A0A060D1R4_MAIZE Loading...

HSF transcription factor

AlphaFold DB , UniProt , Accession A0A060D1R4, Species MAIZE (Zea mays, Maize), Gene HSF21, Length 298 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	41.9	Very low	38.4	Very low	255 Å²	255	125.6 Å²	125.6	100%	1.256	87%	0.869	S	S	*	*				0	85.3	0	-60.1	-105.7	-156.5	0	0	105.6
2	G	39.8	Very low	38.6	Very low	80 Å²	80	132.8 Å²	132.8	83%	0.825	87%	0.874	S	S	*	*				137.7	87.8	62	0	0	0	0	0	105
3	E	34	Very low	39.2	Very low	201 Å²	201	140.6 Å²	140.6	94%	0.939	88%	0.875	S	S	*	*			trans	-74.6	132	-178.4	-179.8	-170.1	124	0	0	110.5
4	A	34.8	Very low	39.6	Very low	98 Å²	98	136.5 Å²	136.5	81%	0.81	87%	0.873	S	S	*	*			trans	155.8	90.6	146	0	0	0	0	0	112.6
5	A	39.7	Very low	41.4	Very low	107 Å²	107	132.2 Å²	132.2	88%	0.884	86%	0.864	S	S	*	*			trans	-156.4	64	162.2	0	0	0	0	0	111
6	A	36.3	Very low	43.8	Very low	104 Å²	104	128.1 Å²	128.1	86%	0.86	85%	0.853	S	S	*	*			trans	-145.4	90.8	176.5	0	0	0	0	0	111.6
7	A	39	Very low	46.4	Very low	101 Å²	101	123.7 Å²	123.7	84%	0.835	82%	0.823	S	S	*	*			trans	-170.1	56.3	153.6	0	0	0	0	0	111.6
8	V	41.5	Very low	48.9	Very low	154 Å²	154	118.1 Å²	118.1	93%	0.933	79%	0.788	S	S	*	*			trans	-112.1	79.5	163.8	-176.8	0	0	0	0	107.5
9	A	37.2	Very low	51.2	Low	95 Å²	95	116.9 Å²	116.9	79%	0.785	78%	0.779	S	S	*	*			trans	-159.1	131.9	169.3	0	0	0	0	0	112.7
10	A	36	Very low	53.3	Low	102 Å²	102	111.6 Å²	111.6	84%	0.843	74%	0.743	S	S	*	*			trans	83.7	84.8	151.1	0	0	0	0	0	119.6
11	S	42.2	Very low	55.3	Low	85 Å²	85	106.3 Å²	106.3	59%	0.594	71%	0.707	S	S	*	*				-157.2	76.2	118.3	-160.7	0	0	0	0	111.9	R13	S11-R13 VanDerWaalsContact C-N 3.29Å; S11-R13 PolarHBondContact O-N 3.46Å; S11-R13 VanDerWaalsContact O-N 3.16Å
12	K	40.5	Very low	57.8	Low	212 Å²	212	95.7 Å²	95.7	92%	0.922	66%	0.657	S	S	*	*			trans	-83.1	70.9	168.4	-169.5	179.9	-178.6	-171	0	109.3
13	R	46.3	Very low	60.3	Low	234 Å²	234	96 Å²	96	88%	0.883	64%	0.635	S	S	*	*			trans	-143.1	93.8	166.5	-70.7	-160.7	-173.7	-141.4	4.3	111.6	S11	S11-R13 VanDerWaalsContact C-N 3.29Å; S11-R13 PolarHBondContact O-N 3.46Å; S11-R13 VanDerWaalsContact O-N 3.16Å
14	G	45.7	Very low	63.2	Low	83 Å²	83	86.4 Å²	86.4	86%	0.856	59%	0.591	S	S	*	*	S	Bend	trans	79.6	94.8	146.3	0	0	0	0	0	118.2
15	G	66.2	Low	66.1	Low	72 Å²	72	81.8 Å²	81.8	74%	0.742	55%	0.553	S	S	*	*	S	Bend	trans	90	128.8	168.4	0	0	0	0	0	113.2
16	G	79.6	Confident	68.6	Low	66 Å²	66	81.1 Å²	81.1	68%	0.68	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-58.3	169.9	176.6	0	0	0	0	0	113.1	A18	G16-A18 PolarHBondContact O-N 2.83Å
17	P	87.4	Confident	71.3	Confident	54 Å²	54	76.2 Å²	76.2	35%	0.351	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-55.5	142.7	178.3	25.2	-34.2	0	0	0	110.5	L103	P17-L103 HydrophobicContact CB-CB 3.7Å
18	A	91.5	Very high	73.9	Confident	23 Å²	23	71.4 Å²	71.4	19%	0.19	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-58.3	137.1	-179.8	0	0	0	0	0	109.9	G16 F20 L21 T22 Y78	G16-A18 PolarHBondContact O-N 2.83Å; A18-F20 PolarHBondContact O-N 3.41Å; A18-L21 HydrophobicContact CB-CD1 4.04Å; A18-L21 HydrophobicContact CB-CG 4.24Å; A18-L21 WeakPolarHBondContact O-CB 3.45Å; A18-L21 PolarHBondContact O-N 2.93Å; A18-T22 PolarHBondContact O-N 3.46Å; A18-Y78 HydrophobicContact CB-CE1 3.74Å; A18-Y78 WeakPolarHBondContact CB-OH 3.31Å
19	P	92.3	Very high	76.3	Confident	95 Å²	95	67 Å²	67	62%	0.617	42%	0.42	S	S	*	.	H	α-helix	trans	-54.7	-31.7	-175.6	-28.2	33.9	0	0	0	113.8	L21 K23	P19-L21 VanDerWaalsContact C-N 3.34Å; P19-L21 PolarHBondContact O-N 3.44Å; P19-K23 WeakPolarHBondContact O-CB 3.44Å; P19-K23 VanDerWaalsContact O-CG 3.25Å; P19-K23 WeakPolarHBondContact O-CG 3.5Å; P19-K23 PolarHBondContact O-N 3.24Å
20	F	94.5	Very high	78.9	Confident	11 Å²	11	67.4 Å²	67.4	5%	0.048	41%	0.406	C	S	.	.	H	α-helix	trans	-58.5	-45	174.2	172.6	-99.2	0	0	0	112.6	A18 T24 F63 F71 Q74 L75 Y78	A18-F20 PolarHBondContact O-N 3.41Å; F20-T24 WeakPolarHBondContact O-CB 3.46Å; F20-T24 PolarHBondContact O-N 2.85Å; F20-T24 PolarHBondContact O-OG1 3.24Å; F20-F63 HydrophobicContact CD2-CD1 4.4Å; F20-F63 AromaticContact CD2-CE1 3.53Å; F20-F63 HydrophobicContact CD2-CE1 3.53Å; F20-F63 AromaticContact CD2-CZ 3.72Å; F20-F63 HydrophobicContact CD2-CZ 3.72Å; F20-F63 HydrophobicContact CE2-CE1 4.14Å; F20-F63 AromaticContact CE2-CZ 3.92Å; F20-F63 HydrophobicContact CE2-CZ 3.92Å; F20-F63 HydrophobicContact CG-CE1 4.43Å; F20-F71 AromaticContact CE2-CD2 3.77Å; F20-F71 HydrophobicContact CE2-CD2 3.77Å; F20-F71 AromaticContact CE2-CE2 3.9Å; F20-F71 HydrophobicContact CE2-CE2 3.9Å; F20-F71 HydrophobicContact CZ-CD2 4.09Å; F20-F71 AromaticContact CZ-CE2 3.94Å; F20-F71 HydrophobicContact CZ-CE2 3.94Å; F20-Q74 HydrophobicContact CD1-CB 4.2Å; F20-Q74 HydrophobicContact CD2-CB 3.74Å; F20-Q74 HydrophobicContact CD2-CG 4.12Å; F20-Q74 HydrophobicContact CE1-CB 3.8Å; F20-Q74 HydrophobicContact CE2-CB 3.32Å; F20-Q74 HydrophobicContact CE2-CG 4.02Å; F20-Q74 HydrophobicContact CG-CB 4.17Å; F20-Q74 HydrophobicContact CZ-CB 3.35Å; F20-Q74 HydrophobicContact CZ-CG 4.5Å; F20-L75 HydrophobicContact CE1-CD2 3.98Å; F20-L75 HydrophobicContact CZ-CD2 3.82Å; F20-L75 HydrophobicContact CZ-CG 4.1Å; F20-Y78 HydrophobicContact CB-CE2 3.95Å; F20-Y78 AromaticContact CD1-CD2 3.35Å; F20-Y78 HydrophobicContact CD1-CD2 3.35Å; F20-Y78 AromaticContact CD1-CE2 3.36Å; F20-Y78 HydrophobicContact CD1-CE2 3.36Å; F20-Y78 HydrophobicContact CD1-CG 4.37Å; F20-Y78 AromaticContact CE1-CD2 3.74Å; F20-Y78 HydrophobicContact CE1-CD2 3.74Å; F20-Y78 HydrophobicContact CE1-CE2 4.16Å; F20-Y78 HydrophobicContact CG-CD2 4.29Å; F20-Y78 AromaticContact CG-CE2 3.87Å; F20-Y78 HydrophobicContact CG-CE2 3.87Å
21	L	94.8	Very high	81.2	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-69.3	-45.9	-177.9	-61.6	171.3	0	0	0	110.9	A18 P19 K23 T24 H25 Y78 F80 L103 I106	A18-L21 HydrophobicContact CB-CD1 4.04Å; A18-L21 HydrophobicContact CB-CG 4.24Å; A18-L21 WeakPolarHBondContact O-CB 3.45Å; A18-L21 PolarHBondContact O-N 2.93Å; P19-L21 VanDerWaalsContact C-N 3.34Å; P19-L21 PolarHBondContact O-N 3.44Å; L21-K23 PolarHBondContact O-N 3.33Å; L21-T24 PolarHBondContact O-N 2.96Å; L21-H25 WeakPolarHBondContact O-CB 3.42Å; L21-H25 PolarHBondContact O-N 3.39Å; L21-Y78 HydrophobicContact CD1-CD1 4.05Å; L21-Y78 HydrophobicContact CD1-CE1 4.24Å; L21-Y78 HydrophobicContact CD2-CD1 4.19Å; L21-Y78 HydrophobicContact CD2-CD2 4.28Å; L21-Y78 HydrophobicContact CD2-CG 3.93Å; L21-Y78 HydrophobicContact CG-CD1 4.24Å; L21-Y78 HydrophobicContact CG-CE1 4.39Å; L21-Y78 HydrophobicContact CG-CG 4.39Å; L21-F80 HydrophobicContact CD2-CE2 3.73Å; L21-F80 HydrophobicContact CD2-CZ 4.1Å; L21-L103 HydrophobicContact CB-CD2 4.46Å; L21-I106 HydrophobicContact CD1-CB 3.61Å; L21-I106 HydrophobicContact CD1-CD1 4.29Å; L21-I106 HydrophobicContact CD1-CG2 3.77Å; L21-I106 HydrophobicContact CD2-CB 4.5Å; L21-I106 HydrophobicContact CD2-CD1 4.13Å; L21-I106 HydrophobicContact CD2-CG2 4Å
22	T	93.5	Very high	83.4	Confident	33 Å²	33	71.1 Å²	71.1	20%	0.202	41%	0.406	C	S	.	.	H	α-helix	trans	-59.4	-47.5	178.7	-48.3	0	0	0	0	111.3	A18 H25 Q26	A18-T22 PolarHBondContact O-N 3.46Å; T22-H25 PolarHBondContact O-N 2.85Å; T22-Q26 WeakPolarHBondContact O-CG 3.38Å; T22-Q26 PolarHBondContact O-N 3.3Å
23	K	94.1	Very high	85.7	Confident	85 Å²	85	61.3 Å²	61.3	37%	0.37	36%	0.364	S	S	.	.	H	α-helix	trans	-66.9	-39.2	178.8	-69.3	-171.7	-173.9	-159	0	112.9	P19 L21 H25 Q26 M27 H62 F63	P19-K23 WeakPolarHBondContact O-CB 3.44Å; P19-K23 VanDerWaalsContact O-CG 3.25Å; P19-K23 WeakPolarHBondContact O-CG 3.5Å; P19-K23 PolarHBondContact O-N 3.24Å; L21-K23 PolarHBondContact O-N 3.33Å; K23-H25 VanDerWaalsContact C-N 3.35Å; K23-Q26 PolarHBondContact O-N 3.02Å; K23-M27 WeakPolarHBondContact O-CB 3.47Å; K23-M27 PolarHBondContact O-N 2.85Å; K23-H62 HydrophobicContact CB-CB 4.43Å; K23-H62 HydrophobicContact CD-CB 4.45Å; K23-H62 WeakPolarHBondContact CD-O 3.35Å; K23-H62 PolarHBondContact NZ-O 3.44Å; K23-F63 HydrophobicContact CB-CE1 4.11Å; K23-F63 HydrophobicContact CB-CZ 3.96Å; K23-F63 HydrophobicContact CD-CE1 4.22Å
24	T	94.7	Very high	87.9	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.006	34%	0.34	C	S	.	.	H	α-helix	trans	-64.9	-41.9	176.6	-54.5	0	0	0	0	110.6	F20 L21 M27 V28 F46 F71 F95	F20-T24 WeakPolarHBondContact O-CB 3.46Å; F20-T24 PolarHBondContact O-N 2.85Å; F20-T24 PolarHBondContact O-OG1 3.24Å; L21-T24 PolarHBondContact O-N 2.96Å; T24-M27 HydrophobicContact CG2-CE 4.39Å; T24-M27 PolarHBondContact O-N 3.48Å; T24-V28 HydrophobicContact CG2-CG2 4.37Å; T24-V28 WeakPolarHBondContact O-CG2 3.4Å; T24-V28 PolarHBondContact O-N 3.47Å; T24-V28 VanDerWaalsContact O-N 3.12Å; T24-F46 HydrophobicContact CG2-CZ 4.48Å; T24-F71 HydrophobicContact CG2-CE2 3.9Å; T24-F71 HydrophobicContact CG2-CZ 3.79Å; T24-F95 HydrophobicContact CG2-CZ 4.04Å
