A0A087Y9J4_POEFO Loading...

Family with sequence similarity 83 member C

AlphaFold DB , UniProt , Accession A0A087Y9J4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 602 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.8	Very low	38.1	Very low	239 Å²	239	153.3 Å²	153.3	100%	1.177	87%	0.87	S	S	*	*				0	115.6	0	-73.8	166.3	163.5	0	0	107.9
2	I	32.7	Very low	38.6	Very low	173 Å²	173	146.7 Å²	146.7	89%	0.887	86%	0.861	S	S	*	*			trans	-142	113.4	161.6	-55.6	179.4	0	0	0	103.9
3	S	34.5	Very low	38.9	Very low	111 Å²	111	141.2 Å²	141.2	78%	0.776	86%	0.855	S	S	*	*			trans	-86.3	130.4	-171.1	-63	0	0	0	0	111.3	E5	S3-E5 PolarHBondContact O-N 3.3Å
4	S	39.8	Very low	40.6	Very low	122 Å²	122	146.3 Å²	146.3	85%	0.853	85%	0.851	S	S	*	*			trans	-87.5	86.9	178.1	55.1	0	0	0	0	111.3
5	E	36.1	Very low	43	Very low	202 Å²	202	141.8 Å²	141.8	94%	0.944	82%	0.818	S	S	*	*			trans	-95.7	95.8	165.7	-73	-163.8	107.6	0	0	110.5	S3	S3-E5 PolarHBondContact O-N 3.3Å
6	G	42.7	Very low	45.5	Very low	63 Å²	63	139.7 Å²	139.7	65%	0.649	81%	0.81	S	S	*	*			trans	-163.1	155.1	173.4	0	0	0	0	0	109.9
7	L	40.2	Very low	48	Very low	180 Å²	180	136.8 Å²	136.8	94%	0.942	79%	0.79	S	S	*	*			trans	69.3	61.1	-179.4	-48.3	177.5	0	0	0	116.1
8	R	36.4	Very low	50.2	Low	243 Å²	243	129.7 Å²	129.7	92%	0.917	75%	0.752	S	S	*	*			trans	-86.8	137.2	133.3	-92.2	-176.2	170.5	154.4	-1.3	108.3	A10	R8-A10 PolarHBondContact O-N 3.48Å
9	P	38.5	Very low	52.4	Low	118 Å²	118	127.9 Å²	127.9	77%	0.766	73%	0.734	S	S	*	*			trans	-63.5	132.4	172.1	-19	31.6	0	0	0	110.2	T11	P9-T11 PolarHBondContact O-N 3.24Å
10	A	35.8	Very low	54.3	Low	103 Å²	103	121.9 Å²	121.9	85%	0.851	70%	0.699	S	S	*	*			trans	-69.7	103	169.2	0	0	0	0	0	108.9	R8 G12	R8-A10 PolarHBondContact O-N 3.48Å; A10-G12 PolarHBondContact O-N 3.06Å
11	T	41.7	Very low	56.1	Low	132 Å²	132	116.5 Å²	116.5	81%	0.81	67%	0.669	S	S	*	*			trans	-59.1	121.3	165.9	47	0	0	0	0	108.2	P9 G13	P9-T11 PolarHBondContact O-N 3.24Å; T11-G13 PolarHBondContact O-N 3.44Å
12	G	43.8	Very low	58.5	Low	74 Å²	74	107.3 Å²	107.3	76%	0.763	63%	0.629	S	S	*	*			trans	-58.5	99	-175.1	0	0	0	0	0	111.9	A10 R14	A10-G12 PolarHBondContact O-N 3.06Å; G12-R14 VanDerWaalsContact C-N 3.3Å; G12-R14 PolarHBondContact O-N 3.09Å
13	G	42.5	Very low	61.3	Low	76 Å²	76	100 Å²	100	78%	0.784	59%	0.59	S	S	*	*			trans	-68.8	81.5	-174.9	0	0	0	0	0	112	T11 K15	T11-G13 PolarHBondContact O-N 3.44Å; G13-K15 PolarHBondContact O-N 3.38Å
14	R	63.8	Low	64	Low	212 Å²	212	95 Å²	95	80%	0.8	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-59.2	117.6	163.2	-71.6	-178	174	-164.9	-2.4	107.2	G12	G12-R14 VanDerWaalsContact C-N 3.3Å; G12-R14 PolarHBondContact O-N 3.09Å
15	K	75.2	Confident	66.5	Low	79 Å²	79	93 Å²	93	34%	0.343	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-47.3	145.7	167.1	-80.1	179.9	-177.8	179.3	0	109.2	G13 E66 E67 R68	G13-K15 PolarHBondContact O-N 3.38Å; K15-E66 VanDerWaalsContact CD-O 3.24Å; K15-E66 WeakPolarHBondContact CD-O 3.26Å; K15-E66 PolarHBondContact NZ-O 3.21Å; K15-E66 IonicContact NZ-OE1 2.73Å; K15-E66 PolarHBondContact NZ-OE1 2.93Å; K15-E67 IonicContact NZ-OE1 3.64Å; K15-E67 PolarHBondContact NZ-OE1 2.92Å; K15-R68 WeakPolarHBondContact O-CD 3.24Å; K15-R68 PolarHBondContact O-NE 2.85Å; K15-R68 PolarHBondContact O-NH1 3.04Å
16	P	83.9	Confident	69.1	Low	108 Å²	108	85.6 Å²	85.6	70%	0.701	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-58.1	170.3	171	28.1	-35.2	0	0	0	110.7	R68	P16-R68 WeakPolarHBondContact O-CD 3.49Å
17	L	88.3	Confident	71.4	Confident	90 Å²	90	82.6 Å²	82.6	47%	0.471	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-69.1	153.5	168.9	-66.9	176.9	0	0	0	110	A21 E25	L17-A21 HydrophobicContact CB-CB 4Å; L17-A21 HydrophobicContact CD2-CB 4.45Å; L17-E25 HydrophobicContact CD1-CG 4.46Å
18	G	87.8	Confident	73.8	Confident	9 Å²	9	75 Å²	75	9%	0.093	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-60.1	167.2	166.4	0	0	0	0	0	112.1	L20 A21 S22 R68	G18-L20 PolarHBondContact O-N 3.23Å; G18-A21 PolarHBondContact O-N 3.45Å; G18-S22 PolarHBondContact O-N 3.4Å; G18-R68 PolarHBondContact N-O 3.25Å
19	K	90.4	Very high	76.1	Confident	96 Å²	96	66.2 Å²	66.2	42%	0.417	40%	0.397	S	S	.	.	H	α-helix	trans	-60.6	-48.5	-176.7	-68.4	-171.4	174.4	-175.9	0	111.3	S22 R23 E38 S40 H41 E69	K19-S22 PolarHBondContact O-N 2.98Å; K19-R23 WeakPolarHBondContact O-CB 3.4Å; K19-R23 PolarHBondContact O-N 3.13Å; K19-E38 IonicContact NZ-OE1 3.21Å; K19-S40 PolarHBondContact NZ-OG 3.27Å; K19-H41 PolarHBondContact NZ-O 2.84Å; K19-E69 PolarHBondContact N-OE2 2.82Å
20	L	90.9	Very high	78	Confident	7 Å²	7	63.9 Å²	63.9	4%	0.037	38%	0.381	C	S	.	.	H	α-helix	trans	-71.6	-37.5	-177	-169.7	62	0	0	0	110.5	G18 R23 L24 E69 L70 F72 V178 D179	G18-L20 PolarHBondContact O-N 3.23Å; L20-R23 PolarHBondContact O-N 2.91Å; L20-L24 PolarHBondContact O-N 3.11Å; L20-E69 WeakPolarHBondContact CA-OE1 3.5Å; L20-E69 VanDerWaalsContact CB-OE1 3.3Å; L20-E69 WeakPolarHBondContact CB-OE1 3.3Å; L20-E69 PolarHBondContact N-OE1 2.96Å; L20-E69 VanDerWaalsContact N-OE1 3.16Å; L20-E69 PolarHBondContact N-OE2 3.21Å; L20-L70 HydrophobicContact CD2-CB 4.3Å; L20-L70 HydrophobicContact CG-CB 4.44Å; L20-L70 HydrophobicContact CG-CD1 4.18Å; L20-F72 HydrophobicContact CD2-CB 3.98Å; L20-V178 HydrophobicContact CD1-CB 4.24Å; L20-V178 HydrophobicContact CD1-CG1 3.87Å; L20-V178 HydrophobicContact CD2-CB 3.95Å; L20-V178 HydrophobicContact CD2-CG1 3.92Å; L20-V178 HydrophobicContact CG-CB 4.36Å; L20-V178 HydrophobicContact CG-CG1 3.85Å; L20-D179 WeakPolarHBondContact CD1-OD1 3.01Å
21	A	91.8	Very high	80	Confident	9 Å²	9	70.5 Å²	70.5	7%	0.074	39%	0.385	C	S	.	.	H	α-helix	trans	-60.8	-46.6	172.2	0	0	0	0	0	113.3	L17 G18 E25 R68 E69 L70	L17-A21 HydrophobicContact CB-CB 4Å; L17-A21 HydrophobicContact CD2-CB 4.45Å; G18-A21 PolarHBondContact O-N 3.45Å; A21-E25 PolarHBondContact O-N 3.06Å; A21-R68 WeakPolarHBondContact CB-O 3.47Å; A21-E69 WeakPolarHBondContact CB-OE1 3.11Å; A21-E69 PolarHBondContact N-OE1 2.69Å; A21-L70 HydrophobicContact CB-CD1 4.43Å; A21-L70 HydrophobicContact CB-CG 3.98Å
22	S	91.4	Very high	81.6	Confident	46 Å²	46	71.3 Å²	71.3	32%	0.322	37%	0.373	S	S	.	.	H	α-helix	trans	-62.7	-44.8	174.5	-166.1	0	0	0	0	111	G18 K19 L24 E25 E26	G18-S22 PolarHBondContact O-N 3.4Å; K19-S22 PolarHBondContact O-N 2.98Å; S22-L24 PolarHBondContact O-N 2.78Å; S22-E25 PolarHBondContact O-N 3.23Å; S22-E26 WeakPolarHBondContact O-CG 3.12Å; S22-E26 PolarHBondContact O-N 2.98Å; S22-E26 PolarHBondContact OG-OE1 3.42Å
23	R	91.3	Very high	82.9	Confident	21 Å²	21	76.4 Å²	76.4	8%	0.079	38%	0.377	C	S	.	.	H	α-helix	trans	-61.1	-43.5	179.7	-169.4	178.4	-174	-147.2	-2.9	112.5	K19 L20 E25 E26 V27 D179 C182 D183 E186	K19-R23 WeakPolarHBondContact O-CB 3.4Å; K19-R23 PolarHBondContact O-N 3.13Å; L20-R23 PolarHBondContact O-N 2.91Å; R23-E25 VanDerWaalsContact C-N 3.34Å; R23-E25 PolarHBondContact O-N 2.81Å; R23-E26 PolarHBondContact O-N 3.03Å; R23-V27 HydrophobicContact CG-CG2 4.39Å; R23-V27 WeakPolarHBondContact O-CB 3.2Å; R23-V27 WeakPolarHBondContact O-CG2 3.38Å; R23-V27 PolarHBondContact O-N 3.07Å; R23-D179 PolarHBondContact NH1-O 3.31Å; R23-C182 HydrophobicContact CG-CB 4.44Å; R23-D183 IonicContact CZ-OD1 3Å; R23-D183 IonicContact CZ-OD2 2.7Å; R23-D183 VanDerWaalsContact NH1-CG 3.3Å; R23-D183 IonicContact NH1-OD1 3.79Å; R23-D183 IonicContact NH1-OD2 2.96Å; R23-D183 PolarHBondContact NH1-OD2 2.78Å; R23-D183 IonicContact NH2-OD1 3.69Å; R23-D183 PolarHBondContact NH2-OD1 2.91Å; R23-D183 IonicContact NH2-OD2 3.12Å; R23-D183 PolarHBondContact NH2-OD2 3.36Å; R23-E186 IonicContact CZ-OE2 3.64Å; R23-E186 IonicContact NE-OE2 3.63Å; R23-E186 IonicContact NH2-OE2 3.64Å; R23-E186 PolarHBondContact NH2-OE2 2.95Å
24	L	92.5	Very high	83.9	Confident	4 Å²	4	74.4 Å²	74.4	2%	0.021	36%	0.356	C	S	.	.	H	α-helix	trans	-59.7	-45.8	177.1	179.8	66.7	0	0	0	111.2	L20 S22 E26 V27 K28 L70 L214	L20-L24 PolarHBondContact O-N 3.11Å; S22-L24 PolarHBondContact O-N 2.78Å; L24-E26 PolarHBondContact O-N 2.9Å; L24-V27 PolarHBondContact O-N 3.19Å; L24-V27 VanDerWaalsContact O-N 3.15Å; L24-K28 HydrophobicContact CD1-CG 4.42Å; L24-K28 HydrophobicContact CG-CD 4.46Å; L24-K28 HydrophobicContact CG-CG 4.43Å; L24-K28 WeakPolarHBondContact O-CG 3.49Å; L24-K28 PolarHBondContact O-N 3.28Å; L24-L70 HydrophobicContact CB-CD1 3.76Å; L24-L70 HydrophobicContact CD2-CD1 3.58Å; L24-L70 HydrophobicContact CD2-CD2 4.27Å; L24-L70 HydrophobicContact CG-CD1 4.3Å; L24-L214 HydrophobicContact CD2-CB 4.02Å; L24-L214 HydrophobicContact CD2-CD2 4.05Å
25	E	91.4	Very high	84	Confident	81 Å²	81	66.5 Å²	66.5	38%	0.379	33%	0.333	S	S	.	.	H	α-helix	trans	-65.1	-37.2	177.6	-73.3	-61.1	125.8	0	0	112.3	L17 A21 S22 R23 V27 K28 N29	L17-E25 HydrophobicContact CD1-CG 4.46Å; A21-E25 PolarHBondContact O-N 3.06Å; S22-E25 PolarHBondContact O-N 3.23Å; R23-E25 VanDerWaalsContact C-N 3.34Å; R23-E25 PolarHBondContact O-N 2.81Å; E25-V27 VanDerWaalsContact C-N 3.3Å; E25-V27 PolarHBondContact O-N 3Å; E25-K28 IonicContact OE1-NZ 2.91Å; E25-N29 WeakPolarHBondContact O-CB 3.27Å; E25-N29 PolarHBondContact O-N 3.14Å; E25-N29 PolarHBondContact O-ND2 2.87Å
26	E	90.9	Very high	84	Confident	46 Å²	46	72.1 Å²	72.1	22%	0.215	36%	0.358	C	S	.	.	H	α-helix	trans	-63	-33.4	171.6	-75.2	165.4	-137.7	0	0	113	S22 R23 L24 S35 K190	S22-E26 WeakPolarHBondContact O-CG 3.12Å; S22-E26 PolarHBondContact O-N 2.98Å; S22-E26 PolarHBondContact OG-OE1 3.42Å; R23-E26 PolarHBondContact O-N 3.03Å; L24-E26 PolarHBondContact O-N 2.9Å; E26-S35 VanDerWaalsContact OE2-CB 3.27Å; E26-S35 WeakPolarHBondContact OE2-CB 3.5Å; E26-S35 PolarHBondContact OE2-OG 3.2Å; E26-K190 WeakPolarHBondContact O-CE 3.36Å; E26-K190 PolarHBondContact O-NZ 3.32Å
27	V	90.5	Very high	83.8	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-87.1	-31.2	-178	172.7	0	0	0	0	112.8	R23 L24 E25 N29 C182 M185 E186	R23-V27 HydrophobicContact CG-CG2 4.39Å; R23-V27 WeakPolarHBondContact O-CB 3.2Å; R23-V27 WeakPolarHBondContact O-CG2 3.38Å; R23-V27 PolarHBondContact O-N 3.07Å; L24-V27 PolarHBondContact O-N 3.19Å; L24-V27 VanDerWaalsContact O-N 3.15Å; E25-V27 VanDerWaalsContact C-N 3.3Å; E25-V27 PolarHBondContact O-N 3Å; V27-N29 VanDerWaalsContact C-N 3.29Å; V27-N29 PolarHBondContact O-N 3.34Å; V27-C182 HydrophobicContact CG2-CB 4.5Å; V27-M185 HydrophobicContact CG1-CB 3.41Å; V27-M185 VanDerWaalsContact CG1-CB 3.41Å; V27-E186 HydrophobicContact CG1-CB 4.23Å; V27-E186 HydrophobicContact CG2-CB 4.03Å
28	K	90.6	Very high	83.3	Confident	21 Å²	21	69.4 Å²	69.4	9%	0.091	33%	0.334	C	S	.	.	H	α-helix	trans	-61.7	-36.1	168.4	-76.8	-175.2	-179.8	-177.9	0	112.1	L24 E25 P30 L214 D215	L24-K28 HydrophobicContact CD1-CG 4.42Å; L24-K28 HydrophobicContact CG-CD 4.46Å; L24-K28 HydrophobicContact CG-CG 4.43Å; L24-K28 WeakPolarHBondContact O-CG 3.49Å; L24-K28 PolarHBondContact O-N 3.28Å; E25-K28 IonicContact OE1-NZ 2.91Å; K28-P30 VanDerWaalsContact O-CD 3.27Å; K28-P30 WeakPolarHBondContact O-CD 3.43Å; K28-L214 WeakPolarHBondContact CE-O 3.15Å; K28-L214 PolarHBondContact NZ-O 3.04Å; K28-D215 WeakPolarHBondContact CE-O 3.45Å; K28-D215 PolarHBondContact NZ-O 3.22Å; K28-D215 IonicContact NZ-OD2 2.85Å; K28-D215 PolarHBondContact NZ-OD2 3.23Å
29	N	86.4	Confident	82.8	Confident	59 Å²	59	72.9 Å²	72.9	32%	0.316	35%	0.35	S	S	.	.			trans	-89	105.3	-176.8	-79.2	-84.3	0	0	0	112.1	E25 V27 W31 R32	E25-N29 WeakPolarHBondContact O-CB 3.27Å; E25-N29 PolarHBondContact O-N 3.14Å; E25-N29 PolarHBondContact O-ND2 2.87Å; V27-N29 VanDerWaalsContact C-N 3.29Å; V27-N29 PolarHBondContact O-N 3.34Å; N29-W31 PolarHBondContact O-N 3.23Å; N29-W31 VanDerWaalsContact O-N 3.11Å; N29-R32 HydrophobicContact CB-CB 4.17Å; N29-R32 HydrophobicContact CB-CG 3.84Å; N29-R32 PolarHBondContact O-N 3.19Å; N29-R32 VanDerWaalsContact O-N 3.16Å
30	P	78.4	Confident	82.1	Confident	68 Å²	68	71 Å²	71	44%	0.442	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-20.4	-175.8	-18.9	33.9	0	0	0	113.7	K28	K28-P30 VanDerWaalsContact O-CD 3.27Å; K28-P30 WeakPolarHBondContact O-CD 3.43Å
31	W	75.9	Confident	81.5	Confident	243 Å²	243	76 Å²	76	92%	0.92	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-5	-178.3	-49.5	107.5	0	0	0	113.8	N29	N29-W31 PolarHBondContact O-N 3.23Å; N29-W31 VanDerWaalsContact O-N 3.11Å
32	R	77.1	Confident	81.4	Confident	148 Å²	148	77.2 Å²	77.2	56%	0.558	38%	0.377	S	S	*	.	S	Bend	trans	-89.4	130.8	172.5	-71.8	-169.9	-175.1	-73.2	-1.8	109.5	N29 K190	N29-R32 HydrophobicContact CB-CB 4.17Å; N29-R32 HydrophobicContact CB-CG 3.84Å; N29-R32 PolarHBondContact O-N 3.19Å; N29-R32 VanDerWaalsContact O-N 3.16Å; R32-K190 WeakPolarHBondContact O-CE 3.42Å; R32-K190 PolarHBondContact O-NZ 2.95Å
33	E	69.8	Low	81.3	Confident	182 Å²	182	79 Å²	79	85%	0.85	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-53.2	147.7	171.2	-166.4	157.7	-128.5	0	0	110.6	K190	E33-K190 PolarHBondContact O-NZ 3.1Å
34	G	64	Low	81.3	Confident	34 Å²	34	78.5 Å²	78.5	35%	0.351	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-76.6	130.3	178.6	0	0	0	0	0	110.8	K36	G34-K36 PolarHBondContact O-N 2.92Å
35	S	65.5	Low	81.2	Confident	45 Å²	45	78.8 Å²	78.8	32%	0.315	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-59.1	133.3	162.5	30.8	0	0	0	0	108.8	E26 L37	E26-S35 VanDerWaalsContact OE2-CB 3.27Å; E26-S35 WeakPolarHBondContact OE2-CB 3.5Å; E26-S35 PolarHBondContact OE2-OG 3.2Å; S35-L37 PolarHBondContact O-N 3.03Å
36	K	75.8	Confident	81.3	Confident	198 Å²	198	79.3 Å²	79.3	86%	0.861	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-56.9	128.2	174.3	176.2	-171.2	172.8	-171.7	0	108.4	G34 E38	G34-K36 PolarHBondContact O-N 2.92Å; K36-E38 PolarHBondContact O-N 2.92Å
37	L	78.8	Confident	81.5	Confident	34 Å²	34	80.2 Å²	80.2	18%	0.178	39%	0.388	C	S	.	.			trans	-36.9	107.5	-178.5	175.9	61.9	0	0	0	112.4	S35 L39 R158 N162	S35-L37 PolarHBondContact O-N 3.03Å; L37-L39 HydrophobicContact CD1-CD2 3.95Å; L37-L39 HydrophobicContact CD2-CD2 4.13Å; L37-L39 HydrophobicContact CG-CD2 3.86Å; L37-L39 HydrophobicContact CG-CG 4.33Å; L37-R158 HydrophobicContact CD1-CB 4.26Å; L37-N162 HydrophobicContact CD2-CB 3.84Å
38	E	78.3	Confident	81.7	Confident	107 Å²	107	80.2 Å²	80.2	50%	0.5	39%	0.388	S	S	.	.			trans	-98.4	122.4	-179.2	-167.1	179.5	171	0	0	110.3	K19 K36 S40 R158	K19-E38 IonicContact NZ-OE1 3.21Å; K36-E38 PolarHBondContact O-N 2.92Å; E38-S40 VanDerWaalsContact OE1-CB 3.3Å; E38-S40 WeakPolarHBondContact OE1-CB 3.42Å; E38-S40 PolarHBondContact OE1-OG 3.1Å; E38-R158 PolarHBondContact O-NH1 3.41Å; E38-R158 PolarHBondContact O-NH2 2.97Å
39	L	77.6	Confident	81.8	Confident	82 Å²	82	80 Å²	80	43%	0.429	39%	0.389	S	S	.	.			trans	-109.2	30.3	179.4	-51.8	177.6	0	0	0	110.9	L37 D155 R158	L37-L39 HydrophobicContact CD1-CD2 3.95Å; L37-L39 HydrophobicContact CD2-CD2 4.13Å; L37-L39 HydrophobicContact CG-CD2 3.86Å; L37-L39 HydrophobicContact CG-CG 4.33Å; L39-D155 HydrophobicContact CD1-CB 4.07Å; L39-D155 HydrophobicContact CD2-CB 4.33Å; L39-R158 HydrophobicContact CD2-CB 4.35Å
40	S	75.3	Confident	82.2	Confident	57 Å²	57	79.8 Å²	79.8	40%	0.399	39%	0.388	S	S	.	.			trans	-91.7	154.4	-176.2	86	0	0	0	0	112.1	K19 E38	K19-S40 PolarHBondContact NZ-OG 3.27Å; E38-S40 VanDerWaalsContact OE1-CB 3.3Å; E38-S40 WeakPolarHBondContact OE1-CB 3.42Å; E38-S40 PolarHBondContact OE1-OG 3.1Å
41	H	79.5	Confident	83	Confident	112 Å²	112	77 Å²	77	52%	0.519	37%	0.37	S	S	.	.			trans	-60.1	136.9	177.2	178.7	-98	0	0	0	112.2	K19 E43	K19-H41 PolarHBondContact NZ-O 2.84Å; H41-E43 IonicContact CE1-OE2 2.57Å; H41-E43 PolarHBondContact CE1-OE2 3.26Å; H41-E43 IonicContact ND1-OE2 3.91Å
42	N	87.7	Confident	83.9	Confident	33 Å²	33	65.6 Å²	65.6	18%	0.176	33%	0.327	C	S	.	.			trans	-96.3	100.9	173.5	-170	-9.3	0	0	0	111	A44 A45 R46 E69	N42-A44 VanDerWaalsContact C-N 3.35Å; N42-A44 PolarHBondContact O-N 2.83Å; N42-A44 PolarHBondContact OD1-N 3.39Å; N42-A45 HydrophobicContact CB-CB 3.97Å; N42-A45 WeakPolarHBondContact O-CB 3.24Å; N42-A45 PolarHBondContact O-N 3.15Å; N42-R46 PolarHBondContact O-N 3.28Å; N42-R46 VanDerWaalsContact O-N 3.12Å; N42-E69 PolarHBondContact ND2-OE2 2.7Å
43	E	89.9	Confident	84.7	Confident	83 Å²	83	62.9 Å²	62.9	39%	0.388	32%	0.324	S	S	.	.	H	α-helix	trans	-65.7	-33.9	-178.4	-174.5	61.5	-173.9	0	0	113.2	H41 A45 R46 L47	H41-E43 IonicContact CE1-OE2 2.57Å; H41-E43 PolarHBondContact CE1-OE2 3.26Å; H41-E43 IonicContact ND1-OE2 3.91Å; E43-A45 VanDerWaalsContact C-N 3.28Å; E43-A45 PolarHBondContact O-N 3.49Å; E43-R46 PolarHBondContact O-N 3.45Å; E43-R46 IonicContact OE1-CZ 3.56Å; E43-R46 IonicContact OE1-NE 2.8Å; E43-R46 PolarHBondContact OE1-NE 2.94Å; E43-R46 IonicContact OE1-NH2 2.94Å; E43-R46 PolarHBondContact OE1-NH2 3.49Å; E43-R46 IonicContact OE2-CZ 2.68Å; E43-R46 IonicContact OE2-NE 3.57Å; E43-R46 PolarHBondContact OE2-NE 2.93Å; E43-R46 IonicContact OE2-NH2 3.43Å; E43-L47 HydrophobicContact CG-CD1 4.16Å; E43-L47 HydrophobicContact CG-CG 4.42Å; E43-L47 WeakPolarHBondContact O-CG 3.34Å; E43-L47 PolarHBondContact O-N 3.45Å
44	A	90.9	Very high	85.8	Confident	11 Å²	11	60.6 Å²	60.6	9%	0.091	31%	0.313	C	S	.	.	H	α-helix	trans	-64.9	-35	174.9	0	0	0	0	0	111.6	N42 A48 E67 E69	N42-A44 VanDerWaalsContact C-N 3.35Å; N42-A44 PolarHBondContact O-N 2.83Å; N42-A44 PolarHBondContact OD1-N 3.39Å; A44-A48 VanDerWaalsContact O-CB 3.29Å; A44-A48 WeakPolarHBondContact O-CB 3.13Å; A44-A48 PolarHBondContact O-N 2.89Å; A44-E67 HydrophobicContact CB-CB 3.88Å; A44-E67 HydrophobicContact CB-CG 4.35Å; A44-E69 HydrophobicContact CB-CB 3.98Å; A44-E69 HydrophobicContact CB-CG 4.03Å
45	A	91.6	Very high	87.1	Confident	10 Å²	10	65.2 Å²	65.2	8%	0.083	33%	0.325	C	S	.	.	H	α-helix	trans	-69.5	-37.6	174	0	0	0	0	0	112.2	N42 E43 T49 F72	N42-A45 HydrophobicContact CB-CB 3.97Å; N42-A45 WeakPolarHBondContact O-CB 3.24Å; N42-A45 PolarHBondContact O-N 3.15Å; E43-A45 VanDerWaalsContact C-N 3.28Å; E43-A45 PolarHBondContact O-N 3.49Å; A45-T49 WeakPolarHBondContact O-CB 3.41Å; A45-T49 PolarHBondContact O-N 3.46Å; A45-T49 PolarHBondContact O-OG1 3.43Å; A45-F72 HydrophobicContact CB-CD1 4Å; A45-F72 HydrophobicContact CB-CD2 4.45Å; A45-F72 HydrophobicContact CB-CE1 3.66Å; A45-F72 HydrophobicContact CB-CE2 4.11Å; A45-F72 HydrophobicContact CB-CG 4.4Å; A45-F72 HydrophobicContact CB-CZ 3.71Å; A45-F72 VanDerWaalsContact O-CZ 3.27Å; A45-F72 WeakPolarHBondContact O-CZ 3.44Å
46	R	93.3	Very high	88.5	Confident	93 Å²	93	64.1 Å²	64.1	35%	0.351	32%	0.32	S	S	.	.	H	α-helix	trans	-63.2	-53.9	174	-164.2	-168.2	66.9	68.7	8.5	111.3	N42 E43 A48 T49 D50	N42-R46 PolarHBondContact O-N 3.28Å; N42-R46 VanDerWaalsContact O-N 3.12Å; E43-R46 PolarHBondContact O-N 3.45Å; E43-R46 IonicContact OE1-CZ 3.56Å; E43-R46 IonicContact OE1-NE 2.8Å; E43-R46 PolarHBondContact OE1-NE 2.94Å; E43-R46 IonicContact OE1-NH2 2.94Å; E43-R46 PolarHBondContact OE1-NH2 3.49Å; E43-R46 IonicContact OE2-CZ 2.68Å; E43-R46 IonicContact OE2-NE 3.57Å; E43-R46 PolarHBondContact OE2-NE 2.93Å; E43-R46 IonicContact OE2-NH2 3.43Å; R46-A48 VanDerWaalsContact C-N 3.3Å; R46-A48 PolarHBondContact O-N 2.85Å; R46-T49 WeakPolarHBondContact O-CA 3.19Å; R46-T49 WeakPolarHBondContact O-CB 3.49Å; R46-T49 PolarHBondContact O-N 3.16Å; R46-D50 IonicContact CZ-OD2 3.15Å; R46-D50 IonicContact NH1-OD1 2.89Å; R46-D50 IonicContact NH1-OD2 2.72Å; R46-D50 PolarHBondContact NH1-OD2 2.96Å; R46-D50 IonicContact NH2-OD2 2.89Å; R46-D50 PolarHBondContact O-N 3.26Å
47	L	94	Very high	89.4	Confident	64 Å²	64	58.1 Å²	58.1	34%	0.335	30%	0.296	S	S	.	.	H	α-helix	trans	-57.7	-40.1	178.4	-69.1	170.4	0	0	0	112.7	E43 A51 V63	E43-L47 HydrophobicContact CG-CD1 4.16Å; E43-L47 HydrophobicContact CG-CG 4.42Å; E43-L47 WeakPolarHBondContact O-CG 3.34Å; E43-L47 PolarHBondContact O-N 3.45Å; L47-A51 WeakPolarHBondContact O-CB 3.27Å; L47-A51 PolarHBondContact O-N 2.76Å; L47-A51 VanDerWaalsContact O-N 3.07Å; L47-V63 HydrophobicContact CB-CG1 4.09Å
48	A	95	Very high	90.1	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-65.7	-38.7	174	0	0	0	0	0	111.8	A44 R46 A51 L52 Y60 V63 L64 F72	A44-A48 VanDerWaalsContact O-CB 3.29Å; A44-A48 WeakPolarHBondContact O-CB 3.13Å; A44-A48 PolarHBondContact O-N 2.89Å; R46-A48 VanDerWaalsContact C-N 3.3Å; R46-A48 PolarHBondContact O-N 2.85Å; A48-A51 WeakPolarHBondContact O-CB 3.43Å; A48-A51 PolarHBondContact O-N 3.43Å; A48-L52 PolarHBondContact O-N 3.2Å; A48-Y60 HydrophobicContact CB-CD2 3.81Å; A48-Y60 HydrophobicContact CB-CE2 3.8Å; A48-Y60 WeakPolarHBondContact O-CD2 3.49Å; A48-V63 HydrophobicContact CB-CB 4.39Å; A48-V63 HydrophobicContact CB-CG1 4.12Å; A48-L64 HydrophobicContact CB-CD2 4.07Å; A48-L64 HydrophobicContact CB-CG 4.16Å; A48-F72 HydrophobicContact CB-CE1 4Å; A48-F72 HydrophobicContact CB-CZ 4.27Å
49	T	94.1	Very high	90.9	Very high	17 Å²	17	61.6 Å²	61.6	10%	0.104	31%	0.308	C	S	.	.	H	α-helix	trans	-66.5	-42.3	177.2	-54.2	0	0	0	0	111.7	A45 R46 A51 L52 L53 W267	A45-T49 WeakPolarHBondContact O-CB 3.41Å; A45-T49 PolarHBondContact O-N 3.46Å; A45-T49 PolarHBondContact O-OG1 3.43Å; R46-T49 WeakPolarHBondContact O-CA 3.19Å; R46-T49 WeakPolarHBondContact O-CB 3.49Å; R46-T49 PolarHBondContact O-N 3.16Å; T49-A51 VanDerWaalsContact C-N 3.33Å; T49-A51 PolarHBondContact O-N 2.92Å; T49-L52 WeakPolarHBondContact O-CB 3.44Å; T49-L52 PolarHBondContact O-N 3.26Å; T49-L52 VanDerWaalsContact O-N 3.16Å; T49-L53 HydrophobicContact CG2-CD1 4.36Å; T49-L53 WeakPolarHBondContact O-CG 3.48Å; T49-L53 PolarHBondContact O-N 3.49Å; T49-W267 HydrophobicContact CG2-CH2 3.86Å; T49-W267 HydrophobicContact CG2-CZ2 4.36Å
50	D	94.1	Very high	91.8	Very high	55 Å²	55	57.7 Å²	57.7	29%	0.294	29%	0.288	S	S	.	.	H	α-helix	trans	-57	-49.1	173.1	-58.3	-19.3	0	0	0	110.1	R46 L52 L53 E54	R46-D50 IonicContact CZ-OD2 3.15Å; R46-D50 IonicContact NH1-OD1 2.89Å; R46-D50 IonicContact NH1-OD2 2.72Å; R46-D50 PolarHBondContact NH1-OD2 2.96Å; R46-D50 IonicContact NH2-OD2 2.89Å; R46-D50 PolarHBondContact O-N 3.26Å; D50-L52 VanDerWaalsContact C-N 3.32Å; D50-L52 PolarHBondContact O-N 2.98Å; D50-L53 PolarHBondContact O-N 2.88Å; D50-L53 VanDerWaalsContact O-N 3.1Å; D50-E54 PolarHBondContact O-N 2.85Å
51	A	94.8	Very high	92.8	Very high	9 Å²	9	60.6 Å²	60.6	7%	0.074	29%	0.29	C	S	.	.	H	α-helix	trans	-58.2	-37.8	175	0	0	0	0	0	113.8	L47 A48 T49 H55 G56 E59 V63	L47-A51 WeakPolarHBondContact O-CB 3.27Å; L47-A51 PolarHBondContact O-N 2.76Å; L47-A51 VanDerWaalsContact O-N 3.07Å; A48-A51 WeakPolarHBondContact O-CB 3.43Å; A48-A51 PolarHBondContact O-N 3.43Å; T49-A51 VanDerWaalsContact C-N 3.33Å; T49-A51 PolarHBondContact O-N 2.92Å; A51-H55 CarbonylContact O-C 3.46Å; A51-H55 WeakPolarHBondContact O-CA 3.49Å; A51-H55 WeakPolarHBondContact O-CB 3.47Å; A51-H55 PolarHBondContact O-N 2.63Å; A51-G56 PolarHBondContact O-N 3.4Å; A51-E59 HydrophobicContact CB-CB 4.4Å; A51-E59 HydrophobicContact CB-CG 3.87Å; A51-V63 HydrophobicContact CB-CB 4.47Å; A51-V63 HydrophobicContact CB-CG2 3.68Å
52	L	95	Very high	93.5	Very high	4 Å²	4	62.8 Å²	62.8	2%	0.021	29%	0.294	C	S	.	.	H	α-helix	trans	-65.5	-38.9	174.7	179.1	59.9	0	0	0	112	A48 T49 D50 G56 E57 Y60 L73 I78 I81	A48-L52 PolarHBondContact O-N 3.2Å; T49-L52 WeakPolarHBondContact O-CB 3.44Å; T49-L52 PolarHBondContact O-N 3.26Å; T49-L52 VanDerWaalsContact O-N 3.16Å; D50-L52 VanDerWaalsContact C-N 3.32Å; D50-L52 PolarHBondContact O-N 2.98Å; L52-G56 VanDerWaalsContact O-CA 3.25Å; L52-G56 WeakPolarHBondContact O-CA 3.43Å; L52-G56 PolarHBondContact O-N 3.06Å; L52-E57 HydrophobicContact CD1-CB 4.23Å; L52-Y60 HydrophobicContact CB-CD2 4.03Å; L52-Y60 HydrophobicContact CB-CG 4.31Å; L52-Y60 HydrophobicContact CD1-CG 4.49Å; L52-Y60 HydrophobicContact CD2-CD2 4.4Å; L52-L73 HydrophobicContact CD2-CD1 3.47Å; L52-L73 VanDerWaalsContact CD2-CD1 3.47Å; L52-I78 HydrophobicContact CD1-CG2 4.4Å; L52-I78 HydrophobicContact CD2-CG1 4.46Å; L52-I81 HydrophobicContact CD2-CB 4.17Å; L52-I81 HydrophobicContact CD2-CD1 4.01Å; L52-I81 HydrophobicContact CD2-CG2 3.86Å; L52-I81 HydrophobicContact CG-CG2 4.13Å
53	L	94.1	Very high	93.9	Very high	91 Å²	91	62.4 Å²	62.4	48%	0.476	29%	0.292	S	S	.	.	H	α-helix	trans	-73.3	-40.6	-179.8	-71.8	168.1	0	0	0	112.6	T49 D50 I81 A85	T49-L53 HydrophobicContact CG2-CD1 4.36Å; T49-L53 WeakPolarHBondContact O-CG 3.48Å; T49-L53 PolarHBondContact O-N 3.49Å; D50-L53 PolarHBondContact O-N 2.88Å; D50-L53 VanDerWaalsContact O-N 3.1Å; L53-I81 HydrophobicContact CD2-CG2 3.61Å; L53-I81 HydrophobicContact CG-CG2 4.25Å; L53-A85 HydrophobicContact CD2-CB 3.77Å
54	E	92.5	Very high	94.1	Very high	133 Å²	133	59 Å²	59	62%	0.621	28%	0.277	S	S	*	.	H	α-helix	trans	-83.9	-41.2	-177.1	-67.1	-172	147.3	0	0	113.9	D50	D50-E54 PolarHBondContact O-N 2.85Å
55	H	92.4	Very high	94.3	Very high	132 Å²	132	62.1 Å²	62.1	61%	0.611	30%	0.302	S	S	*	.	H	α-helix	trans	-127.9	-5.2	-164.7	-62.3	97.9	0	0	0	113.2	A51 E59	A51-H55 CarbonylContact O-C 3.46Å; A51-H55 WeakPolarHBondContact O-CA 3.49Å; A51-H55 WeakPolarHBondContact O-CB 3.47Å; A51-H55 PolarHBondContact O-N 2.63Å; H55-E59 HydrophobicContact CB-CB 3.46Å; H55-E59 VanDerWaalsContact CB-CB 3.46Å; H55-E59 HydrophobicContact CB-CG 3.57Å
56	G	93.3	Very high	94.4	Very high	21 Å²	21	67.1 Å²	67.1	22%	0.216	32%	0.324	C	S	.	.			trans	81.7	-175.8	172.9	0	0	0	0	0	115.6	A51 L52 K58 E59 Y60	A51-G56 PolarHBondContact O-N 3.4Å; L52-G56 VanDerWaalsContact O-CA 3.25Å; L52-G56 WeakPolarHBondContact O-CA 3.43Å; L52-G56 PolarHBondContact O-N 3.06Å; G56-K58 PolarHBondContact O-N 3.09Å; G56-E59 PolarHBondContact O-N 3.18Å; G56-Y60 PolarHBondContact O-N 3.05Å
57	E	94.8	Very high	94.4	Very high	73 Å²	73	65.9 Å²	65.9	34%	0.341	32%	0.322	S	S	.	.	H	α-helix	trans	-63.5	-15.7	-166	-158.3	-151.6	-155.7	0	0	115.6	L52 R61 I78	L52-E57 HydrophobicContact CD1-CB 4.23Å; E57-R61 VanDerWaalsContact CD-CZ 3.41Å; E57-R61 VanDerWaalsContact CG-NH1 3.29Å; E57-R61 WeakPolarHBondContact O-CG 3.43Å; E57-R61 PolarHBondContact O-NH1 3.16Å; E57-R61 IonicContact OE1-CZ 2.63Å; E57-R61 IonicContact OE1-NH1 2.76Å; E57-R61 IonicContact OE1-NH2 3.53Å; E57-R61 PolarHBondContact OE1-NH2 2.76Å; E57-R61 IonicContact OE2-CZ 2.85Å; E57-R61 IonicContact OE2-NH1 3.17Å; E57-R61 PolarHBondContact OE2-NH1 3.17Å; E57-R61 IonicContact OE2-NH2 3.38Å; E57-R61 PolarHBondContact OE2-NH2 2.71Å; E57-R61 VanDerWaalsContact OE2-NH2 3.17Å; E57-I78 HydrophobicContact CB-CG2 4.35Å; E57-I78 HydrophobicContact CG-CD1 4.21Å; E57-I78 HydrophobicContact CG-CG2 3.63Å
58	K	94.9	Very high	94.3	Very high	182 Å²	182	67.4 Å²	67.4	79%	0.791	32%	0.323	S	S	*	.	H	α-helix	trans	-76.1	-38.8	171.9	-68.9	-178.2	-178.5	175.7	0	111.5	G56 R62	G56-K58 PolarHBondContact O-N 3.09Å; K58-R62 PolarHBondContact O-N 3.2Å
59	E	95	Very high	94.3	Very high	31 Å²	31	68 Å²	68	15%	0.145	33%	0.326	C	S	.	.	H	α-helix	trans	-78.5	-39.4	-176.8	-168.1	47.6	-132.6	0	0	111.2	A51 H55 G56 R61 R62 V63	A51-E59 HydrophobicContact CB-CB 4.4Å; A51-E59 HydrophobicContact CB-CG 3.87Å; H55-E59 HydrophobicContact CB-CB 3.46Å; H55-E59 VanDerWaalsContact CB-CB 3.46Å; H55-E59 HydrophobicContact CB-CG 3.57Å; G56-E59 PolarHBondContact O-N 3.18Å; E59-R61 PolarHBondContact O-N 2.97Å; E59-R62 WeakPolarHBondContact O-CA 3.45Å; E59-R62 WeakPolarHBondContact O-CB 3.4Å; E59-R62 PolarHBondContact O-N 2.97Å; E59-R62 IonicContact OE1-CZ 3.47Å; E59-R62 IonicContact OE1-NE 2.64Å; E59-R62 PolarHBondContact OE1-NE 2.85Å; E59-R62 IonicContact OE1-NH2 3.77Å; E59-R62 PolarHBondContact OE1-NH2 2.79Å; E59-R62 IonicContact OE2-CZ 2.71Å; E59-R62 IonicContact OE2-NE 2.69Å; E59-R62 PolarHBondContact OE2-NE 3.24Å; E59-R62 IonicContact OE2-NH1 3.03Å; E59-R62 IonicContact OE2-NH2 3.6Å; E59-R62 PolarHBondContact OE2-NH2 2.93Å; E59-R62 VanDerWaalsContact OE2-NH2 3.12Å; E59-V63 PolarHBondContact O-N 3.14Å
60	Y	96.1	Very high	94.2	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-42.2	-51.5	165.6	176.9	-112	0	0	0	112.6	A48 L52 G56 L64 N71 F72 L73 I78	A48-Y60 HydrophobicContact CB-CD2 3.81Å; A48-Y60 HydrophobicContact CB-CE2 3.8Å; A48-Y60 WeakPolarHBondContact O-CD2 3.49Å; L52-Y60 HydrophobicContact CB-CD2 4.03Å; L52-Y60 HydrophobicContact CB-CG 4.31Å; L52-Y60 HydrophobicContact CD1-CG 4.49Å; L52-Y60 HydrophobicContact CD2-CD2 4.4Å; G56-Y60 PolarHBondContact O-N 3.05Å; Y60-L64 HydrophobicContact CD1-CD1 4.23Å; Y60-L64 HydrophobicContact CE1-CD1 3.65Å; Y60-L64 HydrophobicContact CE2-CD1 4.17Å; Y60-L64 WeakPolarHBondContact O-CG 3.48Å; Y60-L64 PolarHBondContact O-N 2.89Å; Y60-L64 VanDerWaalsContact O-N 3.13Å; Y60-N71 WeakPolarHBondContact CE1-OD1 3.45Å; Y60-F72 AromaticContact CE2-CE1 3.79Å; Y60-F72 HydrophobicContact CE2-CE1 3.79Å; Y60-F72 AromaticContact CE2-CZ 3.72Å; Y60-F72 HydrophobicContact CE2-CZ 3.72Å; Y60-F72 WeakPolarHBondContact OH-CE1 3.32Å; Y60-L73 HydrophobicContact CD2-CD1 4.35Å; Y60-L73 HydrophobicContact CE1-CD1 4.49Å; Y60-L73 HydrophobicContact CE2-CD1 3.64Å; Y60-L73 HydrophobicContact CE2-CG 4.16Å; Y60-L73 WeakPolarHBondContact OH-CB 3.27Å; Y60-L73 WeakPolarHBondContact OH-CG 3.24Å; Y60-L73 PolarHBondContact OH-N 3.01Å; Y60-I78 HydrophobicContact CD1-CD1 4.33Å; Y60-I78 HydrophobicContact CE1-CD1 4.07Å
