 3.54Å; Y113-F261 VanDerWaalsContact CA-O 3.24Å; Y113-F261 WeakPolarHBondContact CA-O 3.4Å; Y113-F261 WeakPolarHBondContact CD1-O 3.28Å; V114-F261 PolarHBondContact N-O 3.01Å; V114-F261 PolarHBondContact O-N 3.27Å; R116-F261 HydrophobicContact CG-CE2 4.36Å; L134-F261 HydrophobicContact CB-CZ 3.87Å; L134-F261 HydrophobicContact CD2-CE1 4.08Å; L134-F261 HydrophobicContact CD2-CZ 3.76Å; L134-F261 HydrophobicContact CG-CZ 4.35Å; L134-F261 VanDerWaalsContact O-CE2 3.28Å; L134-F261 WeakPolarHBondContact O-CE2 3.46Å; G259-F261 WeakPolarHBondContact O-CD2 3.28Å; F261-K263 PolarHBondContact O-N 2.92Å
262	L	98.6	Very high	95.5	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	106.7	157.2	178.7	67.2	0	0	0	108.1	T48 H53 A54 L55 S56 N57 R111 Y113 V265	T48-L262 HydrophobicContact CG2-CB 4.41Å; H53-L262 PolarHBondContact O-N 2.95Å; A54-L262 CarbonylContact C-O 3.56Å; A54-L262 WeakPolarHBondContact CA-O 3.32Å; A54-L262 HydrophobicContact CB-CB 4.03Å; L55-L262 PolarHBondContact N-O 3.15Å; S56-L262 PolarHBondContact N-O 3.39Å; S56-L262 WeakPolarHBondContact O-CD2 3.47Å; S56-L262 VanDerWaalsContact O-CG 3.31Å; S56-L262 WeakPolarHBondContact O-CG 3.43Å; N57-L262 HydrophobicContact CB-CD2 3.81Å; R111-L262 HydrophobicContact CB-CD1 3.98Å; R111-L262 HydrophobicContact CG-CD1 4.24Å; Y113-L262 HydrophobicContact CD1-CB 4.18Å; Y113-L262 HydrophobicContact CD1-CD1 4.34Å; Y113-L262 HydrophobicContact CD2-CD1 4.21Å; Y113-L262 HydrophobicContact CE1-CB 3.79Å; Y113-L262 HydrophobicContact CE1-CD1 3.93Å; Y113-L262 HydrophobicContact CE1-CG 4.44Å; Y113-L262 HydrophobicContact CE2-CD1 3.76Å; Y113-L262 HydrophobicContact CG-CD1 4.48Å; L262-V265 HydrophobicContact CD1-CG2 4.15Å; L262-V265 HydrophobicContact CD2-CG2 3.94Å; L262-V265 HydrophobicContact CG-CG2 4.29Å
263	K	98.3	Very high	95.4	Very high	101 Å²	101	45.7 Å²	45.7	44%	0.439	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	-47	-174.4	177.5	174.7	175.6	-179.8	0	112.3	L55 S56 T112 V114 F261	L55-K263 HydrophobicContact CD1-CB 4.5Å; L55-K263 HydrophobicContact CD1-CG 4.3Å; S56-K263 VanDerWaalsContact CB-O 3.29Å; S56-K263 WeakPolarHBondContact CB-O 3.45Å; T112-K263 WeakPolarHBondContact O-CA 3.26Å; T112-K263 WeakPolarHBondContact O-CB 3.28Å; T112-K263 PolarHBondContact O-N 2.8Å; V114-K263 HydrophobicContact CG2-CB 4.26Å; V114-K263 HydrophobicContact CG2-CD 3.56Å; F261-K263 PolarHBondContact O-N 2.92Å
264	S	97.8	Very high	94.8	Very high	30 Å²	30	49.4 Å²	49.4	21%	0.21	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	156.2	-179.8	75.2	0	0	0	0	112.5	R111 T112 D266	R111-S264 WeakPolarHBondContact CA-O 3.32Å; T112-S264 WeakPolarHBondContact CB-OG 3.44Å; T112-S264 PolarHBondContact N-O 2.9Å; T112-S264 PolarHBondContact O-N 2.85Å; T112-S264 PolarHBondContact OG1-OG 3.25Å; S264-D266 PolarHBondContact OG-OD1 2.96Å