25	H	94.2	Very high	90.1	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.005	33%	0.331	C	S	.	.	H	α-helix	trans	-60.1	-47.3	176	-171.8	-78.3	0	0	0	111.6	L21 T22 K23 M27 V28 E29 W39 F95 R96 Q100 L103	L21-H25 WeakPolarHBondContact O-CB 3.42Å; L21-H25 PolarHBondContact O-N 3.39Å; T22-H25 PolarHBondContact O-N 2.85Å; K23-H25 VanDerWaalsContact C-N 3.35Å; H25-M27 PolarHBondContact O-N 3.06Å; H25-V28 PolarHBondContact O-N 3.17Å; H25-E29 IonicContact CE1-OE2 3.5Å; H25-E29 WeakPolarHBondContact O-CB 3.41Å; H25-E29 PolarHBondContact O-N 3.06Å; H25-W39 AromaticContact CD2-CH2 3.88Å; H25-W39 AromaticContact CD2-CZ2 3.72Å; H25-W39 AromaticContact NE2-CZ2 3.64Å; H25-F95 HydrophobicContact CB-CE2 3.92Å; H25-F95 HydrophobicContact CB-CZ 4.03Å; H25-R96 PolarHBondContact NE2-O 3.33Å; H25-Q100 WeakPolarHBondContact CE1-CG 3.39Å; H25-Q100 VanDerWaalsContact ND1-CG 3.3Å; H25-Q100 WeakPolarHBondContact ND1-CG 3.27Å; H25-Q100 PolarHBondContact ND1-NE2 2.99Å; H25-Q100 VanDerWaalsContact ND1-NE2 3.1Å; H25-L103 HydrophobicContact CB-CD1 3.85Å
26	Q	93	Very high	91.5	Very high	93 Å²	93	53.7 Å²	53.7	44%	0.435	30%	0.3	S	S	.	.	H	α-helix	trans	-59.6	-45.7	176	-71.9	171.7	-3.7	0	0	112.5	T22 K23 V28 E29 E30	T22-Q26 WeakPolarHBondContact O-CG 3.38Å; T22-Q26 PolarHBondContact O-N 3.3Å; K23-Q26 PolarHBondContact O-N 3.02Å; Q26-V28 VanDerWaalsContact C-N 3.26Å; Q26-V28 PolarHBondContact O-N 2.87Å; Q26-E29 PolarHBondContact O-N 2.98Å; Q26-E30 PolarHBondContact O-N 2.88Å
27	M	93.2	Very high	92.2	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.4	-31.4	179.4	-177.2	178.9	71.8	0	0	113.1	K23 T24 H25 T33 I37 L54 L58 H62 F71	K23-M27 WeakPolarHBondContact O-CB 3.47Å; K23-M27 PolarHBondContact O-N 2.85Å; T24-M27 HydrophobicContact CG2-CE 4.39Å; T24-M27 PolarHBondContact O-N 3.48Å; H25-M27 PolarHBondContact O-N 3.06Å; M27-T33 PolarHBondContact O-OG1 2.88Å; M27-I37 HydrophobicContact CE-CD1 3.76Å; M27-I37 HydrophobicContact CG-CG2 4.32Å; M27-L54 HydrophobicContact CE-CD1 4.23Å; M27-L58 HydrophobicContact CG-CB 4.41Å; M27-L58 HydrophobicContact CG-CD1 4.25Å; M27-L58 HydrophobicContact SD-CB 3.92Å; M27-L58 HydrophobicContact SD-CD1 4.47Å; M27-H62 VanDerWaalsContact SD-CD2 3.56Å; M27-F71 HydrophobicContact CE-CE2 3.85Å; M27-F71 HydrophobicContact CE-CZ 3.81Å
28	V	94.2	Very high	92.6	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-86.8	-28.1	179.2	-174.6	0	0	0	0	111.7	T24 H25 Q26 E30 I37 W39 F46	T24-V28 HydrophobicContact CG2-CG2 4.37Å; T24-V28 WeakPolarHBondContact O-CG2 3.4Å; T24-V28 PolarHBondContact O-N 3.47Å; T24-V28 VanDerWaalsContact O-N 3.12Å; H25-V28 PolarHBondContact O-N 3.17Å; Q26-V28 VanDerWaalsContact C-N 3.26Å; Q26-V28 PolarHBondContact O-N 2.87Å; V28-E30 VanDerWaalsContact C-N 3.34Å; V28-I37 HydrophobicContact CG2-CD1 3.49Å; V28-I37 VanDerWaalsContact CG2-CD1 3.49Å; V28-I37 HydrophobicContact CG2-CG1 3.94Å; V28-W39 HydrophobicContact CB-CZ2 4.21Å; V28-W39 HydrophobicContact CG1-CD2 3.6Å; V28-W39 VanDerWaalsContact CG1-CE2 3.47Å; V28-W39 HydrophobicContact CG1-CE3 4.28Å; V28-W39 HydrophobicContact CG1-CG 3.74Å; V28-W39 HydrophobicContact CG1-CZ2 4.06Å; V28-W39 PolarHBondContact O-NE1 2.88Å; V28-F46 HydrophobicContact CG1-CB 3.65Å; V28-F46 HydrophobicContact CG1-CG 4.41Å; V28-F46 HydrophobicContact CG2-CB 4.24Å; V28-F46 HydrophobicContact CG2-CD2 4.28Å; V28-F46 HydrophobicContact CG2-CG 4.14Å
29	E	91.8	Very high	92.8	Very high	63 Å²	63	48.9 Å²	48.9	29%	0.294	25%	0.252	S	S	.	.	H	α-helix	trans	-79.5	-17.5	179	-161.4	72.7	-126.2	0	0	112.8	H25 Q26 R31 W39 R97 G98	H25-E29 IonicContact CE1-OE2 3.5Å; H25-E29 WeakPolarHBondContact O-CB 3.41Å; H25-E29 PolarHBondContact O-N 3.06Å; Q26-E29 PolarHBondContact O-N 2.98Å; E29-R31 PolarHBondContact O-N 3.33Å; E29-W39 PolarHBondContact OE2-NE1 3.39Å; E29-R97 IonicContact OE1-NE 3.14Å; E29-R97 PolarHBondContact OE1-NE 3.47Å; E29-R97 VanDerWaalsContact OE1-NE 3.16Å; E29-R97 IonicContact OE1-NH2 3.49Å; E29-R97 WeakPolarHBondContact OE2-CG 3.23Å; E29-G98 PolarHBondContact OE2-N 3.36Å
30	E	90.8	Very high	92.8	Very high	103 Å²	103	45.3 Å²	45.3	48%	0.481	23%	0.231	S	C	.	.			trans	-69.8	112.3	178.5	-174.8	169.1	-170.5	0	0	111.4	Q26 V28 G32 T33	Q26-E30 PolarHBondContact O-N 2.88Å; V28-E30 VanDerWaalsContact C-N 3.34Å; E30-G32 PolarHBondContact O-N 3.27Å; E30-T33 HydrophobicContact CB-CG2 4.16Å; E30-T33 HydrophobicContact CG-CG2 4.17Å; E30-T33 PolarHBondContact O-N 3.42Å; E30-T33 PolarHBondContact O-OG1 3.17Å
31	R	85.3	Confident	92.5	Very high	195 Å²	195	54 Å²	54	74%	0.736	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-57.7	-24	-179.8	-66.5	-179.3	177.4	-95	5.7	114.1	E29 T33	E29-R31 PolarHBondContact O-N 3.33Å; R31-T33 PolarHBondContact O-N 3.44Å
32	G	87.4	Confident	92.2	Very high	69 Å²	69	60.7 Å²	60.7	71%	0.711	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-69.7	-18.1	176.7	0	0	0	0	0	113.8	E30	E30-G32 PolarHBondContact O-N 3.27Å
33	T	90.1	Very high	92.1	Very high	7 Å²	7	59.5 Å²	59.5	4%	0.043	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-100.8	0.9	-177.3	67.1	0	0	0	0	113.1	M27 E30 R31 E35 V36 I37 L58	M27-T33 PolarHBondContact O-OG1 2.88Å; E30-T33 HydrophobicContact CB-CG2 4.16Å; E30-T33 HydrophobicContact CG-CG2 4.17Å; E30-T33 PolarHBondContact O-N 3.42Å; E30-T33 PolarHBondContact O-OG1 3.17Å; R31-T33 PolarHBondContact O-N 3.44Å; T33-E35 PolarHBondContact O-N 3.43Å; T33-V36 WeakPolarHBondContact O-CA 3.47Å; T33-V36 PolarHBondContact O-N 2.85Å; T33-I37 CarbonylContact C-O 3.4Å; T33-I37 CarbonylContact O-C 3.54Å; T33-I37 PolarHBondContact O-N 3.27Å; T33-L58 HydrophobicContact CG2-CD1 3.93Å; T33-L58 HydrophobicContact CG2-CD2 3.53Å; T33-L58 HydrophobicContact CG2-CG 4.4Å
34	D	91.4	Very high	92	Very high	69 Å²	69	62.8 Å²	62.8	37%	0.369	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-28.9	-173.9	-81	-28.1	0	0	0	113.4	V36	D34-V36 VanDerWaalsContact C-N 3.3Å; D34-V36 PolarHBondContact O-N 3.23Å
35	E	92.9	Very high	92	Very high	143 Å²	143	63.2 Å²	63.2	67%	0.668	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-23.8	175.2	-65.4	-168.3	-173.8	0	0	114.2	T33 K50	T33-E35 PolarHBondContact O-N 3.43Å; E35-K50 IonicContact OE2-NZ 2.75Å
36	V	94.4	Very high	92	Very high	16 Å²	16	63.2 Å²	63.2	10%	0.097	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.2	-45.7	-172.7	176.9	0	0	0	0	110.4	T33 D34 W49 K50 E53 L54 L58	T33-V36 WeakPolarHBondContact O-CA 3.47Å; T33-V36 PolarHBondContact O-N 2.85Å; D34-V36 VanDerWaalsContact C-N 3.3Å; D34-V36 PolarHBondContact O-N 3.23Å; V36-W49 PolarHBondContact O-N 2.88Å; V36-K50 PolarHBondContact O-N 2.93Å; V36-E53 HydrophobicContact CG1-CB 4.21Å; V36-E53 HydrophobicContact CG2-CB 3.99Å; V36-L54 HydrophobicContact CG1-CB 3.54Å; V36-L54 HydrophobicContact CG1-CD1 4.34Å; V36-L54 HydrophobicContact CG1-CG 4.38Å; V36-L54 VanDerWaalsContact CG1-N 3.33Å; V36-L58 HydrophobicContact CB-CD1 4.09Å; V36-L58 HydrophobicContact CG1-CD1 3.72Å; V36-L58 HydrophobicContact CG1-CG 4.49Å
37	I	95.4	Very high	92.2	Very high	0 Å²	0	59 Å²	59	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	125.7	177.5	-173.2	172.9	0	0	0	109.6	M27 V28 T33 F46 V47 V48 L54 L58	M27-I37 HydrophobicContact CE-CD1 3.76Å; M27-I37 HydrophobicContact CG-CG2 4.32Å; V28-I37 HydrophobicContact CG2-CD1 3.49Å; V28-I37 VanDerWaalsContact CG2-CD1 3.49Å; V28-I37 HydrophobicContact CG2-CG1 3.94Å; T33-I37 CarbonylContact C-O 3.4Å; T33-I37 CarbonylContact O-C 3.54Å; T33-I37 PolarHBondContact O-N 3.27Å; I37-F46 HydrophobicContact CD1-CD2 3.69Å; I37-F46 HydrophobicContact CD1-CE2 3.92Å; I37-F46 HydrophobicContact CG1-CD2 3.97Å; I37-V47 WeakPolarHBondContact CA-O 3.37Å; I37-V48 HydrophobicContact CD1-CG2 3.96Å; I37-V48 HydrophobicContact CG1-CG2 4.07Å; I37-L54 HydrophobicContact CB-CD1 3.8Å; I37-L54 HydrophobicContact CD1-CD1 3.78Å; I37-L54 HydrophobicContact CG1-CD1 4.3Å; I37-L54 HydrophobicContact CG2-CD1 4.04Å; I37-L58 HydrophobicContact CG2-CD1 3.68Å