61	R	95.2	Very high	94.2	Very high	118 Å²	118	69.2 Å²	69.2	45%	0.445	33%	0.332	S	S	.	.	H	α-helix	trans	-70.7	-29.6	178.9	-67.2	-175.5	-174.8	98.1	-5	113.5	E57 E59 A65	E57-R61 VanDerWaalsContact CD-CZ 3.41Å; E57-R61 VanDerWaalsContact CG-NH1 3.29Å; E57-R61 WeakPolarHBondContact O-CG 3.43Å; E57-R61 PolarHBondContact O-NH1 3.16Å; E57-R61 IonicContact OE1-CZ 2.63Å; E57-R61 IonicContact OE1-NH1 2.76Å; E57-R61 IonicContact OE1-NH2 3.53Å; E57-R61 PolarHBondContact OE1-NH2 2.76Å; E57-R61 IonicContact OE2-CZ 2.85Å; E57-R61 IonicContact OE2-NH1 3.17Å; E57-R61 PolarHBondContact OE2-NH1 3.17Å; E57-R61 IonicContact OE2-NH2 3.38Å; E57-R61 PolarHBondContact OE2-NH2 2.71Å; E57-R61 VanDerWaalsContact OE2-NH2 3.17Å; E59-R61 PolarHBondContact O-N 2.97Å; R61-A65 WeakPolarHBondContact O-CB 3.27Å; R61-A65 PolarHBondContact O-N 3.26Å; R61-A65 VanDerWaalsContact O-N 3.1Å
62	R	95.8	Very high	94.2	Very high	159 Å²	159	69.2 Å²	69.2	60%	0.6	33%	0.33	S	S	*	.	H	α-helix	trans	-67.5	-47.4	176	-168	178.4	73.6	172.8	-1.6	110.4	K58 E59 A65 E66	K58-R62 PolarHBondContact O-N 3.2Å; E59-R62 WeakPolarHBondContact O-CA 3.45Å; E59-R62 WeakPolarHBondContact O-CB 3.4Å; E59-R62 PolarHBondContact O-N 2.97Å; E59-R62 IonicContact OE1-CZ 3.47Å; E59-R62 IonicContact OE1-NE 2.64Å; E59-R62 PolarHBondContact OE1-NE 2.85Å; E59-R62 IonicContact OE1-NH2 3.77Å; E59-R62 PolarHBondContact OE1-NH2 2.79Å; E59-R62 IonicContact OE2-CZ 2.71Å; E59-R62 IonicContact OE2-NE 2.69Å; E59-R62 PolarHBondContact OE2-NE 3.24Å; E59-R62 IonicContact OE2-NH1 3.03Å; E59-R62 IonicContact OE2-NH2 3.6Å; E59-R62 PolarHBondContact OE2-NH2 2.93Å; E59-R62 VanDerWaalsContact OE2-NH2 3.12Å; R62-A65 PolarHBondContact O-N 3.08Å; R62-E66 WeakPolarHBondContact O-CB 3.45Å; R62-E66 PolarHBondContact O-N 2.83Å
63	V	95.5	Very high	94.2	Very high	25 Å²	25	69.1 Å²	69.1	15%	0.152	33%	0.33	C	S	.	.	H	α-helix	trans	-62.5	-44.8	177.4	177.6	0	0	0	0	111.4	L47 A48 A51 E59 A65 E66 E67	L47-V63 HydrophobicContact CB-CG1 4.09Å; A48-V63 HydrophobicContact CB-CB 4.39Å; A48-V63 HydrophobicContact CB-CG1 4.12Å; A51-V63 HydrophobicContact CB-CB 4.47Å; A51-V63 HydrophobicContact CB-CG2 3.68Å; E59-V63 PolarHBondContact O-N 3.14Å; V63-A65 VanDerWaalsContact C-N 3.34Å; V63-A65 PolarHBondContact O-N 3.44Å; V63-E66 PolarHBondContact O-N 2.95Å; V63-E67 HydrophobicContact CG1-CG 4.43Å; V63-E67 PolarHBondContact O-N 3.26Å
64	L	94.6	Very high	94.2	Very high	11 Å²	11	65.2 Å²	65.2	6%	0.058	31%	0.31	C	S	.	.	H	α-helix	trans	-58	-42.8	174.4	-75.3	179.4	0	0	0	113	A48 Y60 R68 E69 L70 N71 F72	A48-L64 HydrophobicContact CB-CD2 4.07Å; A48-L64 HydrophobicContact CB-CG 4.16Å; Y60-L64 HydrophobicContact CD1-CD1 4.23Å; Y60-L64 HydrophobicContact CE1-CD1 3.65Å; Y60-L64 HydrophobicContact CE2-CD1 4.17Å; Y60-L64 WeakPolarHBondContact O-CG 3.48Å; Y60-L64 PolarHBondContact O-N 2.89Å; Y60-L64 VanDerWaalsContact O-N 3.13Å; L64-R68 WeakPolarHBondContact O-CA 3.38Å; L64-R68 PolarHBondContact O-N 2.81Å; L64-E69 HydrophobicContact CD2-CB 3.96Å; L64-E69 HydrophobicContact CD2-CG 4.27Å; L64-E69 PolarHBondContact O-N 3.13Å; L64-L70 WeakPolarHBondContact CD2-O 3.33Å; L64-N71 HydrophobicContact CD1-CB 4.28Å; L64-F72 HydrophobicContact CD2-CD1 4.09Å; L64-F72 HydrophobicContact CD2-CE1 3.94Å
65	A	94	Very high	94.2	Very high	76 Å²	76	61.6 Å²	61.6	63%	0.628	30%	0.298	S	S	*	.	H	α-helix	trans	-69.5	-32.6	178.1	0	0	0	0	0	112.9	R61 R62 V63	R61-A65 WeakPolarHBondContact O-CB 3.27Å; R61-A65 PolarHBondContact O-N 3.26Å; R61-A65 VanDerWaalsContact O-N 3.1Å; R62-A65 PolarHBondContact O-N 3.08Å; V63-A65 VanDerWaalsContact C-N 3.34Å; V63-A65 PolarHBondContact O-N 3.44Å
66	E	93.9	Very high	94.2	Very high	116 Å²	116	58.4 Å²	58.4	54%	0.542	29%	0.285	S	S	.	.	H	α-helix	trans	-73.5	-46.1	175.8	170.8	158.6	-171.9	0	0	112.4	K15 R62 V63 R68	K15-E66 VanDerWaalsContact CD-O 3.24Å; K15-E66 WeakPolarHBondContact CD-O 3.26Å; K15-E66 PolarHBondContact NZ-O 3.21Å; K15-E66 IonicContact NZ-OE1 2.73Å; K15-E66 PolarHBondContact NZ-OE1 2.93Å; R62-E66 WeakPolarHBondContact O-CB 3.45Å; R62-E66 PolarHBondContact O-N 2.83Å; V63-E66 PolarHBondContact O-N 2.95Å; E66-R68 PolarHBondContact O-N 3.06Å
67	E	93.3	Very high	94.3	Very high	67 Å²	67	57.6 Å²	57.6	31%	0.313	28%	0.276	S	S	.	.	H	α-helix	trans	-82.3	-1.6	177.5	-67.2	-55.7	102.3	0	0	113.2	K15 A44 V63 E69	K15-E67 IonicContact NZ-OE1 3.64Å; K15-E67 PolarHBondContact NZ-OE1 2.92Å; A44-E67 HydrophobicContact CB-CB 3.88Å; A44-E67 HydrophobicContact CB-CG 4.35Å; V63-E67 HydrophobicContact CG1-CG 4.43Å; V63-E67 PolarHBondContact O-N 3.26Å; E67-E69 VanDerWaalsContact C-N 3.25Å; E67-E69 PolarHBondContact O-N 2.91Å
68	R	92.8	Very high	94.3	Very high	95 Å²	95	54.5 Å²	54.5	36%	0.358	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	57	39.2	176.6	-60.1	172.8	155.3	-120.8	-28.8	112.8	K15 P16 G18 A21 L64 E66	K15-R68 WeakPolarHBondContact O-CD 3.24Å; K15-R68 PolarHBondContact O-NE 2.85Å; K15-R68 PolarHBondContact O-NH1 3.04Å; P16-R68 WeakPolarHBondContact O-CD 3.49Å; G18-R68 PolarHBondContact N-O 3.25Å; A21-R68 WeakPolarHBondContact CB-O 3.47Å; L64-R68 WeakPolarHBondContact O-CA 3.38Å; L64-R68 PolarHBondContact O-N 2.81Å; E66-R68 PolarHBondContact O-N 3.06Å
69	E	93.9	Very high	94.3	Very high	13 Å²	13	53.2 Å²	53.2	6%	0.061	25%	0.252	C	S	.	.			trans	-105.8	153.2	-177	-170	60.6	-65.5	0	0	111.5	K19 L20 A21 N42 A44 L64 E67	K19-E69 PolarHBondContact N-OE2 2.82Å; L20-E69 WeakPolarHBondContact CA-OE1 3.5Å; L20-E69 VanDerWaalsContact CB-OE1 3.3Å; L20-E69 WeakPolarHBondContact CB-OE1 3.3Å; L20-E69 PolarHBondContact N-OE1 2.96Å; L20-E69 VanDerWaalsContact N-OE1 3.16Å; L20-E69 PolarHBondContact N-OE2 3.21Å; A21-E69 WeakPolarHBondContact CB-OE1 3.11Å; A21-E69 PolarHBondContact N-OE1 2.69Å; N42-E69 PolarHBondContact ND2-OE2 2.7Å; A44-E69 HydrophobicContact CB-CB 3.98Å; A44-E69 HydrophobicContact CB-CG 4.03Å; L64-E69 HydrophobicContact CD2-CB 3.96Å; L64-E69 HydrophobicContact CD2-CG 4.27Å; L64-E69 PolarHBondContact O-N 3.13Å; E67-E69 VanDerWaalsContact C-N 3.25Å; E67-E69 PolarHBondContact O-N 2.91Å
70	L	93.4	Very high	94.2	Very high	34 Å²	34	55.8 Å²	55.8	18%	0.178	26%	0.261	C	S	.	.			trans	-71.6	152.3	-179.9	-69.5	170.3	0	0	0	112.8	L20 A21 L24 L64 F72 V178 L214	L20-L70 HydrophobicContact CD2-CB 4.3Å; L20-L70 HydrophobicContact CG-CB 4.44Å; L20-L70 HydrophobicContact CG-CD1 4.18Å; A21-L70 HydrophobicContact CB-CD1 4.43Å; A21-L70 HydrophobicContact CB-CG 3.98Å; L24-L70 HydrophobicContact CB-CD1 3.76Å; L24-L70 HydrophobicContact CD2-CD1 3.58Å; L24-L70 HydrophobicContact CD2-CD2 4.27Å; L24-L70 HydrophobicContact CG-CD1 4.3Å; L64-L70 WeakPolarHBondContact CD2-O 3.33Å; L70-F72 PolarHBondContact O-N 3.12Å; L70-V178 HydrophobicContact CD1-CG1 4.38Å; L70-L214 HydrophobicContact CB-CD2 4.5Å; L70-L214 HydrophobicContact CD1-CD2 3.95Å; L70-L214 HydrophobicContact CD2-CD2 4.27Å; L70-L214 HydrophobicContact CG-CD2 4.48Å
71	N	93.4	Very high	94.2	Very high	63 Å²	63	56.5 Å²	56.5	34%	0.337	27%	0.265	S	S	.	.			trans	-67.2	103	169.5	-179.6	87.2	0	0	0	110.4	Y60 L64 L73	Y60-N71 WeakPolarHBondContact CE1-OD1 3.45Å; L64-N71 HydrophobicContact CD1-CB 4.28Å; N71-L73 PolarHBondContact ND2-O 2.96Å
72	F	93.9	Very high	94	Very high	9 Å²	9	54 Å²	54	4%	0.039	27%	0.265	C	S	.	.			trans	-97.5	-9.1	-175.8	65.6	-91	0	0	0	114.3	L20 A45 A48 Y60 L64 L70 W267	L20-F72 HydrophobicContact CD2-CB 3.98Å; A45-F72 HydrophobicContact CB-CD1 4Å; A45-F72 HydrophobicContact CB-CD2 4.45Å; A45-F72 HydrophobicContact CB-CE1 3.66Å; A45-F72 HydrophobicContact CB-CE2 4.11Å; A45-F72 HydrophobicContact CB-CG 4.4Å; A45-F72 HydrophobicContact CB-CZ 3.71Å; A45-F72 VanDerWaalsContact O-CZ 3.27Å; A45-F72 WeakPolarHBondContact O-CZ 3.44Å; A48-F72 HydrophobicContact CB-CE1 4Å; A48-F72 HydrophobicContact CB-CZ 4.27Å; Y60-F72 AromaticContact CE2-CE1 3.79Å; Y60-F72 HydrophobicContact CE2-CE1 3.79Å; Y60-F72 AromaticContact CE2-CZ 3.72Å; Y60-F72 HydrophobicContact CE2-CZ 3.72Å; Y60-F72 WeakPolarHBondContact OH-CE1 3.32Å; L64-F72 HydrophobicContact CD2-CD1 4.09Å; L64-F72 HydrophobicContact CD2-CE1 3.94Å; L70-F72 PolarHBondContact O-N 3.12Å; F72-W267 AromaticContact CD2-CD1 3.42Å; F72-W267 VanDerWaalsContact CD2-CD1 3.42Å; F72-W267 HydrophobicContact CD2-CD2 4.28Å; F72-W267 AromaticContact CD2-CG 3.92Å; F72-W267 HydrophobicContact CD2-CG 3.92Å; F72-W267 AromaticContact CD2-NE1 3.46Å; F72-W267 AromaticContact CE2-CD1 3.88Å; F72-W267 HydrophobicContact CE2-CD2 4.17Å; F72-W267 AromaticContact CE2-CE2 3.63Å; F72-W267 HydrophobicContact CE2-CG 4.3Å; F72-W267 HydrophobicContact CE2-CZ2 4.07Å; F72-W267 AromaticContact CE2-NE1 3.43Å
73	L	94.8	Very high	93.8	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.01	27%	0.269	C	S	.	.	S	Bend	trans	-103.1	132.4	174	-61.1	177.1	0	0	0	110.8	L52 Y60 N71 E77 I78 I81 W267	L52-L73 HydrophobicContact CD2-CD1 3.47Å; L52-L73 VanDerWaalsContact CD2-CD1 3.47Å; Y60-L73 HydrophobicContact CD2-CD1 4.35Å; Y60-L73 HydrophobicContact CE1-CD1 4.49Å; Y60-L73 HydrophobicContact CE2-CD1 3.64Å; Y60-L73 HydrophobicContact CE2-CG 4.16Å; Y60-L73 WeakPolarHBondContact OH-CB 3.27Å; Y60-L73 WeakPolarHBondContact OH-CG 3.24Å; Y60-L73 PolarHBondContact OH-N 3.01Å; N71-L73 PolarHBondContact ND2-O 2.96Å; L73-E77 HydrophobicContact CB-CB 4.46Å; L73-E77 HydrophobicContact CD2-CB 4.31Å; L73-I78 HydrophobicContact CB-CD1 4.27Å; L73-I78 HydrophobicContact CB-CG1 3.73Å; L73-I78 HydrophobicContact CD1-CG1 4.17Å; L73-I81 HydrophobicContact CD1-CD1 3.82Å; L73-I81 HydrophobicContact CD2-CD1 4.13Å; L73-W267 HydrophobicContact CD2-CB 4.07Å; L73-W267 HydrophobicContact CD2-CD2 3.48Å; L73-W267 VanDerWaalsContact CD2-CD2 3.48Å; L73-W267 HydrophobicContact CD2-CE3 3.38Å; L73-W267 HydrophobicContact CD2-CG 3.81Å; L73-W267 HydrophobicContact CD2-CZ3 4Å
74	S	94.3	Very high	93.4	Very high	10 Å²	10	57.8 Å²	57.8	7%	0.07	29%	0.288	C	S	.	.			trans	-74.2	162.8	169	69.8	0	0	0	0	112.3	L76 E77 I78	S74-L76 PolarHBondContact O-N 2.84Å; S74-L76 VanDerWaalsContact O-N 3.11Å; S74-E77 WeakPolarHBondContact CB-OE2 3.43Å; S74-E77 PolarHBondContact N-OE2 2.92Å; S74-E77 PolarHBondContact O-N 3.4Å; S74-E77 WeakPolarHBondContact OG-CG 3.41Å; S74-E77 PolarHBondContact OG-N 3.23Å; S74-E77 PolarHBondContact OG-OE2 3.44Å; S74-I78 WeakPolarHBondContact O-CG1 3.37Å; S74-I78 PolarHBondContact O-N 3.39Å
75	P	93.3	Very high	93	Very high	57 Å²	57	59 Å²	59	37%	0.37	30%	0.299	S	S	.	.	H	α-helix	trans	-58.9	-21.8	173.7	-25.3	35.5	0	0	0	114.4	R79	P75-R79 VanDerWaalsContact O-CD 3.25Å; P75-R79 WeakPolarHBondContact O-CD 3.39Å; P75-R79 WeakPolarHBondContact O-CG 3.43Å; P75-R79 PolarHBondContact O-N 3.33Å
76	L	93.1	Very high	91.8	Very high	64 Å²	64	60 Å²	60	34%	0.335	31%	0.307	S	S	.	.	H	α-helix	trans	-73.2	-46.6	173.5	179.5	63.6	0	0	0	110.9	S74 R79 Y80 I174 Y206	S74-L76 PolarHBondContact O-N 2.84Å; S74-L76 VanDerWaalsContact O-N 3.11Å; L76-R79 PolarHBondContact O-N 3Å; L76-Y80 PolarHBondContact O-N 3.34Å; L76-I174 HydrophobicContact CD2-CD1 3.95Å; L76-Y206 HydrophobicContact CB-CE1 4.12Å; L76-Y206 HydrophobicContact CD2-CE2 4.43Å
77	E	95	Very high	90.1	Very high	4 Å²	4	58.4 Å²	58.4	2%	0.019	31%	0.309	C	S	.	.	H	α-helix	trans	-69.5	-41.3	-177.3	-65.3	164.9	100	0	0	111.4	L73 S74 R79 Y80 I81 T176 T266 W267 L268	L73-E77 HydrophobicContact CB-CB 4.46Å; L73-E77 HydrophobicContact CD2-CB 4.31Å; S74-E77 WeakPolarHBondContact CB-OE2 3.43Å; S74-E77 PolarHBondContact N-OE2 2.92Å; S74-E77 PolarHBondContact O-N 3.4Å; S74-E77 WeakPolarHBondContact OG-CG 3.41Å; S74-E77 PolarHBondContact OG-N 3.23Å; S74-E77 PolarHBondContact OG-OE2 3.44Å; E77-R79 VanDerWaalsContact C-N 3.34Å; E77-R79 PolarHBondContact O-N 3.06Å; E77-Y80 PolarHBondContact O-N 3.09Å; E77-I81 WeakPolarHBondContact O-CD1 3.31Å; E77-I81 VanDerWaalsContact O-CG1 3.27Å; E77-I81 WeakPolarHBondContact O-CG1 3.22Å; E77-I81 PolarHBondContact O-N 3.45Å; E77-T176 PolarHBondContact OE2-OG1 2.99Å; E77-T266 WeakPolarHBondContact OE1-CB 3.42Å; E77-W267 WeakPolarHBondContact OE1-CA 3.41Å; E77-W267 VanDerWaalsContact OE1-CB 3.32Å; E77-W267 WeakPolarHBondContact OE1-CB 3.46Å; E77-W267 PolarHBondContact OE1-N 3.4Å; E77-L268 HydrophobicContact CB-CD1 3.93Å; E77-L268 HydrophobicContact CB-CG 4.05Å; E77-L268 HydrophobicContact CG-CB 4.44Å; E77-L268 HydrophobicContact CG-CD1 3.79Å; E77-L268 HydrophobicContact CG-CG 3.89Å; E77-L268 PolarHBondContact OE1-N 3.14Å
78	I	94.5	Very high	88.2	Confident	9 Å²	9	64.6 Å²	64.6	5%	0.046	34%	0.335	C	S	.	.	H	α-helix	trans	-53.8	-50.2	170.2	-71.4	175.1	0	0	0	110.8	L52 E57 Y60 L73 S74 Y80 I81 S82	L52-I78 HydrophobicContact CD1-CG2 4.4Å; L52-I78 HydrophobicContact CD2-CG1 4.46Å; E57-I78 HydrophobicContact CB-CG2 4.35Å; E57-I78 HydrophobicContact CG-CD1 4.21Å; E57-I78 HydrophobicContact CG-CG2 3.63Å; Y60-I78 HydrophobicContact CD1-CD1 4.33Å; Y60-I78 HydrophobicContact CE1-CD1 4.07Å; L73-I78 HydrophobicContact CB-CD1 4.27Å; L73-I78 HydrophobicContact CB-CG1 3.73Å; L73-I78 HydrophobicContact CD1-CG1 4.17Å; S74-I78 WeakPolarHBondContact O-CG1 3.37Å; S74-I78 PolarHBondContact O-N 3.39Å; I78-Y80 PolarHBondContact O-N 2.82Å; I78-I81 PolarHBondContact O-N 3.16Å; I78-S82 PolarHBondContact O-N 3.42Å; I78-S82 PolarHBondContact O-OG 2.83Å
79	R	94.4	Very high	85.9	Confident	155 Å²	155	64.7 Å²	64.7	59%	0.585	35%	0.347	S	S	*	.	H	α-helix	trans	-62.9	-42.8	179.3	-73.8	168.6	-170.9	179.1	4.6	111.8	P75 L76 E77 S82 Q83	P75-R79 VanDerWaalsContact O-CD 3.25Å; P75-R79 WeakPolarHBondContact O-CD 3.39Å; P75-R79 WeakPolarHBondContact O-CG 3.43Å; P75-R79 PolarHBondContact O-N 3.33Å; L76-R79 PolarHBondContact O-N 3Å; E77-R79 VanDerWaalsContact C-N 3.34Å; E77-R79 PolarHBondContact O-N 3.06Å; R79-S82 PolarHBondContact O-N 3.42Å; R79-Q83 VanDerWaalsContact O-CB 3.3Å; R79-Q83 WeakPolarHBondContact O-CB 3.49Å; R79-Q83 WeakPolarHBondContact O-CG 3.49Å; R79-Q83 PolarHBondContact O-N 3.03Å
80	Y	94.4	Very high	83.4	Confident	85 Å²	85	69.3 Å²	69.3	33%	0.333	38%	0.38	S	S	.	.	H	α-helix	trans	-59.9	-48.5	177.2	-179.2	-89.5	0	0	0	111.1	L76 E77 I78 Q83 H84 L268 H273	L76-Y80 PolarHBondContact O-N 3.34Å; E77-Y80 PolarHBondContact O-N 3.09Å; I78-Y80 PolarHBondContact O-N 2.82Å; Y80-Q83 PolarHBondContact O-N 3.48Å; Y80-H84 AromaticContact CD2-CE1 3.56Å; Y80-H84 AromaticContact CD2-ND1 3.6Å; Y80-H84 AromaticContact CE2-CE1 3.45Å; Y80-H84 VanDerWaalsContact CE2-CE1 3.45Å; Y80-H84 WeakPolarHBondContact CE2-CE1 3.3Å; Y80-H84 AromaticContact CE2-ND1 3.61Å; Y80-H84 AromaticContact CE2-NE2 3.96Å; Y80-H84 AromaticContact CG-ND1 3.88Å; Y80-H84 AromaticContact CZ-ND1 3.9Å; Y80-H84 PolarHBondContact O-N 2.86Å; Y80-H84 PolarHBondContact O-ND1 3.45Å; Y80-L268 HydrophobicContact CD1-CD1 3.43Å; Y80-L268 VanDerWaalsContact CD1-CD1 3.43Å; Y80-L268 HydrophobicContact CD1-CD2 4.11Å; Y80-L268 HydrophobicContact CD1-CG 4.46Å; Y80-L268 HydrophobicContact CE1-CD1 4.17Å; Y80-L268 HydrophobicContact CE1-CD2 4.45Å; Y80-L268 HydrophobicContact CG-CD1 3.75Å; Y80-H273 AromaticContact CE1-CE1 3.84Å; Y80-H273 AromaticContact CZ-CE1 3.78Å
81	I	94.1	Very high	80.8	Confident	15 Å²	15	74 Å²	74	8%	0.077	41%	0.406	C	S	.	.	H	α-helix	trans	-60.7	-50.1	178	-66.8	162.6	0	0	0	110.4	L52 L53 L73 E77 I78 Q83 H84 A85 W267 L268	L52-I81 HydrophobicContact CD2-CB 4.17Å; L52-I81 HydrophobicContact CD2-CD1 4.01Å; L52-I81 HydrophobicContact CD2-CG2 3.86Å; L52-I81 HydrophobicContact CG-CG2 4.13Å; L53-I81 HydrophobicContact CD2-CG2 3.61Å; L53-I81 HydrophobicContact CG-CG2 4.25Å; L73-I81 HydrophobicContact CD1-CD1 3.82Å; L73-I81 HydrophobicContact CD2-CD1 4.13Å; E77-I81 WeakPolarHBondContact O-CD1 3.31Å; E77-I81 VanDerWaalsContact O-CG1 3.27Å; E77-I81 WeakPolarHBondContact O-CG1 3.22Å; E77-I81 PolarHBondContact O-N 3.45Å; I78-I81 PolarHBondContact O-N 3.16Å; I81-Q83 PolarHBondContact O-N 3Å; I81-H84 PolarHBondContact O-N 2.76Å; I81-A85 WeakPolarHBondContact O-CB 3.25Å; I81-A85 PolarHBondContact O-N 3.2Å; I81-W267 HydrophobicContact CD1-CZ3 3.97Å; I81-L268 HydrophobicContact CD1-CD2 4.22Å; I81-L268 HydrophobicContact CG1-CD2 4.05Å
82	S	91.9	Very high	78.6	Confident	66 Å²	66	77.6 Å²	77.6	46%	0.462	43%	0.432	S	S	.	.	H	α-helix	trans	-66.7	-18.1	178.9	-60.7	0	0	0	0	114.7	I78 R79	I78-S82 PolarHBondContact O-N 3.42Å; I78-S82 PolarHBondContact O-OG 2.83Å; R79-S82 PolarHBondContact O-N 3.42Å
83	Q	91.1	Very high	76.3	Confident	144 Å²	144	84.5 Å²	84.5	67%	0.673	47%	0.469	S	S	*	.	H	α-helix	trans	-89.2	-27.3	175.1	-75.4	170.4	1.6	0	0	113.6	R79 Y80 I81	R79-Q83 VanDerWaalsContact O-CB 3.3Å; R79-Q83 WeakPolarHBondContact O-CB 3.49Å; R79-Q83 WeakPolarHBondContact O-CG 3.49Å; R79-Q83 PolarHBondContact O-N 3.03Å; Y80-Q83 PolarHBondContact O-N 3.48Å; I81-Q83 PolarHBondContact O-N 3Å
84	H	88.4	Confident	73.8	Confident	119 Å²	119	89.9 Å²	89.9	55%	0.551	51%	0.507	S	S	*	.	H	α-helix	trans	-110.4	-3.2	-176	-59.8	83.8	0	0	0	113.5	Y80 I81 A86	Y80-H84 AromaticContact CD2-CE1 3.56Å; Y80-H84 AromaticContact CD2-ND1 3.6Å; Y80-H84 AromaticContact CE2-CE1 3.45Å; Y80-H84 VanDerWaalsContact CE2-CE1 3.45Å; Y80-H84 WeakPolarHBondContact CE2-CE1 3.3Å; Y80-H84 AromaticContact CE2-ND1 3.61Å; Y80-H84 AromaticContact CE2-NE2 3.96Å; Y80-H84 AromaticContact CG-ND1 3.88Å; Y80-H84 AromaticContact CZ-ND1 3.9Å; Y80-H84 PolarHBondContact O-N 2.86Å; Y80-H84 PolarHBondContact O-ND1 3.45Å; I81-H84 PolarHBondContact O-N 2.76Å; H84-A86 PolarHBondContact O-N 3.19Å
85	A	85.3	Confident	71.4	Confident	35 Å²	35	92.7 Å²	92.7	29%	0.289	54%	0.538	S	S	.	.	S	Bend	trans	-57.3	132.9	165.6	0	0	0	0	0	110.1	L53 I81 S87	L53-A85 HydrophobicContact CD2-CB 3.77Å; I81-A85 WeakPolarHBondContact O-CB 3.25Å; I81-A85 PolarHBondContact O-N 3.2Å; A85-S87 PolarHBondContact O-N 2.61Å
86	A	69.5	Low	69.1	Low	97 Å²	97	97.4 Å²	97.4	80%	0.802	56%	0.56	S	S	*	*			trans	-66.8	99	177.1	0	0	0	0	0	109.9	H84 K88	H84-A86 PolarHBondContact O-N 3.19Å; A86-K88 PolarHBondContact O-N 2.88Å
87	S	56.8	Low	66.7	Low	84 Å²	84	106 Å²	106	59%	0.587	59%	0.588	S	S	*	*			trans	-58.5	123.6	177.4	-172.5	0	0	0	0	109.9	A85 T89	A85-S87 PolarHBondContact O-N 2.61Å; S87-T89 WeakPolarHBondContact CB-OG1 3.21Å; S87-T89 PolarHBondContact O-N 3Å; S87-T89 WeakPolarHBondContact OG-CG2 3.46Å; S87-T89 PolarHBondContact OG-OG1 3.06Å
88	K	54.2	Low	64.4	Low	196 Å²	196	112.9 Å²	112.9	85%	0.852	63%	0.625	S	S	*	*	S	Bend	trans	-74.5	47.5	174.8	-64.6	-177	-179.7	176.2	0	111.4	A86	A86-K88 PolarHBondContact O-N 2.88Å
89	T	43.6	Very low	61.8	Low	98 Å²	98	120.1 Å²	120.1	60%	0.601	66%	0.664	S	S	*	*			trans	-127.7	57.5	-178.4	59.4	0	0	0	0	109.8	S87	S87-T89 WeakPolarHBondContact CB-OG1 3.21Å; S87-T89 PolarHBondContact O-N 3Å; S87-T89 WeakPolarHBondContact OG-CG2 3.46Å; S87-T89 PolarHBondContact OG-OG1 3.06Å
90	S	41.5	Very low	59.1	Low	109 Å²	109	115.9 Å²	115.9	76%	0.762	67%	0.668	S	S	*	*			trans	-70.9	115.8	145.1	50	0	0	0	0	107.1
91	D	40.3	Very low	56.9	Low	134 Å²	134	119.5 Å²	119.5	72%	0.717	69%	0.694	S	S	*	*			trans	-60.6	133.2	-177.7	-69.4	-65.1	0	0	0	111.4	D93	D91-D93 PolarHBondContact O-N 2.77Å
92	P	47	Very low	54.4	Low	138 Å²	138	123.5 Å²	123.5	90%	0.896	73%	0.729	S	S	*	*	S	Bend	trans	-80.2	28.1	-179.9	35.5	-37.7	0	0	0	113.1
93	D	46	Very low	52.2	Low	153 Å²	153	127.2 Å²	127.2	82%	0.818	74%	0.743	S	S	*	*			trans	-134.8	47.2	-175.4	-162.1	24.9	0	0	0	112.5	D91	D91-D93 PolarHBondContact O-N 2.77Å
94	S	40.8	Very low	50	Low	115 Å²	115	124.4 Å²	124.4	80%	0.804	75%	0.745	S	S	*	*			trans	-118.3	84.1	157.5	67.1	0	0	0	0	108.7
95	G	45.1	Very low	47.9	Very low	70 Å²	70	124.1 Å²	124.1	72%	0.722	75%	0.751	S	S	*	*			trans	-67.5	158.6	-174.6	0	0	0	0	0	114.9
96	D	45.4	Very low	46.1	Very low	156 Å²	156	128.2 Å²	128.2	83%	0.834	78%	0.778	S	S	*	*			trans	64.4	78.6	159.9	-160.3	30.1	0	0	0	117.6
97	R	40.9	Very low	45	Very low	245 Å²	245	132.4 Å²	132.4	93%	0.925	78%	0.781	S	S	*	*			trans	-138.1	109.6	135.3	-68.4	-162.1	178.8	-138.5	-7.3	110.5
98	D	47.5	Very low	44.2	Very low	148 Å²	148	135.8 Å²	135.8	79%	0.791	79%	0.792	S	S	*	*			trans	-72.1	121.7	161.3	176.2	32	0	0	0	109.6
99	D	39.2	Very low	43.7	Very low	161 Å²	161	132.1 Å²	132.1	86%	0.861	79%	0.785	S	S	*	*			trans	-167.6	104.7	161.3	-117.2	-34.4	0	0	0	111
100	G	39.1	Very low	44.1	Very low	66 Å²	66	133.1 Å²	133.1	68%	0.68	80%	0.796	S	S	*	*			trans	74	87.1	147.1	0	0	0	0	0	120	A102	G100-A102 PolarHBondContact O-N 2.95Å
101	D	47.5	Very low	44.3	Very low	161 Å²	161	130.2 Å²	130.2	86%	0.861	78%	0.784	S	S	*	*			trans	-11.2	112.4	150.7	-178.5	23.4	0	0	0	117.6
102	A	41.7	Very low	44.5	Very low	99 Å²	99	129.2 Å²	129.2	82%	0.818	78%	0.783	S	S	*	*			trans	-155	45.4	164.1	0	0	0	0	0	111.5	G100	G100-A102 PolarHBondContact O-N 2.95Å
103	D	45.7	Very low	44.3	Very low	143 Å²	143	132.7 Å²	132.7	77%	0.765	78%	0.78	S	S	*	*			trans	-76.2	172	-179.6	-169.2	23.4	0	0	0	113
104	A	44.7	Very low	44.4	Very low	85 Å²	85	132.5 Å²	132.5	70%	0.702	77%	0.772	S	S	*	*	S	Bend	trans	71.3	38.1	160.5	0	0	0	0	0	118.8
105	V	43.3	Very low	44.7	Very low	113 Å²	113	130 Å²	130	69%	0.685	75%	0.753	S	S	*	*	S	Bend	trans	-125.9	-15	162.9	-150.8	0	0	0	0	114.8	E107	V105-E107 PolarHBondContact O-N 3.12Å
106	S	49.5	Very low	44.9	Very low	121 Å²	121	134.5 Å²	134.5	85%	0.846	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-17	-173	-74.4	0	0	0	0	116
107	E	45	Very low	44.9	Very low	186 Å²	186	134 Å²	134	87%	0.869	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-4.8	-175.3	-61	-160.3	142.3	0	0	114.9	V105	V105-E107 PolarHBondContact O-N 3.12Å
108	L	41.4	Very low	45.1	Very low	155 Å²	155	125.5 Å²	125.5	81%	0.812	73%	0.73	S	S	*	*	S	Bend	trans	-108.3	0.5	-176.1	-77	169.9	0	0	0	115.3	S110	L108-S110 PolarHBondContact O-N 3.38Å
109	T	42.8	Very low	45.2	Very low	118 Å²	118	126.5 Å²	126.5	72%	0.724	74%	0.735	S	S	*	*			trans	-89.6	30.9	176	-45	0	0	0	0	112.3	G111	T109-G111 PolarHBondContact O-N 3.35Å
110	S	52.4	Low	46.1	Very low	119 Å²	119	124 Å²	124	83%	0.832	72%	0.722	S	S	*	*			trans	-76.1	57.2	166.8	66.4	0	0	0	0	110.7	L108	L108-S110 PolarHBondContact O-N 3.38Å
111	G	45.3	Very low	47.1	Very low	49 Å²	49	129.4 Å²	129.4	51%	0.505	73%	0.729	S	S	.	*	S	Bend	trans	-154.5	71.6	-165.6	0	0	0	0	0	112.5	T109	T109-G111 PolarHBondContact O-N 3.35Å
112	T	44.8	Very low	48.2	Very low	112 Å²	112	127 Å²	127	69%	0.687	72%	0.722	S	S	*	*			trans	52.7	99	176.1	54.7	0	0	0	0	115.6	F114	T112-F114 HydrophobicContact CG2-CD2 4.47Å; T112-F114 HydrophobicContact CG2-CE2 3.96Å; T112-F114 PolarHBondContact O-N 2.78Å
113	Y	42	Very low	49.8	Very low	212 Å²	212	127.5 Å²	127.5	83%	0.831	72%	0.717	S	S	*	*			trans	-68.2	82.8	160.8	-179.9	-103.4	0	0	0	110	P115	Y113-P115 HydrophobicContact CE1-CB 4.25Å; Y113-P115 HydrophobicContact CE1-CG 4.11Å; Y113-P115 WeakPolarHBondContact O-CD 3.37Å
114	F	47.7	Very low	51.1	Low	148 Å²	148	129.6 Å²	129.6	65%	0.649	73%	0.725	S	S	*	*			trans	-85.1	116.5	155.9	-73.6	-77.5	0	0	0	107.8	T112 M116	T112-F114 HydrophobicContact CG2-CD2 4.47Å; T112-F114 HydrophobicContact CG2-CE2 3.96Å; T112-F114 PolarHBondContact O-N 2.78Å; F114-M116 HydrophobicContact CB-CG 4.19Å; F114-M116 PolarHBondContact O-N 3.42Å
115	P	47.2	Very low	52.8	Low	64 Å²	64	130 Å²	130	42%	0.416	72%	0.715	S	S	.	*			trans	-69.7	78.2	159.9	29.3	-32.1	0	0	0	108.6	Y113 K149	Y113-P115 HydrophobicContact CE1-CB 4.25Å; Y113-P115 HydrophobicContact CE1-CG 4.11Å; Y113-P115 WeakPolarHBondContact O-CD 3.37Å; P115-K149 PolarHBondContact O-NZ 3.38Å
116	M	50	Low	54.7	Low	163 Å²	163	134.1 Å²	134.1	80%	0.803	73%	0.726	S	S	*	*			trans	-60.1	142.6	164.7	-74.1	177.6	57.5	0	0	108.8	F114	F114-M116 HydrophobicContact CB-CG 4.19Å; F114-M116 PolarHBondContact O-N 3.42Å
117	M	45.3	Very low	56.3	Low	147 Å²	147	136.7 Å²	136.7	72%	0.724	73%	0.73	S	S	*	*			trans	68.6	122.8	-167.7	-45.4	-157.1	-55.9	0	0	114	K149	M117-K149 PolarHBondContact O-NZ 3.34Å; M117-K149 VanDerWaalsContact O-NZ 3.07Å
118	S	46	Very low	57.8	Low	66 Å²	66	130.2 Å²	130.2	46%	0.462	71%	0.712	S	S	.	*				-158.8	44.8	128.1	61.3	0	0	0	0	108.2	D120 K149	S118-D120 WeakPolarHBondContact CA-OD2 3.27Å; S118-K149 PolarHBondContact OG-NZ 3.16Å
119	D	49.7	Very low	59.4	Low	169 Å²	169	132.2 Å²	132.2	90%	0.904	71%	0.709	S	S	*	*			trans	-88.5	17.8	165.3	-67.2	-16.8	0	0	0	109.6	E121	D119-E121 PolarHBondContact O-N 3.01Å
120	D	57.8	Low	61.1	Low	108 Å²	108	131.3 Å²	131.3	58%	0.578	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-62.9	129.4	171.6	-55.7	-72.3	0	0	0	109	S118	S118-D120 WeakPolarHBondContact CA-OD2 3.27Å
121	E	60.1	Low	62.2	Low	179 Å²	179	134.7 Å²	134.7	84%	0.836	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-57.1	131	-179.8	-171.8	173.4	-175.9	0	0	110	D119	D119-E121 PolarHBondContact O-N 3.01Å
122	P	70.9	Confident	63.4	Low	111 Å²	111	138.1 Å²	138.1	72%	0.721	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-52.2	125.3	-176.1	-29.6	35.7	0	0	0	111.5	M124	P122-M124 PolarHBondContact O-N 2.9Å
123	P	74.7	Confident	64.5	Low	109 Å²	109	136.6 Å²	136.6	71%	0.708	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-61	134.4	-169.5	23.3	-34.1	0	0	0	110.7	L125	P123-L125 PolarHBondContact O-N 3.04Å
124	M	72.9	Confident	65.5	Low	188 Å²	188	132.3 Å²	132.3	93%	0.926	71%	0.707	S	S	*	*			trans	-56.1	114	175.4	-69.8	-164.2	-62.6	0	0	109.7	P122 E126	P122-M124 PolarHBondContact O-N 2.9Å; M124-E126 PolarHBondContact O-N 2.81Å
125	L	80.8	Confident	65.9	Low	94 Å²	94	135.6 Å²	135.6	49%	0.492	72%	0.715	S	S	.	*			trans	-65.4	130.5	-177.6	-61.3	170.2	0	0	0	109.5	P123 L127 G128 W129	P123-L125 PolarHBondContact O-N 3.04Å; L125-L127 PolarHBondContact O-N 2.82Å; L125-G128 WeakPolarHBondContact O-CA 3.45Å; L125-G128 PolarHBondContact O-N 3.46Å; L125-W129 HydrophobicContact CD1-CB 4.47Å; L125-W129 HydrophobicContact CD1-CD2 3.97Å; L125-W129 HydrophobicContact CD1-CE3 3.36Å; L125-W129 HydrophobicContact CD1-CG 4.47Å; L125-W129 HydrophobicContact CD1-CZ3 3.82Å
126	E	82.3	Confident	66.4	Low	198 Å²	198	141.8 Å²	141.8	93%	0.925	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58	-23.7	-171.1	-58.7	-179.4	158.3	0	0	114.3	M124	M124-E126 PolarHBondContact O-N 2.81Å
127	L	83	Confident	66.8	Low	176 Å²	176	136.9 Å²	136.9	92%	0.921	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	6.1	178.9	-54.6	-179.9	0	0	0	113.1	L125	L125-L127 PolarHBondContact O-N 2.82Å
128	G	76.6	Confident	67.5	Low	49 Å²	49	135.9 Å²	135.9	51%	0.505	73%	0.732	S	S	.	*			trans	79.2	166.1	-170.5	0	0	0	0	0	113.5	L125	L125-G128 WeakPolarHBondContact O-CA 3.45Å; L125-G128 PolarHBondContact O-N 3.46Å
129	W	76.1	Confident	68.2	Low	197 Å²	197	135 Å²	135	75%	0.746	73%	0.725	S	S	*	*			trans	-129.2	137.5	170.2	-167.6	-113.6	0	0	0	109.5	L125	L125-W129 HydrophobicContact CD1-CB 4.47Å; L125-W129 HydrophobicContact CD1-CD2 3.97Å; L125-W129 HydrophobicContact CD1-CE3 3.36Å; L125-W129 HydrophobicContact CD1-CG 4.47Å; L125-W129 HydrophobicContact CD1-CZ3 3.82Å
130	P	78.5	Confident	69.5	Low	100 Å²	100	132.3 Å²	132.3	65%	0.649	71%	0.707	S	S	*	*			trans	-64.4	137.8	177.4	-20.7	33.1	0	0	0	111.8	T132	P130-T132 PolarHBondContact O-N 3.02Å
131	E	74.6	Confident	70.8	Confident	190 Å²	190	130.1 Å²	130.1	89%	0.888	70%	0.698	S	S	*	*			trans	-56.3	129.9	170	-67.7	-179.3	176.8	0	0	110.4	P133	E131-P133 WeakPolarHBondContact O-CD 3.39Å
132	T	70.6	Confident	72.1	Confident	120 Å²	120	125.3 Å²	125.3	74%	0.736	68%	0.676	S	S	*	*			trans	-68	110.9	-175.7	-53	0	0	0	0	110.9	P130 V134	P130-T132 PolarHBondContact O-N 3.02Å; T132-V134 PolarHBondContact O-N 3.17Å
133	P	67.9	Low	73	Confident	81 Å²	81	124.1 Å²	124.1	53%	0.526	66%	0.662	S	S	.	*			trans	-71.4	129.5	175.5	30.5	-33.2	0	0	0	109.1	E131 R135	E131-P133 WeakPolarHBondContact O-CD 3.39Å; P133-R135 PolarHBondContact O-N 3.19Å
134	V	63.6	Low	73.7	Confident	122 Å²	122	120.2 Å²	120.2	74%	0.739	63%	0.633	S	S	*	*			trans	-64	110.2	177.3	-173.5	0	0	0	0	109.3	T132 F136	T132-V134 PolarHBondContact O-N 3.17Å; V134-F136 HydrophobicContact CG1-CD2 4.23Å; V134-F136 HydrophobicContact CG1-CE2 3.52Å; V134-F136 HydrophobicContact CG1-CZ 3.72Å
135	R	56.1	Low	74.4	Confident	216 Å²	216	116.1 Å²	116.1	82%	0.815	61%	0.611	S	S	*	*			trans	-110.7	124.2	175.7	-59.4	-171.3	-166.1	-171.8	6	109.7	P133	P133-R135 PolarHBondContact O-N 3.19Å
136	F	56	Low	74.5	Confident	195 Å²	195	113.4 Å²	113.4	86%	0.855	60%	0.596	S	S	*	*			trans	-99	132.5	166.3	-63.1	-78.7	0	0	0	109.1	V134	V134-F136 HydrophobicContact CG1-CD2 4.23Å; V134-F136 HydrophobicContact CG1-CE2 3.52Å; V134-F136 HydrophobicContact CG1-CZ 3.72Å
137	G	59	Low	74.1	Confident	59 Å²	59	112.7 Å²	112.7	61%	0.608	58%	0.584	S	S	*	*			trans	-128	153.4	176.4	0	0	0	0	0	111	S139	G137-S139 VanDerWaalsContact C-N 3.27Å; G137-S139 PolarHBondContact O-N 3.17Å
138	P	60	Low	73.6	Confident	127 Å²	127	107.3 Å²	107.3	83%	0.825	56%	0.557	S	S	*	*	S	Bend	trans	-84	5.9	-177.4	36.1	-37.9	0	0	0	114.2