265	V	97.8	Very high	93.5	Very high	13 Å²	13	52 Å²	52	8%	0.079	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	119.6	166.9	-173.8	0	0	0	0	107.2	A108 S110 R111 L262 Y267	A108-V265 HydrophobicContact CB-CG1 3.55Å; S110-V265 WeakPolarHBondContact O-CA 3.4Å; R111-V265 HydrophobicContact CG-CG1 4.45Å; R111-V265 HydrophobicContact CG-CG2 4.23Å; L262-V265 HydrophobicContact CD1-CG2 4.15Å; L262-V265 HydrophobicContact CD2-CG2 3.94Å; L262-V265 HydrophobicContact CG-CG2 4.29Å; V265-Y267 HydrophobicContact CB-CE2 4.13Å; V265-Y267 HydrophobicContact CG1-CE1 4.5Å; V265-Y267 HydrophobicContact CG1-CE2 3.71Å; V265-Y267 WeakPolarHBondContact CG1-OH 3.33Å
266	D	97.6	Very high	91.6	Very high	49 Å²	49	59.3 Å²	59.3	26%	0.262	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	140.4	-173.7	-48.7	-47.1	0	0	0	109.8	A108 Q109 S110 K208 S264	A108-D266 CarbonylContact C-O 3.59Å; A108-D266 WeakPolarHBondContact CA-O 3.21Å; Q109-D266 PolarHBondContact N-O 2.89Å; S110-D266 PolarHBondContact O-N 3.34Å; S110-D266 WeakPolarHBondContact OG-CB 3.46Å; S110-D266 PolarHBondContact OG-OD2 2.87Å; K208-D266 IonicContact NZ-OD2 3.35Å; K208-D266 PolarHBondContact NZ-OD2 3.36Å; S264-D266 PolarHBondContact OG-OD1 2.96Å
267	Y	96.5	Very high	89.4	Confident	34 Å²	34	67.1 Å²	67.1	13%	0.133	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	160.4	177.4	-59.9	-90.7	0	0	0	109.2	S45 S58 F102 A104 R107 A108 V265 L272	S45-Y267 WeakPolarHBondContact CB-OH 3.37Å; S58-Y267 WeakPolarHBondContact CB-OH 3.2Å; S58-Y267 WeakPolarHBondContact OG-CE2 3.33Å; S58-Y267 PolarHBondContact OG-OH 3.35Å; S58-Y267 VanDerWaalsContact OG-OH 3.12Å; F102-Y267 AromaticContact CE2-CD1 3.73Å; F102-Y267 HydrophobicContact CE2-CD1 3.73Å; F102-Y267 AromaticContact CE2-CE1 3.94Å; F102-Y267 HydrophobicContact CE2-CE1 3.94Å; F102-Y267 HydrophobicContact CE2-CG 4.4Å; F102-Y267 AromaticContact CZ-CD1 3.87Å; F102-Y267 HydrophobicContact CZ-CD1 3.87Å; F102-Y267 AromaticContact CZ-CE1 3.62Å; F102-Y267 HydrophobicContact CZ-CE1 3.62Å; A104-Y267 VanDerWaalsContact O-CE1 3.25Å; A104-Y267 WeakPolarHBondContact O-CE1 3.44Å; A104-Y267 PolarHBondContact O-OH 2.85Å; R107-Y267 HydrophobicContact CB-CD1 4.04Å; R107-Y267 HydrophobicContact CB-CE1 4.4Å; A108-Y267 HydrophobicContact CB-CD1 4.14Å; A108-Y267 HydrophobicContact CB-CE1 3.6Å; V265-Y267 HydrophobicContact CB-CE2 4.13Å; V265-Y267 HydrophobicContact CG1-CE1 4.5Å; V265-Y267 HydrophobicContact CG1-CE2 3.71Å; V265-Y267 WeakPolarHBondContact CG1-OH 3.33Å; Y267-L272 HydrophobicContact CG-CD2 4.37Å
268	K	94.9	Very high	86.8	Confident	110 Å²	110	72.1 Å²	72.1	48%	0.478	37%	0.367	S	S	.	.			trans	-67.5	137.7	165.2	-62.3	-179.8	178.1	-179.1	0	108.4	Q109 S270 D271	Q109-K268 VanDerWaalsContact CD-CG 3.45Å; Q109-K268 HydrophobicContact CG-CG 4.12Å; K268-S270 PolarHBondContact O-N 3.4Å; K268-D271 HydrophobicContact CB-CB 4.41Å; K268-D271 WeakPolarHBondContact CB-OD2 3.28Å; K268-D271 WeakPolarHBondContact O-CB 3.42Å; K268-D271 PolarHBondContact O-N 3.23Å