38	S	94.9	Very high	92.3	Very high	16 Å²	16	59.1 Å²	59.1	11%	0.112	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	161.7	178.3	73	0	0	0	0	112	F46 V47 W49	S38-F46 CarbonylContact O-C 3.53Å; S38-F46 VanDerWaalsContact O-CA 3.29Å; S38-F46 WeakPolarHBondContact O-CA 3.49Å; S38-F46 WeakPolarHBondContact O-CB 3.44Å; S38-V47 PolarHBondContact N-O 2.86Å; S38-V47 PolarHBondContact O-N 3.39Å; S38-W49 PolarHBondContact OG-NE1 3.36Å
39	W	95.4	Very high	92.4	Very high	26 Å²	26	64.4 Å²	64.4	10%	0.098	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	140.3	167.9	-68.9	104.1	0	0	0	110.3	H25 V28 E29 F46 F95 R96 R97	H25-W39 AromaticContact CD2-CH2 3.88Å; H25-W39 AromaticContact CD2-CZ2 3.72Å; H25-W39 AromaticContact NE2-CZ2 3.64Å; V28-W39 HydrophobicContact CB-CZ2 4.21Å; V28-W39 HydrophobicContact CG1-CD2 3.6Å; V28-W39 VanDerWaalsContact CG1-CE2 3.47Å; V28-W39 HydrophobicContact CG1-CE3 4.28Å; V28-W39 HydrophobicContact CG1-CG 3.74Å; V28-W39 HydrophobicContact CG1-CZ2 4.06Å; V28-W39 PolarHBondContact O-NE1 2.88Å; E29-W39 PolarHBondContact OE2-NE1 3.39Å; W39-F46 HydrophobicContact CE3-CB 4.3Å; W39-F95 AromaticContact CH2-CD1 3.45Å; W39-F95 HydrophobicContact CH2-CD1 3.45Å; W39-F95 VanDerWaalsContact CH2-CD1 3.45Å; W39-F95 AromaticContact CH2-CE1 3.16Å; W39-F95 HydrophobicContact CH2-CE1 3.16Å; W39-F95 HydrophobicContact CH2-CG 4.41Å; W39-F95 AromaticContact CH2-CZ 3.93Å; W39-F95 HydrophobicContact CH2-CZ 3.93Å; W39-F95 HydrophobicContact CZ2-CE1 4.01Å; W39-F95 HydrophobicContact CZ2-CZ 4.47Å; W39-F95 AromaticContact CZ3-CD1 3.61Å; W39-F95 HydrophobicContact CZ3-CD1 3.61Å; W39-F95 AromaticContact CZ3-CE1 3.59Å; W39-F95 HydrophobicContact CZ3-CE1 3.59Å; W39-R96 VanDerWaalsContact CH2-C 3.48Å; W39-R97 HydrophobicContact CD2-CB 3.75Å; W39-R97 HydrophobicContact CD2-CG 4.08Å; W39-R97 HydrophobicContact CE3-CB 4.09Å; W39-R97 HydrophobicContact CG-CB 4.06Å; W39-R97 HydrophobicContact CG-CG 3.97Å; W39-R97 HydrophobicContact CZ2-CB 4.28Å; W39-R97 HydrophobicContact CZ3-CB 4.47Å
40	A	93.2	Very high	92.6	Very high	21 Å²	21	64.8 Å²	64.8	17%	0.174	31%	0.313	C	S	.	.			trans	-65.7	163.5	165	0	0	0	0	0	110.2	Q42 G43 S45 V47	A40-Q42 PolarHBondContact O-N 3.4Å; A40-G43 PolarHBondContact O-N 3.12Å; A40-S45 WeakPolarHBondContact CB-O 3.4Å; A40-S45 WeakPolarHBondContact CB-OG 3.45Å; A40-S45 PolarHBondContact N-O 2.81Å; A40-V47 HydrophobicContact CB-CG2 4.33Å
41	E	88	Confident	92.7	Very high	193 Å²	193	61.5 Å²	61.5	90%	0.902	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	-37.1	-174.9	-171.4	178.1	-172.1	0	0	113.6
42	Q	88.9	Confident	93.2	Very high	140 Å²	140	57.1 Å²	57.1	65%	0.654	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-7.4	-178.3	-60.5	-62.4	-25.8	0	0	114.3	A40 R44	A40-Q42 PolarHBondContact O-N 3.4Å; Q42-R44 HydrophobicContact CB-CG 4.48Å; Q42-R44 PolarHBondContact O-N 2.67Å; Q42-R44 VanDerWaalsContact O-N 3.16Å
43	G	90.5	Very high	93.5	Very high	9 Å²	9	57.5 Å²	57.5	9%	0.093	28%	0.278	C	S	.	.	S	Bend	trans	64.1	16.2	-177.4	0	0	0	0	0	115.2	A40 R96 R97	A40-G43 PolarHBondContact O-N 3.12Å; G43-R96 CarbonylContact O-C 3.58Å; G43-R96 VanDerWaalsContact O-CA 3.3Å; G43-R96 WeakPolarHBondContact O-CA 3.5Å; G43-R97 PolarHBondContact O-N 3.04Å
44	R	91.8	Very high	93.8	Very high	153 Å²	153	57.2 Å²	57.2	58%	0.577	28%	0.276	S	S	*	.	S	Bend	trans	-103.6	-10.2	178.4	-62.7	179.4	-175.7	-177.8	1.5	113.6	Q42	Q42-R44 HydrophobicContact CB-CG 4.48Å; Q42-R44 PolarHBondContact O-N 2.67Å; Q42-R44 VanDerWaalsContact O-N 3.16Å
45	S	94.5	Very high	93.9	Very high	11 Å²	11	54.5 Å²	54.5	8%	0.077	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	159.7	177.4	53.2	0	0	0	0	108.4	A40 E89 F90	A40-S45 WeakPolarHBondContact CB-O 3.4Å; A40-S45 WeakPolarHBondContact CB-OG 3.45Å; A40-S45 PolarHBondContact N-O 2.81Å; S45-E89 WeakPolarHBondContact CB-OE1 3.22Å; S45-E89 PolarHBondContact OG-OE1 2.67Å; S45-F90 VanDerWaalsContact CA-O 3.28Å; S45-F90 WeakPolarHBondContact CA-O 3.44Å; S45-F90 WeakPolarHBondContact CB-O 3.35Å
46	F	95.7	Very high	94	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	148.9	171.2	68.6	-91.6	0	0	0	109.6	T24 V28 I37 S38 W39 V48 F71 L75 F80 E89 F90 F95	T24-F46 HydrophobicContact CG2-CZ 4.48Å; V28-F46 HydrophobicContact CG1-CB 3.65Å; V28-F46 HydrophobicContact CG1-CG 4.41Å; V28-F46 HydrophobicContact CG2-CB 4.24Å; V28-F46 HydrophobicContact CG2-CD2 4.28Å; V28-F46 HydrophobicContact CG2-CG 4.14Å; I37-F46 HydrophobicContact CD1-CD2 3.69Å; I37-F46 HydrophobicContact CD1-CE2 3.92Å; I37-F46 HydrophobicContact CG1-CD2 3.97Å; S38-F46 CarbonylContact O-C 3.53Å; S38-F46 VanDerWaalsContact O-CA 3.29Å; S38-F46 WeakPolarHBondContact O-CA 3.49Å; S38-F46 WeakPolarHBondContact O-CB 3.44Å; W39-F46 HydrophobicContact CE3-CB 4.3Å; F46-V48 HydrophobicContact CD2-CG2 4.32Å; F46-V48 HydrophobicContact CE2-CG2 4.1Å; F46-F71 HydrophobicContact CE2-CE1 4.38Å; F46-F71 HydrophobicContact CE2-CZ 4.4Å; F46-F71 HydrophobicContact CZ-CZ 4.41Å; F46-L75 HydrophobicContact CE1-CD2 4.27Å; F46-L75 HydrophobicContact CE2-CD1 4.41Å; F46-L75 HydrophobicContact CZ-CD1 3.81Å; F46-L75 HydrophobicContact CZ-CD2 3.76Å; F46-L75 HydrophobicContact CZ-CG 4.47Å; F46-F80 AromaticContact CE1-CD1 3.95Å; F46-F80 HydrophobicContact CE1-CD1 3.95Å; F46-F80 AromaticContact CE1-CE1 3.76Å; F46-F80 HydrophobicContact CE1-CE1 3.76Å; F46-E89 WeakPolarHBondContact O-CA 3.39Å; F46-F90 HydrophobicContact CE1-CB 3.93Å; F46-F90 HydrophobicContact CE2-CB 4.24Å; F46-F90 HydrophobicContact CE2-CD2 4.01Å; F46-F90 HydrophobicContact CZ-CB 3.76Å; F46-F90 HydrophobicContact CZ-CD2 4.17Å; F46-F90 HydrophobicContact CZ-CG 4.3Å; F46-F90 PolarHBondContact N-O 3.31Å; F46-F90 PolarHBondContact O-N 3.25Å; F46-F95 AromaticContact CD1-CD1 3.94Å; F46-F95 HydrophobicContact CD1-CD1 3.94Å; F46-F95 AromaticContact CD1-CE1 3.52Å; F46-F95 HydrophobicContact CD1-CE1 3.52Å; F46-F95 HydrophobicContact CD1-CZ 4.45Å; F46-F95 HydrophobicContact CE1-CD1 4.25Å; F46-F95 AromaticContact CE1-CE1 3.88Å; F46-F95 HydrophobicContact CE1-CE1 3.88Å; F46-F95 HydrophobicContact CE1-CZ 4.5Å; F46-F95 HydrophobicContact CG-CE1 4.48Å
47	V	95.9	Very high	93.9	Very high	4 Å²	4	60.1 Å²	60.1	2%	0.024	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	129.4	-177	-172.7	0	0	0	0	108.5	I37 S38 A40 W49 E89	I37-V47 WeakPolarHBondContact CA-O 3.37Å; S38-V47 PolarHBondContact N-O 2.86Å; S38-V47 PolarHBondContact O-N 3.39Å; A40-V47 HydrophobicContact CB-CG2 4.33Å; V47-W49 HydrophobicContact CB-CZ2 4.12Å; V47-W49 HydrophobicContact CG1-CD2 3.99Å; V47-W49 HydrophobicContact CG1-CE3 4.24Å; V47-W49 HydrophobicContact CG1-CH2 4.34Å; V47-W49 HydrophobicContact CG1-CZ2 4.05Å; V47-W49 HydrophobicContact CG1-CZ3 4.42Å; V47-E89 HydrophobicContact CG2-CB 4.08Å; V47-E89 HydrophobicContact CG2-CG 3.87Å
48	V	96.4	Very high	93.7	Very high	3 Å²	3	60.9 Å²	60.9	2%	0.018	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	107	167.6	-178	0	0	0	0	108.3	I37 F46 P51 L54 F68 W88	I37-V48 HydrophobicContact CD1-CG2 3.96Å; I37-V48 HydrophobicContact CG1-CG2 4.07Å; F46-V48 HydrophobicContact CD2-CG2 4.32Å; F46-V48 HydrophobicContact CE2-CG2 4.1Å; V48-P51 HydrophobicContact CG1-CB 4.31Å; V48-L54 HydrophobicContact CG1-CB 4.27Å; V48-L54 HydrophobicContact CG1-CD1 3.92Å; V48-L54 HydrophobicContact CG2-CD1 4.16Å; V48-F68 HydrophobicContact CB-CE2 4.49Å; V48-F68 HydrophobicContact CG1-CE2 4.03Å; V48-F68 HydrophobicContact CG1-CZ 4.45Å; V48-F68 HydrophobicContact CG2-CE2 4.35Å; V48-W88 HydrophobicContact CB-CB 3.79Å; V48-W88 PolarHBondContact N-O 3.37Å; V48-W88 WeakPolarHBondContact O-CB 3.32Å
49	W	95.5	Very high	93.7	Very high	112 Å²	112	60.1 Å²	60.1	42%	0.424	28%	0.283	S	S	.	.	S	Bend	trans	-75.8	-43.7	-178.7	-59.1	103.1	0	0	0	111.6	V36 S38 V47 R87	V36-W49 PolarHBondContact O-N 2.88Å; S38-W49 PolarHBondContact OG-NE1 3.36Å; V47-W49 HydrophobicContact CB-CZ2 4.12Å; V47-W49 HydrophobicContact CG1-CD2 3.99Å; V47-W49 HydrophobicContact CG1-CE3 4.24Å; V47-W49 HydrophobicContact CG1-CH2 4.34Å; V47-W49 HydrophobicContact CG1-CZ2 4.05Å; V47-W49 HydrophobicContact CG1-CZ3 4.42Å; W49-R87 VanDerWaalsContact CH2-NH1 3.34Å
50	K	95.3	Very high	93.5	Very high	70 Å²	70	62.1 Å²	62.1	30%	0.304	30%	0.299	S	S	.	.			trans	-127.1	84.8	-172.4	-58	-177.5	-168.8	169.2	0	110.3	E35 V36 V52 E53 L54	E35-K50 IonicContact OE2-NZ 2.75Å; V36-K50 PolarHBondContact O-N 2.93Å; K50-V52 PolarHBondContact O-N 3.24Å; K50-V52 VanDerWaalsContact O-N 3.17Å; K50-E53 HydrophobicContact CB-CB 4.06Å; K50-E53 HydrophobicContact CB-CG 4.29Å; K50-E53 HydrophobicContact CD-CG 4.3Å; K50-E53 VanDerWaalsContact CD-OE1 3.27Å; K50-E53 WeakPolarHBondContact CD-OE1 3.41Å; K50-E53 WeakPolarHBondContact CD-OE2 3.24Å; K50-E53 IonicContact NZ-OE1 3.58Å; K50-E53 PolarHBondContact NZ-OE1 3.18Å; K50-E53 IonicContact NZ-OE2 3.38Å; K50-E53 PolarHBondContact NZ-OE2 2.84Å; K50-E53 VanDerWaalsContact NZ-OE2 3.14Å; K50-E53 PolarHBondContact O-N 2.88Å; K50-L54 PolarHBondContact O-N 3.41Å