139	S	61.1	Low	73.1	Confident	46 Å²	46	111 Å²	111	32%	0.322	56%	0.559	S	S	.	*	S	Bend	trans	-111	130.7	178.2	-58.6	0	0	0	0	109.3	G137 T141 F283	G137-S139 VanDerWaalsContact C-N 3.27Å; G137-S139 PolarHBondContact O-N 3.17Å; S139-T141 PolarHBondContact O-N 3.08Å; S139-F283 VanDerWaalsContact OG-CE1 3.22Å; S139-F283 WeakPolarHBondContact OG-CE1 3.39Å; S139-F283 VanDerWaalsContact OG-CZ 3.27Å; S139-F283 WeakPolarHBondContact OG-CZ 3.48Å
140	E	76.2	Confident	72.6	Confident	113 Å²	113	106.9 Å²	106.9	53%	0.528	56%	0.555	S	S	.	*			trans	-78.6	114.5	166.5	-176.3	178	-171.8	0	0	108.9	Q142 S281	E140-Q142 HydrophobicContact CG-CG 4.43Å; E140-Q142 PolarHBondContact OE1-NE2 3.47Å; E140-S281 PolarHBondContact O-N 2.91Å
141	T	85.3	Confident	72.2	Confident	63 Å²	63	106 Å²	106	39%	0.387	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	117.6	174.2	-57.3	0	0	0	0	108.2	S139 I143 H279 F280	S139-T141 PolarHBondContact O-N 3.08Å; T141-I143 HydrophobicContact CG2-CG1 4.35Å; T141-H279 CarbonylContact C-O 3.58Å; T141-H279 WeakPolarHBondContact CA-O 3.47Å; T141-F280 HydrophobicContact CG2-CD1 3.7Å; T141-F280 HydrophobicContact CG2-CE1 3.51Å; T141-F280 HydrophobicContact CG2-CZ 4.31Å
142	Q	88.6	Confident	72.7	Confident	78 Å²	78	100.2 Å²	100.2	36%	0.364	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	137.9	174.7	-55.4	-171.4	18.9	0	0	108.7	E140 Y144 M278 H279	E140-Q142 HydrophobicContact CG-CG 4.43Å; E140-Q142 PolarHBondContact OE1-NE2 3.47Å; Q142-Y144 HydrophobicContact CB-CE2 4.18Å; Q142-Y144 PolarHBondContact OE1-OH 3.42Å; Q142-M278 CarbonylContact O-C 3.59Å; Q142-M278 WeakPolarHBondContact O-CA 3.38Å; Q142-H279 HydrophobicContact CB-CB 4.48Å; Q142-H279 PolarHBondContact N-O 2.78Å; Q142-H279 PolarHBondContact O-N 3.48Å
143	I	90.3	Very high	73.7	Confident	85 Å²	85	94.6 Å²	94.6	44%	0.436	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	125.1	-177.2	-49.5	-177.3	0	0	0	108.7	T141 F145 M276 M278	T141-I143 HydrophobicContact CG2-CG1 4.35Å; I143-F145 HydrophobicContact CB-CE2 4.3Å; I143-F145 HydrophobicContact CG2-CD2 4.34Å; I143-F145 HydrophobicContact CG2-CE1 4.37Å; I143-F145 HydrophobicContact CG2-CE2 3.67Å; I143-F145 HydrophobicContact CG2-CZ 3.69Å; I143-M276 HydrophobicContact CG2-CG 3.93Å; I143-M276 HydrophobicContact CG2-SD 4.08Å; I143-M278 HydrophobicContact CG1-CG 4.18Å; I143-M278 HydrophobicContact CG2-CG 4.2Å
144	Y	89.3	Confident	74.9	Confident	27 Å²	27	91.2 Å²	91.2	11%	0.106	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	133.4	179.3	-49.2	-81	0	0	0	110	Q142 H151 L156 M276 V277 H279	Q142-Y144 HydrophobicContact CB-CE2 4.18Å; Q142-Y144 PolarHBondContact OE1-OH 3.42Å; Y144-H151 HydrophobicContact CD1-CB 4.04Å; Y144-H151 AromaticContact CD1-CD2 3.55Å; Y144-H151 AromaticContact CD1-CG 3.7Å; Y144-H151 AromaticContact CE1-CD2 3.66Å; Y144-H151 AromaticContact CE1-NE2 3.89Å; Y144-L156 HydrophobicContact CD2-CD2 3.38Å; Y144-L156 HydrophobicContact CE2-CD2 3.4Å; Y144-L156 HydrophobicContact CG-CD2 4.02Å; Y144-M276 WeakPolarHBondContact O-CA 3.5Å; Y144-V277 HydrophobicContact CD2-CG2 4.11Å; Y144-V277 PolarHBondContact N-O 3.16Å; Y144-V277 PolarHBondContact O-N 2.84Å; Y144-H279 HydrophobicContact CE2-CB 3.76Å
145	F	87.4	Confident	76.3	Confident	102 Å²	102	87.4 Å²	87.4	45%	0.447	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	129.4	178.5	-61.9	-88.6	0	0	0	108.8	I143 R147 D148 M276	I143-F145 HydrophobicContact CB-CE2 4.3Å; I143-F145 HydrophobicContact CG2-CD2 4.34Å; I143-F145 HydrophobicContact CG2-CE1 4.37Å; I143-F145 HydrophobicContact CG2-CE2 3.67Å; I143-F145 HydrophobicContact CG2-CZ 3.69Å; F145-R147 PolarHBondContact O-N 3.45Å; F145-D148 WeakPolarHBondContact O-CB 3.36Å; F145-D148 PolarHBondContact O-N 3.06Å; F145-M276 HydrophobicContact CD1-CB 4.09Å; F145-M276 HydrophobicContact CD1-CG 3.75Å; F145-M276 HydrophobicContact CD1-SD 4.19Å; F145-M276 HydrophobicContact CE1-CB 4.33Å; F145-M276 HydrophobicContact CE1-CG 3.63Å; F145-M276 HydrophobicContact CE1-SD 3.47Å; F145-M276 WeakPolarHBondContact CE1-SD 3.37Å; F145-M276 HydrophobicContact CZ-CG 4.32Å; F145-M276 HydrophobicContact CZ-SD 4.02Å
146	Q	82.4	Confident	78.1	Confident	38 Å²	38	78.8 Å²	78.8	18%	0.178	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-8.5	-175.9	-160.4	163.6	-4.7	0	0	114.5	I153 S269 A270 H273 N275	Q146-I153 HydrophobicContact CB-CD1 3.83Å; Q146-I153 HydrophobicContact CG-CD1 4.38Å; Q146-S269 PolarHBondContact NE2-O 3.09Å; Q146-S269 PolarHBondContact OE1-O 2.81Å; Q146-A270 PolarHBondContact NE2-O 3.43Å; Q146-A270 VanDerWaalsContact NE2-O 3.11Å; Q146-H273 PolarHBondContact NE2-O 2.81Å; Q146-H273 PolarHBondContact OE1-O 3.45Å; Q146-N275 WeakPolarHBondContact CB-O 3.2Å; Q146-N275 PolarHBondContact N-O 3.24Å; Q146-N275 PolarHBondContact OE1-ND2 3.1Å
147	R	74.4	Confident	80	Confident	182 Å²	182	69.7 Å²	69.7	69%	0.687	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-25.4	169.9	-65.1	-170.7	178.3	88.7	2.4	112.8	F145 K149 S274	F145-R147 PolarHBondContact O-N 3.45Å; R147-K149 PolarHBondContact O-N 2.9Å; R147-S274 PolarHBondContact NH1-OG 3.1Å; R147-S274 PolarHBondContact NH2-OG 3.03Å
148	D	72.2	Confident	81.8	Confident	64 Å²	64	67.5 Å²	67.5	34%	0.342	34%	0.339	S	S	.	.	S	Bend	trans	-74.7	104.7	172	175.2	2.9	0	0	0	108.8	F145 T150 H151	F145-D148 WeakPolarHBondContact O-CB 3.36Å; F145-D148 PolarHBondContact O-N 3.06Å; D148-T150 PolarHBondContact O-N 3.26Å; D148-T150 VanDerWaalsContact O-N 3.07Å; D148-T150 WeakPolarHBondContact OD1-CB 3.43Å; D148-T150 PolarHBondContact OD1-N 3.46Å; D148-T150 PolarHBondContact OD1-OG1 3.07Å; D148-T150 PolarHBondContact OD2-OG1 3.25Å; D148-T150 VanDerWaalsContact OD2-OG1 3.13Å; D148-H151 PolarHBondContact O-N 3.21Å; D148-H151 IonicContact OD2-CE1 2.7Å; D148-H151 IonicContact OD2-CG 2.74Å; D148-H151 IonicContact OD2-ND1 3.75Å; D148-H151 PolarHBondContact OD2-ND1 2.97Å
149	K	65.3	Low	83.4	Confident	126 Å²	126	63.3 Å²	63.3	55%	0.548	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-8.3	-177.5	-64.4	164.8	-171.5	163.5	0	112.7	P115 M117 S118 R147	P115-K149 PolarHBondContact O-NZ 3.38Å; M117-K149 PolarHBondContact O-NZ 3.34Å; M117-K149 VanDerWaalsContact O-NZ 3.07Å; S118-K149 PolarHBondContact OG-NZ 3.16Å; R147-K149 PolarHBondContact O-N 2.9Å
150	T	66.3	Low	85.1	Confident	110 Å²	110	61.2 Å²	61.2	68%	0.675	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-16.4	173.1	72.5	0	0	0	0	113.6	D148	D148-T150 PolarHBondContact O-N 3.26Å; D148-T150 VanDerWaalsContact O-N 3.07Å; D148-T150 WeakPolarHBondContact OD1-CB 3.43Å; D148-T150 PolarHBondContact OD1-N 3.46Å; D148-T150 PolarHBondContact OD1-OG1 3.07Å; D148-T150 PolarHBondContact OD2-OG1 3.25Å; D148-T150 VanDerWaalsContact OD2-OG1 3.13Å
151	H	68.8	Low	86.1	Confident	82 Å²	82	55.8 Å²	55.8	38%	0.38	27%	0.273	S	S	.	.			trans	-125.3	85.1	-173.7	-68.9	106.9	0	0	0	113.5	Y144 D148 I153	Y144-H151 HydrophobicContact CD1-CB 4.04Å; Y144-H151 AromaticContact CD1-CD2 3.55Å; Y144-H151 AromaticContact CD1-CG 3.7Å; Y144-H151 AromaticContact CE1-CD2 3.66Å; Y144-H151 AromaticContact CE1-NE2 3.89Å; D148-H151 PolarHBondContact O-N 3.21Å; D148-H151 IonicContact OD2-CE1 2.7Å; D148-H151 IonicContact OD2-CG 2.74Å; D148-H151 IonicContact OD2-ND1 3.75Å; D148-H151 PolarHBondContact OD2-ND1 2.97Å; H151-I153 PolarHBondContact O-N 3.44Å
152	N	86.3	Confident	86.6	Confident	69 Å²	69	56.2 Å²	56.2	37%	0.369	27%	0.272	S	S	.	.			trans	-69.5	112.9	170.1	-176.9	-6.9	0	0	0	111.2	K154 D155 L156	N152-K154 VanDerWaalsContact C-N 3.33Å; N152-K154 PolarHBondContact O-N 2.94Å; N152-K154 PolarHBondContact OD1-N 3.29Å; N152-D155 HydrophobicContact CB-CB 4.03Å; N152-D155 WeakPolarHBondContact CB-OD2 3.4Å; N152-D155 PolarHBondContact ND2-OD1 3.45Å; N152-D155 PolarHBondContact ND2-OD2 2.97Å; N152-D155 PolarHBondContact O-N 3.45Å; N152-L156 PolarHBondContact O-N 3.08Å
153	I	92.1	Very high	86.8	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-62	-36.4	-179.3	-64	178.2	0	0	0	112.2	Q146 H151 L156 I157 Y263 N275 V277	Q146-I153 HydrophobicContact CB-CD1 3.83Å; Q146-I153 HydrophobicContact CG-CD1 4.38Å; H151-I153 PolarHBondContact O-N 3.44Å; I153-L156 PolarHBondContact O-N 2.84Å; I153-I157 HydrophobicContact CG2-CD1 3.79Å; I153-I157 HydrophobicContact CG2-CG1 4.48Å; I153-I157 WeakPolarHBondContact O-CD1 3.35Å; I153-I157 VanDerWaalsContact O-CG1 3.3Å; I153-I157 WeakPolarHBondContact O-CG1 3.43Å; I153-I157 PolarHBondContact O-N 3.39Å; I153-Y263 HydrophobicContact CB-CD2 4.13Å; I153-Y263 HydrophobicContact CB-CE2 4.3Å; I153-Y263 HydrophobicContact CG2-CD1 4.43Å; I153-Y263 HydrophobicContact CG2-CD2 3.46Å; I153-Y263 VanDerWaalsContact CG2-CD2 3.46Å; I153-Y263 HydrophobicContact CG2-CE2 3.91Å; I153-Y263 HydrophobicContact CG2-CG 3.77Å; I153-N275 HydrophobicContact CD1-CB 3.99Å; I153-V277 HydrophobicContact CB-CG2 4.49Å; I153-V277 HydrophobicContact CD1-CG1 4.34Å; I153-V277 HydrophobicContact CD1-CG2 3.9Å; I153-V277 HydrophobicContact CG1-CG2 3.91Å; I153-V277 HydrophobicContact CG2-CG1 3.83Å; I153-V277 HydrophobicContact CG2-CG2 3.88Å
154	K	93.1	Very high	87.1	Confident	10 Å²	10	53.6 Å²	53.6	4%	0.043	26%	0.257	C	S	.	.	H	α-helix	trans	-65.5	-42.9	177	-179.4	162.2	170.9	166.5	0	111.1	N152 L156 I157 R158 D177 D179 A270	N152-K154 VanDerWaalsContact C-N 3.33Å; N152-K154 PolarHBondContact O-N 2.94Å; N152-K154 PolarHBondContact OD1-N 3.29Å; K154-L156 VanDerWaalsContact C-N 3.35Å; K154-I157 PolarHBondContact O-N 2.83Å; K154-R158 HydrophobicContact CG-CG 4.36Å; K154-R158 WeakPolarHBondContact O-CB 3.19Å; K154-R158 VanDerWaalsContact O-CG 3.27Å; K154-R158 WeakPolarHBondContact O-CG 3.49Å; K154-R158 PolarHBondContact O-N 3.41Å; K154-D177 WeakPolarHBondContact CE-OD2 3.48Å; K154-D177 IonicContact NZ-OD1 3.96Å; K154-D177 PolarHBondContact NZ-OD1 2.72Å; K154-D177 IonicContact NZ-OD2 3.88Å; K154-D177 PolarHBondContact NZ-OD2 2.82Å; K154-D179 WeakPolarHBondContact CE-OD2 3.38Å; K154-D179 IonicContact NZ-OD2 2.82Å; K154-D179 PolarHBondContact NZ-OD2 3.03Å; K154-A270 HydrophobicContact CB-CB 4.35Å; K154-A270 HydrophobicContact CD-CB 3.57Å
155	D	92.5	Very high	87.4	Confident	42 Å²	42	60.5 Å²	60.5	23%	0.225	29%	0.288	C	S	.	.	H	α-helix	trans	-68.9	-34.6	179.7	-65.5	-19.1	0	0	0	111.9	L39 N152 S159	L39-D155 HydrophobicContact CD1-CB 4.07Å; L39-D155 HydrophobicContact CD2-CB 4.33Å; N152-D155 HydrophobicContact CB-CB 4.03Å; N152-D155 WeakPolarHBondContact CB-OD2 3.4Å; N152-D155 PolarHBondContact ND2-OD1 3.45Å; N152-D155 PolarHBondContact ND2-OD2 2.97Å; N152-D155 PolarHBondContact O-N 3.45Å; D155-S159 WeakPolarHBondContact O-CB 3.31Å; D155-S159 PolarHBondContact O-N 3.18Å
156	L	93.6	Very high	87.8	Confident	36 Å²	36	61 Å²	61	19%	0.188	29%	0.29	C	S	.	.	H	α-helix	trans	-59.6	-52.1	169.7	174.8	62.3	0	0	0	111.3	Y144 N152 I153 K154 R158 S159 M160 I259 V277	Y144-L156 HydrophobicContact CD2-CD2 3.38Å; Y144-L156 HydrophobicContact CE2-CD2 3.4Å; Y144-L156 HydrophobicContact CG-CD2 4.02Å; N152-L156 PolarHBondContact O-N 3.08Å; I153-L156 PolarHBondContact O-N 2.84Å; K154-L156 VanDerWaalsContact C-N 3.35Å; L156-R158 PolarHBondContact O-N 3.09Å; L156-S159 WeakPolarHBondContact O-CB 3.41Å; L156-S159 PolarHBondContact O-N 3.41Å; L156-M160 HydrophobicContact CD1-CG 4.38Å; L156-M160 HydrophobicContact CD1-SD 4.32Å; L156-M160 HydrophobicContact CG-SD 4.37Å; L156-M160 WeakPolarHBondContact O-CG 3.46Å; L156-M160 PolarHBondContact O-N 3.31Å; L156-I259 HydrophobicContact CD2-CD1 3.68Å; L156-I259 HydrophobicContact CG-CD1 4.07Å; L156-V277 HydrophobicContact CD2-CG2 4.44Å
157	I	96	Very high	88.5	Confident	4 Å²	4	60.8 Å²	60.8	2%	0.021	29%	0.291	C	S	.	.	H	α-helix	trans	-59.9	-45.6	179.1	-68.7	163.8	0	0	0	110.9	I153 K154 S159 M160 I161 L180 M251 I259 Y263 F265	I153-I157 HydrophobicContact CG2-CD1 3.79Å; I153-I157 HydrophobicContact CG2-CG1 4.48Å; I153-I157 WeakPolarHBondContact O-CD1 3.35Å; I153-I157 VanDerWaalsContact O-CG1 3.3Å; I153-I157 WeakPolarHBondContact O-CG1 3.43Å; I153-I157 PolarHBondContact O-N 3.39Å; K154-I157 PolarHBondContact O-N 2.83Å; I157-S159 PolarHBondContact O-N 3.02Å; I157-M160 PolarHBondContact O-N 2.91Å; I157-I161 HydrophobicContact CG2-CD1 3.84Å; I157-I161 WeakPolarHBondContact O-CG1 3.46Å; I157-I161 PolarHBondContact O-N 2.82Å; I157-L180 HydrophobicContact CG2-CD1 4.47Å; I157-L180 HydrophobicContact CG2-CD2 3.75Å; I157-M251 HydrophobicContact CG2-CE 3.95Å; I157-I259 HydrophobicContact CG1-CD1 4.01Å; I157-Y263 HydrophobicContact CD1-CD1 3.47Å; I157-Y263 VanDerWaalsContact CD1-CD1 3.47Å; I157-Y263 HydrophobicContact CD1-CE1 3.6Å; I157-Y263 HydrophobicContact CD1-CG 4.11Å; I157-F265 HydrophobicContact CD1-CE1 4.15Å; I157-F265 HydrophobicContact CG2-CE1 4.13Å; I157-F265 HydrophobicContact CG2-CZ 4.06Å
158	R	95.8	Very high	89.6	Confident	13 Å²	13	52.1 Å²	52.1	5%	0.049	26%	0.258	C	S	.	.	H	α-helix	trans	-63.7	-40.3	177	-68.4	176.5	76.3	-153.3	-4.6	112.1	L37 E38 L39 K154 L156 I161 N162 L180 D183	L37-R158 HydrophobicContact CD1-CB 4.26Å; E38-R158 PolarHBondContact O-NH1 3.41Å; E38-R158 PolarHBondContact O-NH2 2.97Å; L39-R158 HydrophobicContact CD2-CB 4.35Å; K154-R158 HydrophobicContact CG-CG 4.36Å; K154-R158 WeakPolarHBondContact O-CB 3.19Å; K154-R158 VanDerWaalsContact O-CG 3.27Å; K154-R158 WeakPolarHBondContact O-CG 3.49Å; K154-R158 PolarHBondContact O-N 3.41Å; L156-R158 PolarHBondContact O-N 3.09Å; R158-I161 PolarHBondContact O-N 2.98Å; R158-N162 VanDerWaalsContact O-CB 3.27Å; R158-N162 WeakPolarHBondContact O-CB 3.4Å; R158-N162 PolarHBondContact O-N 3.5Å; R158-L180 HydrophobicContact CG-CD2 3.55Å; R158-D183 WeakPolarHBondContact CG-OD2 3.16Å; R158-D183 IonicContact CZ-OD2 3.57Å; R158-D183 IonicContact NE-OD2 2.98Å; R158-D183 PolarHBondContact NE-OD2 2.99Å; R158-D183 IonicContact NH2-OD2 2.89Å
159	S	95.3	Very high	90.9	Very high	39 Å²	39	49.4 Å²	49.4	27%	0.273	24%	0.244	S	C	.	.	H	α-helix	trans	-60.9	-43.1	173.7	-174.7	0	0	0	0	111.9	D155 L156 I157 N162 K163	D155-S159 WeakPolarHBondContact O-CB 3.31Å; D155-S159 PolarHBondContact O-N 3.18Å; L156-S159 WeakPolarHBondContact O-CB 3.41Å; L156-S159 PolarHBondContact O-N 3.41Å; I157-S159 PolarHBondContact O-N 3.02Å; S159-N162 PolarHBondContact O-N 2.73Å; S159-K163 VanDerWaalsContact O-CG 3.24Å; S159-K163 WeakPolarHBondContact O-CG 3.29Å; S159-K163 PolarHBondContact O-N 3.18Å
160	M	95.7	Very high	92.5	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-64	-48.6	175.3	-70.6	-178.9	81	0	0	112.3	L156 I157 N162 K163 A164 M251 I253 E257 I259 H279	L156-M160 HydrophobicContact CD1-CG 4.38Å; L156-M160 HydrophobicContact CD1-SD 4.32Å; L156-M160 HydrophobicContact CG-SD 4.37Å; L156-M160 WeakPolarHBondContact O-CG 3.46Å; L156-M160 PolarHBondContact O-N 3.31Å; I157-M160 PolarHBondContact O-N 2.91Å; M160-N162 VanDerWaalsContact C-N 3.26Å; M160-N162 PolarHBondContact O-N 2.75Å; M160-K163 PolarHBondContact O-N 2.87Å; M160-K163 VanDerWaalsContact O-N 3.12Å; M160-A164 PolarHBondContact O-N 3.44Å; M160-M251 HydrophobicContact CB-CE 4.06Å; M160-I253 HydrophobicContact CB-CG1 4.2Å; M160-I253 HydrophobicContact CE-CG1 4.19Å; M160-E257 HydrophobicContact CE-CB 3.84Å; M160-I259 HydrophobicContact CE-CB 4.18Å; M160-I259 HydrophobicContact CE-CG2 4.1Å; M160-I259 HydrophobicContact SD-CB 3.99Å; M160-I259 HydrophobicContact SD-CD1 4.08Å; M160-I259 HydrophobicContact SD-CG2 3.88Å; M160-H279 WeakPolarHBondContact CE-NE2 3.45Å
161	I	96.9	Very high	94	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-58.4	-39.1	176.1	-67.6	163.7	0	0	0	111.4	I157 R158 I168 L180 D183 L184 A187 R191 M251	I157-I161 HydrophobicContact CG2-CD1 3.84Å; I157-I161 WeakPolarHBondContact O-CG1 3.46Å; I157-I161 PolarHBondContact O-N 2.82Å; R158-I161 PolarHBondContact O-N 2.98Å; I161-I168 HydrophobicContact CB-CD1 4.49Å; I161-I168 HydrophobicContact CG2-CD1 3.92Å; I161-L180 HydrophobicContact CD1-CD2 4.21Å; I161-D183 HydrophobicContact CB-CB 4.42Å; I161-D183 HydrophobicContact CD1-CB 4.36Å; I161-D183 HydrophobicContact CG2-CB 3.79Å; I161-D183 WeakPolarHBondContact CG2-O 3.4Å; I161-L184 HydrophobicContact CD1-CD2 3.89Å; I161-L184 HydrophobicContact CD1-CG 4.22Å; I161-L184 HydrophobicContact CG1-CD2 3.98Å; I161-L184 HydrophobicContact CG2-CD2 3.97Å; I161-A187 HydrophobicContact CG2-CB 4.47Å; I161-R191 VanDerWaalsContact O-CZ 3.28Å; I161-R191 PolarHBondContact O-NH1 2.95Å; I161-R191 PolarHBondContact O-NH2 2.74Å; I161-M251 HydrophobicContact CD1-CE 4.49Å; I161-M251 HydrophobicContact CD1-SD 4.05Å; I161-M251 HydrophobicContact CG1-CE 3.97Å; I161-M251 HydrophobicContact CG1-SD 3.65Å
162	N	95.4	Very high	95.4	Very high	71 Å²	71	34.4 Å²	34.4	38%	0.38	17%	0.169	S	C	.	.	H	α-helix	trans	-70.1	-31.6	177.4	-177.1	54	0	0	0	113.7	L37 R158 S159 M160 R191	L37-N162 HydrophobicContact CD2-CB 3.84Å; R158-N162 VanDerWaalsContact O-CB 3.27Å; R158-N162 WeakPolarHBondContact O-CB 3.4Å; R158-N162 PolarHBondContact O-N 3.5Å; S159-N162 PolarHBondContact O-N 2.73Å; M160-N162 VanDerWaalsContact C-N 3.26Å; M160-N162 PolarHBondContact O-N 2.75Å; N162-R191 PolarHBondContact O-NH1 2.9Å
163	K	94.6	Very high	95.9	Very high	107 Å²	107	32 Å²	32	47%	0.465	16%	0.156	S	C	.	.	H	α-helix	trans	-73.6	-26.9	177.1	-74.1	166.9	-175.4	178.4	0	114.1	S159 M160 K165	S159-K163 VanDerWaalsContact O-CG 3.24Å; S159-K163 WeakPolarHBondContact O-CG 3.29Å; S159-K163 PolarHBondContact O-N 3.18Å; M160-K163 PolarHBondContact O-N 2.87Å; M160-K163 VanDerWaalsContact O-N 3.12Å; K163-K165 WeakPolarHBondContact O-CG 3.35Å
164	A	96.4	Very high	96.1	Very high	2 Å²	2	33.3 Å²	33.3	2%	0.017	16%	0.163	C	C	.	.			trans	-57.3	144.2	-173.6	0	0	0	0	0	114.2	M160 I168 R191 V193 I253	M160-A164 PolarHBondContact O-N 3.44Å; A164-I168 HydrophobicContact CB-CD1 3.85Å; A164-I168 HydrophobicContact CB-CG1 3.7Å; A164-R191 PolarHBondContact O-NH1 3.27Å; A164-V193 HydrophobicContact CB-CG1 4.44Å; A164-I253 HydrophobicContact CB-CD1 4.31Å; A164-I253 HydrophobicContact CB-CG2 3.69Å
165	K	95.6	Very high	96.3	Very high	172 Å²	172	33 Å²	33	75%	0.748	16%	0.161	S	C	*	.	S	Bend	trans	-135.7	-21.6	-173.6	-62.2	165.4	-166.6	161.2	0	114.6	K163 D254	K163-K165 WeakPolarHBondContact O-CG 3.35Å; K165-D254 WeakPolarHBondContact CB-OD2 3.43Å; K165-D254 PolarHBondContact N-OD1 3.31Å; K165-D254 PolarHBondContact N-OD2 3.18Å
166	K	94.8	Very high	96.5	Very high	113 Å²	113	31.2 Å²	31.2	49%	0.491	15%	0.152	S	C	.	.	S	Bend	trans	-118.2	-47.7	-171.3	-51.3	-179.8	-158.4	161.9	0	112.9	P194 D254 E256	K166-P194 VanDerWaalsContact O-CD 3.31Å; K166-P194 WeakPolarHBondContact O-CD 3.42Å; K166-D254 WeakPolarHBondContact CA-OD1 3.42Å; K166-D254 HydrophobicContact CB-CB 4.16Å; K166-D254 HydrophobicContact CD-CB 4.08Å; K166-D254 HydrophobicContact CG-CB 4.15Å; K166-D254 PolarHBondContact N-OD1 3.02Å; K166-D254 PolarHBondContact N-OD2 2.7Å; K166-E256 IonicContact NZ-OE1 3.59Å; K166-E256 PolarHBondContact NZ-OE1 2.74Å
167	V	97.2	Very high	96.7	Very high	32 Å²	32	29.6 Å²	29.6	19%	0.194	14%	0.144	C	C	.	.			trans	-163.8	146.9	-178	61.8	0	0	0	0	111	Y196 D254	V167-Y196 HydrophobicContact CG2-CD2 3.89Å; V167-Y196 HydrophobicContact CG2-CE2 3.89Å; V167-D254 PolarHBondContact N-OD1 3.24Å; V167-D254 PolarHBondContact O-N 2.97Å
168	I	98.5	Very high	96.7	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	131.7	164.7	-57.9	175	0	0	0	108	I161 A164 V170 L184 A187 V193 P194 V195 Y196 M251 I253	I161-I168 HydrophobicContact CB-CD1 4.49Å; I161-I168 HydrophobicContact CG2-CD1 3.92Å; A164-I168 HydrophobicContact CB-CD1 3.85Å; A164-I168 HydrophobicContact CB-CG1 3.7Å; I168-V170 HydrophobicContact CG2-CG2 4Å; I168-L184 HydrophobicContact CD1-CD2 3.99Å; I168-L184 HydrophobicContact CG2-CD2 3.82Å; I168-A187 HydrophobicContact CD1-CB 3.74Å; I168-V193 HydrophobicContact CD1-CG1 4.44Å; I168-V193 HydrophobicContact CG1-CG1 4.01Å; I168-P194 PolarHBondContact N-O 3.12Å; I168-V195 HydrophobicContact CB-CG1 4.22Å; I168-V195 HydrophobicContact CB-CG2 4.34Å; I168-V195 HydrophobicContact CD1-CG2 4.44Å; I168-V195 HydrophobicContact CG2-CG1 4.28Å; I168-V195 CarbonylContact O-C 3.58Å; I168-V195 WeakPolarHBondContact O-CA 3.44Å; I168-Y196 PolarHBondContact O-N 2.74Å; I168-M251 HydrophobicContact CG2-CG 4.18Å; I168-M251 HydrophobicContact CG2-SD 4.18Å; I168-I253 HydrophobicContact CB-CD1 4.39Å; I168-I253 HydrophobicContact CD1-CD1 4.39Å; I168-I253 HydrophobicContact CG1-CD1 3.86Å; I168-I253 HydrophobicContact CG2-CD1 4Å
169	A	98.4	Very high	96.6	Very high	7 Å²	7	30.9 Å²	30.9	6%	0.058	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	127.3	173.6	0	0	0	0	0	109.7	Y196 M251 I252 F292	A169-Y196 CarbonylContact C-O 3.59Å; A169-Y196 WeakPolarHBondContact CA-O 3.43Å; A169-M251 CarbonylContact O-C 3.58Å; A169-M251 VanDerWaalsContact O-CA 3.27Å; A169-M251 WeakPolarHBondContact O-CA 3.3Å; A169-I252 HydrophobicContact CB-CB 4.22Å; A169-I252 HydrophobicContact CB-CG1 4.41Å; A169-I252 PolarHBondContact N-O 2.49Å; A169-I252 PolarHBondContact O-N 3.24Å; A169-F292 HydrophobicContact CB-CD1 4.06Å; A169-F292 HydrophobicContact CB-CD2 3.94Å; A169-F292 HydrophobicContact CB-CE1 3.89Å; A169-F292 HydrophobicContact CB-CE2 3.77Å; A169-F292 HydrophobicContact CB-CG 4.1Å; A169-F292 HydrophobicContact CB-CZ 3.76Å
170	V	98.6	Very high	96.7	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	131.8	-174.9	-179	0	0	0	0	109.8	I168 M172 L184 Y196 I197 L198 M251 F265	I168-V170 HydrophobicContact CG2-CG2 4Å; V170-M172 HydrophobicContact CG1-CB 4.08Å; V170-M172 HydrophobicContact CG1-CE 4.19Å; V170-L184 HydrophobicContact CG2-CD1 4.44Å; V170-Y196 PolarHBondContact N-O 3.04Å; V170-I197 HydrophobicContact CB-CG2 4.34Å; V170-I197 HydrophobicContact CG1-CG2 4.47Å; V170-I197 WeakPolarHBondContact O-CA 3.42Å; V170-L198 PolarHBondContact O-N 3.44Å; V170-M251 HydrophobicContact CG2-CB 4.45Å; V170-M251 HydrophobicContact CG2-CG 4.01Å; V170-M251 HydrophobicContact CG2-SD 4.28Å; V170-F265 HydrophobicContact CG1-CE2 3.87Å; V170-F265 HydrophobicContact CG1-CZ 4.31Å
171	V	98.5	Very high	96.7	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	124.9	163.3	-172.5	0	0	0	0	107.5	L198 V246 E248 K249 F250 F292 L295	V171-L198 WeakPolarHBondContact CA-O 3.33Å; V171-L198 HydrophobicContact CG2-CB 4.38Å; V171-L198 HydrophobicContact CG2-CD1 4.31Å; V171-V246 HydrophobicContact CG1-CG1 4.14Å; V171-E248 HydrophobicContact CG1-CB 4.38Å; V171-K249 WeakPolarHBondContact O-CA 3.41Å; V171-F250 HydrophobicContact CB-CD1 4.12Å; V171-F250 HydrophobicContact CB-CE1 3.96Å; V171-F250 HydrophobicContact CB-CG 4.49Å; V171-F250 HydrophobicContact CB-CZ 4.19Å; V171-F250 HydrophobicContact CG1-CE1 4.42Å; V171-F250 HydrophobicContact CG2-CD1 4.26Å; V171-F250 HydrophobicContact CG2-CD2 4.3Å; V171-F250 HydrophobicContact CG2-CE1 3.71Å; V171-F250 HydrophobicContact CG2-CE2 3.76Å; V171-F250 HydrophobicContact CG2-CZ 3.44Å; V171-F250 VanDerWaalsContact CG2-CZ 3.44Å; V171-F250 PolarHBondContact N-O 2.77Å; V171-F250 PolarHBondContact O-N 2.8Å; V171-F250 VanDerWaalsContact O-N 3.08Å; V171-F292 HydrophobicContact CG2-CD2 3.57Å; V171-F292 HydrophobicContact CG2-CE2 3.89Å; V171-L295 HydrophobicContact CG1-CD1 4.05Å; V171-L295 HydrophobicContact CG2-CD1 4.04Å
172	M	98	Very high	96.7	Very high	4 Å²	4	29 Å²	29	2%	0.02	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	141.8	-172.4	-163.6	59.2	51	0	0	112.2	V170 I174 F175 L198 L199 D200 K249 F265	V170-M172 HydrophobicContact CG1-CB 4.08Å; V170-M172 HydrophobicContact CG1-CE 4.19Å; M172-I174 VanDerWaalsContact CG-O 3.26Å; M172-I174 WeakPolarHBondContact CG-O 3.22Å; M172-F175 HydrophobicContact CG-CB 4.44Å; M172-L198 PolarHBondContact N-O 2.85Å; M172-L199 HydrophobicContact CB-CD2 3.98Å; M172-L199 WeakPolarHBondContact O-CA 3.37Å; M172-D200 PolarHBondContact O-N 3.27Å; M172-K249 HydrophobicContact SD-CB 4.4Å; M172-K249 HydrophobicContact SD-CD 4.13Å; M172-K249 HydrophobicContact SD-CG 3.79Å; M172-F265 HydrophobicContact CE-CD1 3.37Å; M172-F265 HydrophobicContact CE-CD2 4.12Å; M172-F265 HydrophobicContact CE-CE1 3.33Å; M172-F265 HydrophobicContact CE-CE2 4.08Å; M172-F265 HydrophobicContact CE-CG 3.79Å; M172-F265 HydrophobicContact CE-CZ 3.72Å; M172-F265 HydrophobicContact CG-CB 4.13Å; M172-F265 HydrophobicContact CG-CD2 4.43Å; M172-F265 HydrophobicContact CG-CG 4.11Å; M172-F265 HydrophobicContact SD-CB 4.29Å; M172-F265 HydrophobicContact SD-CD1 3.84Å; M172-F265 HydrophobicContact SD-CE1 4.4Å; M172-F265 HydrophobicContact SD-CG 4.01Å; M172-F265 PolarHBondContact SD-N 3.27Å; M172-F265 VanDerWaalsContact SD-N 3.41Å
173	D	96.4	Very high	96.7	Very high	17 Å²	17	25.7 Å²	25.7	9%	0.091	12%	0.121	C	C	.	.	S	Bend	trans	-81.8	-40.3	177.9	57.6	1.1	0	0	0	113	N203 K249 S264	D173-N203 WeakPolarHBondContact O-CB 3.28Å; D173-N203 PolarHBondContact O-ND2 2.73Å; D173-K249 WeakPolarHBondContact OD1-CD 3.25Å; D173-K249 IonicContact OD2-NZ 3.64Å; D173-K249 PolarHBondContact OD2-NZ 2.87Å; D173-S264 VanDerWaalsContact OD1-CB 3.25Å; D173-S264 WeakPolarHBondContact OD1-CB 3.41Å; D173-S264 PolarHBondContact OD1-OG 2.77Å; D173-S264 PolarHBondContact OD2-OG 3.06Å
174	I	96.6	Very high	96.8	Very high	29 Å²	29	20.6 Å²	20.6	15%	0.149	10%	0.099	C	C	.	.			trans	-137.8	130.3	175.9	-54.1	177.5	0	0	0	109.2	L76 M172 T176 N203 F265 T266	L76-I174 HydrophobicContact CD2-CD1 3.95Å; M172-I174 VanDerWaalsContact CG-O 3.26Å; M172-I174 WeakPolarHBondContact CG-O 3.22Å; I174-T176 HydrophobicContact CG2-CG2 4.08Å; I174-N203 HydrophobicContact CG1-CB 4.09Å; I174-N203 WeakPolarHBondContact CG1-ND2 3.46Å; I174-F265 PolarHBondContact O-N 3.15Å; I174-F265 VanDerWaalsContact O-N 3.09Å; I174-T266 HydrophobicContact CB-CG2 4.04Å; I174-T266 HydrophobicContact CG2-CG2 3.66Å
175	F	97.7	Very high	96.8	Very high	3 Å²	3	20.5 Å²	20.5	1%	0.013	10%	0.098	C	C	.	.	B	Isolated β-bridge	trans	-130.1	105	175.3	-170.8	-174.7	0	0	0	111	M172 D177 L180 M181 L184 I197 L199 F207 M210 F265	M172-F175 HydrophobicContact CG-CB 4.44Å; F175-D177 WeakPolarHBondContact CE2-O 3.36Å; F175-L180 HydrophobicContact CE2-CB 3.97Å; F175-L180 HydrophobicContact CZ-CB 4.34Å; F175-M181 HydrophobicContact CE1-SD 4.06Å; F175-M181 HydrophobicContact CE2-CB 4.22Å; F175-M181 HydrophobicContact CZ-CB 3.98Å; F175-M181 HydrophobicContact CZ-SD 3.97Å; F175-L184 HydrophobicContact CE1-CD1 3.9Å; F175-L184 HydrophobicContact CZ-CD1 3.89Å; F175-I197 HydrophobicContact CD1-CG2 4.43Å; F175-I197 HydrophobicContact CE1-CD1 4.21Å; F175-L199 HydrophobicContact CB-CD2 3.93Å; F175-L199 HydrophobicContact CD1-CD2 4.32Å; F175-F207 HydrophobicContact CB-CD2 3.95Å; F175-F207 AromaticContact CD1-CD2 3.67Å; F175-F207 HydrophobicContact CD1-CD2 3.67Å; F175-F207 AromaticContact CD1-CE2 3.56Å; F175-F207 HydrophobicContact CD1-CE2 3.56Å; F175-F207 HydrophobicContact CE1-CD2 4.36Å; F175-F207 AromaticContact CE1-CE2 3.82Å; F175-F207 HydrophobicContact CE1-CE2 3.82Å; F175-F207 AromaticContact CG-CD2 3.86Å; F175-F207 HydrophobicContact CG-CD2 3.86Å; F175-F207 HydrophobicContact CG-CE2 4.16Å; F175-F207 WeakPolarHBondContact O-CA 3.27Å; F175-M210 HydrophobicContact CD2-CE 4.43Å; F175-F265 CarbonylContact C-O 3.57Å; F175-F265 WeakPolarHBondContact CA-O 3.22Å; F175-F265 HydrophobicContact CB-CB 4.28Å; F175-F265 HydrophobicContact CD1-CD2 4.33Å; F175-F265 HydrophobicContact CD2-CB 3.48Å; F175-F265 VanDerWaalsContact CD2-CB 3.48Å; F175-F265 AromaticContact CD2-CD2 3.89Å; F175-F265 HydrophobicContact CD2-CD2 3.89Å; F175-F265 HydrophobicContact CD2-CG 4.22Å; F175-F265 HydrophobicContact CE1-CD2 4.28Å; F175-F265 HydrophobicContact CE2-CB 4.04Å; F175-F265 AromaticContact CE2-CD2 3.84Å; F175-F265 HydrophobicContact CE2-CD2 3.84Å; F175-F265 HydrophobicContact CE2-CG 4.44Å; F175-F265 HydrophobicContact CG-CB 4.02Å; F175-F265 HydrophobicContact CG-CD2 4.15Å; F175-F265 HydrophobicContact CZ-CD2 4.04Å
176	T	97.2	Very high	96.7	Very high	5 Å²	5	13.1 Å²	13.1	3%	0.031	7%	0.066	C	C	.	.			trans	-132.9	-4.4	177.8	59.7	0	0	0	0	113.6	E77 I174 V178 M210 F265	E77-T176 PolarHBondContact OE2-OG1 2.99Å; I174-T176 HydrophobicContact CG2-CG2 4.08Å; T176-V178 PolarHBondContact O-N 3.01Å; T176-M210 VanDerWaalsContact C-SD 3.51Å; T176-M210 VanDerWaalsContact O-SD 3.34Å; T176-F265 PolarHBondContact N-O 3.16Å
177	D	96.8	Very high	96.7	Very high	3 Å²	3	7.8 Å²	7.8	2%	0.016	4%	0.043	C	C	.	.			trans	-75	108.6	180	-169.5	-40.1	0	0	0	112.3	K154 F175 D179 L180 M181 F265	K154-D177 WeakPolarHBondContact CE-OD2 3.48Å; K154-D177 IonicContact NZ-OD1 3.96Å; K154-D177 PolarHBondContact NZ-OD1 2.72Å; K154-D177 IonicContact NZ-OD2 3.88Å; K154-D177 PolarHBondContact NZ-OD2 2.82Å; F175-D177 WeakPolarHBondContact CE2-O 3.36Å; D177-D179 PolarHBondContact O-N 2.88Å; D177-D179 WeakPolarHBondContact OD1-CB 3.42Å; D177-D179 PolarHBondContact OD1-N 3.39Å; D177-L180 HydrophobicContact CB-CB 4.19Å; D177-L180 HydrophobicContact CB-CD1 3.99Å; D177-L180 HydrophobicContact CB-CG 4.12Å; D177-L180 PolarHBondContact O-N 3.38Å; D177-L180 PolarHBondContact OD1-N 3.43Å; D177-M181 PolarHBondContact O-N 3.11Å; D177-F265 WeakPolarHBondContact CB-O 3.38Å; D177-F265 PolarHBondContact N-O 3.39Å