269	E	91.3	Very high	84.2	Confident	156 Å²	156	75.8 Å²	75.8	73%	0.729	39%	0.392	S	S	*	.	H	α-helix	trans	-56.2	-40.2	175.7	-171.8	171.9	-172.3	0	0	111.3	D271 L272 L273	E269-D271 PolarHBondContact O-N 3.47Å; E269-L272 WeakPolarHBondContact O-CB 3.2Å; E269-L272 PolarHBondContact O-N 2.72Å; E269-L273 PolarHBondContact O-N 3.02Å
270	S	91.4	Very high	81.9	Confident	80 Å²	80	80.7 Å²	80.7	56%	0.559	43%	0.432	S	S	*	.	H	α-helix	trans	-62.4	-25	176.4	58.5	0	0	0	0	114.7	K268 L272	K268-S270 PolarHBondContact O-N 3.4Å; S270-L272 PolarHBondContact O-N 2.96Å
271	D	89.7	Confident	79.5	Confident	21 Å²	21	85.8 Å²	85.8	11%	0.112	46%	0.463	C	S	.	.	H	α-helix	trans	-74.6	-15.5	174.5	-67.5	-42.7	0	0	0	111.7	P99 F102 R107 K268 E269	P99-D271 WeakPolarHBondContact CD-O 3.37Å; F102-D271 HydrophobicContact CD2-CB 4.28Å; F102-D271 VanDerWaalsContact CD2-O 3.3Å; F102-D271 WeakPolarHBondContact CD2-O 3.19Å; F102-D271 HydrophobicContact CE2-CB 4.47Å; R107-D271 IonicContact CZ-OD1 3.59Å; R107-D271 IonicContact NE-OD1 3.85Å; R107-D271 IonicContact NH1-OD1 2.85Å; R107-D271 PolarHBondContact NH1-OD1 2.95Å; K268-D271 HydrophobicContact CB-CB 4.41Å; K268-D271 WeakPolarHBondContact CB-OD2 3.28Å; K268-D271 WeakPolarHBondContact O-CB 3.42Å; K268-D271 PolarHBondContact O-N 3.23Å; E269-D271 PolarHBondContact O-N 3.47Å
272	L	88.4	Confident	76.7	Confident	65 Å²	65	94.1 Å²	94.1	34%	0.34	50%	0.503	S	S	.	.	H	α-helix	trans	-102.7	-11.5	-178.5	-56.5	179.7	0	0	0	113.1	V98 F102 Y267 E269 S270 F274	V98-L272 HydrophobicContact CG1-CD2 4.16Å; F102-L272 HydrophobicContact CD2-CD2 4.28Å; F102-L272 HydrophobicContact CE2-CD2 3.61Å; F102-L272 HydrophobicContact CZ-CD2 3.95Å; Y267-L272 HydrophobicContact CG-CD2 4.37Å; E269-L272 WeakPolarHBondContact O-CB 3.2Å; E269-L272 PolarHBondContact O-N 2.72Å; S270-L272 PolarHBondContact O-N 2.96Å; L272-F274 PolarHBondContact O-N 3.21Å; L272-F274 VanDerWaalsContact O-N 3.17Å
273	L	85.5	Confident	74	Confident	110 Å²	110	101.6 Å²	101.6	58%	0.576	54%	0.543	S	S	*	.			trans	-74.8	105.5	-178.5	-68	177.2	0	0	0	110.8	P99 E269 S275	P99-L273 WeakPolarHBondContact CG-O 3.24Å; E269-L273 PolarHBondContact O-N 3.02Å; L273-S275 PolarHBondContact O-N 3.43Å
274	F	81.8	Confident	71.6	Confident	84 Å²	84	102.1 Å²	102.1	37%	0.368	56%	0.556	S	S	.	*			trans	-84.8	106.5	169	-176.6	-98.7	0	0	0	110.5	R97 V98 L272 Q276	R97-F274 HydrophobicContact CB-CB 4Å; R97-F274 HydrophobicContact CB-CD1 4.13Å; R97-F274 HydrophobicContact CB-CD2 4.35Å; R97-F274 HydrophobicContact CB-CG 3.89Å; V98-F274 WeakPolarHBondContact O-CD2 3.26Å; L272-F274 PolarHBondContact O-N 3.21Å; L272-F274 VanDerWaalsContact O-N 3.17Å; F274-Q276 HydrophobicContact CD1-CG 4.45Å; F274-Q276 HydrophobicContact CE1-CG 3.86Å