51	P	94.7	Very high	93.5	Very high	35 Å²	35	67.5 Å²	67.5	23%	0.227	32%	0.324	C	S	.	.	H	α-helix	trans	-62.7	-26.8	-174.3	24	-34.3	0	0	0	113.6	V48 A55 F68	V48-P51 HydrophobicContact CG1-CB 4.31Å; P51-A55 VanDerWaalsContact O-CB 3.28Å; P51-A55 WeakPolarHBondContact O-CB 3.49Å; P51-A55 PolarHBondContact O-N 2.85Å; P51-F68 HydrophobicContact CB-CD1 4.08Å; P51-F68 HydrophobicContact CB-CD2 4.24Å; P51-F68 HydrophobicContact CB-CE1 4Å; P51-F68 HydrophobicContact CB-CE2 4.17Å; P51-F68 HydrophobicContact CB-CG 4.19Å; P51-F68 HydrophobicContact CB-CZ 4.05Å
52	V	94.9	Very high	93.6	Very high	103 Å²	103	59.8 Å²	59.8	62%	0.624	29%	0.288	S	S	*	.	H	α-helix	trans	-73.6	-44.5	178.4	-178	0	0	0	0	111.5	K50 A55 R56	K50-V52 PolarHBondContact O-N 3.24Å; K50-V52 VanDerWaalsContact O-N 3.17Å; V52-A55 WeakPolarHBondContact O-CB 3.3Å; V52-A55 PolarHBondContact O-N 3.41Å; V52-R56 WeakPolarHBondContact O-CG 3.4Å; V52-R56 PolarHBondContact O-N 3.46Å; V52-R56 VanDerWaalsContact O-N 3.15Å
53	E	94.3	Very high	93.8	Very high	77 Å²	77	54.4 Å²	54.4	36%	0.36	26%	0.262	S	S	.	.	H	α-helix	trans	-67.1	-42.9	176.9	-68.8	179.4	-155.4	0	0	110.6	V36 K50 A55 R56 D57	V36-E53 HydrophobicContact CG1-CB 4.21Å; V36-E53 HydrophobicContact CG2-CB 3.99Å; K50-E53 HydrophobicContact CB-CB 4.06Å; K50-E53 HydrophobicContact CB-CG 4.29Å; K50-E53 HydrophobicContact CD-CG 4.3Å; K50-E53 VanDerWaalsContact CD-OE1 3.27Å; K50-E53 WeakPolarHBondContact CD-OE1 3.41Å; K50-E53 WeakPolarHBondContact CD-OE2 3.24Å; K50-E53 IonicContact NZ-OE1 3.58Å; K50-E53 PolarHBondContact NZ-OE1 3.18Å; K50-E53 IonicContact NZ-OE2 3.38Å; K50-E53 PolarHBondContact NZ-OE2 2.84Å; K50-E53 VanDerWaalsContact NZ-OE2 3.14Å; K50-E53 PolarHBondContact O-N 2.88Å; E53-A55 PolarHBondContact O-N 2.81Å; E53-R56 PolarHBondContact O-N 3.45Å; E53-R56 VanDerWaalsContact O-N 3.13Å; E53-D57 PolarHBondContact O-N 2.82Å
54	L	94.9	Very high	93.8	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	30%	0.303	C	S	.	.	I	π-helix	trans	-54	-43.6	173.7	-174.8	132.6	0	0	0	111.6	M27 V36 I37 V48 K50 L58 L59 F68 F71	M27-L54 HydrophobicContact CE-CD1 4.23Å; V36-L54 HydrophobicContact CG1-CB 3.54Å; V36-L54 HydrophobicContact CG1-CD1 4.34Å; V36-L54 HydrophobicContact CG1-CG 4.38Å; V36-L54 VanDerWaalsContact CG1-N 3.33Å; I37-L54 HydrophobicContact CB-CD1 3.8Å; I37-L54 HydrophobicContact CD1-CD1 3.78Å; I37-L54 HydrophobicContact CG1-CD1 4.3Å; I37-L54 HydrophobicContact CG2-CD1 4.04Å; V48-L54 HydrophobicContact CG1-CB 4.27Å; V48-L54 HydrophobicContact CG1-CD1 3.92Å; V48-L54 HydrophobicContact CG2-CD1 4.16Å; K50-L54 PolarHBondContact O-N 3.41Å; L54-L58 HydrophobicContact CD1-CD1 4.32Å; L54-L58 HydrophobicContact CG-CB 4.43Å; L54-L58 HydrophobicContact CG-CD1 4.41Å; L54-L58 PolarHBondContact O-N 3.45Å; L54-L59 HydrophobicContact CD2-CD1 4.09Å; L54-L59 HydrophobicContact CD2-CD2 3.81Å; L54-L59 HydrophobicContact CD2-CG 3.74Å; L54-L59 WeakPolarHBondContact O-CG 3.15Å; L54-L59 PolarHBondContact O-N 2.79Å; L54-F68 HydrophobicContact CD2-CD2 3.72Å; L54-F68 HydrophobicContact CD2-CE2 4.11Å; L54-F71 HydrophobicContact CD2-CD1 4.35Å
55	A	95.2	Very high	93.8	Very high	13 Å²	13	59.8 Å²	59.8	11%	0.107	29%	0.288	C	S	.	.	I	π-helix	trans	-66.3	-37.6	-178.7	0	0	0	0	0	113.6	P51 V52 E53 L59 C66 F68	P51-A55 VanDerWaalsContact O-CB 3.28Å; P51-A55 WeakPolarHBondContact O-CB 3.49Å; P51-A55 PolarHBondContact O-N 2.85Å; V52-A55 WeakPolarHBondContact O-CB 3.3Å; V52-A55 PolarHBondContact O-N 3.41Å; E53-A55 PolarHBondContact O-N 2.81Å; A55-L59 HydrophobicContact CB-CD1 4.32Å; A55-C66 WeakPolarHBondContact CB-O 3.31Å; A55-C66 CarbonylContact O-C 3.45Å; A55-C66 VanDerWaalsContact O-CA 3.27Å; A55-C66 WeakPolarHBondContact O-CA 3.24Å; A55-C66 VanDerWaalsContact O-CB 3.25Å; A55-C66 WeakPolarHBondContact O-CB 3.36Å; A55-C66 VanDerWaalsContact O-O 3.11Å; A55-F68 HydrophobicContact CB-CB 4.25Å
56	R	93.7	Very high	93.8	Very high	184 Å²	184	63.2 Å²	63.2	69%	0.694	31%	0.311	S	S	*	.	I	π-helix	trans	-84.4	-42.1	-175.9	-71	-179.8	64	173.5	-0.8	113.1	V52 E53 P60	V52-R56 WeakPolarHBondContact O-CG 3.4Å; V52-R56 PolarHBondContact O-N 3.46Å; V52-R56 VanDerWaalsContact O-N 3.15Å; E53-R56 PolarHBondContact O-N 3.45Å; E53-R56 VanDerWaalsContact O-N 3.13Å; R56-P60 WeakPolarHBondContact O-CD 3.29Å; R56-P60 VanDerWaalsContact O-CG 3.31Å; R56-P60 WeakPolarHBondContact O-CG 3.46Å
57	D	92.3	Very high	93.7	Very high	92 Å²	92	67 Å²	67	49%	0.492	33%	0.331	S	S	.	.	I	π-helix	trans	-104.3	-47.6	-166	-55.6	-28.4	0	0	0	110.9	E53 L61	E53-D57 PolarHBondContact O-N 2.82Å; D57-L61 WeakPolarHBondContact O-CD1 3.16Å; D57-L61 WeakPolarHBondContact O-CG 3.36Å
58	L	92.7	Very high	93.7	Very high	17 Å²	17	68 Å²	68	9%	0.089	34%	0.336	C	S	.	.	I	π-helix	trans	-86.2	-41.5	-174.3	-58.3	-178.2	0	0	0	113.9	M27 T33 V36 I37 L54 L61 H62	M27-L58 HydrophobicContact CG-CB 4.41Å; M27-L58 HydrophobicContact CG-CD1 4.25Å; M27-L58 HydrophobicContact SD-CB 3.92Å; M27-L58 HydrophobicContact SD-CD1 4.47Å; T33-L58 HydrophobicContact CG2-CD1 3.93Å; T33-L58 HydrophobicContact CG2-CD2 3.53Å; T33-L58 HydrophobicContact CG2-CG 4.4Å; V36-L58 HydrophobicContact CB-CD1 4.09Å; V36-L58 HydrophobicContact CG1-CD1 3.72Å; V36-L58 HydrophobicContact CG1-CG 4.49Å; I37-L58 HydrophobicContact CG2-CD1 3.68Å; L54-L58 HydrophobicContact CD1-CD1 4.32Å; L54-L58 HydrophobicContact CG-CB 4.43Å; L54-L58 HydrophobicContact CG-CD1 4.41Å; L54-L58 PolarHBondContact O-N 3.45Å; L58-L61 WeakPolarHBondContact O-CB 3.45Å; L58-L61 PolarHBondContact O-N 3.18Å; L58-H62 PolarHBondContact O-CD2 2.82Å; L58-H62 VanDerWaalsContact O-CD2 3.31Å; L58-H62 PolarHBondContact O-N 3.21Å
59	L	93.6	Very high	93.6	Very high	0 Å²	0	71.7 Å²	71.7	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-61.3	-41	-176.9	-70.4	-174.6	0	0	0	113.1	L54 A55 L61 H62 F63 H65 F71	L54-L59 HydrophobicContact CD2-CD1 4.09Å; L54-L59 HydrophobicContact CD2-CD2 3.81Å; L54-L59 HydrophobicContact CD2-CG 3.74Å; L54-L59 WeakPolarHBondContact O-CG 3.15Å; L54-L59 PolarHBondContact O-N 2.79Å; A55-L59 HydrophobicContact CB-CD1 4.32Å; L59-L61 VanDerWaalsContact C-N 3.3Å; L59-L61 PolarHBondContact O-N 2.84Å; L59-H62 PolarHBondContact O-N 3.4Å; L59-F63 HydrophobicContact CD2-CD2 3.74Å; L59-F63 HydrophobicContact CD2-CE2 4.24Å; L59-F63 CarbonylContact O-C 3.45Å; L59-F63 VanDerWaalsContact O-CA 3.3Å; L59-F63 WeakPolarHBondContact O-CA 3.36Å; L59-F63 WeakPolarHBondContact O-CB 3.37Å; L59-F63 PolarHBondContact O-N 2.87Å; L59-H65 CarbonylContact C-O 3.58Å; L59-H65 VanDerWaalsContact CB-O 3.28Å; L59-H65 WeakPolarHBondContact CB-O 3.37Å; L59-F71 HydrophobicContact CD1-CB 4.26Å; L59-F71 HydrophobicContact CD2-CB 4Å; L59-F71 HydrophobicContact CD2-CD2 3.92Å; L59-F71 HydrophobicContact CD2-CG 4.03Å
60	P	92.4	Very high	93.6	Very high	68 Å²	68	68.6 Å²	68.6	44%	0.442	36%	0.357	S	S	.	.	H	α-helix	trans	-66	-28.2	176.8	-24.9	37.9	0	0	0	114.3	R56 C66	R56-P60 WeakPolarHBondContact O-CD 3.29Å; R56-P60 VanDerWaalsContact O-CG 3.31Å; R56-P60 WeakPolarHBondContact O-CG 3.46Å; P60-C66 HydrophobicContact CG-CB 4.09Å
61	L	91.5	Very high	93.6	Very high	133 Å²	133	65.2 Å²	65.2	70%	0.696	34%	0.342	S	S	*	.	H	α-helix	trans	-70.3	-42	177.8	-71.1	161.4	0	0	0	111.4	D57 L58 L59	D57-L61 WeakPolarHBondContact O-CD1 3.16Å; D57-L61 WeakPolarHBondContact O-CG 3.36Å; L58-L61 WeakPolarHBondContact O-CB 3.45Å; L58-L61 PolarHBondContact O-N 3.18Å; L59-L61 VanDerWaalsContact C-N 3.3Å; L59-L61 PolarHBondContact O-N 2.84Å
62	H	90.3	Very high	93.7	Very high	31 Å²	31	64.6 Å²	64.6	14%	0.144	34%	0.338	C	S	.	.	H	α-helix	trans	-98.2	-29.9	-175.8	-60.6	-68.8	0	0	0	113.8	K23 M27 L58 L59	K23-H62 HydrophobicContact CB-CB 4.43Å; K23-H62 HydrophobicContact CD-CB 4.45Å; K23-H62 WeakPolarHBondContact CD-O 3.35Å; K23-H62 PolarHBondContact NZ-O 3.44Å; M27-H62 VanDerWaalsContact SD-CD2 3.56Å; L58-H62 PolarHBondContact O-CD2 2.82Å; L58-H62 VanDerWaalsContact O-CD2 3.31Å; L58-H62 PolarHBondContact O-N 3.21Å; L59-H62 PolarHBondContact O-N 3.4Å