178	V	95.6	Very high	96.6	Very high	4 Å²	4	6.2 Å²	6.2	2%	0.024	3%	0.034	C	C	.	.	H	α-helix	trans	-66.5	-31.3	-176.8	-176.2	0	0	0	0	112.9	L20 L70 T176 M181 C182 M210 L214	L20-V178 HydrophobicContact CD1-CB 4.24Å; L20-V178 HydrophobicContact CD1-CG1 3.87Å; L20-V178 HydrophobicContact CD2-CB 3.95Å; L20-V178 HydrophobicContact CD2-CG1 3.92Å; L20-V178 HydrophobicContact CG-CB 4.36Å; L20-V178 HydrophobicContact CG-CG1 3.85Å; L70-V178 HydrophobicContact CD1-CG1 4.38Å; T176-V178 PolarHBondContact O-N 3.01Å; V178-M181 PolarHBondContact O-N 3.23Å; V178-C182 PolarHBondContact O-N 3.37Å; V178-C182 PolarHBondContact O-SG 2.82Å; V178-M210 HydrophobicContact CG2-SD 4.18Å; V178-L214 HydrophobicContact CG1-CD1 3.89Å; V178-L214 HydrophobicContact CG1-CD2 3.73Å; V178-L214 HydrophobicContact CG1-CG 4.5Å; V178-L214 HydrophobicContact CG2-CD1 4.22Å; V178-L214 HydrophobicContact CG2-CD2 4.18Å
179	D	94.6	Very high	96.3	Very high	40 Å²	40	6.7 Å²	6.7	21%	0.214	4%	0.036	C	C	.	.	H	α-helix	trans	-65.2	-47.2	175.6	-74	-67.9	0	0	0	110.2	L20 R23 K154 D177 M181 C182 D183	L20-D179 WeakPolarHBondContact CD1-OD1 3.01Å; R23-D179 PolarHBondContact NH1-O 3.31Å; K154-D179 WeakPolarHBondContact CE-OD2 3.38Å; K154-D179 IonicContact NZ-OD2 2.82Å; K154-D179 PolarHBondContact NZ-OD2 3.03Å; D177-D179 PolarHBondContact O-N 2.88Å; D177-D179 WeakPolarHBondContact OD1-CB 3.42Å; D177-D179 PolarHBondContact OD1-N 3.39Å; D179-M181 VanDerWaalsContact C-N 3.29Å; D179-M181 PolarHBondContact O-N 2.92Å; D179-C182 CarbonylContact O-C 3.57Å; D179-C182 WeakPolarHBondContact O-CA 3.34Å; D179-C182 WeakPolarHBondContact O-CB 3.16Å; D179-C182 PolarHBondContact O-N 3.49Å; D179-C182 VanDerWaalsContact O-N 3.09Å; D179-D183 PolarHBondContact O-N 2.8Å
180	L	96.9	Very high	95.9	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-64.4	-35.9	-180	-64.3	-179	0	0	0	111.2	I157 R158 I161 F175 D177 D183 L184 Y263 F265	I157-L180 HydrophobicContact CG2-CD1 4.47Å; I157-L180 HydrophobicContact CG2-CD2 3.75Å; R158-L180 HydrophobicContact CG-CD2 3.55Å; I161-L180 HydrophobicContact CD1-CD2 4.21Å; F175-L180 HydrophobicContact CE2-CB 3.97Å; F175-L180 HydrophobicContact CZ-CB 4.34Å; D177-L180 HydrophobicContact CB-CB 4.19Å; D177-L180 HydrophobicContact CB-CD1 3.99Å; D177-L180 HydrophobicContact CB-CG 4.12Å; D177-L180 PolarHBondContact O-N 3.38Å; D177-L180 PolarHBondContact OD1-N 3.43Å; L180-D183 PolarHBondContact O-N 2.85Å; L180-L184 WeakPolarHBondContact O-CG 3.41Å; L180-L184 PolarHBondContact O-N 3.04Å; L180-Y263 HydrophobicContact CD1-CE1 4.25Å; L180-F265 HydrophobicContact CB-CD2 4.4Å; L180-F265 HydrophobicContact CD1-CB 3.91Å; L180-F265 HydrophobicContact CD1-CD1 3.62Å; L180-F265 HydrophobicContact CD1-CD2 3.92Å; L180-F265 HydrophobicContact CD1-CE1 4.04Å; L180-F265 HydrophobicContact CD1-CE2 4.31Å; L180-F265 HydrophobicContact CD1-CG 3.54Å; L180-F265 HydrophobicContact CD1-CZ 4.37Å
181	M	96.7	Very high	95.6	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.005	6%	0.058	C	C	.	.	H	α-helix	trans	-63.7	-42.3	171.3	-169.3	59.9	-178.9	0	0	111.8	F175 D177 V178 D179 L184 M185 F207 M210 I216 L221	F175-M181 HydrophobicContact CE1-SD 4.06Å; F175-M181 HydrophobicContact CE2-CB 4.22Å; F175-M181 HydrophobicContact CZ-CB 3.98Å; F175-M181 HydrophobicContact CZ-SD 3.97Å; D177-M181 PolarHBondContact O-N 3.11Å; V178-M181 PolarHBondContact O-N 3.23Å; D179-M181 VanDerWaalsContact C-N 3.29Å; D179-M181 PolarHBondContact O-N 2.92Å; M181-L184 PolarHBondContact O-N 2.76Å; M181-M185 HydrophobicContact CE-CG 4.07Å; M181-M185 HydrophobicContact CE-SD 3.92Å; M181-M185 HydrophobicContact CG-CG 4.5Å; M181-M185 HydrophobicContact CG-SD 3.98Å; M181-M185 WeakPolarHBondContact O-CB 3.32Å; M181-M185 VanDerWaalsContact O-CG 3.24Å; M181-M185 WeakPolarHBondContact O-CG 3.36Å; M181-M185 PolarHBondContact O-N 2.91Å; M181-F207 HydrophobicContact CE-CE2 4.2Å; M181-F207 HydrophobicContact CE-CZ 3.92Å; M181-F207 HydrophobicContact SD-CE2 3.87Å; M181-F207 HydrophobicContact SD-CZ 4.17Å; M181-M210 HydrophobicContact CB-CE 4.18Å; M181-M210 HydrophobicContact CG-CE 4.14Å; M181-M210 HydrophobicContact SD-CE 4.49Å; M181-I216 HydrophobicContact CE-CD1 3.86Å; M181-I216 HydrophobicContact CG-CD1 4.02Å; M181-L221 HydrophobicContact CE-CD2 3.84Å
182	C	95.3	Very high	95.4	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-63.4	-43.4	174.3	-65.2	0	0	0	0	112.3	R23 V27 V178 D179 L184 M185 E186	R23-C182 HydrophobicContact CG-CB 4.44Å; V27-C182 HydrophobicContact CG2-CB 4.5Å; V178-C182 PolarHBondContact O-N 3.37Å; V178-C182 PolarHBondContact O-SG 2.82Å; D179-C182 CarbonylContact O-C 3.57Å; D179-C182 WeakPolarHBondContact O-CA 3.34Å; D179-C182 WeakPolarHBondContact O-CB 3.16Å; D179-C182 PolarHBondContact O-N 3.49Å; D179-C182 VanDerWaalsContact O-N 3.09Å; C182-L184 PolarHBondContact O-N 3.37Å; C182-M185 PolarHBondContact O-N 3.06Å; C182-E186 WeakPolarHBondContact O-CB 3.5Å; C182-E186 PolarHBondContact O-N 2.84Å
183	D	96.4	Very high	95.3	Very high	1 Å²	1	20 Å²	20	1%	0.005	9%	0.086	C	C	.	.	H	α-helix	trans	-61.4	-40.2	177.9	-81.4	-66.9	0	0	0	112.3	R23 R158 I161 D179 L180 A187	R23-D183 IonicContact CZ-OD1 3Å; R23-D183 IonicContact CZ-OD2 2.7Å; R23-D183 VanDerWaalsContact NH1-CG 3.3Å; R23-D183 IonicContact NH1-OD1 3.79Å; R23-D183 IonicContact NH1-OD2 2.96Å; R23-D183 PolarHBondContact NH1-OD2 2.78Å; R23-D183 IonicContact NH2-OD1 3.69Å; R23-D183 PolarHBondContact NH2-OD1 2.91Å; R23-D183 IonicContact NH2-OD2 3.12Å; R23-D183 PolarHBondContact NH2-OD2 3.36Å; R158-D183 WeakPolarHBondContact CG-OD2 3.16Å; R158-D183 IonicContact CZ-OD2 3.57Å; R158-D183 IonicContact NE-OD2 2.98Å; R158-D183 PolarHBondContact NE-OD2 2.99Å; R158-D183 IonicContact NH2-OD2 2.89Å; I161-D183 HydrophobicContact CB-CB 4.42Å; I161-D183 HydrophobicContact CD1-CB 4.36Å; I161-D183 HydrophobicContact CG2-CB 3.79Å; I161-D183 WeakPolarHBondContact CG2-O 3.4Å; D179-D183 PolarHBondContact O-N 2.8Å; L180-D183 PolarHBondContact O-N 2.85Å; D183-A187 PolarHBondContact O-N 2.59Å; D183-A187 VanDerWaalsContact O-N 3.08Å
184	L	97.1	Very high	95.4	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-72.1	-42.2	175.9	-67.8	177.2	0	0	0	112.6	I161 I168 V170 F175 L180 M181 C182 E186 A187 S188 V195 I197 M224	I161-L184 HydrophobicContact CD1-CD2 3.89Å; I161-L184 HydrophobicContact CD1-CG 4.22Å; I161-L184 HydrophobicContact CG1-CD2 3.98Å; I161-L184 HydrophobicContact CG2-CD2 3.97Å; I168-L184 HydrophobicContact CD1-CD2 3.99Å; I168-L184 HydrophobicContact CG2-CD2 3.82Å; V170-L184 HydrophobicContact CG2-CD1 4.44Å; F175-L184 HydrophobicContact CE1-CD1 3.9Å; F175-L184 HydrophobicContact CZ-CD1 3.89Å; L180-L184 WeakPolarHBondContact O-CG 3.41Å; L180-L184 PolarHBondContact O-N 3.04Å; M181-L184 PolarHBondContact O-N 2.76Å; C182-L184 PolarHBondContact O-N 3.37Å; L184-E186 VanDerWaalsContact C-N 3.28Å; L184-E186 PolarHBondContact O-N 2.87Å; L184-A187 WeakPolarHBondContact O-CB 3.35Å; L184-A187 PolarHBondContact O-N 2.97Å; L184-S188 PolarHBondContact O-N 3.32Å; L184-V195 HydrophobicContact CB-CG1 4.42Å; L184-V195 HydrophobicContact CD1-CG1 4.47Å; L184-V195 HydrophobicContact CD2-CG1 3.99Å; L184-I197 HydrophobicContact CD1-CD1 3.97Å; L184-M224 HydrophobicContact CB-CE 3.94Å
185	M	95.3	Very high	95.4	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-64	-34.4	174.3	-71.7	173.5	68.3	0	0	111.7	V27 M181 C182 S188 N189 I216 H220 L221 M224	V27-M185 HydrophobicContact CG1-CB 3.41Å; V27-M185 VanDerWaalsContact CG1-CB 3.41Å; M181-M185 HydrophobicContact CE-CG 4.07Å; M181-M185 HydrophobicContact CE-SD 3.92Å; M181-M185 HydrophobicContact CG-CG 4.5Å; M181-M185 HydrophobicContact CG-SD 3.98Å; M181-M185 WeakPolarHBondContact O-CB 3.32Å; M181-M185 VanDerWaalsContact O-CG 3.24Å; M181-M185 WeakPolarHBondContact O-CG 3.36Å; M181-M185 PolarHBondContact O-N 2.91Å; C182-M185 PolarHBondContact O-N 3.06Å; M185-S188 PolarHBondContact O-N 2.97Å; M185-N189 VanDerWaalsContact O-CB 3.26Å; M185-N189 WeakPolarHBondContact O-CB 3.49Å; M185-N189 VanDerWaalsContact O-CG 3.31Å; M185-N189 PolarHBondContact O-N 2.71Å; M185-N189 PolarHBondContact O-ND2 2.95Å; M185-I216 HydrophobicContact CE-CD1 4.45Å; M185-I216 HydrophobicContact CE-CG1 4.35Å; M185-I216 HydrophobicContact CE-CG2 4.4Å; M185-I216 HydrophobicContact SD-CD1 3.78Å; M185-I216 HydrophobicContact SD-CG1 4.31Å; M185-H220 HydrophobicContact CE-CB 3.67Å; M185-L221 HydrophobicContact CG-CD2 4.36Å; M185-M224 HydrophobicContact CG-SD 3.89Å
186	E	94.4	Very high	95.5	Very high	17 Å²	17	23.4 Å²	23.4	8%	0.079	10%	0.101	C	C	.	.	H	α-helix	trans	-67	-41.2	174.4	180	155.7	-144.2	0	0	112	R23 V27 C182 L184 K190 R191	R23-E186 IonicContact CZ-OE2 3.64Å; R23-E186 IonicContact NE-OE2 3.63Å; R23-E186 IonicContact NH2-OE2 3.64Å; R23-E186 PolarHBondContact NH2-OE2 2.95Å; V27-E186 HydrophobicContact CG1-CB 4.23Å; V27-E186 HydrophobicContact CG2-CB 4.03Å; C182-E186 WeakPolarHBondContact O-CB 3.5Å; C182-E186 PolarHBondContact O-N 2.84Å; L184-E186 VanDerWaalsContact C-N 3.28Å; L184-E186 PolarHBondContact O-N 2.87Å; E186-K190 HydrophobicContact CG-CD 4.32Å; E186-K190 WeakPolarHBondContact O-CB 3.45Å; E186-K190 PolarHBondContact O-N 3.01Å; E186-K190 VanDerWaalsContact O-N 3.09Å; E186-R191 PolarHBondContact O-N 3.03Å
187	A	95.3	Very high	95.5	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-59	-47.8	170.7	0	0	0	0	0	112	I161 I168 D183 L184 R191 R192 V193 V195	I161-A187 HydrophobicContact CG2-CB 4.47Å; I168-A187 HydrophobicContact CD1-CB 3.74Å; D183-A187 PolarHBondContact O-N 2.59Å; D183-A187 VanDerWaalsContact O-N 3.08Å; L184-A187 WeakPolarHBondContact O-CB 3.35Å; L184-A187 PolarHBondContact O-N 2.97Å; A187-R191 VanDerWaalsContact CB-NH2 3.34Å; A187-R191 CarbonylContact O-C 3.51Å; A187-R191 WeakPolarHBondContact O-CB 3.41Å; A187-R191 PolarHBondContact O-N 3.04Å; A187-R192 PolarHBondContact O-N 2.85Å; A187-V193 HydrophobicContact CB-CB 4.31Å; A187-V193 PolarHBondContact O-N 2.9Å; A187-V195 HydrophobicContact CB-CG2 4.46Å
188	S	94.6	Very high	95.6	Very high	0 Å²	0	23 Å²	23	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-63.1	-52	179.3	165.1	0	0	0	0	113	L184 M185 R192 V193 N223 M224	L184-S188 PolarHBondContact O-N 3.32Å; M185-S188 PolarHBondContact O-N 2.97Å; S188-R192 VanDerWaalsContact O-CA 3.27Å; S188-R192 WeakPolarHBondContact O-CA 3.27Å; S188-R192 PolarHBondContact O-N 3.43Å; S188-V193 WeakPolarHBondContact CA-O 3.47Å; S188-N223 WeakPolarHBondContact OG-CB 3.3Å; S188-M224 VanDerWaalsContact CB-CG 3.44Å; S188-M224 VanDerWaalsContact OG-CG 3.3Å; S188-M224 WeakPolarHBondContact OG-CG 3.26Å
189	N	91.9	Very high	95.7	Very high	9 Å²	9	23 Å²	23	5%	0.048	10%	0.099	C	C	.	.	H	α-helix	trans	-91	-39.4	-163.8	-63.4	-18.5	0	0	0	112.6	M185 R192 H220	M185-N189 VanDerWaalsContact O-CB 3.26Å; M185-N189 WeakPolarHBondContact O-CB 3.49Å; M185-N189 VanDerWaalsContact O-CG 3.31Å; M185-N189 PolarHBondContact O-N 2.71Å; M185-N189 PolarHBondContact O-ND2 2.95Å; N189-R192 PolarHBondContact O-NE 2.73Å; N189-H220 PolarHBondContact ND2-O 2.64Å; N189-H220 PolarHBondContact OD1-O 3.41Å
190	K	90.4	Very high	95.8	Very high	51 Å²	51	21.2 Å²	21.2	22%	0.222	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-46.1	-178.4	-54.9	-165.6	-176.8	-171.6	0	112.2	E26 R32 E33 E186	E26-K190 WeakPolarHBondContact O-CE 3.36Å; E26-K190 PolarHBondContact O-NZ 3.32Å; R32-K190 WeakPolarHBondContact O-CE 3.42Å; R32-K190 PolarHBondContact O-NZ 2.95Å; E33-K190 PolarHBondContact O-NZ 3.1Å; E186-K190 HydrophobicContact CG-CD 4.32Å; E186-K190 WeakPolarHBondContact O-CB 3.45Å; E186-K190 PolarHBondContact O-N 3.01Å; E186-K190 VanDerWaalsContact O-N 3.09Å
191	R	92.3	Very high	95.8	Very high	78 Å²	78	24.5 Å²	24.5	29%	0.294	10%	0.104	S	C	.	.	S	Bend	trans	-88.3	-9.7	179.5	-70.2	-179.3	-80.1	136.7	-6.4	114.7	I161 N162 A164 E186 A187 V193	I161-R191 VanDerWaalsContact O-CZ 3.28Å; I161-R191 PolarHBondContact O-NH1 2.95Å; I161-R191 PolarHBondContact O-NH2 2.74Å; N162-R191 PolarHBondContact O-NH1 2.9Å; A164-R191 PolarHBondContact O-NH1 3.27Å; E186-R191 PolarHBondContact O-N 3.03Å; A187-R191 VanDerWaalsContact CB-NH2 3.34Å; A187-R191 CarbonylContact O-C 3.51Å; A187-R191 WeakPolarHBondContact O-CB 3.41Å; A187-R191 PolarHBondContact O-N 3.04Å; R191-V193 HydrophobicContact CB-CG2 3.89Å; R191-V193 PolarHBondContact O-N 3.2Å
192	R	94.1	Very high	95.6	Very high	160 Å²	160	28.4 Å²	28.4	60%	0.604	12%	0.121	S	C	*	.			trans	58.5	24.5	-177.1	-56.8	-58.7	-172.7	168.8	0.7	114.6	A187 S188 N189 P194 N223	A187-R192 PolarHBondContact O-N 2.85Å; S188-R192 VanDerWaalsContact O-CA 3.27Å; S188-R192 WeakPolarHBondContact O-CA 3.27Å; S188-R192 PolarHBondContact O-N 3.43Å; N189-R192 PolarHBondContact O-NE 2.73Å; R192-P194 WeakPolarHBondContact O-CD 3.38Å; R192-N223 PolarHBondContact O-ND2 3.24Å
193	V	96.5	Very high	95.5	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.006	13%	0.129	C	C	.	.			trans	-76.5	119.6	173.4	-176.4	0	0	0	0	108.9	A164 I168 A187 S188 R191 V195 N223	A164-V193 HydrophobicContact CB-CG1 4.44Å; I168-V193 HydrophobicContact CD1-CG1 4.44Å; I168-V193 HydrophobicContact CG1-CG1 4.01Å; A187-V193 HydrophobicContact CB-CB 4.31Å; A187-V193 PolarHBondContact O-N 2.9Å; S188-V193 WeakPolarHBondContact CA-O 3.47Å; R191-V193 HydrophobicContact CB-CG2 3.89Å; R191-V193 PolarHBondContact O-N 3.2Å; V193-V195 PolarHBondContact O-N 2.64Å; V193-N223 VanDerWaalsContact C-ND2 3.26Å; V193-N223 PolarHBondContact O-ND2 2.72Å
194	P	97.1	Very high	95.4	Very high	37 Å²	37	31 Å²	31	24%	0.24	14%	0.135	C	C	.	.			trans	-62	133.6	175.6	-22.3	34.7	0	0	0	111.3	K166 I168 R192 Y196 N223	K166-P194 VanDerWaalsContact O-CD 3.31Å; K166-P194 WeakPolarHBondContact O-CD 3.42Å; I168-P194 PolarHBondContact N-O 3.12Å; R192-P194 WeakPolarHBondContact O-CD 3.38Å; P194-Y196 HydrophobicContact CB-CE2 4.06Å; P194-N223 WeakPolarHBondContact CA-O 3.43Å
195	V	98.3	Very high	95.3	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.012	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	120.9	179.6	-171.3	0	0	0	0	110.6	I168 L184 A187 V193 I197 N223 M224 R225	I168-V195 HydrophobicContact CB-CG1 4.22Å; I168-V195 HydrophobicContact CB-CG2 4.34Å; I168-V195 HydrophobicContact CD1-CG2 4.44Å; I168-V195 HydrophobicContact CG2-CG1 4.28Å; I168-V195 CarbonylContact O-C 3.58Å; I168-V195 WeakPolarHBondContact O-CA 3.44Å; L184-V195 HydrophobicContact CB-CG1 4.42Å; L184-V195 HydrophobicContact CD1-CG1 4.47Å; L184-V195 HydrophobicContact CD2-CG1 3.99Å; A187-V195 HydrophobicContact CB-CG2 4.46Å; V193-V195 PolarHBondContact O-N 2.64Å; V195-I197 HydrophobicContact CG1-CD1 4.11Å; V195-I197 HydrophobicContact CG1-CG1 3.86Å; V195-N223 PolarHBondContact N-O 2.85Å; V195-N223 VanDerWaalsContact N-O 3.08Å; V195-M224 HydrophobicContact CB-CB 4.45Å; V195-M224 HydrophobicContact CB-CE 4.11Å; V195-M224 HydrophobicContact CB-CG 4.1Å; V195-M224 HydrophobicContact CG1-CE 4.03Å; V195-M224 HydrophobicContact CG2-CG 4.44Å; V195-M224 CarbonylContact O-C 3.57Å; V195-M224 WeakPolarHBondContact O-CA 3.46Å; V195-R225 PolarHBondContact O-N 2.89Å
196	Y	98.4	Very high	95.4	Very high	82 Å²	82	36.4 Å²	36.4	32%	0.322	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	132.6	173.6	-57.8	-90.5	0	0	0	109.6	V167 I168 A169 V170 P194 R225 Y296	V167-Y196 HydrophobicContact CG2-CD2 3.89Å; V167-Y196 HydrophobicContact CG2-CE2 3.89Å; I168-Y196 PolarHBondContact O-N 2.74Å; A169-Y196 CarbonylContact C-O 3.59Å; A169-Y196 WeakPolarHBondContact CA-O 3.43Å; V170-Y196 PolarHBondContact N-O 3.04Å; P194-Y196 HydrophobicContact CB-CE2 4.06Å; Y196-R225 HydrophobicContact CD1-CB 3.97Å; Y196-R225 HydrophobicContact CD1-CG 4.48Å; Y196-R225 HydrophobicContact CE1-CB 4.36Å; Y196-R225 HydrophobicContact CE1-CG 4.39Å; Y196-Y296 AromaticContact CD1-CE2 3.73Å; Y196-Y296 HydrophobicContact CD1-CE2 3.73Å; Y196-Y296 HydrophobicContact CE1-CE2 4.42Å
197	I	98.2	Very high	95.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	118.5	-176.3	-48.2	-178.3	0	0	0	109.3	V170 F175 L184 V195 L199 M224 R225 V226 R227	V170-I197 HydrophobicContact CB-CG2 4.34Å; V170-I197 HydrophobicContact CG1-CG2 4.47Å; V170-I197 WeakPolarHBondContact O-CA 3.42Å; F175-I197 HydrophobicContact CD1-CG2 4.43Å; F175-I197 HydrophobicContact CE1-CD1 4.21Å; L184-I197 HydrophobicContact CD1-CD1 3.97Å; V195-I197 HydrophobicContact CG1-CD1 4.11Å; V195-I197 HydrophobicContact CG1-CG1 3.86Å; I197-L199 HydrophobicContact CG2-CD1 4.45Å; I197-L199 HydrophobicContact CG2-CD2 3.75Å; I197-L199 HydrophobicContact CG2-CG 3.91Å; I197-M224 HydrophobicContact CD1-CE 3.72Å; I197-R225 PolarHBondContact N-O 2.98Å; I197-V226 HydrophobicContact CB-CG1 4.33Å; I197-V226 HydrophobicContact CB-CG2 4.42Å; I197-V226 HydrophobicContact CD1-CG2 4.34Å; I197-V226 CarbonylContact O-C 3.41Å; I197-V226 WeakPolarHBondContact O-CA 3.33Å; I197-R227 PolarHBondContact O-N 3.01Å
198	L	98.3	Very high	95.4	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	123	172.7	-57	-174.6	0	0	0	109.1	V170 V171 M172 R227 V229 F292 L295 Y296	V170-L198 PolarHBondContact O-N 3.44Å; V171-L198 WeakPolarHBondContact CA-O 3.33Å; V171-L198 HydrophobicContact CG2-CB 4.38Å; V171-L198 HydrophobicContact CG2-CD1 4.31Å; M172-L198 PolarHBondContact N-O 2.85Å; L198-R227 WeakPolarHBondContact CA-O 3.49Å; L198-R227 HydrophobicContact CD2-CB 3.78Å; L198-V229 HydrophobicContact CB-CG1 4.24Å; L198-F292 HydrophobicContact CD1-CD2 4.1Å; L198-F292 HydrophobicContact CD1-CE2 3.67Å; L198-F292 HydrophobicContact CD1-CZ 4Å; L198-F292 HydrophobicContact CG-CE2 3.72Å; L198-F292 HydrophobicContact CG-CZ 3.92Å; L198-L295 HydrophobicContact CD1-CB 3.55Å; L198-Y296 HydrophobicContact CD2-CD2 3.88Å
199	L	97.9	Very high	95.4	Very high	5 Å²	5	41.3 Å²	41.3	3%	0.026	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	144.1	-177.3	-60.6	179.2	0	0	0	111.7	M172 F175 I197 E201 L204 F207 V226 R227 S228 V229	M172-L199 HydrophobicContact CB-CD2 3.98Å; M172-L199 WeakPolarHBondContact O-CA 3.37Å; F175-L199 HydrophobicContact CB-CD2 3.93Å; F175-L199 HydrophobicContact CD1-CD2 4.32Å; I197-L199 HydrophobicContact CG2-CD1 4.45Å; I197-L199 HydrophobicContact CG2-CD2 3.75Å; I197-L199 HydrophobicContact CG2-CG 3.91Å; L199-E201 PolarHBondContact O-N 3.25Å; L199-L204 HydrophobicContact CB-CD1 4.43Å; L199-L204 HydrophobicContact CD1-CD1 4.09Å; L199-F207 HydrophobicContact CD1-CB 3.77Å; L199-F207 HydrophobicContact CD1-CD1 3.59Å; L199-F207 HydrophobicContact CD1-CD2 3.86Å; L199-F207 HydrophobicContact CD1-CE1 4.14Å; L199-F207 HydrophobicContact CD1-CE2 4.37Å; L199-F207 HydrophobicContact CD1-CG 3.43Å; L199-F207 VanDerWaalsContact CD1-CG 3.43Å; L199-F207 HydrophobicContact CD1-CZ 4.49Å; L199-V226 HydrophobicContact CD1-CG1 3.88Å; L199-V226 HydrophobicContact CG-CG1 4.38Å; L199-R227 PolarHBondContact N-O 2.69Å; L199-S228 CarbonylContact O-C 3.5Å; L199-S228 WeakPolarHBondContact O-CA 3.39Å; L199-V229 PolarHBondContact O-N 3.09Å
200	D	96.9	Very high	95.6	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	129.2	173.3	-178.4	72	0	0	0	112	M172 K202 N203 L204 V229 Q245 V246	M172-D200 PolarHBondContact O-N 3.27Å; D200-K202 PolarHBondContact O-N 3.42Å; D200-K202 VanDerWaalsContact O-N 3.16Å; D200-K202 VanDerWaalsContact OD2-CB 3.27Å; D200-K202 WeakPolarHBondContact OD2-CB 3.44Å; D200-K202 PolarHBondContact OD2-N 2.94Å; D200-N203 PolarHBondContact O-N 2.8Å; D200-N203 VanDerWaalsContact O-N 3.15Å; D200-L204 PolarHBondContact O-N 3.44Å; D200-V229 WeakPolarHBondContact CA-O 3.25Å; D200-Q245 WeakPolarHBondContact OD1-CA 3.42Å; D200-Q245 WeakPolarHBondContact OD1-CB 3.33Å; D200-Q245 PolarHBondContact OD2-NE2 2.85Å; D200-V246 PolarHBondContact OD1-N 2.8Å
201	E	95.4	Very high	95.8	Very high	69 Å²	69	39.3 Å²	39.3	32%	0.322	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-35.3	-178.4	-169.2	-141.5	113.8	0	0	113	L199 V229 C230	L199-E201 PolarHBondContact O-N 3.25Å; E201-V229 PolarHBondContact N-O 3.31Å; E201-C230 HydrophobicContact CB-CB 4.03Å; E201-C230 WeakPolarHBondContact OE2-CB 3.37Å
202	K	93.2	Very high	95.9	Very high	83 Å²	83	40 Å²	40	36%	0.361	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-22.8	-174.9	-47.3	-53	175.6	-165.1	0	112.9	D200 T243 Q245	D200-K202 PolarHBondContact O-N 3.42Å; D200-K202 VanDerWaalsContact O-N 3.16Å; D200-K202 VanDerWaalsContact OD2-CB 3.27Å; D200-K202 WeakPolarHBondContact OD2-CB 3.44Å; D200-K202 PolarHBondContact OD2-N 2.94Å; K202-T243 WeakPolarHBondContact CE-OG1 3.39Å; K202-T243 PolarHBondContact NZ-OG1 2.57Å; K202-Q245 HydrophobicContact CB-CG 4.39Å; K202-Q245 HydrophobicContact CG-CG 3.81Å
203	N	93.9	Very high	95.8	Very high	29 Å²	29	35.6 Å²	35.6	16%	0.155	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-6.6	-178.6	-63.7	-32.8	0	0	0	113	D173 I174 D200 S205 Y206	D173-N203 WeakPolarHBondContact O-CB 3.28Å; D173-N203 PolarHBondContact O-ND2 2.73Å; I174-N203 HydrophobicContact CG1-CB 4.09Å; I174-N203 WeakPolarHBondContact CG1-ND2 3.46Å; D200-N203 PolarHBondContact O-N 2.8Å; D200-N203 VanDerWaalsContact O-N 3.15Å; N203-S205 PolarHBondContact O-N 2.94Å; N203-Y206 HydrophobicContact CB-CD2 4.21Å; N203-Y206 WeakPolarHBondContact O-CD2 3.27Å; N203-Y206 PolarHBondContact O-N 3.21Å
204	L	94.6	Very high	95.6	Very high	27 Å²	27	35.9 Å²	35.9	14%	0.141	20%	0.196	C	C	.	.	H	α-helix	trans	-53.3	-29.6	-177.9	178.4	64.7	0	0	0	114	L199 D200 Y206 F207 T208 I302	L199-L204 HydrophobicContact CB-CD1 4.43Å; L199-L204 HydrophobicContact CD1-CD1 4.09Å; D200-L204 PolarHBondContact O-N 3.44Å; L204-Y206 VanDerWaalsContact C-N 3.3Å; L204-Y206 PolarHBondContact O-N 2.97Å; L204-F207 HydrophobicContact CD1-CD1 4.49Å; L204-F207 PolarHBondContact O-N 2.99Å; L204-T208 WeakPolarHBondContact O-CB 3.47Å; L204-T208 PolarHBondContact O-N 2.94Å; L204-T208 PolarHBondContact O-OG1 3.02Å; L204-I302 HydrophobicContact CD1-CD1 3.56Å; L204-I302 HydrophobicContact CD1-CG1 4.42Å; L204-I302 HydrophobicContact CD2-CD1 4.01Å; L204-I302 HydrophobicContact CD2-CG1 3.95Å; L204-I302 HydrophobicContact CD2-CG2 4.41Å; L204-I302 HydrophobicContact CG-CD1 4.44Å
205	S	95.1	Very high	95.5	Very high	59 Å²	59	38 Å²	38	41%	0.413	21%	0.205	S	C	.	.	H	α-helix	trans	-56.3	-42.9	176.2	49.1	0	0	0	0	111.9	N203 F207 T208 D209	N203-S205 PolarHBondContact O-N 2.94Å; S205-F207 PolarHBondContact O-N 2.83Å; S205-T208 CarbonylContact O-C 3.58Å; S205-T208 WeakPolarHBondContact O-CB 3.5Å; S205-T208 PolarHBondContact O-N 3.46Å; S205-T208 VanDerWaalsContact O-N 3.12Å; S205-D209 WeakPolarHBondContact O-CB 3.38Å; S205-D209 PolarHBondContact O-N 3.1Å
206	Y	95.7	Very high	95.2	Very high	55 Å²	55	38 Å²	38	22%	0.216	21%	0.205	C	C	.	.	H	α-helix	trans	-64.6	-40.3	-178.1	-56	-63.8	0	0	0	112.8	L76 N203 L204 M210	L76-Y206 HydrophobicContact CB-CE1 4.12Å; L76-Y206 HydrophobicContact CD2-CE2 4.43Å; N203-Y206 HydrophobicContact CB-CD2 4.21Å; N203-Y206 WeakPolarHBondContact O-CD2 3.27Å; N203-Y206 PolarHBondContact O-N 3.21Å; L204-Y206 VanDerWaalsContact C-N 3.3Å; L204-Y206 PolarHBondContact O-N 2.97Å; Y206-M210 WeakPolarHBondContact O-CB 3.46Å; Y206-M210 PolarHBondContact O-N 3.02Å
207	F	96.1	Very high	94.7	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.009	21%	0.212	C	C	.	.	H	α-helix	trans	-67	-39.3	172.8	177.6	-95.5	0	0	0	111.7	F175 M181 L199 L204 S205 M210 C211 V226 F305	F175-F207 HydrophobicContact CB-CD2 3.95Å; F175-F207 AromaticContact CD1-CD2 3.67Å; F175-F207 HydrophobicContact CD1-CD2 3.67Å; F175-F207 AromaticContact CD1-CE2 3.56Å; F175-F207 HydrophobicContact CD1-CE2 3.56Å; F175-F207 HydrophobicContact CE1-CD2 4.36Å; F175-F207 AromaticContact CE1-CE2 3.82Å; F175-F207 HydrophobicContact CE1-CE2 3.82Å; F175-F207 AromaticContact CG-CD2 3.86Å; F175-F207 HydrophobicContact CG-CD2 3.86Å; F175-F207 HydrophobicContact CG-CE2 4.16Å; F175-F207 WeakPolarHBondContact O-CA 3.27Å; M181-F207 HydrophobicContact CE-CE2 4.2Å; M181-F207 HydrophobicContact CE-CZ 3.92Å; M181-F207 HydrophobicContact SD-CE2 3.87Å; M181-F207 HydrophobicContact SD-CZ 4.17Å; L199-F207 HydrophobicContact CD1-CB 3.77Å; L199-F207 HydrophobicContact CD1-CD1 3.59Å; L199-F207 HydrophobicContact CD1-CD2 3.86Å; L199-F207 HydrophobicContact CD1-CE1 4.14Å; L199-F207 HydrophobicContact CD1-CE2 4.37Å; L199-F207 HydrophobicContact CD1-CG 3.43Å; L199-F207 VanDerWaalsContact CD1-CG 3.43Å; L199-F207 HydrophobicContact CD1-CZ 4.49Å; L204-F207 HydrophobicContact CD1-CD1 4.49Å; L204-F207 PolarHBondContact O-N 2.99Å; S205-F207 PolarHBondContact O-N 2.83Å; F207-M210 HydrophobicContact CD2-CE 3.5Å; F207-M210 HydrophobicContact CE2-CE 3.69Å; F207-M210 HydrophobicContact CG-CE 4.45Å; F207-M210 PolarHBondContact O-N 3.13Å; F207-C211 PolarHBondContact O-N 3.23Å; F207-C211 PolarHBondContact O-SG 2.93Å; F207-V226 HydrophobicContact CD1-CG1 4.4Å; F207-V226 HydrophobicContact CE1-CG1 3.81Å; F207-V226 HydrophobicContact CE1-CG2 4.26Å; F207-V226 HydrophobicContact CZ-CG1 4.27Å; F207-V226 HydrophobicContact CZ-CG2 4.22Å; F207-F305 AromaticContact CD1-CE2 3.94Å; F207-F305 HydrophobicContact CD1-CE2 3.94Å; F207-F305 HydrophobicContact CD1-CZ 4.14Å; F207-F305 HydrophobicContact CE1-CD2 4.39Å; F207-F305 AromaticContact CE1-CE2 3.66Å; F207-F305 HydrophobicContact CE1-CE2 3.66Å; F207-F305 AromaticContact CE1-CZ 3.73Å; F207-F305 HydrophobicContact CE1-CZ 3.73Å
208	T	94.6	Very high	94.1	Very high	33 Å²	33	41.3 Å²	41.3	20%	0.202	23%	0.225	C	C	.	.	H	α-helix	trans	-64.1	-46.8	178	-56.3	0	0	0	0	111	L204 S205 C211 V212 R304	L204-T208 WeakPolarHBondContact O-CB 3.47Å; L204-T208 PolarHBondContact O-N 2.94Å; L204-T208 PolarHBondContact O-OG1 3.02Å; S205-T208 CarbonylContact O-C 3.58Å; S205-T208 WeakPolarHBondContact O-CB 3.5Å; S205-T208 PolarHBondContact O-N 3.46Å; S205-T208 VanDerWaalsContact O-N 3.12Å; T208-C211 CarbonylContact O-C 3.55Å; T208-C211 PolarHBondContact O-N 3.23Å; T208-C211 VanDerWaalsContact O-N 3.16Å; T208-V212 WeakPolarHBondContact O-CG2 3.39Å; T208-V212 PolarHBondContact O-N 2.84Å; T208-R304 PolarHBondContact O-NH1 2.9Å
209	D	94.7	Very high	93.6	Very high	85 Å²	85	44.8 Å²	44.8	46%	0.455	25%	0.25	S	S	.	.	H	α-helix	trans	-62.9	-42.9	177	-68.5	-20.3	0	0	0	111.2	S205 C211 V212 A213	S205-D209 WeakPolarHBondContact O-CB 3.38Å; S205-D209 PolarHBondContact O-N 3.1Å; D209-C211 VanDerWaalsContact C-N 3.33Å; D209-C211 PolarHBondContact O-N 2.81Å; D209-V212 WeakPolarHBondContact O-CB 3.27Å; D209-V212 PolarHBondContact O-N 3.49Å; D209-V212 VanDerWaalsContact O-N 3.08Å; D209-A213 PolarHBondContact O-N 2.95Å
210	M	95.7	Very high	93.2	Very high	17 Å²	17	46 Å²	46	8%	0.084	26%	0.255	C	S	.	.	H	α-helix	trans	-55.4	-48.7	170.5	178.3	-177.2	66.7	0	0	110.7	F175 T176 V178 M181 Y206 F207 V212 A213 L214	F175-M210 HydrophobicContact CD2-CE 4.43Å; T176-M210 VanDerWaalsContact C-SD 3.51Å; T176-M210 VanDerWaalsContact O-SD 3.34Å; V178-M210 HydrophobicContact CG2-SD 4.18Å; M181-M210 HydrophobicContact CB-CE 4.18Å; M181-M210 HydrophobicContact CG-CE 4.14Å; M181-M210 HydrophobicContact SD-CE 4.49Å; Y206-M210 WeakPolarHBondContact O-CB 3.46Å; Y206-M210 PolarHBondContact O-N 3.02Å; F207-M210 HydrophobicContact CD2-CE 3.5Å; F207-M210 HydrophobicContact CE2-CE 3.69Å; F207-M210 HydrophobicContact CG-CE 4.45Å; F207-M210 PolarHBondContact O-N 3.13Å; M210-V212 PolarHBondContact O-N 3.31Å; M210-A213 PolarHBondContact O-N 3.25Å; M210-A213 VanDerWaalsContact O-N 3.14Å; M210-L214 HydrophobicContact CG-CD1 3.55Å; M210-L214 HydrophobicContact CG-CG 4.09Å; M210-L214 WeakPolarHBondContact O-CB 3.35Å; M210-L214 VanDerWaalsContact O-CG 3.27Å; M210-L214 WeakPolarHBondContact O-CG 3.44Å; M210-L214 PolarHBondContact O-N 3.25Å; M210-L214 HydrophobicContact SD-CD1 4.17Å
211	C	94.6	Very high	92.9	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-66.8	-19.9	178	-66.3	0	0	0	0	113.9	F207 T208 D209 I216 R304 F305	F207-C211 PolarHBondContact O-N 3.23Å; F207-C211 PolarHBondContact O-SG 2.93Å; T208-C211 CarbonylContact O-C 3.55Å; T208-C211 PolarHBondContact O-N 3.23Å; T208-C211 VanDerWaalsContact O-N 3.16Å; D209-C211 VanDerWaalsContact C-N 3.33Å; D209-C211 PolarHBondContact O-N 2.81Å; C211-I216 HydrophobicContact CB-CB 4.24Å; C211-I216 PolarHBondContact O-N 3.45Å; C211-I216 VanDerWaalsContact O-N 3.07Å; C211-R304 VanDerWaalsContact C-NH2 3.33Å; C211-R304 PolarHBondContact O-NH2 3.21Å; C211-F305 HydrophobicContact CB-CE1 3.99Å; C211-F305 HydrophobicContact CB-CZ 3.85Å
212	V	93.9	Very high	92.4	Very high	93 Å²	93	47.6 Å²	47.6	56%	0.564	27%	0.266	S	S	*	.	H	α-helix	trans	-75.3	-51.7	166.6	179.9	0	0	0	0	109.9	T208 D209 M210 L214 D215 R304	T208-V212 WeakPolarHBondContact O-CG2 3.39Å; T208-V212 PolarHBondContact O-N 2.84Å; D209-V212 WeakPolarHBondContact O-CB 3.27Å; D209-V212 PolarHBondContact O-N 3.49Å; D209-V212 VanDerWaalsContact O-N 3.08Å; M210-V212 PolarHBondContact O-N 3.31Å; V212-L214 VanDerWaalsContact C-N 3.27Å; V212-L214 PolarHBondContact O-N 2.84Å; V212-D215 PolarHBondContact O-N 2.97Å; V212-R304 VanDerWaalsContact CG2-NH1 3.33Å