275	S	71.1	Confident	69.3	Low	98 Å²	98	110.6 Å²	110.6	69%	0.685	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-86	121	166.7	57.1	0	0	0	0	109.6	L273 K277	L273-S275 PolarHBondContact O-N 3.43Å; S275-K277 PolarHBondContact O-N 3.37Å
276	Q	58.5	Low	67.1	Low	152 Å²	152	120 Å²	120	71%	0.71	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-60.4	121.7	164.9	-76	-179.9	-4.5	0	0	107.9	F274	F274-Q276 HydrophobicContact CD1-CG 4.45Å; F274-Q276 HydrophobicContact CE1-CG 3.86Å
277	K	50.4	Low	65.6	Low	190 Å²	190	123.6 Å²	123.6	83%	0.826	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-61.6	132.4	162.3	-78.6	-178.3	177.9	174.5	0	106.7	S275 D279	S275-K277 PolarHBondContact O-N 3.37Å; K277-D279 PolarHBondContact O-N 2.95Å
278	P	42.2	Very low	64	Low	118 Å²	118	128.3 Å²	128.3	77%	0.766	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-58	135.3	170.7	22.8	-29.7	0	0	0	108.6	A280	P278-A280 PolarHBondContact O-N 3Å; P278-A280 VanDerWaalsContact O-N 3.15Å
279	D	42.3	Very low	62.3	Low	155 Å²	155	129.3 Å²	129.3	83%	0.829	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-53.8	120.6	175.2	-91.7	-31	0	0	0	108.9	K277 T281	K277-D279 PolarHBondContact O-N 2.95Å; D279-T281 PolarHBondContact O-N 2.89Å
280	A	50	Low	60.5	Low	102 Å²	102	127.7 Å²	127.7	84%	0.843	71%	0.705	S	S	*	*			trans	-78.2	69.3	172.5	0	0	0	0	0	109.2	P278	P278-A280 PolarHBondContact O-N 3Å; P278-A280 VanDerWaalsContact O-N 3.15Å
281	T	47	Very low	58.6	Low	115 Å²	115	130.7 Å²	130.7	71%	0.706	71%	0.714	S	S	*	*			trans	-156.9	90.5	166.4	47.6	0	0	0	0	111.6	D279	D279-T281 PolarHBondContact O-N 2.89Å
282	E	39.8	Very low	56.6	Low	193 Å²	193	138 Å²	138	90%	0.902	75%	0.754	S	S	*	*			trans	-140.8	90.6	132.6	-91.6	-169.9	169.9	0	0	106.1	P284	E282-P284 VanDerWaalsContact O-CD 3.28Å; E282-P284 WeakPolarHBondContact O-CD 3.47Å
283	D	42.7	Very low	54.3	Low	157 Å²	157	143.2 Å²	143.2	84%	0.84	78%	0.784	S	S	*	*			trans	-66.9	116.5	157	-88.7	-32.9	0	0	0	106.6	K285	D283-K285 PolarHBondContact O-N 3.49Å
284	P	47.8	Very low	51.9	Low	112 Å²	112	145.8 Å²	145.8	73%	0.727	80%	0.8	S	S	*	*			trans	-70.7	102.7	171.1	28.4	-28.7	0	0	0	107.1	E282 T286	E282-P284 VanDerWaalsContact O-CD 3.28Å; E282-P284 WeakPolarHBondContact O-CD 3.47Å; P284-T286 PolarHBondContact O-N 2.97Å
285	K	49.3	Very low	49.4	Very low	208 Å²	208	150.9 Å²	150.9	90%	0.904	84%	0.836	S	S	*	*			trans	-51.7	113.4	165.5	-76.4	-176.7	176.6	179.2	0	108.3	D283	D283-K285 PolarHBondContact O-N 3.49Å
286	T	51.7	Low	47.4	Very low	211 Å²	211	155.7 Å²	155.7	100%	1.294	85%	0.85	S	S	*	*			trans	-104.8	0	157.4	11.9	0	0	0	0	108.3	P284	P284-T286 PolarHBondContact O-N 2.97Å

Retrieved 286 of 286 residues in 86.5 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).