63	F	93.2	Very high	93.6	Very high	27 Å²	27	68.7 Å²	68.7	12%	0.118	34%	0.342	C	S	.	.	S	Bend	trans	-130.4	158.3	-170.3	-57.8	-71	0	0	0	112.7	F20 K23 L59 H65 F71	F20-F63 HydrophobicContact CD2-CD1 4.4Å; F20-F63 AromaticContact CD2-CE1 3.53Å; F20-F63 HydrophobicContact CD2-CE1 3.53Å; F20-F63 AromaticContact CD2-CZ 3.72Å; F20-F63 HydrophobicContact CD2-CZ 3.72Å; F20-F63 HydrophobicContact CE2-CE1 4.14Å; F20-F63 AromaticContact CE2-CZ 3.92Å; F20-F63 HydrophobicContact CE2-CZ 3.92Å; F20-F63 HydrophobicContact CG-CE1 4.43Å; K23-F63 HydrophobicContact CB-CE1 4.11Å; K23-F63 HydrophobicContact CB-CZ 3.96Å; K23-F63 HydrophobicContact CD-CE1 4.22Å; L59-F63 HydrophobicContact CD2-CD2 3.74Å; L59-F63 HydrophobicContact CD2-CE2 4.24Å; L59-F63 CarbonylContact O-C 3.45Å; L59-F63 VanDerWaalsContact O-CA 3.3Å; L59-F63 WeakPolarHBondContact O-CA 3.36Å; L59-F63 WeakPolarHBondContact O-CB 3.37Å; L59-F63 PolarHBondContact O-N 2.87Å; F63-H65 PolarHBondContact O-N 3.23Å; F63-F71 HydrophobicContact CE2-CD2 4.12Å; F63-F71 HydrophobicContact CE2-CE2 4.16Å
64	K	91.5	Very high	93.7	Very high	219 Å²	219	67.7 Å²	67.7	95%	0.952	34%	0.338	S	S	*	.	S	Bend	trans	-82.9	36.7	179.2	-60.6	-175	176.5	-174.3	0	112.7
65	H	92.2	Very high	93.7	Very high	56 Å²	56	67.7 Å²	67.7	26%	0.259	34%	0.338	S	S	.	.			trans	-161.3	158.7	177.8	63.7	63.8	0	0	0	111	L59 F63	L59-H65 CarbonylContact C-O 3.58Å; L59-H65 VanDerWaalsContact CB-O 3.28Å; L59-H65 WeakPolarHBondContact CB-O 3.37Å; F63-H65 PolarHBondContact O-N 3.23Å
66	C	93.2	Very high	93.7	Very high	83 Å²	83	70.9 Å²	70.9	56%	0.561	35%	0.353	S	S	*	.			trans	-110	14.8	172.6	57.4	0	0	0	0	113	A55 P60	A55-C66 WeakPolarHBondContact CB-O 3.31Å; A55-C66 CarbonylContact O-C 3.45Å; A55-C66 VanDerWaalsContact O-CA 3.27Å; A55-C66 WeakPolarHBondContact O-CA 3.24Å; A55-C66 VanDerWaalsContact O-CB 3.25Å; A55-C66 WeakPolarHBondContact O-CB 3.36Å; A55-C66 VanDerWaalsContact O-O 3.11Å; P60-C66 HydrophobicContact CG-CB 4.09Å
67	N	94.1	Very high	93.7	Very high	79 Å²	79	63.6 Å²	63.6	42%	0.422	33%	0.329	S	S	.	.			trans	-97.2	115.8	-175.8	-170.9	-13.2	0	0	0	112.1	S69 S70 F71	N67-S69 PolarHBondContact O-N 3.39Å; N67-S69 VanDerWaalsContact OD1-CB 3.23Å; N67-S69 WeakPolarHBondContact OD1-CB 3.45Å; N67-S69 PolarHBondContact OD1-N 2.99Å; N67-S69 PolarHBondContact OD1-OG 3.07Å; N67-S69 VanDerWaalsContact OD1-OG 3.07Å; N67-S70 WeakPolarHBondContact O-CB 3.21Å; N67-S70 PolarHBondContact O-N 2.95Å; N67-S70 VanDerWaalsContact O-N 3.13Å; N67-F71 PolarHBondContact O-N 3.38Å
68	F	95.7	Very high	93.8	Very high	26 Å²	26	60.8 Å²	60.8	11%	0.114	31%	0.311	C	S	.	.	H	α-helix	trans	-54.4	-36.4	173.5	-176	-114.4	0	0	0	113.1	V48 P51 L54 A55 S70 F71 V72 W88	V48-F68 HydrophobicContact CB-CE2 4.49Å; V48-F68 HydrophobicContact CG1-CE2 4.03Å; V48-F68 HydrophobicContact CG1-CZ 4.45Å; V48-F68 HydrophobicContact CG2-CE2 4.35Å; P51-F68 HydrophobicContact CB-CD1 4.08Å; P51-F68 HydrophobicContact CB-CD2 4.24Å; P51-F68 HydrophobicContact CB-CE1 4Å; P51-F68 HydrophobicContact CB-CE2 4.17Å; P51-F68 HydrophobicContact CB-CG 4.19Å; P51-F68 HydrophobicContact CB-CZ 4.05Å; L54-F68 HydrophobicContact CD2-CD2 3.72Å; L54-F68 HydrophobicContact CD2-CE2 4.11Å; A55-F68 HydrophobicContact CB-CB 4.25Å; F68-S70 VanDerWaalsContact C-N 3.3Å; F68-S70 PolarHBondContact O-N 2.87Å; F68-F71 HydrophobicContact CD2-CD1 4.3Å; F68-F71 HydrophobicContact CE2-CD1 4.11Å; F68-F71 WeakPolarHBondContact O-CB 3.31Å; F68-F71 PolarHBondContact O-N 3.35Å; F68-F71 VanDerWaalsContact O-N 3.12Å; F68-V72 HydrophobicContact CD1-CG2 4Å; F68-V72 HydrophobicContact CD2-CG2 4.48Å; F68-V72 HydrophobicContact CE1-CG2 3.55Å; F68-V72 HydrophobicContact CE2-CG2 4.09Å; F68-V72 HydrophobicContact CG-CG2 4.45Å; F68-V72 HydrophobicContact CZ-CG2 3.61Å; F68-V72 WeakPolarHBondContact O-CG2 3.38Å; F68-V72 PolarHBondContact O-N 2.92Å; F68-W88 AromaticContact CE1-CD2 3.83Å; F68-W88 HydrophobicContact CE1-CD2 3.83Å; F68-W88 AromaticContact CE1-CE2 3.97Å; F68-W88 AromaticContact CE1-CE3 3.83Å; F68-W88 HydrophobicContact CE1-CE3 3.83Å; F68-W88 HydrophobicContact CE1-CG 4.45Å; F68-W88 HydrophobicContact CE1-CH2 4.09Å; F68-W88 HydrophobicContact CE1-CZ2 4.11Å; F68-W88 AromaticContact CE1-CZ3 3.96Å; F68-W88 HydrophobicContact CE1-CZ3 3.96Å; F68-W88 HydrophobicContact CZ-CB 4.46Å; F68-W88 AromaticContact CZ-CD2 3.9Å; F68-W88 HydrophobicContact CZ-CD2 3.9Å; F68-W88 AromaticContact CZ-CE3 3.94Å; F68-W88 HydrophobicContact CZ-CE3 3.94Å; F68-W88 HydrophobicContact CZ-CG 4.15Å; F68-W88 HydrophobicContact CZ-CZ3 4.47Å
69	S	95.2	Very high	93.9	Very high	80 Å²	80	60.4 Å²	60.4	56%	0.559	31%	0.312	S	S	*	.	H	α-helix	trans	-63.6	-36.9	-179.7	-46.8	0	0	0	0	112.2	N67 F71 V72 R73	N67-S69 PolarHBondContact O-N 3.39Å; N67-S69 VanDerWaalsContact OD1-CB 3.23Å; N67-S69 WeakPolarHBondContact OD1-CB 3.45Å; N67-S69 PolarHBondContact OD1-N 2.99Å; N67-S69 PolarHBondContact OD1-OG 3.07Å; N67-S69 VanDerWaalsContact OD1-OG 3.07Å; S69-F71 VanDerWaalsContact C-N 3.34Å; S69-V72 PolarHBondContact O-N 3.03Å; S69-R73 WeakPolarHBondContact O-CB 3.39Å; S69-R73 PolarHBondContact O-N 2.75Å
70	S	94.5	Very high	94	Very high	47 Å²	47	60.6 Å²	60.6	33%	0.329	31%	0.313	S	S	.	.	H	α-helix	trans	-66	-40.1	175.5	-62.7	0	0	0	0	111	N67 F68 R73 Q74	N67-S70 WeakPolarHBondContact O-CB 3.21Å; N67-S70 PolarHBondContact O-N 2.95Å; N67-S70 VanDerWaalsContact O-N 3.13Å; F68-S70 VanDerWaalsContact C-N 3.3Å; F68-S70 PolarHBondContact O-N 2.87Å; S70-R73 PolarHBondContact O-N 3.05Å; S70-Q74 WeakPolarHBondContact O-CG 3.45Å; S70-Q74 PolarHBondContact O-N 3.38Å
71	F	95.7	Very high	94.1	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-61.3	-49.4	174.6	178	-105.8	0	0	0	111.5	F20 T24 M27 F46 L54 L59 F63 N67 F68 S69 R73 Q74 L75	F20-F71 AromaticContact CE2-CD2 3.77Å; F20-F71 HydrophobicContact CE2-CD2 3.77Å; F20-F71 AromaticContact CE2-CE2 3.9Å; F20-F71 HydrophobicContact CE2-CE2 3.9Å; F20-F71 HydrophobicContact CZ-CD2 4.09Å; F20-F71 AromaticContact CZ-CE2 3.94Å; F20-F71 HydrophobicContact CZ-CE2 3.94Å; T24-F71 HydrophobicContact CG2-CE2 3.9Å; T24-F71 HydrophobicContact CG2-CZ 3.79Å; M27-F71 HydrophobicContact CE-CE2 3.85Å; M27-F71 HydrophobicContact CE-CZ 3.81Å; F46-F71 HydrophobicContact CE2-CE1 4.38Å; F46-F71 HydrophobicContact CE2-CZ 4.4Å; F46-F71 HydrophobicContact CZ-CZ 4.41Å; L54-F71 HydrophobicContact CD2-CD1 4.35Å; L59-F71 HydrophobicContact CD1-CB 4.26Å; L59-F71 HydrophobicContact CD2-CB 4Å; L59-F71 HydrophobicContact CD2-CD2 3.92Å; L59-F71 HydrophobicContact CD2-CG 4.03Å; F63-F71 HydrophobicContact CE2-CD2 4.12Å; F63-F71 HydrophobicContact CE2-CE2 4.16Å; N67-F71 PolarHBondContact O-N 3.38Å; F68-F71 HydrophobicContact CD2-CD1 4.3Å; F68-F71 HydrophobicContact CE2-CD1 4.11Å; F68-F71 WeakPolarHBondContact O-CB 3.31Å; F68-F71 PolarHBondContact O-N 3.35Å; F68-F71 VanDerWaalsContact O-N 3.12Å; S69-F71 VanDerWaalsContact C-N 3.34Å; F71-R73 VanDerWaalsContact C-N 3.31Å; F71-R73 PolarHBondContact O-N 3.45Å; F71-Q74 WeakPolarHBondContact O-CB 3.31Å; F71-Q74 PolarHBondContact O-N 3Å; F71-Q74 VanDerWaalsContact O-N 3.1Å; F71-L75 HydrophobicContact CD1-CD1 4.01Å; F71-L75 HydrophobicContact CE1-CD1 3.6Å; F71-L75 HydrophobicContact CE1-CG 4.2Å; F71-L75 HydrophobicContact CZ-CD1 4.08Å; F71-L75 HydrophobicContact CZ-CD2 4.25Å; F71-L75 HydrophobicContact CZ-CG 4.3Å; F71-L75 PolarHBondContact O-N 3.1Å
72	V	95.6	Very high	94.2	Very high	22 Å²	22	62.7 Å²	62.7	13%	0.133	31%	0.305	C	S	.	.	H	α-helix	trans	-60.7	-39	176.6	175.8	0	0	0	0	112	F68 S69 Q74 L75 N76 F90	F68-V72 HydrophobicContact CD1-CG2 4Å; F68-V72 HydrophobicContact CD2-CG2 4.48Å; F68-V72 HydrophobicContact CE1-CG2 3.55Å; F68-V72 HydrophobicContact CE2-CG2 4.09Å; F68-V72 HydrophobicContact CG-CG2 4.45Å; F68-V72 HydrophobicContact CZ-CG2 3.61Å; F68-V72 WeakPolarHBondContact O-CG2 3.38Å; F68-V72 PolarHBondContact O-N 2.92Å; S69-V72 PolarHBondContact O-N 3.03Å; V72-Q74 VanDerWaalsContact C-N 3.3Å; V72-Q74 PolarHBondContact O-N 3.47Å; V72-L75 WeakPolarHBondContact O-CB 3.46Å; V72-L75 PolarHBondContact O-N 2.96Å; V72-N76 PolarHBondContact O-N 3.27Å; V72-N76 PolarHBondContact O-ND2 2.96Å; V72-F90 HydrophobicContact CG1-CE1 4.38Å; V72-F90 HydrophobicContact CG1-CZ 4.21Å; V72-F90 HydrophobicContact CG2-CZ 4.06Å
73	R	94.4	Very high	94.4	Very high	188 Å²	188	65 Å²	65	71%	0.709	32%	0.321	S	S	*	.	H	α-helix	trans	-62.3	-39.1	175.9	-175.6	171.5	179.6	159.2	-0.4	112.1	S69 S70 F71 N76 T77	S69-R73 WeakPolarHBondContact O-CB 3.39Å; S69-R73 PolarHBondContact O-N 2.75Å; S70-R73 PolarHBondContact O-N 3.05Å; F71-R73 VanDerWaalsContact C-N 3.31Å; F71-R73 PolarHBondContact O-N 3.45Å; R73-N76 PolarHBondContact O-N 3.26Å; R73-T77 WeakPolarHBondContact O-CB 3.25Å; R73-T77 PolarHBondContact O-N 3.33Å; R73-T77 VanDerWaalsContact O-N 3.08Å; R73-T77 PolarHBondContact O-OG1 2.9Å