213	A	92.9	Very high	92.4	Very high	67 Å²	67	45.8 Å²	45.8	55%	0.554	26%	0.26	S	S	*	.	H	α-helix	trans	-63	-30.4	-174.6	0	0	0	0	0	113.7	D209 M210	D209-A213 PolarHBondContact O-N 2.95Å; M210-A213 PolarHBondContact O-N 3.25Å; M210-A213 VanDerWaalsContact O-N 3.14Å
214	L	93	Very high	92.5	Very high	7 Å²	7	44.6 Å²	44.6	4%	0.037	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-4.5	175.7	-60	177.8	0	0	0	113.6	L24 K28 L70 V178 M210 V212 I216	L24-L214 HydrophobicContact CD2-CB 4.02Å; L24-L214 HydrophobicContact CD2-CD2 4.05Å; K28-L214 WeakPolarHBondContact CE-O 3.15Å; K28-L214 PolarHBondContact NZ-O 3.04Å; L70-L214 HydrophobicContact CB-CD2 4.5Å; L70-L214 HydrophobicContact CD1-CD2 3.95Å; L70-L214 HydrophobicContact CD2-CD2 4.27Å; L70-L214 HydrophobicContact CG-CD2 4.48Å; V178-L214 HydrophobicContact CG1-CD1 3.89Å; V178-L214 HydrophobicContact CG1-CD2 3.73Å; V178-L214 HydrophobicContact CG1-CG 4.5Å; V178-L214 HydrophobicContact CG2-CD1 4.22Å; V178-L214 HydrophobicContact CG2-CD2 4.18Å; M210-L214 HydrophobicContact CG-CD1 3.55Å; M210-L214 HydrophobicContact CG-CG 4.09Å; M210-L214 WeakPolarHBondContact O-CB 3.35Å; M210-L214 VanDerWaalsContact O-CG 3.27Å; M210-L214 WeakPolarHBondContact O-CG 3.44Å; M210-L214 PolarHBondContact O-N 3.25Å; M210-L214 HydrophobicContact SD-CD1 4.17Å; V212-L214 VanDerWaalsContact C-N 3.27Å; V212-L214 PolarHBondContact O-N 2.84Å; L214-I216 HydrophobicContact CB-CD1 3.91Å; L214-I216 HydrophobicContact CB-CG1 3.86Å; L214-I216 HydrophobicContact CD1-CD1 3.82Å
215	D	93.4	Very high	92.5	Very high	82 Å²	82	47.6 Å²	47.6	44%	0.439	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	60.3	-171.4	169.1	58.1	0	0	0	111.7	K28 V212 Q217	K28-D215 WeakPolarHBondContact CE-O 3.45Å; K28-D215 PolarHBondContact NZ-O 3.22Å; K28-D215 IonicContact NZ-OD2 2.85Å; K28-D215 PolarHBondContact NZ-OD2 3.23Å; V212-D215 PolarHBondContact O-N 2.97Å; D215-Q217 PolarHBondContact OD1-NE2 3.3Å
216	I	92.1	Very high	92.6	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.01	25%	0.246	C	C	.	.			trans	-94.3	112.1	175.6	-64.2	174.6	0	0	0	108.6	M181 M185 C211 L214 L221	M181-I216 HydrophobicContact CE-CD1 3.86Å; M181-I216 HydrophobicContact CG-CD1 4.02Å; M185-I216 HydrophobicContact CE-CD1 4.45Å; M185-I216 HydrophobicContact CE-CG1 4.35Å; M185-I216 HydrophobicContact CE-CG2 4.4Å; M185-I216 HydrophobicContact SD-CD1 3.78Å; M185-I216 HydrophobicContact SD-CG1 4.31Å; C211-I216 HydrophobicContact CB-CB 4.24Å; C211-I216 PolarHBondContact O-N 3.45Å; C211-I216 VanDerWaalsContact O-N 3.07Å; L214-I216 HydrophobicContact CB-CD1 3.91Å; L214-I216 HydrophobicContact CB-CG1 3.86Å; L214-I216 HydrophobicContact CD1-CD1 3.82Å; I216-L221 HydrophobicContact CG2-CD1 3.81Å; I216-L221 HydrophobicContact CG2-CD2 3.86Å; I216-L221 HydrophobicContact CG2-CG 3.8Å
217	Q	87.8	Confident	92.6	Very high	98 Å²	98	44.9 Å²	44.9	46%	0.458	25%	0.245	S	C	.	.			trans	-94.6	156.4	176.6	-56.6	-61.2	-22.7	0	0	110.6	D215 S219 H220	D215-Q217 PolarHBondContact OD1-NE2 3.3Å; Q217-S219 PolarHBondContact O-N 3.08Å; Q217-H220 PolarHBondContact N-ND1 2.75Å; Q217-H220 WeakPolarHBondContact O-CB 3.19Å; Q217-H220 PolarHBondContact O-N 2.86Å
218	N	86.2	Confident	92.7	Very high	53 Å²	53	45.3 Å²	45.3	28%	0.283	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-62.2	-28.5	-177.4	-71.3	-10.3	0	0	0	113.4	H220 L221 N222 R304 N306	N218-H220 PolarHBondContact O-N 3.27Å; N218-L221 CarbonylContact O-C 3.41Å; N218-L221 WeakPolarHBondContact O-CA 3.45Å; N218-L221 PolarHBondContact O-N 3.02Å; N218-N222 PolarHBondContact O-N 3.01Å; N218-N222 PolarHBondContact O-OD1 2.99Å; N218-R304 VanDerWaalsContact CG-O 3.31Å; N218-R304 PolarHBondContact ND2-O 2.91Å; N218-R304 PolarHBondContact OD1-O 2.78Å; N218-N306 PolarHBondContact ND2-O 3.07Å
219	S	87.6	Confident	92.8	Very high	74 Å²	74	44 Å²	44	52%	0.517	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-56.8	-30.2	170.6	55.2	0	0	0	0	113.6	Q217 L221 N222	Q217-S219 PolarHBondContact O-N 3.08Å; S219-L221 VanDerWaalsContact C-N 3.28Å; S219-N222 PolarHBondContact O-ND2 3.09Å
220	H	89.1	Confident	92.9	Very high	30 Å²	30	41.9 Å²	41.9	14%	0.139	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-81.1	-7.1	175	-45.4	153.8	0	0	0	113	M185 N189 Q217 N218	M185-H220 HydrophobicContact CE-CB 3.67Å; N189-H220 PolarHBondContact ND2-O 2.64Å; N189-H220 PolarHBondContact OD1-O 3.41Å; Q217-H220 PolarHBondContact N-ND1 2.75Å; Q217-H220 WeakPolarHBondContact O-CB 3.19Å; Q217-H220 PolarHBondContact O-N 2.86Å; N218-H220 PolarHBondContact O-N 3.27Å
221	L	91	Very high	92.8	Very high	8 Å²	8	41.9 Å²	41.9	4%	0.042	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-120.3	11	-174.9	-58.1	179	0	0	0	112.5	M181 M185 I216 N218 S219 N223 M224 F305	M181-L221 HydrophobicContact CE-CD2 3.84Å; M185-L221 HydrophobicContact CG-CD2 4.36Å; I216-L221 HydrophobicContact CG2-CD1 3.81Å; I216-L221 HydrophobicContact CG2-CD2 3.86Å; I216-L221 HydrophobicContact CG2-CG 3.8Å; N218-L221 CarbonylContact O-C 3.41Å; N218-L221 WeakPolarHBondContact O-CA 3.45Å; N218-L221 PolarHBondContact O-N 3.02Å; S219-L221 VanDerWaalsContact C-N 3.28Å; L221-N223 PolarHBondContact O-N 2.94Å; L221-M224 HydrophobicContact CB-CB 4.32Å; L221-M224 HydrophobicContact CD2-CB 4.48Å; L221-M224 HydrophobicContact CD2-CE 4.4Å; L221-M224 HydrophobicContact CD2-CG 4.43Å; L221-M224 HydrophobicContact CD2-SD 3.49Å; L221-M224 WeakPolarHBondContact CD2-SD 3.16Å; L221-M224 WeakPolarHBondContact O-CA 3.12Å; L221-M224 WeakPolarHBondContact O-CB 3.46Å; L221-M224 PolarHBondContact O-N 2.89Å; L221-M224 VanDerWaalsContact O-O 3.07Å; L221-F305 HydrophobicContact CD1-CD1 3.59Å; L221-F305 HydrophobicContact CD1-CE1 4.05Å; L221-F305 HydrophobicContact CD1-CG 4.44Å
222	N	86.1	Confident	92.7	Very high	95 Å²	95	49.3 Å²	49.3	51%	0.508	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-36	-173	-79.6	-15.7	0	0	0	114.4	N218 S219 R225	N218-N222 PolarHBondContact O-N 3.01Å; N218-N222 PolarHBondContact O-OD1 2.99Å; S219-N222 PolarHBondContact O-ND2 3.09Å; N222-R225 PolarHBondContact O-NH1 2.81Å
223	N	92.3	Very high	92.7	Very high	45 Å²	45	48.4 Å²	48.4	24%	0.241	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	22.6	177.6	-166	42.1	0	0	0	112.8	S188 R192 V193 P194 V195 L221	S188-N223 WeakPolarHBondContact OG-CB 3.3Å; R192-N223 PolarHBondContact O-ND2 3.24Å; V193-N223 VanDerWaalsContact C-ND2 3.26Å; V193-N223 PolarHBondContact O-ND2 2.72Å; P194-N223 WeakPolarHBondContact CA-O 3.43Å; V195-N223 PolarHBondContact N-O 2.85Å; V195-N223 VanDerWaalsContact N-O 3.08Å; L221-N223 PolarHBondContact O-N 2.94Å
224	M	95.4	Very high	92.9	Very high	4 Å²	4	51.8 Å²	51.8	2%	0.02	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	149.5	173.9	-52.2	-175.4	65.5	0	0	109.9	L184 M185 S188 V195 I197 L221	L184-M224 HydrophobicContact CB-CE 3.94Å; M185-M224 HydrophobicContact CG-SD 3.89Å; S188-M224 VanDerWaalsContact CB-CG 3.44Å; S188-M224 VanDerWaalsContact OG-CG 3.3Å; S188-M224 WeakPolarHBondContact OG-CG 3.26Å; V195-M224 HydrophobicContact CB-CB 4.45Å; V195-M224 HydrophobicContact CB-CE 4.11Å; V195-M224 HydrophobicContact CB-CG 4.1Å; V195-M224 HydrophobicContact CG1-CE 4.03Å; V195-M224 HydrophobicContact CG2-CG 4.44Å; V195-M224 CarbonylContact O-C 3.57Å; V195-M224 WeakPolarHBondContact O-CA 3.46Å; I197-M224 HydrophobicContact CD1-CE 3.72Å; L221-M224 HydrophobicContact CB-CB 4.32Å; L221-M224 HydrophobicContact CD2-CB 4.48Å; L221-M224 HydrophobicContact CD2-CE 4.4Å; L221-M224 HydrophobicContact CD2-CG 4.43Å; L221-M224 HydrophobicContact CD2-SD 3.49Å; L221-M224 WeakPolarHBondContact CD2-SD 3.16Å; L221-M224 WeakPolarHBondContact O-CA 3.12Å; L221-M224 WeakPolarHBondContact O-CB 3.46Å; L221-M224 PolarHBondContact O-N 2.89Å; L221-M224 VanDerWaalsContact O-O 3.07Å
225	R	95.1	Very high	93	Very high	91 Å²	91	54.8 Å²	54.8	34%	0.343	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	105.2	172.5	-67.8	-63.2	179.6	-88.3	2.5	109.6	V195 Y196 I197 N222	V195-R225 PolarHBondContact O-N 2.89Å; Y196-R225 HydrophobicContact CD1-CB 3.97Å; Y196-R225 HydrophobicContact CD1-CG 4.48Å; Y196-R225 HydrophobicContact CE1-CB 4.36Å; Y196-R225 HydrophobicContact CE1-CG 4.39Å; I197-R225 PolarHBondContact N-O 2.98Å; N222-R225 PolarHBondContact O-NH1 2.81Å
226	V	96.6	Very high	93.2	Very high	9 Å²	9	53.3 Å²	53.3	6%	0.055	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	129.7	175.6	-165.3	0	0	0	0	108.8	I197 L199 F207 I302 F305	I197-V226 HydrophobicContact CB-CG1 4.33Å; I197-V226 HydrophobicContact CB-CG2 4.42Å; I197-V226 HydrophobicContact CD1-CG2 4.34Å; I197-V226 CarbonylContact O-C 3.41Å; I197-V226 WeakPolarHBondContact O-CA 3.33Å; L199-V226 HydrophobicContact CD1-CG1 3.88Å; L199-V226 HydrophobicContact CG-CG1 4.38Å; F207-V226 HydrophobicContact CD1-CG1 4.4Å; F207-V226 HydrophobicContact CE1-CG1 3.81Å; F207-V226 HydrophobicContact CE1-CG2 4.26Å; F207-V226 HydrophobicContact CZ-CG1 4.27Å; F207-V226 HydrophobicContact CZ-CG2 4.22Å; V226-I302 HydrophobicContact CB-CD1 4.4Å; V226-I302 HydrophobicContact CG1-CD1 3.87Å; V226-F305 HydrophobicContact CB-CB 4.47Å; V226-F305 HydrophobicContact CB-CD2 4.23Å; V226-F305 HydrophobicContact CG1-CD2 4.46Å
227	R	97.3	Very high	93.3	Very high	48 Å²	48	64.9 Å²	64.9	18%	0.181	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	154.5	-179.9	-64.3	178.3	73.6	104.2	-4.7	110.2	I197 L198 L199 Y296 S299 Q300 I301	I197-R227 PolarHBondContact O-N 3.01Å; L198-R227 WeakPolarHBondContact CA-O 3.49Å; L198-R227 HydrophobicContact CD2-CB 3.78Å; L199-R227 PolarHBondContact N-O 2.69Å; R227-Y296 HydrophobicContact CG-CE2 4.5Å; R227-S299 WeakPolarHBondContact CD-OG 3.47Å; R227-S299 PolarHBondContact NE-OG 2.87Å; R227-S299 PolarHBondContact NH2-O 2.87Å; R227-Q300 VanDerWaalsContact CA-O 3.31Å; R227-Q300 WeakPolarHBondContact CA-O 3.27Å; R227-Q300 WeakPolarHBondContact CB-O 3.22Å; R227-I301 VanDerWaalsContact NH1-CG1 3.3Å
228	S	97.3	Very high	93.7	Very high	10 Å²	10	63.4 Å²	63.4	7%	0.07	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	140.6	177.8	55.3	0	0	0	0	111.3	L199 S299 Q300	L199-S228 CarbonylContact O-C 3.5Å; L199-S228 WeakPolarHBondContact O-CA 3.39Å; S228-S299 CarbonylContact O-C 3.49Å; S228-S299 WeakPolarHBondContact O-CA 3.36Å; S228-S299 VanDerWaalsContact O-CB 3.28Å; S228-S299 WeakPolarHBondContact O-CB 3.45Å; S228-Q300 PolarHBondContact N-O 2.89Å; S228-Q300 PolarHBondContact O-N 2.97Å
229	V	96.9	Very high	94.1	Very high	5 Å²	5	63.7 Å²	63.7	3%	0.03	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	150.3	178.1	65.3	0	0	0	0	109.4	L198 L199 D200 E201 V246 L295	L198-V229 HydrophobicContact CB-CG1 4.24Å; L199-V229 PolarHBondContact O-N 3.09Å; D200-V229 WeakPolarHBondContact CA-O 3.25Å; E201-V229 PolarHBondContact N-O 3.31Å; V229-V246 HydrophobicContact CB-CG2 4.35Å; V229-V246 HydrophobicContact CG1-CB 4.1Å; V229-V246 HydrophobicContact CG1-CG1 4.34Å; V229-V246 HydrophobicContact CG1-CG2 3.76Å; V229-V246 HydrophobicContact CG2-CG2 3.97Å; V229-L295 HydrophobicContact CG2-CD2 4.18Å
230	C	95.9	Very high	94.6	Very high	41 Å²	41	68.1 Å²	68.1	28%	0.277	36%	0.364	S	S	.	.			trans	-135.8	153.8	178.8	63.1	0	0	0	0	110.5	E201	E201-C230 HydrophobicContact CB-CB 4.03Å; E201-C230 WeakPolarHBondContact OE2-CB 3.37Å
231	G	93.6	Very high	95	Very high	17 Å²	17	73.9 Å²	73.9	18%	0.175	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	173.4	176.3	0	0	0	0	0	113.4	G244	G231-G244 PolarHBondContact N-O 3.26Å; G231-G244 PolarHBondContact O-N 2.94Å
232	D	92.9	Very high	95.1	Very high	157 Å²	157	79.6 Å²	79.6	84%	0.84	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-39.4	138.5	-177.5	-91.1	-36.9	0	0	0	115.1	Y234 G244	D232-Y234 PolarHBondContact O-N 3.21Å; D232-G244 PolarHBondContact O-N 3.12Å
233	T	95.1	Very high	95.6	Very high	74 Å²	74	76.9 Å²	76.9	45%	0.454	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	97.8	175.1	-59.2	0	0	0	0	111.5	C235 K241 F242 T243	T233-C235 PolarHBondContact O-N 3.41Å; T233-K241 HydrophobicContact CG2-CB 3.91Å; T233-K241 HydrophobicContact CG2-CD 3.96Å; T233-K241 HydrophobicContact CG2-CG 4.37Å; T233-F242 CarbonylContact C-O 3.59Å; T233-F242 WeakPolarHBondContact CA-O 3.42Å; T233-T243 WeakPolarHBondContact OG1-CG2 3.26Å
234	Y	96.3	Very high	95.7	Very high	137 Å²	137	75.9 Å²	75.9	54%	0.537	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	127.2	171	-176.7	-89.2	0	0	0	111	D232 T236 K241 F242	D232-Y234 PolarHBondContact O-N 3.21Å; Y234-T236 HydrophobicContact CD1-CG2 4.36Å; Y234-T236 HydrophobicContact CE1-CG2 3.88Å; Y234-K241 VanDerWaalsContact O-CA 3.26Å; Y234-K241 WeakPolarHBondContact O-CA 2.99Å; Y234-F242 HydrophobicContact CD1-CD1 4.03Å; Y234-F242 AromaticContact CD1-CE1 3.4Å; Y234-F242 HydrophobicContact CD1-CE1 3.4Å; Y234-F242 HydrophobicContact CD1-CZ 4.04Å; Y234-F242 HydrophobicContact CE1-CE1 4.29Å; Y234-F242 HydrophobicContact CG-CD1 4.5Å; Y234-F242 AromaticContact CG-CE1 3.78Å; Y234-F242 HydrophobicContact CG-CE1 3.78Å; Y234-F242 AromaticContact CG-CZ 3.96Å; Y234-F242 HydrophobicContact CG-CZ 3.96Å; Y234-F242 PolarHBondContact N-O 3.11Å; Y234-F242 PolarHBondContact O-N 3.39Å
235	C	96.1	Very high	95.6	Very high	70 Å²	70	80 Å²	80	47%	0.473	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	117.5	178.7	-64.2	0	0	0	0	111	T233 K241	T233-C235 PolarHBondContact O-N 3.41Å; C235-K241 HydrophobicContact CB-CG 4.47Å
236	T	96.1	Very high	95.6	Very high	51 Å²	51	76.3 Å²	76.3	31%	0.313	41%	0.407	S	S	.	.			trans	-70.8	156.6	173	67.5	0	0	0	0	111.5	Y234 G238 G239 K240	Y234-T236 HydrophobicContact CD1-CG2 4.36Å; Y234-T236 HydrophobicContact CE1-CG2 3.88Å; T236-G238 PolarHBondContact O-N 2.97Å; T236-G238 VanDerWaalsContact O-N 3.1Å; T236-G238 PolarHBondContact OG1-N 3.46Å; T236-G239 PolarHBondContact O-N 2.86Å; T236-G239 PolarHBondContact OG1-N 3.16Å; T236-K240 WeakPolarHBondContact CB-O 3.33Å; T236-K240 HydrophobicContact CG2-CB 4.25Å; T236-K240 WeakPolarHBondContact CG2-O 3.27Å; T236-K240 PolarHBondContact N-O 2.97Å; T236-K240 WeakPolarHBondContact OG1-CB 3.47Å; T236-K240 PolarHBondContact OG1-N 2.92Å; T236-K240 VanDerWaalsContact OG1-N 3.1Å; T236-K240 PolarHBondContact OG1-O 3.33Å
237	R	95.5	Very high	95.5	Very high	246 Å²	246	81.2 Å²	81.2	93%	0.928	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-24	169.7	179.2	176.8	171.6	-165.6	-5.1	113.3	G239	R237-G239 VanDerWaalsContact C-N 3.33Å
238	G	95.5	Very high	95.4	Very high	67 Å²	67	83.3 Å²	83.3	69%	0.691	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	16.6	177.3	0	0	0	0	0	114.5	T236 K240	T236-G238 PolarHBondContact O-N 2.97Å; T236-G238 VanDerWaalsContact O-N 3.1Å; T236-G238 PolarHBondContact OG1-N 3.46Å; G238-K240 PolarHBondContact O-N 2.86Å
239	G	95.4	Very high	95.4	Very high	58 Å²	58	84.4 Å²	84.4	60%	0.598	45%	0.448	S	S	*	.	S	Bend	trans	77.2	-16.9	177	0	0	0	0	0	115.6	T236 R237	T236-G239 PolarHBondContact O-N 2.86Å; T236-G239 PolarHBondContact OG1-N 3.16Å; R237-G239 VanDerWaalsContact C-N 3.33Å
240	K	97.1	Very high	95.5	Very high	167 Å²	167	84.6 Å²	84.6	73%	0.726	45%	0.448	S	S	*	.			trans	-60.8	136.7	171.6	-56	-173.7	178.5	-173.2	0	110.1	T236 G238	T236-K240 WeakPolarHBondContact CB-O 3.33Å; T236-K240 HydrophobicContact CG2-CB 4.25Å; T236-K240 WeakPolarHBondContact CG2-O 3.27Å; T236-K240 PolarHBondContact N-O 2.97Å; T236-K240 WeakPolarHBondContact OG1-CB 3.47Å; T236-K240 PolarHBondContact OG1-N 2.92Å; T236-K240 VanDerWaalsContact OG1-N 3.1Å; T236-K240 PolarHBondContact OG1-O 3.33Å; G238-K240 PolarHBondContact O-N 2.86Å
241	K	96.8	Very high	95.6	Very high	151 Å²	151	82.8 Å²	82.8	66%	0.657	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.6	154.9	179.1	-54.5	-172.7	-179.7	179.8	0	111.1	T233 Y234 C235	T233-K241 HydrophobicContact CG2-CB 3.91Å; T233-K241 HydrophobicContact CG2-CD 3.96Å; T233-K241 HydrophobicContact CG2-CG 4.37Å; Y234-K241 VanDerWaalsContact O-CA 3.26Å; Y234-K241 WeakPolarHBondContact O-CA 2.99Å; C235-K241 HydrophobicContact CB-CG 4.47Å
242	F	94.7	Very high	95.8	Very high	128 Å²	128	82.1 Å²	82.1	56%	0.561	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.7	149.1	162.1	69.5	-92.9	0	0	0	110.1	T233 Y234	T233-F242 CarbonylContact C-O 3.59Å; T233-F242 WeakPolarHBondContact CA-O 3.42Å; Y234-F242 HydrophobicContact CD1-CD1 4.03Å; Y234-F242 AromaticContact CD1-CE1 3.4Å; Y234-F242 HydrophobicContact CD1-CE1 3.4Å; Y234-F242 HydrophobicContact CD1-CZ 4.04Å; Y234-F242 HydrophobicContact CE1-CE1 4.29Å; Y234-F242 HydrophobicContact CG-CD1 4.5Å; Y234-F242 AromaticContact CG-CE1 3.78Å; Y234-F242 HydrophobicContact CG-CE1 3.78Å; Y234-F242 AromaticContact CG-CZ 3.96Å; Y234-F242 HydrophobicContact CG-CZ 3.96Å; Y234-F242 PolarHBondContact N-O 3.11Å; Y234-F242 PolarHBondContact O-N 3.39Å
243	T	95.4	Very high	96	Very high	38 Å²	38	74.8 Å²	74.8	23%	0.233	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	143.1	172.4	43.9	0	0	0	0	111.2	K202 T233	K202-T243 WeakPolarHBondContact CE-OG1 3.39Å; K202-T243 PolarHBondContact NZ-OG1 2.57Å; T233-T243 WeakPolarHBondContact OG1-CG2 3.26Å
244	G	94.1	Very high	96	Very high	24 Å²	24	72 Å²	72	25%	0.247	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	178.3	167.6	0	0	0	0	0	112.5	G231 D232	G231-G244 PolarHBondContact N-O 3.26Å; G231-G244 PolarHBondContact O-N 2.94Å; D232-G244 PolarHBondContact O-N 3.12Å
245	Q	94.6	Very high	95.8	Very high	92 Å²	92	68.1 Å²	68.1	43%	0.43	36%	0.364	S	S	.	.			trans	-103.9	150.5	171.3	-67.6	-176.1	-74.5	0	0	110.6	D200 K202 L247	D200-Q245 WeakPolarHBondContact OD1-CA 3.42Å; D200-Q245 WeakPolarHBondContact OD1-CB 3.33Å; D200-Q245 PolarHBondContact OD2-NE2 2.85Å; K202-Q245 HydrophobicContact CB-CG 4.39Å; K202-Q245 HydrophobicContact CG-CG 3.81Å; Q245-L247 HydrophobicContact CB-CD2 3.95Å; Q245-L247 HydrophobicContact CB-CG 4.5Å
246	V	95.3	Very high	95.6	Very high	12 Å²	12	70.3 Å²	70.3	7%	0.073	37%	0.367	C	S	.	.			trans	-85.5	108.9	165.4	179.5	0	0	0	0	108.2	V171 D200 V229 E248	V171-V246 HydrophobicContact CG1-CG1 4.14Å; D200-V246 PolarHBondContact OD1-N 2.8Å; V229-V246 HydrophobicContact CB-CG2 4.35Å; V229-V246 HydrophobicContact CG1-CB 4.1Å; V229-V246 HydrophobicContact CG1-CG1 4.34Å; V229-V246 HydrophobicContact CG1-CG2 3.76Å; V229-V246 HydrophobicContact CG2-CG2 3.97Å; V246-E248 HydrophobicContact CG1-CB 4.07Å
247	L	94.7	Very high	95.5	Very high	112 Å²	112	70.5 Å²	70.5	59%	0.586	36%	0.364	S	S	*	.			trans	-95	-2.5	179.8	-56.8	-178.9	0	0	0	112.7	Q245 K249	Q245-L247 HydrophobicContact CB-CD2 3.95Å; Q245-L247 HydrophobicContact CB-CG 4.5Å; L247-K249 PolarHBondContact O-NZ 2.92Å
248	E	94.8	Very high	95.6	Very high	93 Å²	93	58.8 Å²	58.8	44%	0.435	32%	0.32	S	S	.	.			trans	-68.1	137.9	179	-64.6	-177	-159.2	0	0	111.2	V171 V246 F250	V171-E248 HydrophobicContact CG1-CB 4.38Å; V246-E248 HydrophobicContact CG1-CB 4.07Å; E248-F250 HydrophobicContact CB-CD1 4.49Å; E248-F250 HydrophobicContact CB-CE1 4.48Å
249	K	97.6	Very high	95.7	Very high	33 Å²	33	55.9 Å²	55.9	14%	0.143	29%	0.289	C	S	.	.			trans	-137.7	102.8	-176.8	-77.4	176	-78.3	-62.9	0	109.1	V171 M172 D173 L247 A260 G261 S262	V171-K249 WeakPolarHBondContact O-CA 3.41Å; M172-K249 HydrophobicContact SD-CB 4.4Å; M172-K249 HydrophobicContact SD-CD 4.13Å; M172-K249 HydrophobicContact SD-CG 3.79Å; D173-K249 WeakPolarHBondContact OD1-CD 3.25Å; D173-K249 IonicContact OD2-NZ 3.64Å; D173-K249 PolarHBondContact OD2-NZ 2.87Å; L247-K249 PolarHBondContact O-NZ 2.92Å; K249-A260 VanDerWaalsContact O-CA 3.31Å; K249-A260 WeakPolarHBondContact O-CA 3.3Å; K249-G261 WeakPolarHBondContact CB-O 3.48Å; K249-G261 WeakPolarHBondContact CE-O 3.44Å; K249-G261 PolarHBondContact O-N 3.49Å; K249-G261 VanDerWaalsContact O-N 3.16Å; K249-S262 VanDerWaalsContact CE-O 3.26Å; K249-S262 WeakPolarHBondContact CE-O 3.36Å
250	F	98.2	Very high	95.8	Very high	8 Å²	8	53.7 Å²	53.7	4%	0.035	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	153.4	174.6	65	-93.6	0	0	0	112.5	V171 E248 I252 V258 I259 A260 F288 F292 L295	V171-F250 HydrophobicContact CB-CD1 4.12Å; V171-F250 HydrophobicContact CB-CE1 3.96Å; V171-F250 HydrophobicContact CB-CG 4.49Å; V171-F250 HydrophobicContact CB-CZ 4.19Å; V171-F250 HydrophobicContact CG1-CE1 4.42Å; V171-F250 HydrophobicContact CG2-CD1 4.26Å; V171-F250 HydrophobicContact CG2-CD2 4.3Å; V171-F250 HydrophobicContact CG2-CE1 3.71Å; V171-F250 HydrophobicContact CG2-CE2 3.76Å; V171-F250 HydrophobicContact CG2-CZ 3.44Å; V171-F250 VanDerWaalsContact CG2-CZ 3.44Å; V171-F250 PolarHBondContact N-O 2.77Å; V171-F250 PolarHBondContact O-N 2.8Å; V171-F250 VanDerWaalsContact O-N 3.08Å; E248-F250 HydrophobicContact CB-CD1 4.49Å; E248-F250 HydrophobicContact CB-CE1 4.48Å; F250-I252 HydrophobicContact CD2-CD1 4.49Å; F250-I252 HydrophobicContact CD2-CG1 4.01Å; F250-I252 HydrophobicContact CE2-CD1 4.09Å; F250-I252 HydrophobicContact CE2-CG1 4.09Å; F250-V258 HydrophobicContact CB-CG1 4.5Å; F250-I259 CarbonylContact C-O 3.44Å; F250-I259 WeakPolarHBondContact CA-O 3.26Å; F250-A260 HydrophobicContact CB-CB 3.63Å; F250-F288 HydrophobicContact CB-CD1 4.3Å; F250-F288 HydrophobicContact CB-CE1 4.35Å; F250-F288 HydrophobicContact CD1-CD1 4.19Å; F250-F288 HydrophobicContact CD1-CE1 4.5Å; F250-F288 HydrophobicContact CD2-CB 4.46Å; F250-F288 AromaticContact CD2-CD1 3.94Å; F250-F288 HydrophobicContact CD2-CD1 3.94Å; F250-F288 HydrophobicContact CE1-CD1 4.46Å; F250-F288 HydrophobicContact CE2-CB 4.32Å; F250-F288 HydrophobicContact CE2-CD1 4.23Å; F250-F288 AromaticContact CG-CD1 3.91Å; F250-F288 HydrophobicContact CG-CD1 3.91Å; F250-F288 HydrophobicContact CG-CE1 4.34Å; F250-F288 HydrophobicContact CZ-CD1 4.47Å; F250-F292 HydrophobicContact CE2-CB 4.17Å; F250-F292 HydrophobicContact CE2-CD2 4.3Å; F250-F292 HydrophobicContact CZ-CB 4.36Å; F250-L295 HydrophobicContact CE1-CD1 4.32Å; F250-L295 HydrophobicContact CZ-CD1 4.32Å
251	M	98.3	Very high	95.7	Very high	3 Å²	3	46.9 Å²	46.9	2%	0.015	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	128.9	172.9	176.9	178	69.8	0	0	109.5	I157 M160 I161 I168 A169 V170 I253 V258 I259 F265	I157-M251 HydrophobicContact CG2-CE 3.95Å; M160-M251 HydrophobicContact CB-CE 4.06Å; I161-M251 HydrophobicContact CD1-CE 4.49Å; I161-M251 HydrophobicContact CD1-SD 4.05Å; I161-M251 HydrophobicContact CG1-CE 3.97Å; I161-M251 HydrophobicContact CG1-SD 3.65Å; I168-M251 HydrophobicContact CG2-CG 4.18Å; I168-M251 HydrophobicContact CG2-SD 4.18Å; A169-M251 CarbonylContact O-C 3.58Å; A169-M251 VanDerWaalsContact O-CA 3.27Å; A169-M251 WeakPolarHBondContact O-CA 3.3Å; V170-M251 HydrophobicContact CG2-CB 4.45Å; V170-M251 HydrophobicContact CG2-CG 4.01Å; V170-M251 HydrophobicContact CG2-SD 4.28Å; M251-I253 HydrophobicContact CE-CD1 3.97Å; M251-I253 HydrophobicContact CE-CG1 4.2Å; M251-I253 HydrophobicContact CG-CD1 4.02Å; M251-I253 HydrophobicContact CG-CG1 4.46Å; M251-I253 HydrophobicContact SD-CD1 3.91Å; M251-V258 WeakPolarHBondContact O-CA 3.24Å; M251-I259 HydrophobicContact CB-CG2 3.9Å; M251-I259 HydrophobicContact CE-CG2 3.7Å; M251-I259 PolarHBondContact N-O 3.49Å; M251-I259 PolarHBondContact O-N 3.1Å; M251-F265 HydrophobicContact SD-CZ 4.47Å
252	I	98	Very high	95.7	Very high	3 Å²	3	42.2 Å²	42.2	2%	0.015	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	133.3	173.4	-42.1	-175.3	0	0	0	108.4	A169 F250 V258 F288 D289 F292	A169-I252 HydrophobicContact CB-CB 4.22Å; A169-I252 HydrophobicContact CB-CG1 4.41Å; A169-I252 PolarHBondContact N-O 2.49Å; A169-I252 PolarHBondContact O-N 3.24Å; F250-I252 HydrophobicContact CD2-CD1 4.49Å; F250-I252 HydrophobicContact CD2-CG1 4.01Å; F250-I252 HydrophobicContact CE2-CD1 4.09Å; F250-I252 HydrophobicContact CE2-CG1 4.09Å; I252-V258 HydrophobicContact CB-CG2 4.18Å; I252-V258 HydrophobicContact CG1-CG2 4.01Å; I252-V258 HydrophobicContact CG2-CG2 3.88Å; I252-F288 HydrophobicContact CD1-CB 4.07Å; I252-F288 HydrophobicContact CG1-CB 4.45Å; I252-D289 HydrophobicContact CD1-CB 4.36Å; I252-F292 HydrophobicContact CD1-CB 4.03Å
253	I	97.4	Very high	95.8	Very high	4 Å²	4	36.3 Å²	36.3	2%	0.021	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	124.4	174.1	-58.6	-63.3	0	0	0	109.3	M160 A164 I168 M251 C255 E256 E257	M160-I253 HydrophobicContact CB-CG1 4.2Å; M160-I253 HydrophobicContact CE-CG1 4.19Å; A164-I253 HydrophobicContact CB-CD1 4.31Å; A164-I253 HydrophobicContact CB-CG2 3.69Å; I168-I253 HydrophobicContact CB-CD1 4.39Å; I168-I253 HydrophobicContact CD1-CD1 4.39Å; I168-I253 HydrophobicContact CG1-CD1 3.86Å; I168-I253 HydrophobicContact CG2-CD1 4Å; M251-I253 HydrophobicContact CE-CD1 3.97Å; M251-I253 HydrophobicContact CE-CG1 4.2Å; M251-I253 HydrophobicContact CG-CD1 4.02Å; M251-I253 HydrophobicContact CG-CG1 4.46Å; M251-I253 HydrophobicContact SD-CD1 3.91Å; I253-C255 PolarHBondContact O-N 3.44Å; I253-E256 PolarHBondContact O-N 3.45Å; I253-E257 HydrophobicContact CB-CB 4.37Å; I253-E257 PolarHBondContact N-O 2.86Å; I253-E257 PolarHBondContact O-N 2.9Å; I253-E257 VanDerWaalsContact O-N 3.16Å
254	D	95	Very high	95.8	Very high	16 Å²	16	35.3 Å²	35.3	9%	0.086	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	14.6	174.4	-68.5	-1.5	0	0	0	116.3	K165 K166 V167 E256	K165-D254 WeakPolarHBondContact CB-OD2 3.43Å; K165-D254 PolarHBondContact N-OD1 3.31Å; K165-D254 PolarHBondContact N-OD2 3.18Å; K166-D254 WeakPolarHBondContact CA-OD1 3.42Å; K166-D254 HydrophobicContact CB-CB 4.16Å; K166-D254 HydrophobicContact CD-CB 4.08Å; K166-D254 HydrophobicContact CG-CB 4.15Å; K166-D254 PolarHBondContact N-OD1 3.02Å; K166-D254 PolarHBondContact N-OD2 2.7Å; V167-D254 PolarHBondContact N-OD1 3.24Å; V167-D254 PolarHBondContact O-N 2.97Å; D254-E256 PolarHBondContact O-N 3.24Å
255	C	91.9	Very high	96	Very high	55 Å²	55	34.4 Å²	34.4	37%	0.372	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	13.1	-166.5	-59.7	0	0	0	0	115.2	I253 T285	I253-C255 PolarHBondContact O-N 3.44Å; C255-T285 PolarHBondContact O-OG1 3.49Å
256	E	91.5	Very high	96.1	Very high	116 Å²	116	30.5 Å²	30.5	54%	0.542	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111	-31.8	-174.2	-71.3	175.1	-172.3	0	0	113.5	K166 I253 D254	K166-E256 IonicContact NZ-OE1 3.59Å; K166-E256 PolarHBondContact NZ-OE1 2.74Å; I253-E256 PolarHBondContact O-N 3.45Å; D254-E256 PolarHBondContact O-N 3.24Å
257	E	94.6	Very high	96.1	Very high	54 Å²	54	31.7 Å²	31.7	25%	0.252	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	141.1	178.2	-70.9	-176	138.3	0	0	110.2	M160 I253 H279	M160-E257 HydrophobicContact CE-CB 3.84Å; I253-E257 HydrophobicContact CB-CB 4.37Å; I253-E257 PolarHBondContact N-O 2.86Å; I253-E257 PolarHBondContact O-N 2.9Å; I253-E257 VanDerWaalsContact O-N 3.16Å; E257-H279 WeakPolarHBondContact CB-NE2 3.14Å; E257-H279 IonicContact OE1-CE1 2.76Å; E257-H279 PolarHBondContact OE1-CE1 3.27Å; E257-H279 IonicContact OE1-NE2 3.79Å
258	V	97.1	Very high	96.1	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	134	172.6	174.2	0	0	0	0	110.6	F250 M251 I252 H279 F280 T285 F288	F250-V258 HydrophobicContact CB-CG1 4.5Å; M251-V258 WeakPolarHBondContact O-CA 3.24Å; I252-V258 HydrophobicContact CB-CG2 4.18Å; I252-V258 HydrophobicContact CG1-CG2 4.01Å; I252-V258 HydrophobicContact CG2-CG2 3.88Å; V258-H279 CarbonylContact O-C 3.59Å; V258-H279 WeakPolarHBondContact O-CA 3.5Å; V258-H279 PolarHBondContact O-CD2 3.06Å; V258-F280 HydrophobicContact CB-CB 4.45Å; V258-F280 PolarHBondContact N-O 2.9Å; V258-F280 PolarHBondContact O-N 3.21Å; V258-T285 HydrophobicContact CB-CG2 4.25Å; V258-T285 HydrophobicContact CG2-CG2 3.61Å; V258-F288 HydrophobicContact CB-CD2 4.26Å; V258-F288 HydrophobicContact CG1-CB 4.24Å; V258-F288 HydrophobicContact CG1-CD1 3.98Å; V258-F288 HydrophobicContact CG1-CD2 3.8Å; V258-F288 HydrophobicContact CG1-CE1 4.22Å; V258-F288 HydrophobicContact CG1-CE2 4.05Å; V258-F288 HydrophobicContact CG1-CG 3.76Å; V258-F288 HydrophobicContact CG1-CZ 4.25Å; V258-F288 HydrophobicContact CG2-CB 4.03Å; V258-F288 HydrophobicContact CG2-CD2 4.23Å; V258-F288 HydrophobicContact CG2-CG 4.28Å
259	I	96.9	Very high	96.1	Very high	7 Å²	7	22.4 Å²	22.4	4%	0.036	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	127.9	169.6	-176.6	162.1	0	0	0	110.2	L156 I157 M160 F250 M251 V277 M278	L156-I259 HydrophobicContact CD2-CD1 3.68Å; L156-I259 HydrophobicContact CG-CD1 4.07Å; I157-I259 HydrophobicContact CG1-CD1 4.01Å; M160-I259 HydrophobicContact CE-CB 4.18Å; M160-I259 HydrophobicContact CE-CG2 4.1Å; M160-I259 HydrophobicContact SD-CB 3.99Å; M160-I259 HydrophobicContact SD-CD1 4.08Å; M160-I259 HydrophobicContact SD-CG2 3.88Å; F250-I259 CarbonylContact C-O 3.44Å; F250-I259 WeakPolarHBondContact CA-O 3.26Å; M251-I259 HydrophobicContact CB-CG2 3.9Å; M251-I259 HydrophobicContact CE-CG2 3.7Å; M251-I259 PolarHBondContact N-O 3.49Å; M251-I259 PolarHBondContact O-N 3.1Å; I259-V277 HydrophobicContact CD1-CB 4.11Å; I259-V277 HydrophobicContact CD1-CG2 3.94Å; I259-V277 HydrophobicContact CG1-CB 3.99Å; I259-V277 HydrophobicContact CG1-CG1 4.47Å; I259-V277 HydrophobicContact CG1-CG2 4.36Å; I259-M278 WeakPolarHBondContact CA-O 3.42Å
260	A	97.4	Very high	95.7	Very high	11 Å²	11	21.2 Å²	21.2	9%	0.091	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	147.5	-178	0	0	0	0	0	111.9	K249 F250 V277 M278 F280 F288	K249-A260 VanDerWaalsContact O-CA 3.31Å; K249-A260 WeakPolarHBondContact O-CA 3.3Å; F250-A260 HydrophobicContact CB-CB 3.63Å; A260-V277 WeakPolarHBondContact O-CA 3.43Å; A260-M278 PolarHBondContact N-O 3.05Å; A260-M278 PolarHBondContact O-N 3.4Å; A260-F280 HydrophobicContact CB-CE2 4.3Å; A260-F288 HydrophobicContact CB-CE1 4.08Å; A260-F288 HydrophobicContact CB-CZ 4.28Å
261	G	96.3	Very high	95.3	Very high	25 Å²	25	26.4 Å²	26.4	26%	0.258	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	168.3	-150.1	-179.1	0	0	0	0	0	116	K249 M276	K249-G261 WeakPolarHBondContact CB-O 3.48Å; K249-G261 WeakPolarHBondContact CE-O 3.44Å; K249-G261 PolarHBondContact O-N 3.49Å; K249-G261 VanDerWaalsContact O-N 3.16Å; G261-M276 WeakPolarHBondContact CA-O 3.31Å
262	S	95.7	Very high	94.8	Very high	52 Å²	52	30.3 Å²	30.3	36%	0.364	17%	0.17	S	C	.	.	S	Bend	trans	-87.9	-14.2	179.8	70.8	0	0	0	0	114.2	K249 S264 N275 M276	K249-S262 VanDerWaalsContact CE-O 3.26Å; K249-S262 WeakPolarHBondContact CE-O 3.36Å; S262-S264 PolarHBondContact O-N 2.82Å; S262-S264 VanDerWaalsContact O-N 3.1Å; S262-N275 PolarHBondContact O-OD1 2.85Å; S262-N275 VanDerWaalsContact OG-CA 3.25Å; S262-N275 WeakPolarHBondContact OG-CA 3.26Å; S262-N275 VanDerWaalsContact OG-CB 3.23Å; S262-N275 WeakPolarHBondContact OG-CB 3.45Å; S262-N275 PolarHBondContact OG-OD1 2.92Å; S262-M276 PolarHBondContact N-O 3.08Å; S262-M276 PolarHBondContact OG-N 2.86Å; S262-M276 PolarHBondContact OG-O 3.18Å
263	Y	96.4	Very high	94.5	Very high	5 Å²	5	33.1 Å²	33.1	2%	0.02	18%	0.184	C	C	.	.			trans	-71.4	101.3	-171.2	-172.5	-82.5	0	0	0	112	I153 I157 L180 F265 S269 A270 N275	I153-Y263 HydrophobicContact CB-CD2 4.13Å; I153-Y263 HydrophobicContact CB-CE2 4.3Å; I153-Y263 HydrophobicContact CG2-CD1 4.43Å; I153-Y263 HydrophobicContact CG2-CD2 3.46Å; I153-Y263 VanDerWaalsContact CG2-CD2 3.46Å; I153-Y263 HydrophobicContact CG2-CE2 3.91Å; I153-Y263 HydrophobicContact CG2-CG 3.77Å; I157-Y263 HydrophobicContact CD1-CD1 3.47Å; I157-Y263 VanDerWaalsContact CD1-CD1 3.47Å; I157-Y263 HydrophobicContact CD1-CE1 3.6Å; I157-Y263 HydrophobicContact CD1-CG 4.11Å; L180-Y263 HydrophobicContact CD1-CE1 4.25Å; Y263-F265 AromaticContact CD1-CD1 3.99Å; Y263-F265 HydrophobicContact CD1-CD1 3.99Å; Y263-F265 HydrophobicContact CD1-CE1 4.34Å; Y263-F265 AromaticContact CE1-CD1 3.95Å; Y263-F265 HydrophobicContact CE1-CD1 3.95Å; Y263-F265 HydrophobicContact CE1-CE1 4.45Å; Y263-S269 VanDerWaalsContact CE2-O 3.31Å; Y263-S269 WeakPolarHBondContact CE2-O 3.45Å; Y263-A270 WeakPolarHBondContact OH-CB 3.48Å; Y263-N275 WeakPolarHBondContact CA-OD1 3.31Å; Y263-N275 HydrophobicContact CD2-CB 4.15Å; Y263-N275 PolarHBondContact N-OD1 2.81Å
264	S	97.2	Very high	94.1	Very high	16 Å²	16	35.8 Å²	35.8	11%	0.112	20%	0.202	C	C	.	.			trans	-71.7	151	165.5	-56.1	0	0	0	0	110.3	D173 S262 T266 S269	D173-S264 VanDerWaalsContact OD1-CB 3.25Å; D173-S264 WeakPolarHBondContact OD1-CB 3.41Å; D173-S264 PolarHBondContact OD1-OG 2.77Å; D173-S264 PolarHBondContact OD2-OG 3.06Å; S262-S264 PolarHBondContact O-N 2.82Å; S262-S264 VanDerWaalsContact O-N 3.1Å; S264-T266 VanDerWaalsContact C-N 3.26Å; S264-T266 PolarHBondContact O-N 2.87Å; S264-S269 WeakPolarHBondContact O-CB 3.45Å; S264-S269 PolarHBondContact O-OG 2.68Å
265	F	97.6	Very high	94	Very high	5 Å²	5	35.7 Å²	35.7	2%	0.022	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-79.1	70.6	178.5	-73.5	3.8	0	0	0	111.7	I157 V170 M172 I174 F175 T176 D177 L180 M251 Y263	I157-F265 HydrophobicContact CD1-CE1 4.15Å; I157-F265 HydrophobicContact CG2-CE1 4.13Å; I157-F265 HydrophobicContact CG2-CZ 4.06Å; V170-F265 HydrophobicContact CG1-CE2 3.87Å; V170-F265 HydrophobicContact CG1-CZ 4.31Å; M172-F265 HydrophobicContact CE-CD1 3.37Å; M172-F265 HydrophobicContact CE-CD2 4.12Å; M172-F265 HydrophobicContact CE-CE1 3.33Å; M172-F265 HydrophobicContact CE-CE2 4.08Å; M172-F265 HydrophobicContact CE-CG 3.79Å; M172-F265 HydrophobicContact CE-CZ 3.72Å; M172-F265 HydrophobicContact CG-CB 4.13Å; M172-F265 HydrophobicContact CG-CD2 4.43Å; M172-F265 HydrophobicContact CG-CG 4.11Å; M172-F265 HydrophobicContact SD-CB 4.29Å; M172-F265 HydrophobicContact SD-CD1 3.84Å; M172-F265 HydrophobicContact SD-CE1 4.4Å; M172-F265 HydrophobicContact SD-CG 4.01Å; M172-F265 PolarHBondContact SD-N 3.27Å; M172-F265 VanDerWaalsContact SD-N 3.41Å; I174-F265 PolarHBondContact O-N 3.15Å; I174-F265 VanDerWaalsContact O-N 3.09Å; F175-F265 CarbonylContact C-O 3.57Å; F175-F265 WeakPolarHBondContact CA-O 3.22Å; F175-F265 HydrophobicContact CB-CB 4.28Å; F175-F265 HydrophobicContact CD1-CD2 4.33Å; F175-F265 HydrophobicContact CD2-CB 3.48Å; F175-F265 VanDerWaalsContact CD2-CB 3.48Å; F175-F265 AromaticContact CD2-CD2 3.89Å; F175-F265 HydrophobicContact CD2-CD2 3.89Å; F175-F265 HydrophobicContact CD2-CG 4.22Å; F175-F265 HydrophobicContact CE1-CD2 4.28Å; F175-F265 HydrophobicContact CE2-CB 4.04Å; F175-F265 AromaticContact CE2-CD2 3.84Å; F175-F265 HydrophobicContact CE2-CD2 3.84Å; F175-F265 HydrophobicContact CE2-CG 4.44Å; F175-F265 HydrophobicContact CG-CB 4.02Å; F175-F265 HydrophobicContact CG-CD2 4.15Å; F175-F265 HydrophobicContact CZ-CD2 4.04Å; T176-F265 PolarHBondContact N-O 3.16Å; D177-F265 WeakPolarHBondContact CB-O 3.38Å; D177-F265 PolarHBondContact N-O 3.39Å; L180-F265 HydrophobicContact CB-CD2 4.4Å; L180-F265 HydrophobicContact CD1-CB 3.91Å; L180-F265 HydrophobicContact CD1-CD1 3.62Å; L180-F265 HydrophobicContact CD1-CD2 3.92Å; L180-F265 HydrophobicContact CD1-CE1 4.04Å; L180-F265 HydrophobicContact CD1-CE2 4.31Å; L180-F265 HydrophobicContact CD1-CG 3.54Å; L180-F265 HydrophobicContact CD1-CZ 4.37Å; M251-F265 HydrophobicContact SD-CZ 4.47Å; Y263-F265 AromaticContact CD1-CD1 3.99Å; Y263-F265 HydrophobicContact CD1-CD1 3.99Å; Y263-F265 HydrophobicContact CD1-CE1 4.34Å; Y263-F265 AromaticContact CE1-CD1 3.95Å; Y263-F265 HydrophobicContact CE1-CD1 3.95Å; Y263-F265 HydrophobicContact CE1-CE1 4.45Å
266	T	97.1	Very high	94.1	Very high	11 Å²	11	36.3 Å²	36.3	7%	0.067	20%	0.2	C	C	.	.	S	Bend	trans	-129.6	158.9	179.4	76.4	0	0	0	0	111.2	E77 I174 S264 L268 S269 A270	E77-T266 WeakPolarHBondContact OE1-CB 3.42Å; I174-T266 HydrophobicContact CB-CG2 4.04Å; I174-T266 HydrophobicContact CG2-CG2 3.66Å; S264-T266 VanDerWaalsContact C-N 3.26Å; S264-T266 PolarHBondContact O-N 2.87Å; T266-L268 VanDerWaalsContact C-N 3.34Å; T266-S269 WeakPolarHBondContact O-CB 3.32Å; T266-S269 PolarHBondContact O-N 3.32Å; T266-S269 WeakPolarHBondContact OG1-CB 3.39Å; T266-S269 PolarHBondContact OG1-N 3.06Å; T266-S269 PolarHBondContact OG1-OG 3.27Å; T266-A270 PolarHBondContact O-N 3.32Å
267	W	95	Very high	94.3	Very high	36 Å²	36	31 Å²	31	14%	0.136	18%	0.175	C	C	.	.	H	α-helix	trans	-66.7	-36.3	174.5	179.6	98.1	0	0	0	111.4	T49 F72 L73 E77 I81 S269 A270 Q271 V272	T49-W267 HydrophobicContact CG2-CH2 3.86Å; T49-W267 HydrophobicContact CG2-CZ2 4.36Å; F72-W267 AromaticContact CD2-CD1 3.42Å; F72-W267 VanDerWaalsContact CD2-CD1 3.42Å; F72-W267 HydrophobicContact CD2-CD2 4.28Å; F72-W267 AromaticContact CD2-CG 3.92Å; F72-W267 HydrophobicContact CD2-CG 3.92Å; F72-W267 AromaticContact CD2-NE1 3.46Å; F72-W267 AromaticContact CE2-CD1 3.88Å; F72-W267 HydrophobicContact CE2-CD2 4.17Å; F72-W267 AromaticContact CE2-CE2 3.63Å; F72-W267 HydrophobicContact CE2-CG 4.3Å; F72-W267 HydrophobicContact CE2-CZ2 4.07Å; F72-W267 AromaticContact CE2-NE1 3.43Å; L73-W267 HydrophobicContact CD2-CB 4.07Å; L73-W267 HydrophobicContact CD2-CD2 3.48Å; L73-W267 VanDerWaalsContact CD2-CD2 3.48Å; L73-W267 HydrophobicContact CD2-CE3 3.38Å; L73-W267 HydrophobicContact CD2-CG 3.81Å; L73-W267 HydrophobicContact CD2-CZ3 4Å; E77-W267 WeakPolarHBondContact OE1-CA 3.41Å; E77-W267 VanDerWaalsContact OE1-CB 3.32Å; E77-W267 WeakPolarHBondContact OE1-CB 3.46Å; E77-W267 PolarHBondContact OE1-N 3.4Å; I81-W267 HydrophobicContact CD1-CZ3 3.97Å; W267-S269 VanDerWaalsContact C-N 3.34Å; W267-S269 PolarHBondContact O-N 3.12Å; W267-A270 WeakPolarHBondContact O-CB 3.44Å; W267-A270 PolarHBondContact O-N 2.82Å; W267-A270 VanDerWaalsContact O-N 3.09Å; W267-Q271 HydrophobicContact CD2-CB 4.37Å; W267-Q271 HydrophobicContact CD2-CG 3.94Å; W267-Q271 HydrophobicContact CE3-CB 4.42Å; W267-Q271 HydrophobicContact CE3-CG 4.48Å; W267-Q271 HydrophobicContact CG-CG 4.37Å; W267-Q271 HydrophobicContact CH2-CB 4.16Å; W267-Q271 HydrophobicContact CH2-CG 4.34Å; W267-Q271 HydrophobicContact CZ2-CB 4.12Å; W267-Q271 HydrophobicContact CZ2-CG 3.8Å; W267-Q271 HydrophobicContact CZ3-CB 4.32Å; W267-Q271 PolarHBondContact O-N 3.29Å; W267-V272 HydrophobicContact CH2-CG2 4.44Å; W267-V272 HydrophobicContact CZ3-CG2 3.99Å
268	L	94.2	Very high	94.3	Very high	7 Å²	7	31 Å²	31	4%	0.037	18%	0.176	C	C	.	.	H	α-helix	trans	-62.8	-38.7	173.6	-76.1	178.9	0	0	0	112.5	E77 Y80 I81 T266 A270 Q271 V272 H273	E77-L268 HydrophobicContact CB-CD1 3.93Å; E77-L268 HydrophobicContact CB-CG 4.05Å; E77-L268 HydrophobicContact CG-CB 4.44Å; E77-L268 HydrophobicContact CG-CD1 3.79Å; E77-L268 HydrophobicContact CG-CG 3.89Å; E77-L268 PolarHBondContact OE1-N 3.14Å; Y80-L268 HydrophobicContact CD1-CD1 3.43Å; Y80-L268 VanDerWaalsContact CD1-CD1 3.43Å; Y80-L268 HydrophobicContact CD1-CD2 4.11Å; Y80-L268 HydrophobicContact CD1-CG 4.46Å; Y80-L268 HydrophobicContact CE1-CD1 4.17Å; Y80-L268 HydrophobicContact CE1-CD2 4.45Å; Y80-L268 HydrophobicContact CG-CD1 3.75Å; I81-L268 HydrophobicContact CD1-CD2 4.22Å; I81-L268 HydrophobicContact CG1-CD2 4.05Å; T266-L268 VanDerWaalsContact C-N 3.34Å; L268-A270 VanDerWaalsContact C-N 3.26Å; L268-A270 PolarHBondContact O-N 3.02Å; L268-Q271 PolarHBondContact O-N 2.93Å; L268-V272 HydrophobicContact CD2-CB 3.96Å; L268-V272 HydrophobicContact CD2-CG1 4.45Å; L268-V272 HydrophobicContact CD2-CG2 3.8Å; L268-V272 PolarHBondContact O-N 2.91Å; L268-H273 PolarHBondContact O-N 3.22Å
269	S	94.2	Very high	94.2	Very high	3 Å²	3	32 Å²	32	2%	0.021	18%	0.181	C	C	.	.	H	α-helix	trans	-59.7	-38	171.3	-63.3	0	0	0	0	112.3	Q146 Y263 S264 T266 W267 N275	Q146-S269 PolarHBondContact NE2-O 3.09Å; Q146-S269 PolarHBondContact OE1-O 2.81Å; Y263-S269 VanDerWaalsContact CE2-O 3.31Å; Y263-S269 WeakPolarHBondContact CE2-O 3.45Å; S264-S269 WeakPolarHBondContact O-CB 3.45Å; S264-S269 PolarHBondContact O-OG 2.68Å; T266-S269 WeakPolarHBondContact O-CB 3.32Å; T266-S269 PolarHBondContact O-N 3.32Å; T266-S269 WeakPolarHBondContact OG1-CB 3.39Å; T266-S269 PolarHBondContact OG1-N 3.06Å; T266-S269 PolarHBondContact OG1-OG 3.27Å; W267-S269 VanDerWaalsContact C-N 3.34Å; W267-S269 PolarHBondContact O-N 3.12Å; S269-N275 PolarHBondContact O-ND2 3.46Å
270	A	90.9	Very high	94	Very high	8 Å²	8	33 Å²	33	7%	0.066	19%	0.185	C	C	.	.	H	α-helix	trans	-71.3	-42.8	-179.6	0	0	0	0	0	113	Q146 K154 Y263 T266 W267 L268	Q146-A270 PolarHBondContact NE2-O 3.43Å; Q146-A270 VanDerWaalsContact NE2-O 3.11Å; K154-A270 HydrophobicContact CB-CB 4.35Å; K154-A270 HydrophobicContact CD-CB 3.57Å; Y263-A270 WeakPolarHBondContact OH-CB 3.48Å; T266-A270 PolarHBondContact O-N 3.32Å; W267-A270 WeakPolarHBondContact O-CB 3.44Å; W267-A270 PolarHBondContact O-N 2.82Å; W267-A270 VanDerWaalsContact O-N 3.09Å; L268-A270 VanDerWaalsContact C-N 3.26Å; L268-A270 PolarHBondContact O-N 3.02Å
271	Q	87.8	Confident	93.7	Very high	117 Å²	117	34 Å²	34	55%	0.547	19%	0.191	S	C	.	.	H	α-helix	trans	-109.4	-27.4	-165.3	-58.1	-60	-23.2	0	0	115.5	W267 L268	W267-Q271 HydrophobicContact CD2-CB 4.37Å; W267-Q271 HydrophobicContact CD2-CG 3.94Å; W267-Q271 HydrophobicContact CE3-CB 4.42Å; W267-Q271 HydrophobicContact CE3-CG 4.48Å; W267-Q271 HydrophobicContact CG-CG 4.37Å; W267-Q271 HydrophobicContact CH2-CB 4.16Å; W267-Q271 HydrophobicContact CH2-CG 4.34Å; W267-Q271 HydrophobicContact CZ2-CB 4.12Å; W267-Q271 HydrophobicContact CZ2-CG 3.8Å; W267-Q271 HydrophobicContact CZ3-CB 4.32Å; W267-Q271 PolarHBondContact O-N 3.29Å; L268-Q271 PolarHBondContact O-N 2.93Å
272	V	89.6	Confident	93.2	Very high	85 Å²	85	35 Å²	35	52%	0.515	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-127.6	-41.5	-163.8	-175.5	0	0	0	0	113.6	W267 L268	W267-V272 HydrophobicContact CH2-CG2 4.44Å; W267-V272 HydrophobicContact CZ3-CG2 3.99Å; L268-V272 HydrophobicContact CD2-CB 3.96Å; L268-V272 HydrophobicContact CD2-CG1 4.45Å; L268-V272 HydrophobicContact CD2-CG2 3.8Å; L268-V272 PolarHBondContact O-N 2.91Å
273	H	90.4	Very high	92.6	Very high	63 Å²	63	38.5 Å²	38.5	29%	0.292	21%	0.21	S	C	.	.	S	Bend	trans	-77.9	147.7	-178.9	-61.1	-24.1	0	0	0	111.6	Y80 Q146 L268 N275	Y80-H273 AromaticContact CE1-CE1 3.84Å; Y80-H273 AromaticContact CZ-CE1 3.78Å; Q146-H273 PolarHBondContact NE2-O 2.81Å; Q146-H273 PolarHBondContact OE1-O 3.45Å; L268-H273 PolarHBondContact O-N 3.22Å; H273-N275 PolarHBondContact O-N 3.3Å
274	S	90	Very high	92.2	Very high	59 Å²	59	40.3 Å²	40.3	41%	0.413	22%	0.22	S	C	.	.			trans	-95.1	89.6	178.1	165.9	0	0	0	0	110.9	R147	R147-S274 PolarHBondContact NH1-OG 3.1Å; R147-S274 PolarHBondContact NH2-OG 3.03Å
275	N	92.3	Very high	91.9	Very high	15 Å²	15	39.9 Å²	39.9	8%	0.08	22%	0.217	C	C	.	.			trans	-86.8	165.8	-178.7	-65.7	-75.7	0	0	0	114.9	Q146 I153 S262 Y263 S269 H273	Q146-N275 WeakPolarHBondContact CB-O 3.2Å; Q146-N275 PolarHBondContact N-O 3.24Å; Q146-N275 PolarHBondContact OE1-ND2 3.1Å; I153-N275 HydrophobicContact CD1-CB 3.99Å; S262-N275 PolarHBondContact O-OD1 2.85Å; S262-N275 VanDerWaalsContact OG-CA 3.25Å; S262-N275 WeakPolarHBondContact OG-CA 3.26Å; S262-N275 VanDerWaalsContact OG-CB 3.23Å; S262-N275 WeakPolarHBondContact OG-CB 3.45Å; S262-N275 PolarHBondContact OG-OD1 2.92Å; Y263-N275 WeakPolarHBondContact CA-OD1 3.31Å; Y263-N275 HydrophobicContact CD2-CB 4.15Å; Y263-N275 PolarHBondContact N-OD1 2.81Å; S269-N275 PolarHBondContact O-ND2 3.46Å; H273-N275 PolarHBondContact O-N 3.3Å
276	M	93.4	Very high	91.6	Very high	67 Å²	67	44.7 Å²	44.7	33%	0.33	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	138.9	164.7	-178.2	-168.7	77.3	0	0	109	I143 Y144 F145 G261 S262 M278	I143-M276 HydrophobicContact CG2-CG 3.93Å; I143-M276 HydrophobicContact CG2-SD 4.08Å; Y144-M276 WeakPolarHBondContact O-CA 3.5Å; F145-M276 HydrophobicContact CD1-CB 4.09Å; F145-M276 HydrophobicContact CD1-CG 3.75Å; F145-M276 HydrophobicContact CD1-SD 4.19Å; F145-M276 HydrophobicContact CE1-CB 4.33Å; F145-M276 HydrophobicContact CE1-CG 3.63Å; F145-M276 HydrophobicContact CE1-SD 3.47Å; F145-M276 WeakPolarHBondContact CE1-SD 3.37Å; F145-M276 HydrophobicContact CZ-CG 4.32Å; F145-M276 HydrophobicContact CZ-SD 4.02Å; G261-M276 WeakPolarHBondContact CA-O 3.31Å; S262-M276 PolarHBondContact N-O 3.08Å; S262-M276 PolarHBondContact OG-N 2.86Å; S262-M276 PolarHBondContact OG-O 3.18Å; M276-M278 HydrophobicContact CE-CE 4.45Å; M276-M278 HydrophobicContact CE-CG 4.42Å; M276-M278 HydrophobicContact CE-SD 4.36Å
277	V	95.4	Very high	91.5	Very high	4 Å²	4	47.4 Å²	47.4	2%	0.024	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	146.4	171	-66	0	0	0	0	110.7	Y144 I153 L156 I259 A260	Y144-V277 HydrophobicContact CD2-CG2 4.11Å; Y144-V277 PolarHBondContact N-O 3.16Å; Y144-V277 PolarHBondContact O-N 2.84Å; I153-V277 HydrophobicContact CB-CG2 4.49Å; I153-V277 HydrophobicContact CD1-CG1 4.34Å; I153-V277 HydrophobicContact CD1-CG2 3.9Å; I153-V277 HydrophobicContact CG1-CG2 3.91Å; I153-V277 HydrophobicContact CG2-CG1 3.83Å; I153-V277 HydrophobicContact CG2-CG2 3.88Å; L156-V277 HydrophobicContact CD2-CG2 4.44Å; I259-V277 HydrophobicContact CD1-CB 4.11Å; I259-V277 HydrophobicContact CD1-CG2 3.94Å; I259-V277 HydrophobicContact CG1-CB 3.99Å; I259-V277 HydrophobicContact CG1-CG1 4.47Å; I259-V277 HydrophobicContact CG1-CG2 4.36Å; A260-V277 WeakPolarHBondContact O-CA 3.43Å
278	M	94.8	Very high	91.5	Very high	56 Å²	56	47.8 Å²	47.8	28%	0.276	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	126.4	176	-60.6	171.3	-70.4	0	0	107.8	Q142 I143 I259 A260 M276 F280	Q142-M278 CarbonylContact O-C 3.59Å; Q142-M278 WeakPolarHBondContact O-CA 3.38Å; I143-M278 HydrophobicContact CG1-CG 4.18Å; I143-M278 HydrophobicContact CG2-CG 4.2Å; I259-M278 WeakPolarHBondContact CA-O 3.42Å; A260-M278 PolarHBondContact N-O 3.05Å; A260-M278 PolarHBondContact O-N 3.4Å; M276-M278 HydrophobicContact CE-CE 4.45Å; M276-M278 HydrophobicContact CE-CG 4.42Å; M276-M278 HydrophobicContact CE-SD 4.36Å; M278-F280 HydrophobicContact CB-CD2 4.3Å; M278-F280 HydrophobicContact CB-CE1 4.39Å; M278-F280 HydrophobicContact CB-CE2 3.5Å; M278-F280 HydrophobicContact CB-CZ 3.55Å; M278-F280 HydrophobicContact CE-CE2 4.43Å; M278-F280 HydrophobicContact CE-CZ 4.17Å; M278-F280 HydrophobicContact CG-CZ 4.34Å; M278-F280 HydrophobicContact SD-CZ 3.98Å
279	H	95.1	Very high	91.6	Very high	20 Å²	20	48.7 Å²	48.7	9%	0.093	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	131.7	171.5	-179.7	-129.1	0	0	0	109.5	T141 Q142 Y144 M160 E257 V258	T141-H279 CarbonylContact C-O 3.58Å; T141-H279 WeakPolarHBondContact CA-O 3.47Å; Q142-H279 HydrophobicContact CB-CB 4.48Å; Q142-H279 PolarHBondContact N-O 2.78Å; Q142-H279 PolarHBondContact O-N 3.48Å; Y144-H279 HydrophobicContact CE2-CB 3.76Å; M160-H279 WeakPolarHBondContact CE-NE2 3.45Å; E257-H279 WeakPolarHBondContact CB-NE2 3.14Å; E257-H279 IonicContact OE1-CE1 2.76Å; E257-H279 PolarHBondContact OE1-CE1 3.27Å; E257-H279 IonicContact OE1-NE2 3.79Å; V258-H279 CarbonylContact O-C 3.59Å; V258-H279 WeakPolarHBondContact O-CA 3.5Å; V258-H279 PolarHBondContact O-CD2 3.06Å
280	F	94	Very high	91.7	Very high	27 Å²	27	55.9 Å²	55.9	12%	0.118	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	137.6	-174.3	-59.3	-82.4	0	0	0	110	T141 V258 A260 M278 I284 F288	T141-F280 HydrophobicContact CG2-CD1 3.7Å; T141-F280 HydrophobicContact CG2-CE1 3.51Å; T141-F280 HydrophobicContact CG2-CZ 4.31Å; V258-F280 HydrophobicContact CB-CB 4.45Å; V258-F280 PolarHBondContact N-O 2.9Å; V258-F280 PolarHBondContact O-N 3.21Å; A260-F280 HydrophobicContact CB-CE2 4.3Å; M278-F280 HydrophobicContact CB-CD2 4.3Å; M278-F280 HydrophobicContact CB-CE1 4.39Å; M278-F280 HydrophobicContact CB-CE2 3.5Å; M278-F280 HydrophobicContact CB-CZ 3.55Å; M278-F280 HydrophobicContact CE-CE2 4.43Å; M278-F280 HydrophobicContact CE-CZ 4.17Å; M278-F280 HydrophobicContact CG-CZ 4.34Å; M278-F280 HydrophobicContact SD-CZ 3.98Å; F280-I284 HydrophobicContact CB-CG2 3.75Å; F280-I284 HydrophobicContact CD1-CG1 4.43Å; F280-I284 HydrophobicContact CD1-CG2 4.37Å; F280-I284 HydrophobicContact CG-CG2 4.43Å; F280-F288 HydrophobicContact CD2-CE2 4.04Å; F280-F288 HydrophobicContact CD2-CZ 4.18Å; F280-F288 HydrophobicContact CE2-CE2 4.24Å; F280-F288 AromaticContact CE2-CZ 4Å; F280-F288 HydrophobicContact CE2-CZ 4Å; F280-F288 HydrophobicContact CG-CE2 4.47Å
281	S	90.5	Very high	91.9	Very high	33 Å²	33	58.6 Å²	58.6	23%	0.231	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	159.6	173.9	69.7	0	0	0	0	112.2	E140	E140-S281 PolarHBondContact O-N 2.91Å
282	G	84.8	Confident	92.4	Very high	45 Å²	45	53.7 Å²	53.7	46%	0.464	29%	0.285	S	S	.	.	S	Bend	trans	74	-157.4	-179.6	0	0	0	0	0	113.9	I284 T285	G282-I284 PolarHBondContact O-N 3.46Å; G282-T285 WeakPolarHBondContact O-CG2 3.4Å; G282-T285 PolarHBondContact O-N 2.89Å; G282-T285 PolarHBondContact O-OG1 2.89Å; G282-T285 VanDerWaalsContact O-OG1 3.08Å
283	F	84.7	Confident	92.8	Very high	127 Å²	127	57.1 Å²	57.1	56%	0.557	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	-18.5	-164	78.2	-92.5	0	0	0	117.2	S139 T285 D286	S139-F283 VanDerWaalsContact OG-CE1 3.22Å; S139-F283 WeakPolarHBondContact OG-CE1 3.39Å; S139-F283 VanDerWaalsContact OG-CZ 3.27Å; S139-F283 WeakPolarHBondContact OG-CZ 3.48Å; F283-T285 PolarHBondContact O-N 3.32Å; F283-D286 WeakPolarHBondContact O-CB 3.39Å; F283-D286 PolarHBondContact O-N 2.94Å
284	I	88.4	Confident	93.1	Very high	42 Å²	42	55.9 Å²	55.9	22%	0.215	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-24.7	175.8	-175.1	60.7	0	0	0	111.9	F280 G282 D286 S287 F288	F280-I284 HydrophobicContact CB-CG2 3.75Å; F280-I284 HydrophobicContact CD1-CG1 4.43Å; F280-I284 HydrophobicContact CD1-CG2 4.37Å; F280-I284 HydrophobicContact CG-CG2 4.43Å; G282-I284 PolarHBondContact O-N 3.46Å; I284-D286 VanDerWaalsContact C-N 3.27Å; I284-D286 PolarHBondContact O-N 2.99Å; I284-S287 WeakPolarHBondContact O-CB 3.47Å; I284-S287 PolarHBondContact O-N 3.08Å; I284-S287 VanDerWaalsContact O-N 3.1Å; I284-F288 HydrophobicContact CG1-CE2 4.19Å
285	T	90.7	Very high	93.4	Very high	7 Å²	7	54 Å²	54	4%	0.043	27%	0.272	C	S	.	.	H	α-helix	trans	-63.4	-31.1	176.4	64.8	0	0	0	0	112.6	C255 V258 G282 F283 S287 F288 D289	C255-T285 PolarHBondContact O-OG1 3.49Å; V258-T285 HydrophobicContact CB-CG2 4.25Å; V258-T285 HydrophobicContact CG2-CG2 3.61Å; G282-T285 WeakPolarHBondContact O-CG2 3.4Å; G282-T285 PolarHBondContact O-N 2.89Å; G282-T285 PolarHBondContact O-OG1 2.89Å; G282-T285 VanDerWaalsContact O-OG1 3.08Å; F283-T285 PolarHBondContact O-N 3.32Å; T285-S287 PolarHBondContact O-N 3.29Å; T285-F288 PolarHBondContact O-N 2.82Å; T285-F288 VanDerWaalsContact O-N 3.08Å; T285-D289 PolarHBondContact O-N 3.38Å
286	D	91.1	Very high	93.6	Very high	106 Å²	106	56.5 Å²	56.5	57%	0.567	28%	0.281	S	S	*	.	H	α-helix	trans	-56.8	-31.3	173.8	-66.6	-37.3	0	0	0	112.3	F283 I284 R290	F283-D286 WeakPolarHBondContact O-CB 3.39Å; F283-D286 PolarHBondContact O-N 2.94Å; I284-D286 VanDerWaalsContact C-N 3.27Å; I284-D286 PolarHBondContact O-N 2.99Å; D286-R290 WeakPolarHBondContact O-CB 3.43Å; D286-R290 PolarHBondContact O-N 2.91Å
287	S	93.5	Very high	93.7	Very high	69 Å²	69	57 Å²	57	48%	0.483	30%	0.295	S	S	.	.	H	α-helix	trans	-73.7	-38.6	178.2	-59.6	0	0	0	0	111.8	I284 T285 E291	I284-S287 WeakPolarHBondContact O-CB 3.47Å; I284-S287 PolarHBondContact O-N 3.08Å; I284-S287 VanDerWaalsContact O-N 3.1Å; T285-S287 PolarHBondContact O-N 3.29Å; S287-E291 PolarHBondContact O-N 2.94Å; S287-E291 VanDerWaalsContact O-N 3.1Å
288	F	96.3	Very high	93.6	Very high	44 Å²	44	63.1 Å²	63.1	19%	0.193	33%	0.328	C	S	.	.	H	α-helix	trans	-73.6	-37.4	175.2	-72.2	-84.1	0	0	0	112.3	F250 I252 V258 A260 F280 I284 T285 E291 F292	F250-F288 HydrophobicContact CB-CD1 4.3Å; F250-F288 HydrophobicContact CB-CE1 4.35Å; F250-F288 HydrophobicContact CD1-CD1 4.19Å; F250-F288 HydrophobicContact CD1-CE1 4.5Å; F250-F288 HydrophobicContact CD2-CB 4.46Å; F250-F288 AromaticContact CD2-CD1 3.94Å; F250-F288 HydrophobicContact CD2-CD1 3.94Å; F250-F288 HydrophobicContact CE1-CD1 4.46Å; F250-F288 HydrophobicContact CE2-CB 4.32Å; F250-F288 HydrophobicContact CE2-CD1 4.23Å; F250-F288 AromaticContact CG-CD1 3.91Å; F250-F288 HydrophobicContact CG-CD1 3.91Å; F250-F288 HydrophobicContact CG-CE1 4.34Å; F250-F288 HydrophobicContact CZ-CD1 4.47Å; I252-F288 HydrophobicContact CD1-CB 4.07Å; I252-F288 HydrophobicContact CG1-CB 4.45Å; V258-F288 HydrophobicContact CB-CD2 4.26Å; V258-F288 HydrophobicContact CG1-CB 4.24Å; V258-F288 HydrophobicContact CG1-CD1 3.98Å; V258-F288 HydrophobicContact CG1-CD2 3.8Å; V258-F288 HydrophobicContact CG1-CE1 4.22Å; V258-F288 HydrophobicContact CG1-CE2 4.05Å; V258-F288 HydrophobicContact CG1-CG 3.76Å; V258-F288 HydrophobicContact CG1-CZ 4.25Å; V258-F288 HydrophobicContact CG2-CB 4.03Å; V258-F288 HydrophobicContact CG2-CD2 4.23Å; V258-F288 HydrophobicContact CG2-CG 4.28Å; A260-F288 HydrophobicContact CB-CE1 4.08Å; A260-F288 HydrophobicContact CB-CZ 4.28Å; F280-F288 HydrophobicContact CD2-CE2 4.04Å; F280-F288 HydrophobicContact CD2-CZ 4.18Å; F280-F288 HydrophobicContact CE2-CE2 4.24Å; F280-F288 AromaticContact CE2-CZ 4Å; F280-F288 HydrophobicContact CE2-CZ 4Å; F280-F288 HydrophobicContact CG-CE2 4.47Å; I284-F288 HydrophobicContact CG1-CE2 4.19Å; T285-F288 PolarHBondContact O-N 2.82Å; T285-F288 VanDerWaalsContact O-N 3.08Å; F288-E291 PolarHBondContact O-N 3.03Å; F288-F292 WeakPolarHBondContact O-CB 3.23Å; F288-F292 PolarHBondContact O-N 3.43Å
289	D	95.1	Very high	93.7	Very high	26 Å²	26	60.7 Å²	60.7	14%	0.139	32%	0.316	C	S	.	.	H	α-helix	trans	-61.4	-44.6	172.3	166.4	81.7	0	0	0	111.2	I252 T285 E291 F292 R293	I252-D289 HydrophobicContact CD1-CB 4.36Å; T285-D289 PolarHBondContact O-N 3.38Å; D289-E291 VanDerWaalsContact C-N 3.34Å; D289-E291 PolarHBondContact O-N 3.44Å; D289-F292 PolarHBondContact O-N 3.21Å; D289-R293 VanDerWaalsContact CG-CZ 3.42Å; D289-R293 VanDerWaalsContact CG-NE 3.27Å; D289-R293 VanDerWaalsContact O-CG 3.26Å; D289-R293 WeakPolarHBondContact O-CG 3.25Å; D289-R293 PolarHBondContact O-N 3.35Å; D289-R293 IonicContact OD1-CZ 3.56Å; D289-R293 IonicContact OD1-NE 3.18Å; D289-R293 PolarHBondContact OD1-NE 3.32Å; D289-R293 IonicContact OD1-NH2 2.73Å; D289-R293 PolarHBondContact OD1-NH2 3.35Å; D289-R293 IonicContact OD2-CZ 3.5Å; D289-R293 IonicContact OD2-NE 3.35Å; D289-R293 PolarHBondContact OD2-NE 3.1Å; D289-R293 IonicContact OD2-NH1 3.52Å; D289-R293 IonicContact OD2-NH2 2.75Å; D289-R293 PolarHBondContact OD2-NH2 3.46Å
290	R	96.2	Very high	93.7	Very high	153 Å²	153	65 Å²	65	58%	0.577	34%	0.336	S	S	*	.	H	α-helix	trans	-58.1	-46.9	173.7	-174.6	-170.2	166.3	-72.6	-9.5	111.4	D286 R293 C294	D286-R290 WeakPolarHBondContact O-CB 3.43Å; D286-R290 PolarHBondContact O-N 2.91Å; R290-R293 PolarHBondContact O-N 2.83Å; R290-C294 PolarHBondContact O-N 2.94Å; R290-C294 VanDerWaalsContact O-N 3.09Å; R290-C294 PolarHBondContact O-SG 3.48Å
291	E	96.7	Very high	93.7	Very high	66 Å²	66	68 Å²	68	31%	0.308	35%	0.353	S	S	.	.	H	α-helix	trans	-70.1	-38.5	-178.1	-154.7	53.4	-125.7	0	0	112.4	S287 F288 D289 R293 C294 L295	S287-E291 PolarHBondContact O-N 2.94Å; S287-E291 VanDerWaalsContact O-N 3.1Å; F288-E291 PolarHBondContact O-N 3.03Å; D289-E291 VanDerWaalsContact C-N 3.34Å; D289-E291 PolarHBondContact O-N 3.44Å; E291-R293 PolarHBondContact O-N 3.1Å; E291-C294 WeakPolarHBondContact O-CB 3.41Å; E291-C294 PolarHBondContact O-N 2.93Å; E291-C294 VanDerWaalsContact O-N 3.12Å; E291-L295 WeakPolarHBondContact O-CG 3.4Å; E291-L295 PolarHBondContact O-N 2.79Å
292	F	97.9	Very high	93.7	Very high	14 Å²	14	67.2 Å²	67.2	6%	0.061	35%	0.346	C	S	.	.	H	α-helix	trans	-55.5	-41.8	170.6	-173.2	-94	0	0	0	111.7	A169 V171 L198 F250 I252 F288 D289 L295 Y296	A169-F292 HydrophobicContact CB-CD1 4.06Å; A169-F292 HydrophobicContact CB-CD2 3.94Å; A169-F292 HydrophobicContact CB-CE1 3.89Å; A169-F292 HydrophobicContact CB-CE2 3.77Å; A169-F292 HydrophobicContact CB-CG 4.1Å; A169-F292 HydrophobicContact CB-CZ 3.76Å; V171-F292 HydrophobicContact CG2-CD2 3.57Å; V171-F292 HydrophobicContact CG2-CE2 3.89Å; L198-F292 HydrophobicContact CD1-CD2 4.1Å; L198-F292 HydrophobicContact CD1-CE2 3.67Å; L198-F292 HydrophobicContact CD1-CZ 4Å; L198-F292 HydrophobicContact CG-CE2 3.72Å; L198-F292 HydrophobicContact CG-CZ 3.92Å; F250-F292 HydrophobicContact CE2-CB 4.17Å; F250-F292 HydrophobicContact CE2-CD2 4.3Å; F250-F292 HydrophobicContact CZ-CB 4.36Å; I252-F292 HydrophobicContact CD1-CB 4.03Å; F288-F292 WeakPolarHBondContact O-CB 3.23Å; F288-F292 PolarHBondContact O-N 3.43Å; D289-F292 PolarHBondContact O-N 3.21Å; F292-L295 PolarHBondContact O-N 3.07Å; F292-Y296 AromaticContact CE1-CD2 3.99Å; F292-Y296 HydrophobicContact CE1-CD2 3.99Å; F292-Y296 HydrophobicContact CE1-CG 4.46Å; F292-Y296 HydrophobicContact CZ-CD2 4.16Å; F292-Y296 WeakPolarHBondContact O-CB 3.46Å; F292-Y296 PolarHBondContact O-N 3.22Å
293	R	96.9	Very high	93.6	Very high	156 Å²	156	71.8 Å²	71.8	59%	0.589	36%	0.36	S	S	*	.	H	α-helix	trans	-69.8	-33.1	177.8	-68.4	169.9	-168	-169.3	9	113	D289 R290 E291 A297	D289-R293 VanDerWaalsContact CG-CZ 3.42Å; D289-R293 VanDerWaalsContact CG-NE 3.27Å; D289-R293 VanDerWaalsContact O-CG 3.26Å; D289-R293 WeakPolarHBondContact O-CG 3.25Å; D289-R293 PolarHBondContact O-N 3.35Å; D289-R293 IonicContact OD1-CZ 3.56Å; D289-R293 IonicContact OD1-NE 3.18Å; D289-R293 PolarHBondContact OD1-NE 3.32Å; D289-R293 IonicContact OD1-NH2 2.73Å; D289-R293 PolarHBondContact OD1-NH2 3.35Å; D289-R293 IonicContact OD2-CZ 3.5Å; D289-R293 IonicContact OD2-NE 3.35Å; D289-R293 PolarHBondContact OD2-NE 3.1Å; D289-R293 IonicContact OD2-NH1 3.52Å; D289-R293 IonicContact OD2-NH2 2.75Å; D289-R293 PolarHBondContact OD2-NH2 3.46Å; R290-R293 PolarHBondContact O-N 2.83Å; E291-R293 PolarHBondContact O-N 3.1Å; R293-A297 WeakPolarHBondContact O-CB 3.41Å; R293-A297 PolarHBondContact O-N 2.91Å; R293-A297 VanDerWaalsContact O-N 3.1Å
294	C	96.4	Very high	93.3	Very high	38 Å²	38	70 Å²	70	26%	0.257	35%	0.349	S	S	.	.	H	α-helix	trans	-61.9	-57.9	169.8	-62	0	0	0	0	110.2	R290 E291 Y296 A297 D298	R290-C294 PolarHBondContact O-N 2.94Å; R290-C294 VanDerWaalsContact O-N 3.09Å; R290-C294 PolarHBondContact O-SG 3.48Å; E291-C294 WeakPolarHBondContact O-CB 3.41Å; E291-C294 PolarHBondContact O-N 2.93Å; E291-C294 VanDerWaalsContact O-N 3.12Å; C294-Y296 PolarHBondContact O-N 3.44Å; C294-A297 WeakPolarHBondContact O-CB 3.35Å; C294-A297 PolarHBondContact O-N 2.79Å; C294-D298 PolarHBondContact O-N 2.81Å; C294-D298 VanDerWaalsContact O-N 3.13Å