74	Q	95	Very high	94.4	Very high	57 Å²	57	65.8 Å²	65.8	27%	0.266	33%	0.328	S	S	.	.	H	α-helix	trans	-64.9	-45.2	174.7	-69	-74.3	84.1	0	0	110.7	F20 S70 F71 V72 N76 T77 Y78	F20-Q74 HydrophobicContact CD1-CB 4.2Å; F20-Q74 HydrophobicContact CD2-CB 3.74Å; F20-Q74 HydrophobicContact CD2-CG 4.12Å; F20-Q74 HydrophobicContact CE1-CB 3.8Å; F20-Q74 HydrophobicContact CE2-CB 3.32Å; F20-Q74 HydrophobicContact CE2-CG 4.02Å; F20-Q74 HydrophobicContact CG-CB 4.17Å; F20-Q74 HydrophobicContact CZ-CB 3.35Å; F20-Q74 HydrophobicContact CZ-CG 4.5Å; S70-Q74 WeakPolarHBondContact O-CG 3.45Å; S70-Q74 PolarHBondContact O-N 3.38Å; F71-Q74 WeakPolarHBondContact O-CB 3.31Å; F71-Q74 PolarHBondContact O-N 3Å; F71-Q74 VanDerWaalsContact O-N 3.1Å; V72-Q74 VanDerWaalsContact C-N 3.3Å; V72-Q74 PolarHBondContact O-N 3.47Å; Q74-N76 PolarHBondContact O-N 3.06Å; Q74-T77 WeakPolarHBondContact O-CB 3.5Å; Q74-T77 PolarHBondContact O-N 3.19Å; Q74-T77 VanDerWaalsContact O-N 3.1Å; Q74-Y78 WeakPolarHBondContact O-CD2 3.48Å; Q74-Y78 PolarHBondContact O-N 3.06Å; Q74-Y78 VanDerWaalsContact O-N 3.09Å
75	L	96	Very high	94.3	Very high	0 Å²	0	60 Å²	60	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-53.2	-52.3	173.7	-68.2	177.9	0	0	0	111.8	F20 F46 F71 V72 T77 Y78 G79 F80 F90	F20-L75 HydrophobicContact CE1-CD2 3.98Å; F20-L75 HydrophobicContact CZ-CD2 3.82Å; F20-L75 HydrophobicContact CZ-CG 4.1Å; F46-L75 HydrophobicContact CE1-CD2 4.27Å; F46-L75 HydrophobicContact CE2-CD1 4.41Å; F46-L75 HydrophobicContact CZ-CD1 3.81Å; F46-L75 HydrophobicContact CZ-CD2 3.76Å; F46-L75 HydrophobicContact CZ-CG 4.47Å; F71-L75 HydrophobicContact CD1-CD1 4.01Å; F71-L75 HydrophobicContact CE1-CD1 3.6Å; F71-L75 HydrophobicContact CE1-CG 4.2Å; F71-L75 HydrophobicContact CZ-CD1 4.08Å; F71-L75 HydrophobicContact CZ-CD2 4.25Å; F71-L75 HydrophobicContact CZ-CG 4.3Å; F71-L75 PolarHBondContact O-N 3.1Å; V72-L75 WeakPolarHBondContact O-CB 3.46Å; V72-L75 PolarHBondContact O-N 2.96Å; L75-T77 PolarHBondContact O-N 3.14Å; L75-Y78 CarbonylContact O-C 3.44Å; L75-Y78 PolarHBondContact O-N 2.85Å; L75-Y78 VanDerWaalsContact O-N 3.09Å; L75-G79 PolarHBondContact O-N 3.26Å; L75-G79 VanDerWaalsContact O-N 3.13Å; L75-F80 HydrophobicContact CB-CB 3.88Å; L75-F80 HydrophobicContact CB-CD2 4.3Å; L75-F80 HydrophobicContact CB-CG 4.18Å; L75-F80 HydrophobicContact CD2-CB 4.4Å; L75-F80 HydrophobicContact CD2-CD1 4.07Å; L75-F80 HydrophobicContact CD2-CD2 3.88Å; L75-F80 HydrophobicContact CD2-CE1 4.31Å; L75-F80 HydrophobicContact CD2-CE2 4.14Å; L75-F80 HydrophobicContact CD2-CG 3.84Å; L75-F80 HydrophobicContact CD2-CZ 4.34Å; L75-F80 WeakPolarHBondContact O-CB 3.32Å; L75-F80 WeakPolarHBondContact O-CD2 3.29Å; L75-F80 PolarHBondContact O-N 2.89Å; L75-F90 HydrophobicContact CD1-CB 4.41Å; L75-F90 HydrophobicContact CD1-CD1 4.05Å; L75-F90 HydrophobicContact CD1-CD2 3.79Å; L75-F90 HydrophobicContact CD1-CE1 4.21Å; L75-F90 HydrophobicContact CD1-CE2 3.96Å; L75-F90 HydrophobicContact CD1-CG 3.83Å; L75-F90 HydrophobicContact CD1-CZ 4.15Å
76	N	95.1	Very high	94.3	Very high	80 Å²	80	64.6 Å²	64.6	43%	0.428	34%	0.339	S	S	.	.	H	α-helix	trans	-58.3	-37.1	178.9	-68.3	-24.1	0	0	0	112.4	V72 R73 Q74 Y78 G79	V72-N76 PolarHBondContact O-N 3.27Å; V72-N76 PolarHBondContact O-ND2 2.96Å; R73-N76 PolarHBondContact O-N 3.26Å; Q74-N76 PolarHBondContact O-N 3.06Å; N76-Y78 VanDerWaalsContact C-N 3.34Å; N76-Y78 PolarHBondContact O-N 3.06Å; N76-G79 PolarHBondContact O-N 3.34Å; N76-G79 VanDerWaalsContact O-N 3.09Å
77	T	93.4	Very high	94.2	Very high	31 Å²	31	66.4 Å²	66.4	19%	0.19	33%	0.334	C	S	.	.	H	α-helix	trans	-68.5	-31.5	-179.9	-61.3	0	0	0	0	112.8	R73 Q74 L75 G79 R108 R109	R73-T77 WeakPolarHBondContact O-CB 3.25Å; R73-T77 PolarHBondContact O-N 3.33Å; R73-T77 VanDerWaalsContact O-N 3.08Å; R73-T77 PolarHBondContact O-OG1 2.9Å; Q74-T77 WeakPolarHBondContact O-CB 3.5Å; Q74-T77 PolarHBondContact O-N 3.19Å; Q74-T77 VanDerWaalsContact O-N 3.1Å; L75-T77 PolarHBondContact O-N 3.14Å; T77-G79 VanDerWaalsContact C-N 3.29Å; T77-R108 HydrophobicContact CG2-CG 3.42Å; T77-R108 VanDerWaalsContact CG2-CG 3.42Å; T77-R109 PolarHBondContact O-N 2.91Å
78	Y	94.9	Very high	94.3	Very high	32 Å²	32	67.2 Å²	67.2	13%	0.125	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	5.8	172.2	-71.2	-75.5	0	0	0	113.2	A18 F20 L21 Q74 L75 N76 N92 I106 R108	A18-Y78 HydrophobicContact CB-CE1 3.74Å; A18-Y78 WeakPolarHBondContact CB-OH 3.31Å; F20-Y78 HydrophobicContact CB-CE2 3.95Å; F20-Y78 AromaticContact CD1-CD2 3.35Å; F20-Y78 HydrophobicContact CD1-CD2 3.35Å; F20-Y78 AromaticContact CD1-CE2 3.36Å; F20-Y78 HydrophobicContact CD1-CE2 3.36Å; F20-Y78 HydrophobicContact CD1-CG 4.37Å; F20-Y78 AromaticContact CE1-CD2 3.74Å; F20-Y78 HydrophobicContact CE1-CD2 3.74Å; F20-Y78 HydrophobicContact CE1-CE2 4.16Å; F20-Y78 HydrophobicContact CG-CD2 4.29Å; F20-Y78 AromaticContact CG-CE2 3.87Å; F20-Y78 HydrophobicContact CG-CE2 3.87Å; L21-Y78 HydrophobicContact CD1-CD1 4.05Å; L21-Y78 HydrophobicContact CD1-CE1 4.24Å; L21-Y78 HydrophobicContact CD2-CD1 4.19Å; L21-Y78 HydrophobicContact CD2-CD2 4.28Å; L21-Y78 HydrophobicContact CD2-CG 3.93Å; L21-Y78 HydrophobicContact CG-CD1 4.24Å; L21-Y78 HydrophobicContact CG-CE1 4.39Å; L21-Y78 HydrophobicContact CG-CG 4.39Å; Q74-Y78 WeakPolarHBondContact O-CD2 3.48Å; Q74-Y78 PolarHBondContact O-N 3.06Å; Q74-Y78 VanDerWaalsContact O-N 3.09Å; L75-Y78 CarbonylContact O-C 3.44Å; L75-Y78 PolarHBondContact O-N 2.85Å; L75-Y78 VanDerWaalsContact O-N 3.09Å; N76-Y78 VanDerWaalsContact C-N 3.34Å; N76-Y78 PolarHBondContact O-N 3.06Å; Y78-N92 PolarHBondContact O-ND2 3.13Å; Y78-I106 HydrophobicContact CD1-CG2 4.05Å; Y78-I106 HydrophobicContact CG-CG2 4.35Å; Y78-I106 WeakPolarHBondContact O-CG2 3.44Å; Y78-R108 HydrophobicContact CD1-CB 4.49Å; Y78-R108 HydrophobicContact CE1-CB 4.2Å; Y78-R108 HydrophobicContact CE1-CG 4.49Å
79	G	93.9	Very high	94.3	Very high	10 Å²	10	67.2 Å²	67.2	10%	0.103	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.3	16.6	172.5	0	0	0	0	0	115.7	L75 N76 T77 R109	L75-G79 PolarHBondContact O-N 3.26Å; L75-G79 VanDerWaalsContact O-N 3.13Å; N76-G79 PolarHBondContact O-N 3.34Å; N76-G79 VanDerWaalsContact O-N 3.09Å; T77-G79 VanDerWaalsContact C-N 3.29Å; G79-R109 VanDerWaalsContact CA-NE 3.27Å; G79-R109 PolarHBondContact O-NH2 2.9Å
80	F	95.7	Very high	94.4	Very high	4 Å²	4	63.6 Å²	63.6	2%	0.018	31%	0.306	C	S	.	.			trans	-62.5	143.6	166.8	-70.4	-101.5	0	0	0	110.1	L21 F46 L75 F90 A91 N92 F95 I106	L21-F80 HydrophobicContact CD2-CE2 3.73Å; L21-F80 HydrophobicContact CD2-CZ 4.1Å; F46-F80 AromaticContact CE1-CD1 3.95Å; F46-F80 HydrophobicContact CE1-CD1 3.95Å; F46-F80 AromaticContact CE1-CE1 3.76Å; F46-F80 HydrophobicContact CE1-CE1 3.76Å; L75-F80 HydrophobicContact CB-CB 3.88Å; L75-F80 HydrophobicContact CB-CD2 4.3Å; L75-F80 HydrophobicContact CB-CG 4.18Å; L75-F80 HydrophobicContact CD2-CB 4.4Å; L75-F80 HydrophobicContact CD2-CD1 4.07Å; L75-F80 HydrophobicContact CD2-CD2 3.88Å; L75-F80 HydrophobicContact CD2-CE1 4.31Å; L75-F80 HydrophobicContact CD2-CE2 4.14Å; L75-F80 HydrophobicContact CD2-CG 3.84Å; L75-F80 HydrophobicContact CD2-CZ 4.34Å; L75-F80 WeakPolarHBondContact O-CB 3.32Å; L75-F80 WeakPolarHBondContact O-CD2 3.29Å; L75-F80 PolarHBondContact O-N 2.89Å; F80-F90 HydrophobicContact CB-CB 4.48Å; F80-F90 HydrophobicContact CD1-CB 4.32Å; F80-A91 WeakPolarHBondContact CA-O 3.28Å; F80-N92 HydrophobicContact CD1-CB 3.63Å; F80-N92 HydrophobicContact CD2-CB 4.33Å; F80-N92 HydrophobicContact CE1-CB 3.61Å; F80-N92 HydrophobicContact CE2-CB 4.31Å; F80-N92 HydrophobicContact CG-CB 4.01Å; F80-N92 HydrophobicContact CZ-CB 3.97Å; F80-F95 HydrophobicContact CE1-CB 3.69Å; F80-F95 AromaticContact CE1-CD1 3.81Å; F80-F95 HydrophobicContact CE1-CD1 3.81Å; F80-F95 AromaticContact CE1-CD2 3.96Å; F80-F95 HydrophobicContact CE1-CD2 3.96Å; F80-F95 HydrophobicContact CE1-CE1 4.41Å; F80-F95 AromaticContact CE1-CG 3.55Å; F80-F95 HydrophobicContact CE1-CG 3.55Å; F80-F95 HydrophobicContact CZ-CB 3.79Å; F80-F95 HydrophobicContact CZ-CD1 4.25Å; F80-F95 AromaticContact CZ-CD2 3.54Å; F80-F95 HydrophobicContact CZ-CD2 3.54Å; F80-F95 HydrophobicContact CZ-CE2 4.15Å; F80-F95 AromaticContact CZ-CG 3.6Å; F80-F95 HydrophobicContact CZ-CG 3.6Å; F80-I106 HydrophobicContact CZ-CD1 4.36Å