295	L	96.9	Very high	93	Very high	20 Å²	20	68.6 Å²	68.6	11%	0.105	34%	0.341	C	S	.	.	H	α-helix	trans	-57.2	-37.3	179.1	-66.1	170.5	0	0	0	112.1	V171 L198 V229 F250 E291 F292 S299	V171-L295 HydrophobicContact CG1-CD1 4.05Å; V171-L295 HydrophobicContact CG2-CD1 4.04Å; L198-L295 HydrophobicContact CD1-CB 3.55Å; V229-L295 HydrophobicContact CG2-CD2 4.18Å; F250-L295 HydrophobicContact CE1-CD1 4.32Å; F250-L295 HydrophobicContact CZ-CD1 4.32Å; E291-L295 WeakPolarHBondContact O-CG 3.4Å; E291-L295 PolarHBondContact O-N 2.79Å; F292-L295 PolarHBondContact O-N 3.07Å; L295-S299 WeakPolarHBondContact O-CB 3.33Å; L295-S299 PolarHBondContact O-N 2.79Å
296	Y	96.8	Very high	92.2	Very high	67 Å²	67	71 Å²	71	26%	0.263	35%	0.354	S	S	.	.	H	α-helix	trans	-67.6	-37.8	176.8	-168.2	-84.8	0	0	0	112.3	Y196 L198 R227 F292 C294 S299	Y196-Y296 AromaticContact CD1-CE2 3.73Å; Y196-Y296 HydrophobicContact CD1-CE2 3.73Å; Y196-Y296 HydrophobicContact CE1-CE2 4.42Å; L198-Y296 HydrophobicContact CD2-CD2 3.88Å; R227-Y296 HydrophobicContact CG-CE2 4.5Å; F292-Y296 AromaticContact CE1-CD2 3.99Å; F292-Y296 HydrophobicContact CE1-CD2 3.99Å; F292-Y296 HydrophobicContact CE1-CG 4.46Å; F292-Y296 HydrophobicContact CZ-CD2 4.16Å; F292-Y296 WeakPolarHBondContact O-CB 3.46Å; F292-Y296 PolarHBondContact O-N 3.22Å; C294-Y296 PolarHBondContact O-N 3.44Å; Y296-S299 PolarHBondContact O-N 3.35Å; Y296-S299 PolarHBondContact O-OG 3.46Å
297	A	95.3	Very high	90.9	Very high	77 Å²	77	67.9 Å²	67.9	64%	0.636	34%	0.34	S	S	*	.	H	α-helix	trans	-66.7	-38.8	176.9	0	0	0	0	0	112.5	R293 C294	R293-A297 WeakPolarHBondContact O-CB 3.41Å; R293-A297 PolarHBondContact O-N 2.91Å; R293-A297 VanDerWaalsContact O-N 3.1Å; C294-A297 WeakPolarHBondContact O-CB 3.35Å; C294-A297 PolarHBondContact O-N 2.79Å
298	D	93.8	Very high	89.1	Confident	132 Å²	132	72.6 Å²	72.6	71%	0.706	35%	0.354	S	S	*	.	H	α-helix	trans	-82.8	-16.7	178.2	-66.3	-33.8	0	0	0	113.4	C294	C294-D298 PolarHBondContact O-N 2.81Å; C294-D298 VanDerWaalsContact O-N 3.13Å
299	S	96.6	Very high	86.9	Confident	5 Å²	5	77.6 Å²	77.6	4%	0.035	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-69.9	150.9	179.5	71	0	0	0	0	113.9	R227 S228 L295 Y296	R227-S299 WeakPolarHBondContact CD-OG 3.47Å; R227-S299 PolarHBondContact NE-OG 2.87Å; R227-S299 PolarHBondContact NH2-O 2.87Å; S228-S299 CarbonylContact O-C 3.49Å; S228-S299 WeakPolarHBondContact O-CA 3.36Å; S228-S299 VanDerWaalsContact O-CB 3.28Å; S228-S299 WeakPolarHBondContact O-CB 3.45Å; L295-S299 WeakPolarHBondContact O-CB 3.33Å; L295-S299 PolarHBondContact O-N 2.79Å; Y296-S299 PolarHBondContact O-N 3.35Å; Y296-S299 PolarHBondContact O-OG 3.46Å
300	Q	95.4	Very high	84.4	Confident	110 Å²	110	85.7 Å²	85.7	51%	0.514	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	150.2	179.4	-67.6	171	80.9	0	0	111.9	R227 S228	R227-Q300 VanDerWaalsContact CA-O 3.31Å; R227-Q300 WeakPolarHBondContact CA-O 3.27Å; R227-Q300 WeakPolarHBondContact CB-O 3.22Å; S228-Q300 PolarHBondContact N-O 2.89Å; S228-Q300 PolarHBondContact O-N 2.97Å
301	I	93.3	Very high	82	Confident	90 Å²	90	87.3 Å²	87.3	46%	0.462	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	142.1	170.2	-63.3	172.9	0	0	0	108.6	R227 N306	R227-I301 VanDerWaalsContact NH1-CG1 3.3Å; I301-N306 HydrophobicContact CG2-CB 3.89Å
302	I	91	Very high	78.9	Confident	18 Å²	18	90.1 Å²	90.1	9%	0.092	45%	0.449	C	S	.	.			trans	-101.4	106.1	171.2	-58.7	156.5	0	0	0	106.7	L204 V226 R304 F305 N306	L204-I302 HydrophobicContact CD1-CD1 3.56Å; L204-I302 HydrophobicContact CD1-CG1 4.42Å; L204-I302 HydrophobicContact CD2-CD1 4.01Å; L204-I302 HydrophobicContact CD2-CG1 3.95Å; L204-I302 HydrophobicContact CD2-CG2 4.41Å; L204-I302 HydrophobicContact CG-CD1 4.44Å; V226-I302 HydrophobicContact CB-CD1 4.4Å; V226-I302 HydrophobicContact CG1-CD1 3.87Å; I302-R304 PolarHBondContact O-N 3.38Å; I302-F305 HydrophobicContact CB-CD2 4.05Å; I302-F305 HydrophobicContact CD1-CD2 4.28Å; I302-F305 HydrophobicContact CG2-CD2 3.64Å; I302-F305 HydrophobicContact CG2-CE2 4.12Å; I302-F305 PolarHBondContact O-N 3.07Å; I302-N306 PolarHBondContact O-N 3.06Å
303	D	81.8	Confident	75.9	Confident	141 Å²	141	94 Å²	94	75%	0.754	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-46.4	-44.3	-171.1	-55.5	-32.5	0	0	0	113	F305 N306	D303-F305 PolarHBondContact O-N 2.98Å; D303-N306 WeakPolarHBondContact O-CB 3.49Å; D303-N306 PolarHBondContact O-N 3.2Å; D303-N306 VanDerWaalsContact O-N 3.09Å
304	R	78.6	Confident	72.8	Confident	90 Å²	90	97.4 Å²	97.4	34%	0.34	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-54.4	-36.5	178.5	-178.4	179.2	174.9	-153.2	-6.4	113.5	T208 C211 V212 N218 I302	T208-R304 PolarHBondContact O-NH1 2.9Å; C211-R304 VanDerWaalsContact C-NH2 3.33Å; C211-R304 PolarHBondContact O-NH2 3.21Å; V212-R304 VanDerWaalsContact CG2-NH1 3.33Å; N218-R304 VanDerWaalsContact CG-O 3.31Å; N218-R304 PolarHBondContact ND2-O 2.91Å; N218-R304 PolarHBondContact OD1-O 2.78Å; I302-R304 PolarHBondContact O-N 3.38Å
305	F	82	Confident	70	Confident	11 Å²	11	104.6 Å²	104.6	5%	0.048	51%	0.513	C	S	.	.	G	3₁₀ helix	trans	-102.9	5.7	-177	-56.3	-56.6	0	0	0	113	F207 C211 L221 V226 I302 D303	F207-F305 AromaticContact CD1-CE2 3.94Å; F207-F305 HydrophobicContact CD1-CE2 3.94Å; F207-F305 HydrophobicContact CD1-CZ 4.14Å; F207-F305 HydrophobicContact CE1-CD2 4.39Å; F207-F305 AromaticContact CE1-CE2 3.66Å; F207-F305 HydrophobicContact CE1-CE2 3.66Å; F207-F305 AromaticContact CE1-CZ 3.73Å; F207-F305 HydrophobicContact CE1-CZ 3.73Å; C211-F305 HydrophobicContact CB-CE1 3.99Å; C211-F305 HydrophobicContact CB-CZ 3.85Å; L221-F305 HydrophobicContact CD1-CD1 3.59Å; L221-F305 HydrophobicContact CD1-CE1 4.05Å; L221-F305 HydrophobicContact CD1-CG 4.44Å; V226-F305 HydrophobicContact CB-CB 4.47Å; V226-F305 HydrophobicContact CB-CD2 4.23Å; V226-F305 HydrophobicContact CG1-CD2 4.46Å; I302-F305 HydrophobicContact CB-CD2 4.05Å; I302-F305 HydrophobicContact CD1-CD2 4.28Å; I302-F305 HydrophobicContact CG2-CD2 3.64Å; I302-F305 HydrophobicContact CG2-CE2 4.12Å; I302-F305 PolarHBondContact O-N 3.07Å; D303-F305 PolarHBondContact O-N 2.98Å
306	N	75.1	Confident	67.1	Low	58 Å²	58	108.8 Å²	108.8	31%	0.31	54%	0.541	S	S	.	.	S	Bend	trans	-73.5	129.2	166.9	-168	60.5	0	0	0	108.5	N218 I301 I302 D303 E308	N218-N306 PolarHBondContact ND2-O 3.07Å; I301-N306 HydrophobicContact CG2-CB 3.89Å; I302-N306 PolarHBondContact O-N 3.06Å; D303-N306 WeakPolarHBondContact O-CB 3.49Å; D303-N306 PolarHBondContact O-N 3.2Å; D303-N306 VanDerWaalsContact O-N 3.09Å; N306-E308 PolarHBondContact O-N 2.83Å
307	P	63.5	Low	64	Low	41 Å²	41	110.7 Å²	110.7	27%	0.266	57%	0.565	S	S	.	*			trans	-67.2	105	159.9	28.6	-29.8	0	0	0	107.1
308	E	55.8	Low	61.1	Low	167 Å²	167	117.8 Å²	117.8	78%	0.78	58%	0.576	S	S	*	*			trans	-62.8	131.9	162.7	-63.2	-171	142.9	0	0	107.9	N306 E310	N306-E308 PolarHBondContact O-N 2.83Å; E308-E310 PolarHBondContact O-N 2.77Å; E308-E310 VanDerWaalsContact O-N 3.13Å
309	D	48.9	Very low	58.2	Low	149 Å²	149	120.2 Å²	120.2	80%	0.797	58%	0.583	S	S	*	*			trans	-66.9	111.1	178.9	-67.7	-65.1	0	0	0	109.7	E311	D309-E311 PolarHBondContact O-N 2.76Å
310	E	44.5	Very low	55.2	Low	197 Å²	197	126.3 Å²	126.3	92%	0.921	62%	0.621	S	S	*	*	S	Bend	trans	-61.4	100.4	168.9	-77.8	-170.9	127.4	0	0	109.7	E308 M312	E308-E310 PolarHBondContact O-N 2.77Å; E308-E310 VanDerWaalsContact O-N 3.13Å; E310-M312 PolarHBondContact O-N 3.13Å
311	E	44.8	Very low	52.4	Low	186 Å²	186	131 Å²	131	87%	0.869	64%	0.64	S	S	*	*			trans	40.9	68	168.4	-61.6	-164	127	0	0	116.1	D309 P313	D309-E311 PolarHBondContact O-N 2.76Å; E311-P313 WeakPolarHBondContact O-CD 3.44Å
312	M	31.5	Very low	49.9	Very low	126 Å²	126	135.7 Å²	135.7	62%	0.621	66%	0.66	S	S	*	*			trans	-77.3	101.9	149.5	-125.5	-88.3	72.8	0	0	107.4	E310 Y314 Y315	E310-M312 PolarHBondContact O-N 3.13Å; M312-Y314 PolarHBondContact O-N 2.63Å; M312-Y315 HydrophobicContact CE-CD2 4.1Å; M312-Y315 HydrophobicContact CE-CE2 4.15Å; M312-Y315 HydrophobicContact SD-CD2 4.4Å
313	P	35.3	Very low	47.3	Very low	95 Å²	95	139 Å²	139	62%	0.617	69%	0.689	S	S	*	*			trans	-57.5	135.4	178.1	23.1	-35.5	0	0	0	111.1	E311 Y315	E311-P313 WeakPolarHBondContact O-CD 3.44Å; P313-Y315 PolarHBondContact O-N 2.89Å
314	Y	32.3	Very low	45.2	Very low	227 Å²	227	138.5 Å²	138.5	89%	0.89	69%	0.694	S	S	*	*			trans	-41.6	108.5	179.5	-97.6	-110.3	0	0	0	111.9	M312 P316	M312-Y314 PolarHBondContact O-N 2.63Å; Y314-P316 VanDerWaalsContact O-CD 3.24Å; Y314-P316 WeakPolarHBondContact O-CD 3.27Å
315	Y	36.4	Very low	43.1	Very low	189 Å²	189	140.6 Å²	140.6	74%	0.741	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-68.3	117.2	159.6	-103	-87.6	0	0	0	107.7	M312 P313 S317	M312-Y315 HydrophobicContact CE-CD2 4.1Å; M312-Y315 HydrophobicContact CE-CE2 4.15Å; M312-Y315 HydrophobicContact SD-CD2 4.4Å; P313-Y315 PolarHBondContact O-N 2.89Å; Y315-S317 PolarHBondContact O-N 2.8Å
316	P	36	Very low	40.9	Very low	109 Å²	109	148.3 Å²	148.3	71%	0.708	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-63	134.9	174.6	-18.9	33.1	0	0	0	109	Y314 Y318	Y314-P316 VanDerWaalsContact O-CD 3.24Å; Y314-P316 WeakPolarHBondContact O-CD 3.27Å; P316-Y318 PolarHBondContact O-N 3.33Å
317	S	32.3	Very low	38.9	Very low	107 Å²	107	148.5 Å²	148.5	75%	0.748	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-59.2	137.6	171.6	45.4	0	0	0	0	109.8	Y315 Q319	Y315-S317 PolarHBondContact O-N 2.8Å; S317-Q319 PolarHBondContact O-N 3.33Å
318	Y	33.9	Very low	37.4	Very low	226 Å²	226	155.3 Å²	155.3	89%	0.886	81%	0.806	S	S	*	*			trans	-55.3	105.3	-176	-74.5	-92	0	0	0	111.2	P316 T320	P316-Y318 PolarHBondContact O-N 3.33Å; Y318-T320 PolarHBondContact O-N 3.41Å
319	Q	33.6	Very low	36.2	Very low	182 Å²	182	150.1 Å²	150.1	85%	0.85	80%	0.796	S	S	*	*			trans	-71.5	110.5	169.4	-70.7	-173.2	-9.9	0	0	108.7	S317 F321	S317-Q319 PolarHBondContact O-N 3.33Å; Q319-F321 PolarHBondContact O-N 3.41Å
320	T	33.3	Very low	35.4	Very low	133 Å²	133	151.8 Å²	151.8	82%	0.816	81%	0.805	S	S	*	*			trans	-55.7	122.8	171.7	-58.1	0	0	0	0	109.6	Y318 Q322	Y318-T320 PolarHBondContact O-N 3.41Å; T320-Q322 PolarHBondContact O-N 3.42Å; T320-Q322 VanDerWaalsContact O-N 3.09Å
321	F	36.7	Very low	34.7	Very low	209 Å²	209	146.6 Å²	146.6	92%	0.917	80%	0.803	S	S	*	*			trans	-49.9	113.8	-178.4	-74	-95.9	0	0	0	112.4	Q319	Q319-F321 PolarHBondContact O-N 3.41Å
322	Q	41.2	Very low	34.2	Very low	188 Å²	188	141.1 Å²	141.1	88%	0.879	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-83.5	136.6	156.8	-74.5	-171.1	-23	0	0	109.2	T320	T320-Q322 PolarHBondContact O-N 3.42Å; T320-Q322 VanDerWaalsContact O-N 3.09Å
323	A	36.5	Very low	35.2	Very low	87 Å²	87	141 Å²	141	72%	0.719	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-69.3	149.4	178	0	0	0	0	0	111.2	V325	A323-V325 PolarHBondContact O-N 3.14Å
324	P	36	Very low	35.1	Very low	131 Å²	131	144.4 Å²	144.4	85%	0.851	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-69.9	131.3	-174.5	28.1	-35.1	0	0	0	112.4
325	V	35.7	Very low	35.1	Very low	135 Å²	135	137 Å²	137	82%	0.818	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-91.2	133.5	168.6	176.3	0	0	0	0	109.2	A323	A323-V325 PolarHBondContact O-N 3.14Å
326	I	35.6	Very low	35	Very low	172 Å²	172	136.3 Å²	136.3	88%	0.882	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-72.4	127.3	175.3	-61.7	173.3	0	0	0	108.7
327	G	32.1	Very low	34.7	Very low	62 Å²	62	138.2 Å²	138.2	64%	0.639	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-96.8	155.5	-161.3	0	0	0	0	0	117.3
328	L	33.2	Very low	34.7	Very low	185 Å²	185	141.5 Å²	141.5	97%	0.969	83%	0.831	S	S	*	*			trans	-168	138.7	161.2	-130.9	71.3	0	0	0	105.2
329	G	29.7	Very low	34.7	Very low	57 Å²	57	139.2 Å²	139.2	59%	0.588	83%	0.828	S	S	*	*			cis	175.1	170.9	-6.8	0	0	0	0	0	109.6
330	L	32.4	Very low	34.5	Very low	185 Å²	185	135.8 Å²	135.8	97%	0.969	83%	0.825	S	S	*	*			trans	68.2	138.4	175.4	-65.9	79.1	0	0	0	118.8
331	G	30.2	Very low	34.3	Very low	87 Å²	87	136.6 Å²	136.6	90%	0.897	82%	0.824	S	S	*	*			trans	108.9	121.9	144.1	0	0	0	0	0	118.6
332	G	33.5	Very low	34.1	Very low	72 Å²	72	137.9 Å²	137.9	74%	0.742	82%	0.823	S	S	*	*			trans	-159.9	-168.5	160.7	0	0	0	0	0	108.5
333	P	52.3	Low	33.5	Very low	122 Å²	122	137.2 Å²	137.2	79%	0.792	82%	0.819	S	S	*	*			cis	-123.8	-136	-8.1	41.6	-24.5	0	0	0	110.8
334	L	34.9	Very low	33.3	Very low	167 Å²	167	144.9 Å²	144.9	87%	0.874	83%	0.83	S	S	*	*			trans	79.3	137.4	-178.2	-48.3	173.8	0	0	0	114.8
335	G	31.1	Very low	32.9	Very low	71 Å²	71	144.5 Å²	144.5	73%	0.732	82%	0.821	S	S	*	*			cis	121.7	97	-15	0	0	0	0	0	115.7
336	L	34.6	Very low	33.2	Very low	176 Å²	176	150.1 Å²	150.1	92%	0.921	83%	0.827	S	S	*	*			trans	-163	139.7	158.9	-154.8	73.4	0	0	0	111.8
337	D	30.8	Very low	32.8	Very low	148 Å²	148	147.2 Å²	147.2	79%	0.791	82%	0.822	S	S	*	*			trans	-89.9	153.1	168.6	-65.5	-69	0	0	0	112
338	L	32	Very low	32.6	Very low	177 Å²	177	150.2 Å²	150.2	93%	0.927	83%	0.832	S	S	*	*			trans	-154.4	143.1	144.7	-156.1	61.6	0	0	0	112.4
339	H	33.6	Very low	32.5	Very low	178 Å²	178	147.1 Å²	147.1	82%	0.824	83%	0.826	S	S	*	*			trans	-107.7	169.8	-179.4	-109.7	-97.4	0	0	0	112.2
340	S	30.2	Very low	32.6	Very low	110 Å²	110	152.6 Å²	152.6	77%	0.769	84%	0.836	S	S	*	*			trans	72.4	153.2	178.2	-83.4	0	0	0	0	116.5
341	D	27.2	Very low	32.4	Very low	149 Å²	149	150.9 Å²	150.9	80%	0.797	83%	0.828	S	S	*	*			cis	-139.5	170.4	8	-146.1	-22	0	0	0	114
342	R	33.6	Very low	32.4	Very low	237 Å²	237	152.4 Å²	152.4	89%	0.894	83%	0.825	S	S	*	*			trans	-92.7	97.1	-178.8	-67.4	175.6	73.2	168.1	4.7	112.8
343	Q	28.6	Very low	32.2	Very low	174 Å²	174	154.7 Å²	154.7	81%	0.813	83%	0.83	S	S	*	*			trans	-140.1	128.7	148.2	-110.4	-177.9	-97.2	0	0	110.2
344	R	32.5	Very low	31.2	Very low	247 Å²	247	154.3 Å²	154.3	93%	0.932	83%	0.83	S	S	*	*			trans	-137.8	106.5	168.6	-170.3	-174.4	-67.6	-174	0.9	108.6
345	D	28.2	Very low	31.4	Very low	124 Å²	124	155.5 Å²	155.5	66%	0.663	83%	0.831	S	S	*	*			trans	-66.6	161.1	176.8	-79	-70.9	0	0	0	112.9	S347	D345-S347 PolarHBondContact O-N 2.86Å
346	R	40	Very low	31.4	Very low	252 Å²	252	157.2 Å²	157.2	95%	0.951	83%	0.832	S	S	*	*			trans	-68.2	100.5	172.5	-80.1	-180	162.3	130.5	-6.7	110.3
347	S	27.7	Very low	31.6	Very low	112 Å²	112	153.9 Å²	153.9	78%	0.783	82%	0.823	S	S	*	*			trans	-107.1	102.4	168	-58.5	0	0	0	0	110.2	D345 S349	D345-S347 PolarHBondContact O-N 2.86Å; S347-S349 PolarHBondContact O-N 3.44Å
348	C	29	Very low	31.6	Very low	124 Å²	124	154.3 Å²	154.3	84%	0.838	83%	0.826	S	S	*	*			trans	-67.2	124	166.9	-60.4	0	0	0	0	108.7	E350	C348-E350 PolarHBondContact O-N 2.89Å
349	S	29.5	Very low	31.6	Very low	121 Å²	121	151.6 Å²	151.6	85%	0.846	82%	0.821	S	S	*	*			trans	-70.7	110.9	179.4	53.3	0	0	0	0	111.2	S347	S347-S349 PolarHBondContact O-N 3.44Å
350	E	31.9	Very low	31.7	Very low	171 Å²	171	149.5 Å²	149.5	80%	0.799	82%	0.821	S	S	*	*			trans	-69.2	160	165.7	-62.4	-170.6	116.8	0	0	111.3	C348	C348-E350 PolarHBondContact O-N 2.89Å
351	N	30	Very low	31.9	Very low	149 Å²	149	149.2 Å²	149.2	80%	0.797	82%	0.818	S	S	*	*			trans	61.1	109.6	169.5	89	101.8	0	0	0	119.2
352	S	28.2	Very low	32.2	Very low	119 Å²	119	147.6 Å²	147.6	83%	0.832	82%	0.819	S	S	*	*			trans	-162.1	71.7	144.6	-84.8	0	0	0	0	109.8	S354	S352-S354 PolarHBondContact O-N 3.27Å
353	S	30.5	Very low	32.3	Very low	121 Å²	121	141.9 Å²	141.9	85%	0.846	81%	0.81	S	S	*	*			trans	-86.9	85.7	179.4	57.2	0	0	0	0	111.6
354	S	30.9	Very low	32.8	Very low	114 Å²	114	143.3 Å²	143.3	80%	0.797	81%	0.814	S	S	*	*			trans	-92.6	132.6	170.2	-68.9	0	0	0	0	110.9	S352	S352-S354 PolarHBondContact O-N 3.27Å
355	Q	39.8	Very low	33.2	Very low	191 Å²	191	137.6 Å²	137.6	89%	0.893	81%	0.806	S	S	*	*			trans	-80.4	133.2	-177.7	-62.1	177.6	1.2	0	0	111.7
356	S	31.3	Very low	33.4	Very low	108 Å²	108	135.6 Å²	135.6	76%	0.755	81%	0.807	S	S	*	*			trans	-138.9	90.1	165.6	52.2	0	0	0	0	111	N358	S356-N358 PolarHBondContact O-N 3.46Å
357	S	39	Very low	33.2	Very low	106 Å²	106	130.1 Å²	130.1	74%	0.741	80%	0.804	S	S	*	*			trans	-74	110.5	-179.3	-58.5	0	0	0	0	111.8
358	N	29.8	Very low	33.9	Very low	157 Å²	157	128.4 Å²	128.4	84%	0.84	80%	0.804	S	S	*	*			trans	-136.4	64.6	170.2	-91.9	-39.9	0	0	0	111.7	S356 V360	S356-N358 PolarHBondContact O-N 3.46Å; N358-V360 PolarHBondContact O-N 2.89Å
359	S	32.3	Very low	34.2	Very low	119 Å²	119	131.5 Å²	131.5	83%	0.832	81%	0.808	S	S	*	*			trans	-79.4	103.5	174.4	-56.7	0	0	0	0	111.2	S361	S359-S361 PolarHBondContact O-N 2.98Å
360	V	34.9	Very low	34.6	Very low	135 Å²	135	131.6 Å²	131.6	82%	0.818	80%	0.804	S	S	*	*			trans	-65.4	121.5	169.7	-74	0	0	0	0	110.7	N358 S362	N358-V360 PolarHBondContact O-N 2.89Å; V360-S362 PolarHBondContact O-N 2.81Å
361	S	34.5	Very low	34.5	Very low	103 Å²	103	129.9 Å²	129.9	72%	0.72	80%	0.8	S	S	*	*			trans	-86.2	99.9	-175.4	46	0	0	0	0	111.7	S359 V363	S359-S361 PolarHBondContact O-N 2.98Å; S361-V363 VanDerWaalsContact C-N 3.28Å; S361-V363 PolarHBondContact O-N 3.4Å
362	S	33.3	Very low	34.6	Very low	116 Å²	116	129.5 Å²	129.5	81%	0.811	80%	0.798	S	S	*	*			trans	-69.4	76.2	176.3	-58	0	0	0	0	112.8	V360 K364	V360-S362 PolarHBondContact O-N 2.81Å; S362-K364 PolarHBondContact O-N 3.38Å
363	V	36.4	Very low	34.6	Very low	117 Å²	117	129.6 Å²	129.6	71%	0.709	79%	0.794	S	S	*	*			trans	-71.1	98.3	177.7	-178.7	0	0	0	0	110.5	S361 V365	S361-V363 VanDerWaalsContact C-N 3.28Å; S361-V363 PolarHBondContact O-N 3.4Å; V363-V365 HydrophobicContact CG1-CG2 4.07Å; V363-V365 PolarHBondContact O-N 3.48Å
364	K	38.3	Very low	34.6	Very low	204 Å²	204	134.8 Å²	134.8	89%	0.887	80%	0.796	S	S	*	*			trans	-86.2	96.3	174.7	-172.3	170.4	-176.6	169.5	0	110.7	S362	S362-K364 PolarHBondContact O-N 3.38Å
365	V	40.9	Very low	34.7	Very low	126 Å²	126	139 Å²	139	76%	0.764	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-70.6	140.9	179.6	-179	0	0	0	0	111.4	V363	V363-V365 HydrophobicContact CG1-CG2 4.07Å; V363-V365 PolarHBondContact O-N 3.48Å
366	A	32.3	Very low	34	Very low	82 Å²	82	136.2 Å²	136.2	68%	0.678	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-93.2	151.7	173.1	0	0	0	0	0	111.1
367	P	36.8	Very low	34	Very low	137 Å²	137	136.4 Å²	136.4	89%	0.89	79%	0.792	S	S	*	*	S	Bend	trans	-74.6	138.3	-169.5	29.5	-35.5	0	0	0	113.5
368	G	41.9	Very low	33.6	Very low	76 Å²	76	139.7 Å²	139.7	78%	0.784	80%	0.796	S	S	*	*			trans	111.2	60.1	158.8	0	0	0	0	0	117.9
369	M	34.8	Very low	33.5	Very low	190 Å²	190	135.2 Å²	135.2	94%	0.936	79%	0.787	S	S	*	*			trans	-142	151.7	155.5	-81.7	-178.2	71.5	0	0	109.8
370	T	39.3	Very low	33.4	Very low	122 Å²	122	138.9 Å²	138.9	75%	0.748	79%	0.791	S	S	*	*			trans	-119.3	161.4	-170.8	54.8	0	0	0	0	113.6
371	N	30.1	Very low	33.1	Very low	136 Å²	136	139.2 Å²	139.2	73%	0.727	79%	0.788	S	S	*	*			trans	107.7	100.4	160.6	-56.3	-15.2	0	0	0	118.3
372	N	32.1	Very low	33.2	Very low	140 Å²	140	144.2 Å²	144.2	75%	0.749	80%	0.797	S	S	*	*				55.6	115.5	118.9	-62.6	-1.4	0	0	0	122.8
373	V	27.2	Very low	33.1	Very low	122 Å²	122	146.7 Å²	146.7	74%	0.739	79%	0.793	S	S	*	*				69.7	110.7	127.2	-176.6	0	0	0	0	119.9
374	Y	29.9	Very low	33	Very low	230 Å²	230	148.1 Å²	148.1	90%	0.902	79%	0.792	S	S	*	*			trans	-136.3	149.3	131.3	-21.4	-80.5	0	0	0	108.8
375	K	32.8	Very low	33.5	Very low	202 Å²	202	143.4 Å²	143.4	88%	0.878	78%	0.782	S	S	*	*			trans	-153.1	111.3	176.8	-169	-174.8	-175.9	-174.7	0	111.3
376	V	26	Very low	33	Very low	132 Å²	132	144.2 Å²	144.2	80%	0.8	79%	0.787	S	S	*	*			trans	-153.5	132.7	-179.3	173.9	0	0	0	0	107.7
377	T	32.3	Very low	32.9	Very low	112 Å²	112	143.4 Å²	143.4	69%	0.687	79%	0.787	S	S	*	*			cis	-132.6	-135	-23.4	30.5	0	0	0	0	104.7
378	Q	30	Very low	32.5	Very low	176 Å²	176	142.1 Å²	142.1	82%	0.822	78%	0.781	S	S	*	*			cis	-155.8	157.3	-22.3	-147.1	145.6	-52.6	0	0	106.1
379	G	27.3	Very low	31.9	Very low	63 Å²	63	143.8 Å²	143.8	65%	0.649	78%	0.781	S	S	*	*			cis	160.8	158.4	-10.9	0	0	0	0	0	110.3
380	H	30.5	Very low	31.6	Very low	195 Å²	195	141.7 Å²	141.7	90%	0.903	77%	0.772	S	S	*	*			trans	-163.4	141.2	155.4	-141.2	-75.4	0	0	0	111.5
381	D	28.8	Very low	31	Very low	143 Å²	143	144.3 Å²	144.3	77%	0.765	78%	0.776	S	S	*	*			trans	-83.9	143.1	-178.4	-88.1	-81.6	0	0	0	114.4
382	K	35.8	Very low	30.9	Very low	208 Å²	208	143.2 Å²	143.2	90%	0.904	78%	0.779	S	S	*	*			trans	-164.3	123.1	132.7	-108.7	166.3	-174.1	178	0	114
383	K	31.8	Very low	31.4	Very low	167 Å²	167	142.3 Å²	142.3	73%	0.726	78%	0.781	S	S	*	*			trans	-47	158.3	164.3	-92.5	-175.1	170.7	-115.6	0	114.9
384	E	33.9	Very low	31.5	Very low	147 Å²	147	142.8 Å²	142.8	69%	0.687	78%	0.775	S	S	*	*			cis	-160.3	-157.9	-9.9	-137.4	174.2	176.5	0	0	109.8
385	P	48.8	Very low	31.5	Very low	106 Å²	106	141 Å²	141	69%	0.688	77%	0.766	S	S	*	*			trans	-119.5	-173	-135.7	43.8	-25.7	0	0	0	115.6
386	V	30.3	Very low	31.3	Very low	142 Å²	142	141.9 Å²	141.9	86%	0.861	76%	0.764	S	S	*	*				-177.2	133.1	122.9	144.4	0	0	0	0	112.3
387	G	30.5	Very low	31.4	Very low	66 Å²	66	142.2 Å²	142.2	68%	0.68	77%	0.767	S	S	*	*			trans	72.9	160.5	155.9	0	0	0	0	0	119.3
388	S	28.4	Very low	31.2	Very low	109 Å²	109	140.3 Å²	140.3	76%	0.762	77%	0.769	S	S	*	*			cis	175.7	155.9	-29.5	38.8	0	0	0	0	108.4
389	S	29.3	Very low	31.3	Very low	111 Å²	111	135.5 Å²	135.5	78%	0.776	77%	0.766	S	S	*	*			trans	67.5	159.2	178.2	78.3	0	0	0	0	116.5
390	L	29.2	Very low	31.4	Very low	146 Å²	146	139.7 Å²	139.7	76%	0.764	77%	0.773	S	S	*	*			cis	164	145.9	-44.8	-97.4	165.7	0	0	0	107.6
391	Q	26.9	Very low	31.5	Very low	178 Å²	178	141.3 Å²	141.3	83%	0.832	77%	0.772	S	S	*	*			trans	67.3	115.2	155.3	-69.3	170.2	-7.8	0	0	121
392	S	26.9	Very low	31.7	Very low	112 Å²	112	141.6 Å²	141.6	78%	0.783	78%	0.778	S	S	*	*			trans	-74.9	166.7	140.9	-31.2	0	0	0	0	109.8
393	P	43.8	Very low	31.4	Very low	121 Å²	121	135.1 Å²	135.1	79%	0.786	77%	0.77	S	S	*	*				-155.7	174	71.9	40.8	-19.2	0	0	0	119.2
394	E	28.7	Very low	31.3	Very low	132 Å²	132	130.8 Å²	130.8	62%	0.617	77%	0.773	S	S	*	*			trans	7.2	137.4	155.6	-62.6	-147.4	128.8	0	0	126
395	R	29.3	Very low	32	Very low	192 Å²	192	130.1 Å²	130.1	73%	0.725	78%	0.781	S	S	*	*			trans	61.4	145.9	135.5	-59.8	168.1	178	156	-2.4	118.1
396	R	28.9	Very low	31.2	Very low	221 Å²	221	130.3 Å²	130.3	83%	0.834	79%	0.785	S	S	*	*			cis	-178.4	178.9	40.5	-151.9	-178.5	-144.9	162.2	6.4	111.3
397	V	27.9	Very low	32.3	Very low	140 Å²	140	129.6 Å²	129.6	85%	0.848	78%	0.783	S	S	*	*			trans	78.8	139.7	165.7	-167.2	0	0	0	0	116.5
398	G	29.1	Very low	32.3	Very low	72 Å²	72	129.9 Å²	129.9	74%	0.742	79%	0.786	S	S	*	*			cis	159.1	154.7	-13.8	0	0	0	0	0	116.3
399	G	30.4	Very low	32.5	Very low	74 Å²	74	131.4 Å²	131.4	76%	0.763	79%	0.791	S	S	*	*			trans	99.1	153.4	172	0	0	0	0	0	115.9
400	L	30.5	Very low	32.5	Very low	151 Å²	151	138 Å²	138	79%	0.791	80%	0.799	S	S	*	*			cis	-162.4	135.2	-3.1	-100.7	151	0	0	0	110.6
401	R	33	Very low	32.4	Very low	230 Å²	230	134.4 Å²	134.4	87%	0.868	80%	0.797	S	S	*	*			trans	48.6	141.3	147.8	-67.9	176.1	-175	-171.1	0.3	120.1
402	V	32.7	Very low	32.7	Very low	149 Å²	149	131.6 Å²	131.6	90%	0.903	80%	0.797	S	S	*	*			cis	-162	174.5	1.4	93	0	0	0	0	107.3
403	G	29.8	Very low	33.7	Very low	71 Å²	71	131.4 Å²	131.4	73%	0.732	79%	0.793	S	S	*	*			cis	-170.1	-99.5	8.4	0	0	0	0	0	114
404	G	29.1	Very low	33.2	Very low	77 Å²	77	133.3 Å²	133.3	79%	0.794	80%	0.796	S	S	*	*			trans	-178.9	-170	-175.3	0	0	0	0	0	113.2
405	P	49.3	Very low	33.3	Very low	132 Å²	132	131.1 Å²	131.1	86%	0.857	81%	0.809	S	S	*	*			cis	-134	-167	28.9	42.1	-24.3	0	0	0	116.9
406	S	32.1	Very low	33.2	Very low	110 Å²	110	126 Å²	126	77%	0.769	82%	0.816	S	S	*	*			trans	-127.4	-151.4	-176.8	-45.7	0	0	0	0	109.6
407	P	52	Low	33.4	Very low	127 Å²	127	122.5 Å²	122.5	83%	0.825	82%	0.82	S	S	*	*			cis	-141.2	-179.5	-15.4	41.1	-22.2	0	0	0	117
408	G	31	Very low	33.5	Very low	72 Å²	72	118.9 Å²	118.9	74%	0.742	81%	0.81	S	S	*	*			trans	100.6	165.7	145.6	0	0	0	0	0	120
409	V	31.6	Very low	33.8	Very low	141 Å²	141	123.6 Å²	123.6	86%	0.855	81%	0.813	S	S	*	*			cis	-157.6	140.6	-16.2	147.5	0	0	0	0	110.7
410	R	30	Very low	33.9	Very low	250 Å²	250	126 Å²	126	94%	0.943	81%	0.808	S	S	*	*			trans	8.4	134	155.3	-174.7	-167.4	-90	-161.6	-5.8	121.4
411	G	28	Very low	33.9	Very low	70 Å²	70	125 Å²	125	72%	0.722	80%	0.803	S	S	*	*			trans	-174.3	146.3	159.7	0	0	0	0	0	118.5
412	S	32.3	Very low	33.9	Very low	119 Å²	119	120.9 Å²	120.9	83%	0.832	80%	0.797	S	S	*	*			trans	-159.4	161.6	169.2	-63.9	0	0	0	0	106.6
413	P	48.6	Very low	33.9	Very low	109 Å²	109	119.3 Å²	119.3	71%	0.708	79%	0.787	S	S	*	*			cis	-152.2	-166.7	34.4	45	-22.7	0	0	0	117.8
414	N	33.4	Very low	33.9	Very low	160 Å²	160	122.7 Å²	122.7	86%	0.856	79%	0.789	S	S	*	*			trans	56.6	125.9	148.2	-68.7	-1	0	0	0	124.9
415	G	29.4	Very low	33.9	Very low	86 Å²	86	128.3 Å²	128.3	89%	0.887	79%	0.786	S	S	*	*				117.1	140.9	122.1	0	0	0	0	0	119.4
416	G	29	Very low	32.9	Very low	84 Å²	84	129.3 Å²	129.3	87%	0.866	78%	0.779	S	S	*	*			trans	141.4	100	159.3	0	0	0	0	0	119
417	T	31.9	Very low	33.1	Very low	149 Å²	149	131.1 Å²	131.1	91%	0.914	78%	0.78	S	S	*	*			trans	-66.7	155.3	175.7	43	0	0	0	0	119.1
418	G	31.1	Very low	32.7	Very low	63 Å²	63	130.9 Å²	130.9	65%	0.649	78%	0.778	S	S	*	*			trans	152.8	118.3	157.3	0	0	0	0	0	113.3
419	H	33.8	Very low	32.7	Very low	172 Å²	172	133 Å²	133	80%	0.796	78%	0.776	S	S	*	*				63.9	137	72.8	-70.2	-64.2	0	0	0	114.2
420	N	32.5	Very low	32.7	Very low	124 Å²	124	137.4 Å²	137.4	66%	0.663	78%	0.779	S	S	*	*			cis	-168	162.8	8.7	-121.4	-3.2	0	0	0	113.7
421	L	31.5	Very low	32.6	Very low	131 Å²	131	128.9 Å²	128.9	69%	0.686	77%	0.77	S	S	*	*			trans	60.4	144.6	162.4	-80.5	78.3	0	0	0	118.6
422	I	33.8	Very low	32.8	Very low	143 Å²	143	134.9 Å²	134.9	73%	0.733	78%	0.779	S	S	*	*			cis	75.6	123.5	44.6	-57.4	170.2	0	0	0	110.6
423	T	32.6	Very low	32.7	Very low	115 Å²	115	134.5 Å²	134.5	71%	0.706	78%	0.776	S	S	*	*				-165.4	147.5	62.3	-22.4	0	0	0	0	114.5
424	D	29.7	Very low	31.8	Very low	143 Å²	143	136 Å²	136	77%	0.765	78%	0.784	S	S	*	*			trans	40.7	149.4	141.4	-100.5	-44.7	0	0	0	129.3
425	R	28.8	Very low	31.5	Very low	194 Å²	194	131.8 Å²	131.8	73%	0.732	78%	0.778	S	S	*	*			trans	89.3	105.2	137.2	-87.1	-175.9	137.2	150.3	0.9	126.5
426	Q	28.4	Very low	31.5	Very low	153 Å²	153	136.5 Å²	136.5	72%	0.715	78%	0.78	S	S	*	*				69.8	143.2	121.8	-74.9	-171.2	-95	0	0	124.2
427	L	36.7	Very low	31.5	Very low	149 Å²	149	139.6 Å²	139.6	78%	0.78	77%	0.773	S	S	*	*			trans	-75.1	167.2	173.8	-85.2	68.3	0	0	0	114.4
428	P	41.7	Very low	31.2	Very low	122 Å²	122	142.2 Å²	142.2	79%	0.792	77%	0.766	S	S	*	*			trans	-120.7	-179	131.8	37.4	-30.6	0	0	0	113.9
429	T	31	Very low	31.1	Very low	115 Å²	115	143.9 Å²	143.9	71%	0.706	76%	0.76	S	S	*	*			trans	-143	172	-172.6	-54.8	0	0	0	0	110.6
430	Y	32.4	Very low	31.1	Very low	234 Å²	234	144.7 Å²	144.7	92%	0.918	76%	0.761	S	S	*	*			trans	80.5	148.9	-173.2	-66.5	-97.2	0	0	0	115.2
431	G	27.9	Very low	31.3	Very low	72 Å²	72	144.8 Å²	144.8	74%	0.742	77%	0.769	S	S	*	*			cis	-159.5	-171.4	3.7	0	0	0	0	0	114
432	Q	32.6	Very low	31.1	Very low	196 Å²	196	143.9 Å²	143.9	92%	0.916	77%	0.773	S	S	*	*			trans	-87.5	158.4	-167.3	-60.8	174.2	-29.9	0	0	116
433	S	30.3	Very low	31	Very low	110 Å²	110	142.8 Å²	142.8	77%	0.769	78%	0.778	S	S	*	*				175.9	146.4	119	37.5	0	0	0	0	114
434	T	28.8	Very low	30.9	Very low	142 Å²	142	141.8 Å²	141.8	87%	0.871	78%	0.781	S	S	*	*			trans	34.7	135.6	156.3	54.6	0	0	0	0	121.3
435	G	27.1	Very low	31	Very low	70 Å²	70	143.6 Å²	143.6	72%	0.722	79%	0.785	S	S	*	*			cis	127.4	125.7	3.7	0	0	0	0	0	112.6
436	I	30.5	Very low	31.1	Very low	185 Å²	185	142.8 Å²	142.8	95%	0.949	80%	0.795	S	S	*	*			trans	-174.2	165.1	167.3	-103.3	153.2	0	0	0	110.5
437	E	28.9	Very low	31.5	Very low	150 Å²	150	142.8 Å²	142.8	70%	0.701	80%	0.799	S	S	*	*			trans	-127.9	153.7	-166.2	179.5	-168.5	-134.1	0	0	112.2
438	W	25.9	Very low	31.2	Very low	203 Å²	203	147 Å²	147	77%	0.769	80%	0.804	S	S	*	*			trans	154.6	115.8	135.6	-93.2	69.5	0	0	0	117.3
439	N	29.4	Very low	30.7	Very low	98 Å²	98	145.1 Å²	145.1	52%	0.524	80%	0.799	S	S	.	*			trans	34	129.5	130.4	-82.5	-65.2	0	0	0	124.8
440	K	32	Very low	30.6	Very low	189 Å²	189	146.4 Å²	146.4	82%	0.822	80%	0.802	S	S	*	*				56.6	160.3	125.6	-90.2	177.5	179.6	175.1	0	120.4
441	P	37.6	Very low	30.6	Very low	127 Å²	127	142.5 Å²	142.5	83%	0.825	80%	0.795	S	S	*	*			cis	-143.1	-160.7	36.5	44	-22.9	0	0	0	116.4
442	S	27.1	Very low	30.6	Very low	112 Å²	112	142.9 Å²	142.9	78%	0.783	80%	0.8	S	S	*	*			trans	-144.2	145	174.6	60.6	0	0	0	0	111.4
443	S	31	Very low	30.3	Very low	119 Å²	119	137.1 Å²	137.1	83%	0.832	79%	0.792	S	S	*	*			trans	-169.4	120.8	162.1	55.2	0	0	0	0	116
444	A	32.1	Very low	30.2	Very low	94 Å²	94	139 Å²	139	78%	0.777	80%	0.799	S	S	*	*			trans	32.8	122.4	143.7	0	0	0	0	0	124.4
445	E	31.5	Very low	30.4	Very low	182 Å²	182	138.1 Å²	138.1	85%	0.85	80%	0.799	S	S	*	*				38.5	137.7	127.6	-57.5	-168.5	113.6	0	0	124.6