81	R	94.5	Very high	94.4	Very high	157 Å²	157	62.6 Å²	62.6	59%	0.592	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.7	144.2	176.3	-66.3	-175.1	-71.2	-148.4	-3.8	109.7	V83 F90 A91	R81-V83 PolarHBondContact O-N 2.97Å; R81-F90 VanDerWaalsContact O-CA 3.31Å; R81-F90 WeakPolarHBondContact O-CA 3.11Å; R81-A91 PolarHBondContact N-O 3.01Å; R81-A91 PolarHBondContact O-N 3.18Å
82	K	95	Very high	94.4	Very high	87 Å²	87	63.6 Å²	63.6	38%	0.378	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	118.5	172.1	-165.3	179.3	-177.5	-172	0	108.3	V84 P85 R87 E89 F90	K82-V84 WeakPolarHBondContact CE-O 3.41Å; K82-V84 WeakPolarHBondContact CG-O 3.4Å; K82-P85 WeakPolarHBondContact CE-O 2.84Å; K82-P85 PolarHBondContact NZ-O 3.01Å; K82-R87 WeakPolarHBondContact CE-O 3.15Å; K82-E89 CarbonylContact C-O 3.5Å; K82-E89 VanDerWaalsContact CA-O 3.23Å; K82-E89 WeakPolarHBondContact CA-O 3.17Å; K82-F90 HydrophobicContact CB-CD1 4.4Å; K82-F90 HydrophobicContact CB-CE1 4.25Å
83	V	93.5	Very high	94.2	Very high	79 Å²	79	67.9 Å²	67.9	48%	0.479	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	-41	-175.5	-177.5	0	0	0	0	110.9	R81 E89 A91	R81-V83 PolarHBondContact O-N 2.97Å; V83-E89 HydrophobicContact CB-CB 4.44Å; V83-E89 HydrophobicContact CB-CG 4.03Å; V83-E89 HydrophobicContact CG2-CG 4.21Å; V83-E89 PolarHBondContact N-O 3.5Å; V83-A91 HydrophobicContact CG2-CB 3.31Å
84	V	92.3	Very high	94.2	Very high	45 Å²	45	61.7 Å²	61.7	27%	0.273	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	127.1	-176.6	178.5	0	0	0	0	108.8	K82 D86 R87 E89	K82-V84 WeakPolarHBondContact CE-O 3.41Å; K82-V84 WeakPolarHBondContact CG-O 3.4Å; V84-D86 VanDerWaalsContact C-N 3.31Å; V84-D86 PolarHBondContact O-N 3.19Å; V84-R87 HydrophobicContact CB-CB 4.03Å; V84-R87 HydrophobicContact CG1-CB 3.89Å; V84-R87 HydrophobicContact CG1-CG 4.13Å; V84-R87 PolarHBondContact O-N 3.45Å; V84-E89 HydrophobicContact CB-CB 4.46Å; V84-E89 HydrophobicContact CG2-CB 4.45Å; V84-E89 WeakPolarHBondContact CG2-OE2 3.35Å
85	P	90.6	Very high	94.1	Very high	98 Å²	98	59 Å²	59	64%	0.636	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-34	-178.7	24.2	-32.8	0	0	0	113	K82	K82-P85 WeakPolarHBondContact CE-O 2.84Å; K82-P85 PolarHBondContact NZ-O 3.01Å
86	D	92	Very high	93.9	Very high	151 Å²	151	63.1 Å²	63.1	81%	0.807	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-5.5	-175.1	-57.1	-39.7	0	0	0	114.1	V84	V84-D86 VanDerWaalsContact C-N 3.31Å; V84-D86 PolarHBondContact O-N 3.19Å
87	R	91.9	Very high	93.8	Very high	121 Å²	121	65.3 Å²	65.3	46%	0.457	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.4	150	178.5	-70.6	-178.3	153.5	-153.4	-1.8	110.9	W49 K82 V84 E89	W49-R87 VanDerWaalsContact CH2-NH1 3.34Å; K82-R87 WeakPolarHBondContact CE-O 3.15Å; V84-R87 HydrophobicContact CB-CB 4.03Å; V84-R87 HydrophobicContact CG1-CB 3.89Å; V84-R87 HydrophobicContact CG1-CG 4.13Å; V84-R87 PolarHBondContact O-N 3.45Å; R87-E89 HydrophobicContact CB-CB 4.49Å; R87-E89 PolarHBondContact O-N 3.38Å
88	W	95.2	Very high	93.6	Very high	97 Å²	97	66.7 Å²	66.7	37%	0.367	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	56.3	173.1	-64.1	105	0	0	0	111.1	V48 F68 F90	V48-W88 HydrophobicContact CB-CB 3.79Å; V48-W88 PolarHBondContact N-O 3.37Å; V48-W88 WeakPolarHBondContact O-CB 3.32Å; F68-W88 AromaticContact CE1-CD2 3.83Å; F68-W88 HydrophobicContact CE1-CD2 3.83Å; F68-W88 AromaticContact CE1-CE2 3.97Å; F68-W88 AromaticContact CE1-CE3 3.83Å; F68-W88 HydrophobicContact CE1-CE3 3.83Å; F68-W88 HydrophobicContact CE1-CG 4.45Å; F68-W88 HydrophobicContact CE1-CH2 4.09Å; F68-W88 HydrophobicContact CE1-CZ2 4.11Å; F68-W88 AromaticContact CE1-CZ3 3.96Å; F68-W88 HydrophobicContact CE1-CZ3 3.96Å; F68-W88 HydrophobicContact CZ-CB 4.46Å; F68-W88 AromaticContact CZ-CD2 3.9Å; F68-W88 HydrophobicContact CZ-CD2 3.9Å; F68-W88 AromaticContact CZ-CE3 3.94Å; F68-W88 HydrophobicContact CZ-CE3 3.94Å; F68-W88 HydrophobicContact CZ-CG 4.15Å; F68-W88 HydrophobicContact CZ-CZ3 4.47Å; W88-F90 HydrophobicContact CB-CE2 4.17Å; W88-F90 HydrophobicContact CE3-CE2 4.08Å; W88-F90 AromaticContact CE3-CZ 3.76Å; W88-F90 HydrophobicContact CE3-CZ 3.76Å; W88-F90 HydrophobicContact CZ3-CZ 4.3Å
89	E	96.4	Very high	93.3	Very high	26 Å²	26	69.6 Å²	69.6	12%	0.121	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	124.6	177.6	-176.1	171.7	169.9	0	0	110.5	S45 F46 V47 K82 V83 V84 R87	S45-E89 WeakPolarHBondContact CB-OE1 3.22Å; S45-E89 PolarHBondContact OG-OE1 2.67Å; F46-E89 WeakPolarHBondContact O-CA 3.39Å; V47-E89 HydrophobicContact CG2-CB 4.08Å; V47-E89 HydrophobicContact CG2-CG 3.87Å; K82-E89 CarbonylContact C-O 3.5Å; K82-E89 VanDerWaalsContact CA-O 3.23Å; K82-E89 WeakPolarHBondContact CA-O 3.17Å; V83-E89 HydrophobicContact CB-CB 4.44Å; V83-E89 HydrophobicContact CB-CG 4.03Å; V83-E89 HydrophobicContact CG2-CG 4.21Å; V83-E89 PolarHBondContact N-O 3.5Å; V84-E89 HydrophobicContact CB-CB 4.46Å; V84-E89 HydrophobicContact CG2-CB 4.45Å; V84-E89 WeakPolarHBondContact CG2-OE2 3.35Å; R87-E89 HydrophobicContact CB-CB 4.49Å; R87-E89 PolarHBondContact O-N 3.38Å
90	F	96.4	Very high	93	Very high	3 Å²	3	73.4 Å²	73.4	1%	0.013	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	134.1	-178.6	-62.8	-84.8	0	0	0	111.2	S45 F46 V72 L75 F80 R81 K82 W88	S45-F90 VanDerWaalsContact CA-O 3.28Å; S45-F90 WeakPolarHBondContact CA-O 3.44Å; S45-F90 WeakPolarHBondContact CB-O 3.35Å; F46-F90 HydrophobicContact CE1-CB 3.93Å; F46-F90 HydrophobicContact CE2-CB 4.24Å; F46-F90 HydrophobicContact CE2-CD2 4.01Å; F46-F90 HydrophobicContact CZ-CB 3.76Å; F46-F90 HydrophobicContact CZ-CD2 4.17Å; F46-F90 HydrophobicContact CZ-CG 4.3Å; F46-F90 PolarHBondContact N-O 3.31Å; F46-F90 PolarHBondContact O-N 3.25Å; V72-F90 HydrophobicContact CG1-CE1 4.38Å; V72-F90 HydrophobicContact CG1-CZ 4.21Å; V72-F90 HydrophobicContact CG2-CZ 4.06Å; L75-F90 HydrophobicContact CD1-CB 4.41Å; L75-F90 HydrophobicContact CD1-CD1 4.05Å; L75-F90 HydrophobicContact CD1-CD2 3.79Å; L75-F90 HydrophobicContact CD1-CE1 4.21Å; L75-F90 HydrophobicContact CD1-CE2 3.96Å; L75-F90 HydrophobicContact CD1-CG 3.83Å; L75-F90 HydrophobicContact CD1-CZ 4.15Å; F80-F90 HydrophobicContact CB-CB 4.48Å; F80-F90 HydrophobicContact CD1-CB 4.32Å; R81-F90 VanDerWaalsContact O-CA 3.31Å; R81-F90 WeakPolarHBondContact O-CA 3.11Å; K82-F90 HydrophobicContact CB-CD1 4.4Å; K82-F90 HydrophobicContact CB-CE1 4.25Å; W88-F90 HydrophobicContact CB-CE2 4.17Å; W88-F90 HydrophobicContact CE3-CE2 4.08Å; W88-F90 AromaticContact CE3-CZ 3.76Å; W88-F90 HydrophobicContact CE3-CZ 3.76Å; W88-F90 HydrophobicContact CZ3-CZ 4.3Å
91	A	95.1	Very high	92.7	Very high	27 Å²	27	76 Å²	76	22%	0.223	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	149.4	176.8	0	0	0	0	0	112.3	F80 R81 V83	F80-A91 WeakPolarHBondContact CA-O 3.28Å; R81-A91 PolarHBondContact N-O 3.01Å; R81-A91 PolarHBondContact O-N 3.18Å; V83-A91 HydrophobicContact CG2-CB 3.31Å
92	N	94.7	Very high	92.5	Very high	20 Å²	20	71.2 Å²	71.2	11%	0.107	38%	0.379	C	S	.	.			trans	-150.1	138	169.5	-172.2	-45.4	0	0	0	108.4	Y78 F80 N94 F95	Y78-N92 PolarHBondContact O-ND2 3.13Å; F80-N92 HydrophobicContact CD1-CB 3.63Å; F80-N92 HydrophobicContact CD2-CB 4.33Å; F80-N92 HydrophobicContact CE1-CB 3.61Å; F80-N92 HydrophobicContact CE2-CB 4.31Å; F80-N92 HydrophobicContact CG-CB 4.01Å; F80-N92 HydrophobicContact CZ-CB 3.97Å; N92-N94 PolarHBondContact O-N 3Å; N92-N94 VanDerWaalsContact O-N 3.12Å; N92-N94 PolarHBondContact OD1-N 3.26Å; N92-F95 HydrophobicContact CB-CB 3.87Å; N92-F95 PolarHBondContact O-N 3.32Å
93	D	92.7	Very high	92.3	Very high	113 Å²	113	67.1 Å²	67.1	60%	0.604	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-32.8	-171.6	-55.7	-34.2	0	0	0	113.2	R96	D93-R96 PolarHBondContact O-NE 2.87Å
94	N	93.2	Very high	92.1	Very high	57 Å²	57	66 Å²	66	31%	0.305	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	7.1	-177.5	-69.5	-30.2	0	0	0	113.5	N92 L102 I106	N92-N94 PolarHBondContact O-N 3Å; N92-N94 VanDerWaalsContact O-N 3.12Å; N92-N94 PolarHBondContact OD1-N 3.26Å; N94-L102 HydrophobicContact CB-CB 4.3Å; N94-L102 CarbonylContact O-C 3.51Å; N94-L102 WeakPolarHBondContact O-CB 3.31Å; N94-I106 HydrophobicContact CB-CD1 4.12Å; N94-I106 HydrophobicContact CB-CG1 3.5Å; N94-I106 VanDerWaalsContact CB-CG1 3.5Å