446	L	29.6	Very low	30.5	Very low	177 Å²	177	140.4 Å²	140.4	93%	0.927	80%	0.799	S	S	*	*			trans	-151.5	168	140.6	-144.3	100.9	0	0	0	111.8
447	L	38.4	Very low	30.5	Very low	153 Å²	153	139.6 Å²	139.6	80%	0.801	79%	0.789	S	S	*	*			trans	-119.8	139.5	-163.4	-78.6	167.8	0	0	0	116.7
448	R	29.3	Very low	30.5	Very low	236 Å²	236	140.5 Å²	140.5	89%	0.891	79%	0.791	S	S	*	*			trans	75.6	131.3	142.4	-121.5	-175.3	-175.6	172.7	2.7	123.2
449	A	32.2	Very low	30.7	Very low	84 Å²	84	138.4 Å²	138.4	69%	0.694	79%	0.789	S	S	*	*			trans	76.9	156.1	142.4	0	0	0	0	0	118.9
450	N	29.1	Very low	30.7	Very low	141 Å²	141	136.4 Å²	136.4	75%	0.754	79%	0.792	S	S	*	*			cis	-160.4	162.8	7.1	-142.1	-4	0	0	0	115.4
451	I	32.4	Very low	30.7	Very low	152 Å²	152	135.9 Å²	135.9	78%	0.779	80%	0.798	S	S	*	*			trans	71.9	120.7	154.1	-63.8	156.2	0	0	0	122.2
452	G	26.9	Very low	30.2	Very low	81 Å²	81	133 Å²	133	84%	0.835	79%	0.79	S	S	*	*			trans	87.6	136.6	137.1	0	0	0	0	0	119.9
453	G	25.6	Very low	30.4	Very low	74 Å²	74	134.8 Å²	134.8	76%	0.763	79%	0.791	S	S	*	*			cis	140.5	112.8	-17.1	0	0	0	0	0	115.9
454	T	28.8	Very low	30.4	Very low	150 Å²	150	139.6 Å²	139.6	92%	0.92	79%	0.792	S	S	*	*			trans	-162.8	129.4	168	22.7	0	0	0	0	113.5
455	S	33.3	Very low	30.2	Very low	124 Å²	124	140.5 Å²	140.5	87%	0.867	78%	0.784	S	S	*	*			trans	-167.4	147.1	145	-166.2	0	0	0	0	111.4
456	T	29.9	Very low	30	Very low	118 Å²	118	140.3 Å²	140.3	72%	0.724	78%	0.783	S	S	*	*			trans	-104.6	138.2	-174.7	32.7	0	0	0	0	111.8
457	K	29.1	Very low	30	Very low	168 Å²	168	141 Å²	141	73%	0.73	78%	0.778	S	S	*	*				48.1	135.7	89.1	-65.5	-174.6	176.4	-178	0	113.8
458	F	29.6	Very low	30.8	Very low	169 Å²	169	138.9 Å²	138.9	74%	0.741	77%	0.773	S	S	*	*			cis	-167.5	-179.9	5.8	-115.2	-21.9	0	0	0	107.6
459	Q	30.8	Very low	30.7	Very low	158 Å²	158	133.6 Å²	133.6	74%	0.738	77%	0.768	S	S	*	*			cis	-171.6	159.1	-9	171.3	179	-21.2	0	0	105.4
460	G	29.3	Very low	30.6	Very low	57 Å²	57	135.9 Å²	135.9	59%	0.588	77%	0.767	S	S	*	*			cis	137.4	94	-3.1	0	0	0	0	0	113.2
461	L	30.8	Very low	30.5	Very low	178 Å²	178	137.5 Å²	137.5	93%	0.932	77%	0.768	S	S	*	*			trans	-137.7	142.4	170	-60.5	173.3	0	0	0	107.4
462	G	28.4	Very low	30.3	Very low	65 Å²	65	137.6 Å²	137.6	67%	0.67	77%	0.765	S	S	*	*			cis	108.7	125.6	12.6	0	0	0	0	0	109.8
463	L	30.9	Very low	30.1	Very low	151 Å²	151	138.2 Å²	138.2	79%	0.791	76%	0.757	S	S	*	*			cis	-112.6	-160.5	9.7	-65.1	176.2	0	0	0	110.3
464	Y	30.2	Very low	30.4	Very low	219 Å²	219	140 Å²	140	86%	0.859	76%	0.757	S	S	*	*			cis	-144.9	-171.4	17.6	-121.7	-79.5	0	0	0	112
465	D	27.4	Very low	31.2	Very low	113 Å²	113	138.7 Å²	138.7	60%	0.604	75%	0.752	S	S	*	*			trans	-142.8	154	-169.2	-179.5	26.9	0	0	0	112.2
466	H	29	Very low	30.9	Very low	179 Å²	179	140.5 Å²	140.5	83%	0.829	75%	0.752	S	S	*	*			trans	-173.8	160.6	135.4	-89.3	-30.8	0	0	0	112.6
467	K	28.7	Very low	30.8	Very low	191 Å²	191	141.4 Å²	141.4	83%	0.83	76%	0.757	S	S	*	*			trans	-137.6	-178.2	-157.6	-114.2	-162.1	167.8	176.6	0	113.6
468	P	55.8	Low	30.7	Very low	108 Å²	108	140.6 Å²	140.6	70%	0.701	76%	0.761	S	S	*	*			trans	-134.1	-171	-133.6	45.3	-26.6	0	0	0	116.8
469	T	25.5	Very low	30.8	Very low	126 Å²	126	139.5 Å²	139.5	77%	0.773	76%	0.762	S	S	*	*			trans	-141	130.3	159.9	35.6	0	0	0	0	108.1
470	L	30.4	Very low	30.6	Very low	131 Å²	131	138.7 Å²	138.7	69%	0.686	76%	0.763	S	S	*	*				60.8	126.8	67.6	-70.3	168.1	0	0	0	112.5
471	F	28.4	Very low	30.6	Very low	175 Å²	175	142.4 Å²	142.4	77%	0.768	77%	0.769	S	S	*	*			cis	-122.3	156.9	21.8	-79.6	-105.2	0	0	0	112
472	Q	26.6	Very low	30.4	Very low	154 Å²	154	142 Å²	142	72%	0.72	76%	0.759	S	S	*	*				57	136.9	66.7	-78.8	-175.4	-31.9	0	0	115.1
473	S	24.5	Very low	30.4	Very low	94 Å²	94	145.1 Å²	145.1	66%	0.657	76%	0.759	S	S	*	*			cis	-175	149.9	-7	52.5	0	0	0	0	114.8
474	S	30.7	Very low	30.2	Very low	111 Å²	111	146.7 Å²	146.7	78%	0.776	76%	0.763	S	S	*	*			trans	75.2	174.1	148.7	-53.9	0	0	0	0	119.3
475	P	45.6	Very low	30.3	Very low	123 Å²	123	142.1 Å²	142.1	80%	0.799	76%	0.758	S	S	*	*				-138.9	-169	-68.2	44.3	-28.2	0	0	0	115.3
476	N	28.1	Very low	30.9	Very low	162 Å²	162	142.8 Å²	142.8	87%	0.866	77%	0.768	S	S	*	*			trans	-54.3	153	-178.8	-60	-26.4	0	0	0	117.3
477	T	26.5	Very low	31	Very low	138 Å²	138	139.3 Å²	139.3	85%	0.847	76%	0.764	S	S	*	*			trans	-90.9	152.6	170.5	49.5	0	0	0	0	113.9
478	N	26.9	Very low	31.9	Very low	150 Å²	150	135.6 Å²	135.6	80%	0.802	76%	0.759	S	S	*	*			trans	-156.3	154.9	161.8	-141.9	-27.6	0	0	0	113.3
479	L	31.7	Very low	30.6	Very low	147 Å²	147	136.2 Å²	136.2	77%	0.77	76%	0.761	S	S	*	*			trans	64.5	91.1	163.8	-57.1	178.9	0	0	0	122.6
480	N	27.7	Very low	30.7	Very low	140 Å²	140	137.4 Å²	137.4	75%	0.749	76%	0.762	S	S	*	*				73.6	154	107.7	-145.7	4.6	0	0	0	124.2
481	L	28.6	Very low	30.6	Very low	136 Å²	136	139.2 Å²	139.2	71%	0.712	77%	0.767	S	S	*	*			trans	82.3	105.9	155.4	-75.2	164.4	0	0	0	123.8
482	K	26	Very low	31.3	Very low	169 Å²	169	136.2 Å²	136.2	74%	0.735	77%	0.765	S	S	*	*				101.4	104.8	110.2	-158.2	176.5	-169.6	176.5	0	122.2
483	I	28.5	Very low	31.4	Very low	130 Å²	130	138 Å²	138	67%	0.667	77%	0.771	S	S	*	*			trans	57.1	119.5	136.7	-54.9	172.7	0	0	0	120.1
484	Q	28.3	Very low	31.8	Very low	185 Å²	185	141.2 Å²	141.2	86%	0.864	78%	0.78	S	S	*	*				-171.9	156.3	101.5	-138.5	145	120.1	0	0	114.8
485	T	32.4	Very low	32.4	Very low	123 Å²	123	141.4 Å²	141.4	76%	0.755	78%	0.778	S	S	*	*			trans	-95.6	160	173.1	-13.3	0	0	0	0	110.8
486	P	38.3	Very low	32.5	Very low	126 Å²	126	140.1 Å²	140.1	82%	0.818	77%	0.77	S	S	*	*				-150.1	174.1	87.6	39.3	-21.1	0	0	0	116.3
487	S	31.7	Very low	32.5	Very low	106 Å²	106	141.8 Å²	141.8	74%	0.741	77%	0.769	S	S	*	*			trans	-114.4	166.7	164.7	59.7	0	0	0	0	110.4
488	P	47.1	Very low	32.6	Very low	113 Å²	113	142.7 Å²	142.7	73%	0.734	76%	0.764	S	S	*	*				-157.6	152.7	111.7	38.6	-19.5	0	0	0	119
489	V	29.4	Very low	32.6	Very low	121 Å²	121	145.4 Å²	145.4	73%	0.733	76%	0.763	S	S	*	*			trans	65.1	116.7	133.2	171.9	0	0	0	0	122
490	N	27.4	Very low	32.3	Very low	152 Å²	152	144.2 Å²	144.2	81%	0.813	76%	0.762	S	S	*	*				179.2	152.2	97.2	-118.5	-27.7	0	0	0	115.4
491	E	28.9	Very low	33.3	Very low	169 Å²	169	143.1 Å²	143.1	79%	0.79	76%	0.762	S	S	*	*			trans	-116.1	-179.7	158.9	-68.8	-162.1	147.8	0	0	110
492	P	43.4	Very low	33.3	Very low	111 Å²	111	142.5 Å²	142.5	72%	0.721	77%	0.77	S	S	*	*				-157.9	149.3	92.9	38.2	-17.6	0	0	0	120.2
493	K	27.9	Very low	33.3	Very low	192 Å²	192	139.4 Å²	139.4	84%	0.835	77%	0.769	S	S	*	*			trans	84.4	130.4	135.6	-76.8	170.5	-178.9	173.4	0	124.6
494	L	32.9	Very low	33.4	Very low	162 Å²	162	141.6 Å²	141.6	85%	0.848	78%	0.777	S	S	*	*			trans	-90.7	-166.9	154.4	-68.6	168.9	0	0	0	109.9
495	P	42.8	Very low	33.4	Very low	115 Å²	115	141.2 Å²	141.2	75%	0.747	77%	0.773	S	S	*	*			cis	-146.8	-141.3	20.4	42.8	-16	0	0	0	113.2
496	P	47.1	Very low	33.3	Very low	96 Å²	96	142.3 Å²	142.3	62%	0.623	77%	0.769	S	S	*	*			cis	-143.3	165.4	-12.1	37.1	-15.8	0	0	0	120.8
497	K	29.9	Very low	32.8	Very low	197 Å²	197	142.4 Å²	142.4	86%	0.857	76%	0.762	S	S	*	*			trans	69	151	150.8	-71.4	161.2	-176.4	176.8	0	118.1
498	Q	28.3	Very low	32.6	Very low	156 Å²	156	145.6 Å²	145.6	73%	0.729	76%	0.763	S	S	*	*			cis	-143.5	-158.9	3	-137.2	-171.1	12.5	0	0	108.6
499	R	26.5	Very low	31.6	Very low	208 Å²	208	147.8 Å²	147.8	79%	0.785	77%	0.765	S	S	*	*			cis	-158.5	171.8	6.2	-156.3	170.9	166.9	138.7	-6	111
500	T	26.3	Very low	31.5	Very low	122 Å²	122	147.2 Å²	147.2	75%	0.748	77%	0.766	S	S	*	*			trans	-145.8	-172.2	171.8	59.3	0	0	0	0	109.4
501	P	47.2	Very low	31.4	Very low	116 Å²	116	146 Å²	146	75%	0.753	76%	0.76	S	S	*	*			cis	-139.2	178.5	-5.1	44.1	-27.5	0	0	0	116.4
502	S	28.6	Very low	31.3	Very low	124 Å²	124	145.7 Å²	145.7	87%	0.867	76%	0.756	S	S	*	*			trans	-167.2	167.9	139.9	57.9	0	0	0	0	111.1
503	S	27.4	Very low	30.6	Very low	104 Å²	104	146.5 Å²	146.5	73%	0.727	75%	0.754	S	S	*	*			trans	-147.7	-176.3	-163.2	59.7	0	0	0	0	115
504	Q	29.1	Very low	30.7	Very low	176 Å²	176	143.2 Å²	143.2	82%	0.822	75%	0.745	S	S	*	*			trans	94.5	152.6	168.6	-60.3	178.1	-10.9	0	0	119
505	F	29.7	Very low	30.4	Very low	177 Å²	177	143.9 Å²	143.9	78%	0.776	74%	0.741	S	S	*	*			cis	-171.4	121.9	-42.4	-129.8	-89.5	0	0	0	109.1
506	H	28.8	Very low	29.6	Very low	146 Å²	146	143.4 Å²	143.4	68%	0.676	74%	0.74	S	S	*	*			trans	55.3	141.1	152.1	-83.3	-105.1	0	0	0	126.7
507	N	28.9	Very low	28.7	Very low	127 Å²	127	143.1 Å²	143.1	68%	0.679	74%	0.741	S	S	*	*			trans	81.4	114.1	134.8	-77.3	-23.3	0	0	0	125.6
508	K	27.1	Very low	28.8	Very low	173 Å²	173	141.4 Å²	141.4	75%	0.752	73%	0.733	S	S	*	*				64.9	140	122.6	-80.2	-175.1	173.2	-178.6	0	124.8
509	M	25.9	Very low	28.8	Very low	159 Å²	159	138.9 Å²	138.9	78%	0.783	73%	0.725	S	S	*	*			trans	79.5	106.6	147.4	-75.3	178.7	178.8	0	0	121.9
510	S	26.6	Very low	29.1	Very low	109 Å²	109	136.3 Å²	136.3	76%	0.762	72%	0.719	S	S	*	*				54.7	129.3	113.2	-47.2	0	0	0	0	123.7
511	D	26.4	Very low	29.3	Very low	127 Å²	127	136.9 Å²	136.9	68%	0.679	71%	0.713	S	S	*	*			trans	86.8	127.2	132.6	-108.5	14.5	0	0	0	122.8
512	K	26.6	Very low	28.6	Very low	162 Å²	162	135.2 Å²	135.2	70%	0.704	70%	0.701	S	S	*	*			trans	72.6	144.2	149.6	-61.3	-174.6	172.6	91.2	0	117.6
513	L	28.8	Very low	28.6	Very low	129 Å²	129	137.4 Å²	137.4	68%	0.675	70%	0.695	S	S	*	*			cis	-167.8	156.5	-3	-117.6	175.5	0	0	0	112.1
514	L	29.7	Very low	28.7	Very low	123 Å²	123	138.1 Å²	138.1	64%	0.644	69%	0.691	S	S	*	*			trans	72.6	158.2	153.2	-58.9	167.5	0	0	0	119.1
515	F	27.1	Very low	28.7	Very low	175 Å²	175	138.4 Å²	138.4	77%	0.768	69%	0.69	S	S	*	*			cis	-154.2	154.8	1.1	-124.1	-43	0	0	0	112
516	S	26.1	Very low	28.6	Very low	105 Å²	105	139.3 Å²	139.3	73%	0.734	69%	0.688	S	S	*	*			trans	142.2	100.4	147.9	-166.7	0	0	0	0	110.1
517	S	28.7	Very low	28.4	Very low	91 Å²	91	142.1 Å²	142.1	64%	0.636	69%	0.693	S	S	*	*				67.4	131.3	82.9	-59.9	0	0	0	0	113.3
518	K	30.8	Very low	28.6	Very low	161 Å²	161	141 Å²	141	70%	0.7	70%	0.695	S	S	*	*			cis	-163.7	175.2	3.9	-110	172.8	157.1	-74.2	0	107.2
519	D	29.6	Very low	29.3	Very low	102 Å²	102	138.7 Å²	138.7	55%	0.545	70%	0.698	S	S	.	*			cis	-155.8	150.1	4.4	-121.6	-21.5	0	0	0	107.7
520	K	32.3	Very low	29.6	Very low	155 Å²	155	136.2 Å²	136.2	67%	0.674	70%	0.696	S	S	*	*				58.6	134	97.6	-80.8	-158.7	156.9	-147.6	0	117.6
521	E	29.4	Very low	30.5	Very low	133 Å²	133	137 Å²	137	62%	0.621	70%	0.699	S	S	*	*			cis	-149.7	-168.6	1.6	-75.4	-125.6	-132.5	0	0	111.8
522	T	32	Very low	30.6	Very low	82 Å²	82	138.1 Å²	138.1	50%	0.503	70%	0.704	S	S	.	*				-165.5	158.3	-71	-49.8	0	0	0	0	108.3
523	F	30.1	Very low	30.7	Very low	169 Å²	169	137.6 Å²	137.6	74%	0.741	71%	0.709	S	S	*	*			trans	74.6	150.7	162.9	-56.1	-47.6	0	0	0	119.1
524	N	29.9	Very low	30.7	Very low	119 Å²	119	136 Å²	136	64%	0.636	71%	0.708	S	S	*	*			cis	-160.7	151.7	-18.7	-115.2	-14.8	0	0	0	114.7
525	F	28.4	Very low	30.7	Very low	182 Å²	182	135.1 Å²	135.1	80%	0.798	71%	0.712	S	S	*	*			trans	35.8	139	146.8	-85.5	-72.2	0	0	0	126.3
526	R	26.7	Very low	31.9	Very low	196 Å²	196	131.9 Å²	131.9	74%	0.74	71%	0.709	S	S	*	*			trans	97.6	113.1	135.8	-90.2	-168.3	-178	-155.4	2.9	122.7
527	R	25.2	Very low	32	Very low	206 Å²	206	139.1 Å²	139.1	78%	0.777	72%	0.721	S	S	*	*				79.7	132.5	120.9	-162.7	178.5	-82.5	-157.9	-6.2	119.9
528	S	32.8	Very low	32	Very low	104 Å²	104	138.4 Å²	138.4	73%	0.727	73%	0.728	S	S	*	*			trans	-78.8	171.7	173.2	49.6	0	0	0	0	112.4
529	P	41.4	Very low	31.9	Very low	123 Å²	123	134.4 Å²	134.4	80%	0.799	73%	0.732	S	S	*	*			cis	-149.8	-160.6	49.1	43.6	-19.8	0	0	0	117.5
530	S	33.2	Very low	32.7	Very low	108 Å²	108	135.2 Å²	135.2	76%	0.755	74%	0.743	S	S	*	*			trans	-70.9	174.4	-171.7	-32.6	0	0	0	0	116.8
531	P	44.8	Very low	32.5	Very low	126 Å²	126	135.2 Å²	135.2	82%	0.818	75%	0.745	S	S	*	*				-144.7	-179.8	119.4	39.8	-25.9	0	0	0	116
532	L	29.6	Very low	32.6	Very low	149 Å²	149	135.9 Å²	135.9	78%	0.78	75%	0.752	S	S	*	*			trans	-104.5	158	175.2	-63.9	73.1	0	0	0	111.5
533	N	27.3	Very low	32.5	Very low	151 Å²	151	137.1 Å²	137.1	81%	0.807	76%	0.764	S	S	*	*				166.5	146.7	117.7	-88.1	-16.3	0	0	0	118.1
534	S	29.8	Very low	32.7	Very low	95 Å²	95	136.8 Å²	136.8	66%	0.664	77%	0.765	S	S	*	*			trans	13	119.5	151.1	61.1	0	0	0	0	124.6
535	S	30.4	Very low	33.4	Very low	105 Å²	105	137.2 Å²	137.2	73%	0.734	77%	0.774	S	S	*	*				26	161.1	110.7	64.1	0	0	0	0	122.7
536	P	50.8	Low	33.6	Very low	107 Å²	107	135.4 Å²	135.4	70%	0.695	77%	0.768	S	S	*	*			cis	-148.2	-165	-17.2	36.5	-12.6	0	0	0	117.1
537	W	29.6	Very low	34.5	Very low	258 Å²	258	132 Å²	132	98%	0.977	77%	0.772	S	S	*	*			trans	76.3	141.7	156.8	-89.1	75.9	0	0	0	121.7
538	G	27.8	Very low	34.7	Very low	76 Å²	76	130.6 Å²	130.6	78%	0.784	77%	0.774	S	S	*	*			trans	125	124.5	154.6	0	0	0	0	0	118.8
539	G	28.2	Very low	34.8	Very low	77 Å²	77	130.7 Å²	130.7	79%	0.794	78%	0.775	S	S	*	*			trans	-101.8	-162.2	160.3	0	0	0	0	0	111.6
540	P	46.1	Very low	34.4	Very low	119 Å²	119	132.8 Å²	132.8	77%	0.773	77%	0.774	S	S	*	*			cis	-152.9	178.3	34.6	45.1	-24.3	0	0	0	119.4
541	E	28.1	Very low	34.5	Very low	154 Å²	154	136.3 Å²	136.3	72%	0.72	78%	0.778	S	S	*	*			trans	60.2	136.4	137.1	-75	-78.3	83.1	0	0	126.2
542	L	33.1	Very low	34	Very low	147 Å²	147	136.1 Å²	136.1	77%	0.77	78%	0.779	S	S	*	*			trans	68.4	149.6	148.2	-62.8	166.2	0	0	0	120.4
543	S	30.1	Very low	34.6	Very low	108 Å²	108	135 Å²	135	76%	0.755	78%	0.78	S	S	*	*			cis	-160.4	173.7	-11	51	0	0	0	0	113.9
544	Q	32.8	Very low	35.6	Very low	163 Å²	163	133.4 Å²	133.4	76%	0.762	78%	0.778	S	S	*	*			trans	-63.8	174.2	-177.1	-114.1	-178.9	-8.5	0	0	116.3
545	P	44.4	Very low	35.8	Very low	127 Å²	127	134.6 Å²	134.6	83%	0.825	78%	0.784	S	S	*	*			cis	-146.6	-176.3	49.3	42.5	-21	0	0	0	119.4
546	E	33.2	Very low	36.3	Very low	145 Å²	145	135.9 Å²	135.9	68%	0.678	79%	0.789	S	S	*	*			trans	-129.6	166.4	-176.4	176.3	178.8	-169.3	0	0	110.1
547	P	46	Very low	35.6	Very low	125 Å²	125	137.7 Å²	137.7	81%	0.812	80%	0.798	S	S	*	*			trans	-137.1	153.6	146	37.4	-24.2	0	0	0	115.9
548	E	30.4	Very low	36	Very low	175 Å²	175	130.6 Å²	130.6	82%	0.818	79%	0.789	S	S	*	*			trans	-101.5	-174	-166.7	-53.1	173.8	85.5	0	0	116.6
549	S	33	Very low	36.8	Very low	107 Å²	107	132.9 Å²	132.9	75%	0.748	79%	0.79	S	S	*	*			trans	102.1	147.9	149.6	84.1	0	0	0	0	117.8
550	Q	33.3	Very low	37.5	Very low	166 Å²	166	135.7 Å²	135.7	78%	0.776	79%	0.794	S	S	*	*			cis	-143.3	137.7	17	-64.8	176.7	0.3	0	0	116
551	Q	35.7	Very low	36.8	Very low	182 Å²	182	133.5 Å²	133.5	85%	0.85	79%	0.793	S	S	*	*			trans	63.8	156.6	133.5	-63.4	-172.8	-10.8	0	0	125.5
552	C	34.3	Very low	37.4	Very low	123 Å²	123	135.5 Å²	135.5	83%	0.831	80%	0.802	S	S	*	*			trans	-147.1	173	-168.8	-48.3	0	0	0	0	112.7
553	P	42.8	Very low	37.6	Very low	125 Å²	125	137 Å²	137	81%	0.812	81%	0.807	S	S	*	*			trans	-115.4	165.3	159.6	37.7	-28	0	0	0	114.9
554	P	48.2	Very low	37.7	Very low	118 Å²	118	137.2 Å²	137.2	77%	0.766	81%	0.809	S	S	*	*			trans	-128.4	170	-160.6	43	-29.4	0	0	0	118.2
555	P	33.7	Very low	38.3	Very low	120 Å²	120	141.4 Å²	141.4	78%	0.779	82%	0.817	S	S	*	*			trans	-100.5	174.3	161.1	38.6	-31.2	0	0	0	113.3
556	P	40.9	Very low	38.2	Very low	131 Å²	131	142.9 Å²	142.9	85%	0.851	81%	0.813	S	S	*	*			trans	-95.5	171.2	-150.1	36.8	-38.1	0	0	0	118.7
557	T	36.4	Very low	38.7	Very low	145 Å²	145	143 Å²	143	89%	0.89	82%	0.818	S	S	*	*			trans	-83.5	160.5	-175.9	41.9	0	0	0	0	116.4
558	S	37.2	Very low	38.5	Very low	110 Å²	110	146.5 Å²	146.5	77%	0.769	82%	0.824	S	S	*	*			trans	-122.8	157.6	167.4	54.2	0	0	0	0	112.8
559	P	44.4	Very low	39.3	Very low	124 Å²	124	144.8 Å²	144.8	81%	0.805	81%	0.814	S	S	*	*			trans	-79.3	166.8	-173.1	-14.5	32.3	0	0	0	115
560	P	42.6	Very low	40	Very low	135 Å²	135	151.1 Å²	151.1	88%	0.877	82%	0.821	S	S	*	*			trans	-88.4	143.3	-160.9	33.8	-36.1	0	0	0	115.7
561	G	32.9	Very low	40.7	Very low	73 Å²	73	148.1 Å²	148.1	75%	0.753	81%	0.809	S	S	*	*			trans	-134.2	113.1	163.7	0	0	0	0	0	110.1	M563	G561-M563 PolarHBondContact O-N 2.97Å
562	H	40.5	Very low	41.7	Very low	197 Å²	197	142.8 Å²	142.8	91%	0.912	79%	0.788	S	S	*	*			trans	-88.3	105	-168.2	-161.5	-84.4	0	0	0	111.7
563	M	36	Very low	42.3	Very low	178 Å²	178	145 Å²	145	88%	0.877	79%	0.791	S	S	*	*			trans	-128.5	135.2	172.7	-68.5	-165.7	73.8	0	0	111.5	G561	G561-M563 PolarHBondContact O-N 2.97Å
564	S	32.5	Very low	42.7	Very low	113 Å²	113	141.6 Å²	141.6	79%	0.79	78%	0.779	S	S	*	*			trans	-70.2	144.9	-173.7	-167.3	0	0	0	0	112.8	Q566	S564-Q566 PolarHBondContact O-N 3.02Å
565	R	46	Very low	42.9	Very low	251 Å²	251	139.8 Å²	139.8	95%	0.947	76%	0.76	S	S	*	*			trans	-95.4	84	-172.5	-168.6	-171.6	-164.2	-158.1	7.3	111
566	Q	41.5	Very low	44	Very low	158 Å²	158	137.8 Å²	137.8	74%	0.738	75%	0.749	S	S	*	*			trans	-140.8	125.7	175.8	-148.2	161.8	1.9	0	0	112.5	S564	S564-Q566 PolarHBondContact O-N 3.02Å
567	D	44.2	Very low	44.6	Very low	146 Å²	146	139.4 Å²	139.4	78%	0.781	74%	0.742	S	S	*	*			trans	49	57.6	160.9	-55.9	-24	0	0	0	120.5	K569	D567-K569 VanDerWaalsContact C-N 3.26Å; D567-K569 PolarHBondContact O-N 2.84Å
568	Q	41.3	Very low	45.6	Very low	200 Å²	200	137.4 Å²	137.4	94%	0.935	73%	0.726	S	S	*	*			trans	-74.4	81.3	153.6	-83.5	-163.5	-5.5	0	0	111.7	R570	Q568-R570 PolarHBondContact O-N 3.08Å; Q568-R570 VanDerWaalsContact O-N 3.14Å
569	K	47.1	Very low	46.8	Very low	139 Å²	139	135.2 Å²	135.2	60%	0.604	71%	0.705	S	S	*	*			trans	-54.3	112.8	167.4	-176.1	-175.4	-179.8	-170.3	0	109.8	D567 M571	D567-K569 VanDerWaalsContact C-N 3.26Å; D567-K569 PolarHBondContact O-N 2.84Å; K569-M571 HydrophobicContact CD-SD 4.31Å; K569-M571 PolarHBondContact O-N 3.2Å
570	R	48.4	Very low	47.9	Very low	240 Å²	240	135.2 Å²	135.2	91%	0.906	70%	0.698	S	S	*	*			trans	-71	86.1	-173.9	-159.8	-180	-163	-144.3	4.6	111.7	Q568 T572	Q568-R570 PolarHBondContact O-N 3.08Å; Q568-R570 VanDerWaalsContact O-N 3.14Å; R570-T572 PolarHBondContact O-N 3.33Å
571	M	49.1	Very low	48.9	Very low	103 Å²	103	132.4 Å²	132.4	51%	0.507	68%	0.678	S	S	.	*			trans	-60.3	119.6	-176.4	-66.9	-64.1	-82.3	0	0	112	K569 H575	K569-M571 HydrophobicContact CD-SD 4.31Å; K569-M571 PolarHBondContact O-N 3.2Å; M571-H575 HydrophobicContact CE-CB 3.69Å; M571-H575 HydrophobicContact SD-CB 4.05Å
572	T	54.9	Low	50.5	Low	69 Å²	69	132.7 Å²	132.7	42%	0.423	66%	0.663	S	S	.	*			trans	-95.7	153	165	63.2	0	0	0	0	109.8	R570 G574 H575	R570-T572 PolarHBondContact O-N 3.33Å; T572-G574 PolarHBondContact O-N 3.23Å; T572-H575 WeakPolarHBondContact O-CB 3.45Å; T572-H575 PolarHBondContact O-N 3.01Å; T572-H575 PolarHBondContact OG1-CE1 3.37Å; T572-H575 PolarHBondContact OG1-ND1 2.95Å
573	L	47.8	Very low	51.5	Low	169 Å²	169	129.1 Å²	129.1	89%	0.885	65%	0.646	S	S	*	*	H	α-helix	trans	-49.9	-32.6	-172.3	-78.7	159.5	0	0	0	115.1	H575	L573-H575 PolarHBondContact O-N 3.44Å
574	G	51	Low	52.7	Low	54 Å²	54	126.9 Å²	126.9	56%	0.557	63%	0.629	S	S	*	*	H	α-helix	trans	-65.6	-31.3	176.7	0	0	0	0	0	114.7	T572 K577 L578	T572-G574 PolarHBondContact O-N 3.23Å; G574-K577 PolarHBondContact O-N 3.04Å; G574-L578 PolarHBondContact O-N 3.35Å
575	H	52.6	Low	54	Low	81 Å²	81	126 Å²	126	38%	0.375	62%	0.615	S	S	.	*	H	α-helix	trans	-66.4	-44.3	-178.6	-72.4	85.2	0	0	0	111.7	M571 T572 L573 K577 L578 D579	M571-H575 HydrophobicContact CE-CB 3.69Å; M571-H575 HydrophobicContact SD-CB 4.05Å; T572-H575 WeakPolarHBondContact O-CB 3.45Å; T572-H575 PolarHBondContact O-N 3.01Å; T572-H575 PolarHBondContact OG1-CE1 3.37Å; T572-H575 PolarHBondContact OG1-ND1 2.95Å; L573-H575 PolarHBondContact O-N 3.44Å; H575-K577 PolarHBondContact O-N 2.85Å; H575-L578 PolarHBondContact O-N 3.32Å; H575-L578 VanDerWaalsContact O-N 3.08Å; H575-D579 WeakPolarHBondContact O-CB 3.4Å; H575-D579 PolarHBondContact O-N 3.2Å
576	S	56.6	Low	54.7	Low	78 Å²	78	122 Å²	122	55%	0.545	60%	0.604	S	S	.	*	H	α-helix	trans	-56.1	-37.7	179.5	-173.6	0	0	0	0	112.6	L580	S576-L580 VanDerWaalsContact O-CB 3.27Å; S576-L580 WeakPolarHBondContact O-CB 3.44Å; S576-L580 PolarHBondContact O-N 3.44Å
577	K	54.6	Low	55.5	Low	164 Å²	164	120.6 Å²	120.6	71%	0.713	60%	0.602	S	S	*	*	H	α-helix	trans	-73.6	-35.9	178.7	-160.2	173.3	-174.8	178.7	0	112.7	G574 H575 V581	G574-K577 PolarHBondContact O-N 3.04Å; H575-K577 PolarHBondContact O-N 2.85Å; K577-V581 WeakPolarHBondContact O-CG2 3.27Å; K577-V581 PolarHBondContact O-N 2.91Å
578	L	57.2	Low	55.9	Low	103 Å²	103	119.8 Å²	119.8	54%	0.539	59%	0.591	S	S	.	*	H	α-helix	trans	-73.6	-43.5	177.6	-157.2	165.7	0	0	0	110.8	G574 H575 L580 V581 N582	G574-L578 PolarHBondContact O-N 3.35Å; H575-L578 PolarHBondContact O-N 3.32Å; H575-L578 VanDerWaalsContact O-N 3.08Å; L578-L580 VanDerWaalsContact C-N 3.33Å; L578-L580 PolarHBondContact O-N 2.83Å; L578-V581 PolarHBondContact O-N 3.03Å; L578-N582 VanDerWaalsContact CD2-ND2 3.27Å; L578-N582 WeakPolarHBondContact CD2-ND2 3.16Å; L578-N582 PolarHBondContact O-N 3.4Å
579	D	62.6	Low	56.5	Low	64 Å²	64	116.5 Å²	116.5	34%	0.342	59%	0.585	S	S	.	*	H	α-helix	trans	-63.3	-37.5	175.1	-71.6	-35.4	0	0	0	111.6	H575 N582 H583	H575-D579 WeakPolarHBondContact O-CB 3.4Å; H575-D579 PolarHBondContact O-N 3.2Å; D579-N582 PolarHBondContact O-N 3.42Å; D579-H583 WeakPolarHBondContact O-CB 3.43Å; D579-H583 PolarHBondContact O-N 3Å
580	L	66.5	Low	56.6	Low	124 Å²	124	118.6 Å²	118.6	65%	0.649	59%	0.594	S	S	*	*	H	α-helix	trans	-62.1	-42	172.6	-174.6	67.5	0	0	0	112.6	S576 L578 H583 Y584	S576-L580 VanDerWaalsContact O-CB 3.27Å; S576-L580 WeakPolarHBondContact O-CB 3.44Å; S576-L580 PolarHBondContact O-N 3.44Å; L578-L580 VanDerWaalsContact C-N 3.33Å; L578-L580 PolarHBondContact O-N 2.83Å; L580-H583 PolarHBondContact O-N 3.34Å; L580-Y584 WeakPolarHBondContact O-CB 3.42Å; L580-Y584 PolarHBondContact O-N 3.36Å
581	V	64	Low	56.7	Low	77 Å²	77	115.1 Å²	115.1	47%	0.467	59%	0.588	S	S	.	*	H	α-helix	trans	-64.9	-43.3	174.7	168.7	0	0	0	0	110.9	K577 L578 H583 Y584 N585	K577-V581 WeakPolarHBondContact O-CG2 3.27Å; K577-V581 PolarHBondContact O-N 2.91Å; L578-V581 PolarHBondContact O-N 3.03Å; V581-H583 VanDerWaalsContact C-N 3.32Å; V581-H583 PolarHBondContact O-N 3.36Å; V581-Y584 PolarHBondContact O-N 3.49Å; V581-N585 WeakPolarHBondContact O-CB 3.44Å; V581-N585 PolarHBondContact O-N 3.31Å; V581-N585 PolarHBondContact O-ND2 2.97Å
582	N	65.8	Low	56.4	Low	79 Å²	79	116.9 Å²	116.9	42%	0.422	60%	0.604	S	S	.	*	H	α-helix	trans	-61.8	-39	175	-76.2	-20.5	0	0	0	112.2	L578 D579 N585 K586	L578-N582 VanDerWaalsContact CD2-ND2 3.27Å; L578-N582 WeakPolarHBondContact CD2-ND2 3.16Å; L578-N582 PolarHBondContact O-N 3.4Å; D579-N582 PolarHBondContact O-N 3.42Å; N582-N585 PolarHBondContact O-N 3.36Å; N582-K586 WeakPolarHBondContact O-CB 3.41Å; N582-K586 PolarHBondContact O-N 3.43Å
583	H	62.2	Low	55.8	Low	121 Å²	121	120 Å²	120	56%	0.56	61%	0.609	S	S	*	*	H	α-helix	trans	-68	-43.1	177	-134	-77.4	0	0	0	111.8	D579 L580 V581 N585 K586 L587	D579-H583 WeakPolarHBondContact O-CB 3.43Å; D579-H583 PolarHBondContact O-N 3Å; L580-H583 PolarHBondContact O-N 3.34Å; V581-H583 VanDerWaalsContact C-N 3.32Å; V581-H583 PolarHBondContact O-N 3.36Å; H583-N585 VanDerWaalsContact C-N 3.35Å; H583-N585 PolarHBondContact O-N 3.34Å; H583-K586 PolarHBondContact O-N 3.43Å; H583-L587 WeakPolarHBondContact O-CB 3.27Å; H583-L587 VanDerWaalsContact O-CG 3.27Å; H583-L587 WeakPolarHBondContact O-CG 3.49Å; H583-L587 PolarHBondContact O-N 2.95Å
584	Y	61.4	Low	55.8	Low	132 Å²	132	114.8 Å²	114.8	52%	0.518	59%	0.587	S	S	.	*	H	α-helix	trans	-62.6	-40	175.3	179.1	-103.3	0	0	0	112.3	L580 V581 L587 K588	L580-Y584 WeakPolarHBondContact O-CB 3.42Å; L580-Y584 PolarHBondContact O-N 3.36Å; V581-Y584 PolarHBondContact O-N 3.49Å; Y584-L587 PolarHBondContact O-N 3.5Å; Y584-K588 HydrophobicContact CE1-CD 4.25Å; Y584-K588 HydrophobicContact CE2-CD 4.42Å; Y584-K588 PolarHBondContact O-N 2.92Å; Y584-K588 PolarHBondContact OH-NZ 2.82Å
585	N	59.4	Low	55.6	Low	93 Å²	93	123.9 Å²	123.9	50%	0.497	61%	0.605	S	S	.	*	H	α-helix	trans	-67.8	-42.2	175.7	-69.4	-14.5	0	0	0	111.8	V581 N582 H583 L587 K588	V581-N585 WeakPolarHBondContact O-CB 3.44Å; V581-N585 PolarHBondContact O-N 3.31Å; V581-N585 PolarHBondContact O-ND2 2.97Å; N582-N585 PolarHBondContact O-N 3.36Å; H583-N585 VanDerWaalsContact C-N 3.35Å; H583-N585 PolarHBondContact O-N 3.34Å; N585-L587 VanDerWaalsContact C-N 3.3Å; N585-L587 PolarHBondContact O-N 2.86Å; N585-K588 PolarHBondContact O-N 3.38Å; N585-K588 VanDerWaalsContact O-N 3.12Å
586	K	60.3	Low	55.2	Low	167 Å²	167	128.7 Å²	128.7	73%	0.726	62%	0.624	S	S	*	*	H	α-helix	trans	-61.3	-35.1	172.5	-84.8	-173.4	172.6	-177.5	0	113.2	N582 H583 K588	N582-K586 WeakPolarHBondContact O-CB 3.41Å; N582-K586 PolarHBondContact O-N 3.43Å; H583-K586 PolarHBondContact O-N 3.43Å; K586-K588 PolarHBondContact O-N 3.12Å
587	L	59.4	Low	54.7	Low	130 Å²	130	130.9 Å²	130.9	68%	0.681	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-5.2	177.1	-71.3	167.6	0	0	0	113.6	H583 Y584 N585	H583-L587 WeakPolarHBondContact O-CB 3.27Å; H583-L587 VanDerWaalsContact O-CG 3.27Å; H583-L587 WeakPolarHBondContact O-CG 3.49Å; H583-L587 PolarHBondContact O-N 2.95Å; Y584-L587 PolarHBondContact O-N 3.5Å; N585-L587 VanDerWaalsContact C-N 3.3Å; N585-L587 PolarHBondContact O-N 2.86Å
588	K	52.3	Low	54.3	Low	128 Å²	128	131.2 Å²	131.2	56%	0.557	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.1	52.7	175.5	-76.4	-169.1	167.3	-176.9	0	112.9	Y584 N585 K586 K590	Y584-K588 HydrophobicContact CE1-CD 4.25Å; Y584-K588 HydrophobicContact CE2-CD 4.42Å; Y584-K588 PolarHBondContact O-N 2.92Å; Y584-K588 PolarHBondContact OH-NZ 2.82Å; N585-K588 PolarHBondContact O-N 3.38Å; N585-K588 VanDerWaalsContact O-N 3.12Å; K586-K588 PolarHBondContact O-N 3.12Å; K588-K590 PolarHBondContact O-N 3.4Å
589	T	52.5	Low	53.5	Low	132 Å²	132	135.1 Å²	135.1	81%	0.81	65%	0.647	S	S	*	*			trans	-69.8	64.4	162.9	43.4	0	0	0	0	112.3
590	K	51.1	Low	52.7	Low	183 Å²	183	137 Å²	137	80%	0.796	67%	0.665	S	S	*	*			trans	-118.1	124.4	157.8	-71.4	-168.6	175	-172.4	0	107.6	K588 V592	K588-K590 PolarHBondContact O-N 3.4Å; K590-V592 PolarHBondContact O-N 3.17Å
591	Q	50.6	Low	51.5	Low	166 Å²	166	139.7 Å²	139.7	78%	0.776	67%	0.672	S	S	*	*			trans	-60.2	111	177.6	-73.8	173.1	-52.5	0	0	109.7	Y593	Q591-Y593 HydrophobicContact CB-CD2 4.36Å; Q591-Y593 HydrophobicContact CB-CE2 4.37Å; Q591-Y593 PolarHBondContact O-N 3.04Å; Q591-Y593 VanDerWaalsContact O-N 3.17Å
592	V	41.2	Very low	50.2	Low	140 Å²	140	147 Å²	147	85%	0.848	71%	0.708	S	S	*	*			trans	-80.3	91.5	167.3	-179.1	0	0	0	0	106.5	K590 S594	K590-V592 PolarHBondContact O-N 3.17Å; V592-S594 PolarHBondContact O-N 3.37Å
593	Y	43.8	Very low	49.4	Very low	134 Å²	134	150.4 Å²	150.4	53%	0.525	72%	0.722	S	S	.	*			trans	-60.2	128.4	173.5	-95.5	-77.8	0	0	0	110.2	Q591 E597	Q591-Y593 HydrophobicContact CB-CD2 4.36Å; Q591-Y593 HydrophobicContact CB-CE2 4.37Å; Q591-Y593 PolarHBondContact O-N 3.04Å; Q591-Y593 VanDerWaalsContact O-N 3.17Å; Y593-E597 WeakPolarHBondContact CD1-OE2 3.21Å; Y593-E597 VanDerWaalsContact CE1-OE2 3.22Å; Y593-E597 WeakPolarHBondContact CE1-OE2 3.22Å
594	S	47.3	Very low	48.7	Very low	60 Å²	60	151.9 Å²	151.9	42%	0.42	73%	0.731	S	S	.	*			trans	-67.3	137.5	174.2	179.9	0	0	0	0	110.1	V592 F596 E597	V592-S594 PolarHBondContact O-N 3.37Å; S594-F596 PolarHBondContact O-N 3.17Å; S594-E597 PolarHBondContact O-N 3.07Å
595	R	46.4	Very low	48	Very low	246 Å²	246	153 Å²	153	93%	0.928	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	-11	178.6	-170.7	173	176.3	-171	-2.1	113.5
596	F	43.9	Very low	47.3	Very low	181 Å²	181	156.5 Å²	156.5	79%	0.794	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	-1.8	-179.1	-64.7	-78.8	0	0	0	114.7	S594 L598	S594-F596 PolarHBondContact O-N 3.17Å; F596-L598 PolarHBondContact O-N 2.99Å
597	E	47.2	Very low	46.5	Very low	125 Å²	125	155.9 Å²	155.9	58%	0.584	76%	0.759	S	S	*	*			trans	-78.8	90.9	177.5	-77.1	179.7	-160.1	0	0	112.1	Y593 S594 K599	Y593-E597 WeakPolarHBondContact CD1-OE2 3.21Å; Y593-E597 VanDerWaalsContact CE1-OE2 3.22Å; Y593-E597 WeakPolarHBondContact CE1-OE2 3.22Å; S594-E597 PolarHBondContact O-N 3.07Å; E597-K599 PolarHBondContact O-N 3.17Å
598	L	45.4	Very low	45.7	Very low	170 Å²	170	157.6 Å²	157.6	89%	0.89	77%	0.765	S	S	*	*			trans	-64.9	111.5	163.2	-85.1	103	0	0	0	110.1	F596 S600	F596-L598 PolarHBondContact O-N 2.99Å; L598-S600 PolarHBondContact O-N 3.19Å
599	K	41.3	Very low	45.2	Very low	185 Å²	185	159.7 Å²	159.7	80%	0.804	78%	0.779	S	S	*	*			trans	-67.5	109.8	164.1	-91.5	-171.1	172	-176.2	0	110.2	E597	E597-K599 PolarHBondContact O-N 3.17Å
600	S	43.9	Very low	44.6	Very low	103 Å²	103	161.8 Å²	161.8	72%	0.72	78%	0.777	S	S	*	*			trans	-81.2	132.3	161.4	-168.3	0	0	0	0	109.6	L598	L598-S600 PolarHBondContact O-N 3.19Å
601	K	41.8	Very low	44.1	Very low	182 Å²	182	160.1 Å²	160.1	79%	0.791	78%	0.776	S	S	*	*			trans	29.8	141.5	152.9	-59.2	-175.4	179	-177.4	0	119.9
602	N	36.4	Very low	43.5	Very low	229 Å²	229	159.5 Å²	159.5	100%	1.225	78%	0.775	S	S	*	*			cis	-127.8	0	25.8	-64.8	-66.7	0	0	0	112.8

Retrieved 602 of 602 residues in 322.5 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).