95	F	93.3	Very high	92	Very high	1 Å²	1	65.5 Å²	65.5	0%	0.004	36%	0.361	C	S	.	.			trans	-109.4	96.1	176.9	-167	-94.1	0	0	0	109.5	T24 H25 W39 F46 F80 N92 L103 I106	T24-F95 HydrophobicContact CG2-CZ 4.04Å; H25-F95 HydrophobicContact CB-CE2 3.92Å; H25-F95 HydrophobicContact CB-CZ 4.03Å; W39-F95 AromaticContact CH2-CD1 3.45Å; W39-F95 HydrophobicContact CH2-CD1 3.45Å; W39-F95 VanDerWaalsContact CH2-CD1 3.45Å; W39-F95 AromaticContact CH2-CE1 3.16Å; W39-F95 HydrophobicContact CH2-CE1 3.16Å; W39-F95 HydrophobicContact CH2-CG 4.41Å; W39-F95 AromaticContact CH2-CZ 3.93Å; W39-F95 HydrophobicContact CH2-CZ 3.93Å; W39-F95 HydrophobicContact CZ2-CE1 4.01Å; W39-F95 HydrophobicContact CZ2-CZ 4.47Å; W39-F95 AromaticContact CZ3-CD1 3.61Å; W39-F95 HydrophobicContact CZ3-CD1 3.61Å; W39-F95 AromaticContact CZ3-CE1 3.59Å; W39-F95 HydrophobicContact CZ3-CE1 3.59Å; F46-F95 AromaticContact CD1-CD1 3.94Å; F46-F95 HydrophobicContact CD1-CD1 3.94Å; F46-F95 AromaticContact CD1-CE1 3.52Å; F46-F95 HydrophobicContact CD1-CE1 3.52Å; F46-F95 HydrophobicContact CD1-CZ 4.45Å; F46-F95 HydrophobicContact CE1-CD1 4.25Å; F46-F95 AromaticContact CE1-CE1 3.88Å; F46-F95 HydrophobicContact CE1-CE1 3.88Å; F46-F95 HydrophobicContact CE1-CZ 4.5Å; F46-F95 HydrophobicContact CG-CE1 4.48Å; F80-F95 HydrophobicContact CE1-CB 3.69Å; F80-F95 AromaticContact CE1-CD1 3.81Å; F80-F95 HydrophobicContact CE1-CD1 3.81Å; F80-F95 AromaticContact CE1-CD2 3.96Å; F80-F95 HydrophobicContact CE1-CD2 3.96Å; F80-F95 HydrophobicContact CE1-CE1 4.41Å; F80-F95 AromaticContact CE1-CG 3.55Å; F80-F95 HydrophobicContact CE1-CG 3.55Å; F80-F95 HydrophobicContact CZ-CB 3.79Å; F80-F95 HydrophobicContact CZ-CD1 4.25Å; F80-F95 AromaticContact CZ-CD2 3.54Å; F80-F95 HydrophobicContact CZ-CD2 3.54Å; F80-F95 HydrophobicContact CZ-CE2 4.15Å; F80-F95 AromaticContact CZ-CG 3.6Å; F80-F95 HydrophobicContact CZ-CG 3.6Å; N92-F95 HydrophobicContact CB-CB 3.87Å; N92-F95 PolarHBondContact O-N 3.32Å; F95-L103 HydrophobicContact CD2-CD2 3.35Å; F95-L103 HydrophobicContact CE2-CD2 3.77Å; F95-L103 HydrophobicContact CG-CD2 4.33Å; F95-I106 HydrophobicContact CB-CD1 3.92Å; F95-I106 HydrophobicContact CD2-CD1 4.17Å
96	R	93	Very high	92	Very high	87 Å²	87	61.4 Å²	61.4	33%	0.328	33%	0.333	S	S	.	.			trans	-128	151.1	-174.6	-61.2	-173.1	-176.3	-179.1	-1	112.4	H25 W39 G43 D93 E99 L102	H25-R96 PolarHBondContact NE2-O 3.33Å; W39-R96 VanDerWaalsContact CH2-C 3.48Å; G43-R96 CarbonylContact O-C 3.58Å; G43-R96 VanDerWaalsContact O-CA 3.3Å; G43-R96 WeakPolarHBondContact O-CA 3.5Å; D93-R96 PolarHBondContact O-NE 2.87Å; R96-E99 HydrophobicContact CB-CB 4.23Å; R96-E99 PolarHBondContact O-N 3.42Å; R96-L102 HydrophobicContact CG-CD1 4.22Å
97	R	91.8	Very high	91.9	Very high	125 Å²	125	64.3 Å²	64.3	47%	0.472	33%	0.333	S	S	.	.	S	Bend	trans	-60.4	133.4	174.4	-170.8	177.2	178.4	-157.1	3.3	110.5	E29 W39 G43 E99	E29-R97 IonicContact OE1-NE 3.14Å; E29-R97 PolarHBondContact OE1-NE 3.47Å; E29-R97 VanDerWaalsContact OE1-NE 3.16Å; E29-R97 IonicContact OE1-NH2 3.49Å; E29-R97 WeakPolarHBondContact OE2-CG 3.23Å; W39-R97 HydrophobicContact CD2-CB 3.75Å; W39-R97 HydrophobicContact CD2-CG 4.08Å; W39-R97 HydrophobicContact CE3-CB 4.09Å; W39-R97 HydrophobicContact CG-CB 4.06Å; W39-R97 HydrophobicContact CG-CG 3.97Å; W39-R97 HydrophobicContact CZ2-CB 4.28Å; W39-R97 HydrophobicContact CZ3-CB 4.47Å; G43-R97 PolarHBondContact O-N 3.04Å; R97-E99 PolarHBondContact O-N 2.88Å
98	G	89.8	Confident	91.8	Very high	61 Å²	61	66.4 Å²	66.4	63%	0.629	34%	0.341	S	S	*	.	S	Bend	trans	71.6	-20.9	-179.1	0	0	0	0	0	117	E29 Q100	E29-G98 PolarHBondContact OE2-N 3.36Å; G98-Q100 PolarHBondContact O-N 3.26Å
99	E	88.1	Confident	91.5	Very high	93 Å²	93	69 Å²	69	44%	0.435	35%	0.351	S	S	.	.			trans	-98.8	64.6	-175.5	-65.4	178.5	-168.7	0	0	112.9	R96 R97 G101 L102	R96-E99 HydrophobicContact CB-CB 4.23Å; R96-E99 PolarHBondContact O-N 3.42Å; R97-E99 PolarHBondContact O-N 2.88Å; E99-G101 PolarHBondContact O-N 3.38Å; E99-G101 VanDerWaalsContact O-N 3.11Å; E99-L102 HydrophobicContact CB-CD1 4.11Å; E99-L102 HydrophobicContact CB-CG 4.22Å; E99-L102 PolarHBondContact O-N 3.14Å; E99-L102 WeakPolarHBondContact OE2-CD1 3.35Å
100	Q	87.7	Confident	90.6	Very high	89 Å²	89	76.7 Å²	76.7	42%	0.416	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-60.8	-21.9	178.8	-70.9	-174.6	3.3	0	0	114	H25 G98 L102 L103	H25-Q100 WeakPolarHBondContact CE1-CG 3.39Å; H25-Q100 VanDerWaalsContact ND1-CG 3.3Å; H25-Q100 WeakPolarHBondContact ND1-CG 3.27Å; H25-Q100 PolarHBondContact ND1-NE2 2.99Å; H25-Q100 VanDerWaalsContact ND1-NE2 3.1Å; G98-Q100 PolarHBondContact O-N 3.26Å; Q100-L102 VanDerWaalsContact C-N 3.28Å; Q100-L102 PolarHBondContact O-N 3.12Å; Q100-L103 HydrophobicContact CB-CD1 4.25Å; Q100-L103 HydrophobicContact CG-CD1 4.38Å; Q100-L103 VanDerWaalsContact O-CB 3.29Å; Q100-L103 WeakPolarHBondContact O-CB 3.47Å; Q100-L103 VanDerWaalsContact O-CG 3.24Å; Q100-L103 WeakPolarHBondContact O-CG 3.09Å; Q100-L103 PolarHBondContact O-N 2.69Å
101	G	89	Confident	89	Confident	59 Å²	59	81.5 Å²	81.5	61%	0.608	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-62.6	-32.3	176.9	0	0	0	0	0	113.5	E99 L103 S104	E99-G101 PolarHBondContact O-N 3.38Å; E99-G101 VanDerWaalsContact O-N 3.11Å; G101-L103 PolarHBondContact O-N 3.27Å; G101-S104 PolarHBondContact O-N 3.27Å; G101-S104 PolarHBondContact O-OG 3.45Å
102	L	91.2	Very high	87	Confident	56 Å²	56	86.3 Å²	86.3	29%	0.293	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-69.4	-20.3	179.5	-69	-176.5	0	0	0	113	N94 R96 E99 Q100 S104 G105	N94-L102 HydrophobicContact CB-CB 4.3Å; N94-L102 CarbonylContact O-C 3.51Å; N94-L102 WeakPolarHBondContact O-CB 3.31Å; R96-L102 HydrophobicContact CG-CD1 4.22Å; E99-L102 HydrophobicContact CB-CD1 4.11Å; E99-L102 HydrophobicContact CB-CG 4.22Å; E99-L102 PolarHBondContact O-N 3.14Å; E99-L102 WeakPolarHBondContact OE2-CD1 3.35Å; Q100-L102 VanDerWaalsContact C-N 3.28Å; Q100-L102 PolarHBondContact O-N 3.12Å; L102-S104 PolarHBondContact O-N 3.34Å; L102-S104 VanDerWaalsContact O-N 3.08Å; L102-G105 PolarHBondContact O-N 3.24Å
103	L	91.3	Very high	85	Confident	1 Å²	1	89.1 Å²	89.1	1%	0.005	47%	0.471	C	S	.	.	G	3₁₀ helix	trans	-58.2	-27.3	178.2	-58.3	178.8	0	0	0	112.4	P17 L21 H25 F95 Q100 G101 G105 I106	P17-L103 HydrophobicContact CB-CB 3.7Å; L21-L103 HydrophobicContact CB-CD2 4.46Å; H25-L103 HydrophobicContact CB-CD1 3.85Å; F95-L103 HydrophobicContact CD2-CD2 3.35Å; F95-L103 HydrophobicContact CE2-CD2 3.77Å; F95-L103 HydrophobicContact CG-CD2 4.33Å; Q100-L103 HydrophobicContact CB-CD1 4.25Å; Q100-L103 HydrophobicContact CG-CD1 4.38Å; Q100-L103 VanDerWaalsContact O-CB 3.29Å; Q100-L103 WeakPolarHBondContact O-CB 3.47Å; Q100-L103 VanDerWaalsContact O-CG 3.24Å; Q100-L103 WeakPolarHBondContact O-CG 3.09Å; Q100-L103 PolarHBondContact O-N 2.69Å; G101-L103 PolarHBondContact O-N 3.27Å; L103-G105 PolarHBondContact O-N 3.02Å; L103-I106 HydrophobicContact CD2-CD1 4.12Å; L103-I106 PolarHBondContact O-N 2.63Å
104	S	89.2	Confident	82.9	Confident	56 Å²	56	91.6 Å²	91.6	39%	0.392	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-64.1	-25.8	174.7	64.2	0	0	0	0	113.5	G101 L102 I106	G101-S104 PolarHBondContact O-N 3.27Å; G101-S104 PolarHBondContact O-OG 3.45Å; L102-S104 PolarHBondContact O-N 3.34Å; L102-S104 VanDerWaalsContact O-N 3.08Å; S104-I106 VanDerWaalsContact C-N 3.33Å
105	G	88.6	Confident	80.8	Confident	34 Å²	34	98 Å²	98	35%	0.351	51%	0.511	S	S	.	.	G	3₁₀ helix	trans	-77.3	-16	176.2	0	0	0	0	0	113.9	L102 L103 R107	L102-G105 PolarHBondContact O-N 3.24Å; L103-G105 PolarHBondContact O-N 3.02Å; G105-R107 PolarHBondContact O-N 2.84Å
106	I	91.8	Very high	78.8	Confident	12 Å²	12	106.1 Å²	106.1	6%	0.062	55%	0.551	C	S	.	*			trans	-82.9	105.9	-179.4	-57	172.8	0	0	0	109.3	L21 Y78 F80 N94 F95 L103 S104	L21-I106 HydrophobicContact CD1-CB 3.61Å; L21-I106 HydrophobicContact CD1-CD1 4.29Å; L21-I106 HydrophobicContact CD1-CG2 3.77Å; L21-I106 HydrophobicContact CD2-CB 4.5Å; L21-I106 HydrophobicContact CD2-CD1 4.13Å; L21-I106 HydrophobicContact CD2-CG2 4Å; Y78-I106 HydrophobicContact CD1-CG2 4.05Å; Y78-I106 HydrophobicContact CG-CG2 4.35Å; Y78-I106 WeakPolarHBondContact O-CG2 3.44Å; F80-I106 HydrophobicContact CZ-CD1 4.36Å; N94-I106 HydrophobicContact CB-CD1 4.12Å; N94-I106 HydrophobicContact CB-CG1 3.5Å; N94-I106 VanDerWaalsContact CB-CG1 3.5Å; F95-I106 HydrophobicContact CB-CD1 3.92Å; F95-I106 HydrophobicContact CD2-CD1 4.17Å; L103-I106 HydrophobicContact CD2-CD1 4.12Å; L103-I106 PolarHBondContact O-N 2.63Å; S104-I106 VanDerWaalsContact C-N 3.33Å
107	R	89.2	Confident	76.7	Confident	213 Å²	213	106.6 Å²	106.6	80%	0.804	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-100.7	143.4	178	-64.3	179.4	68.2	-140.3	2.3	111.1	G105 R109	G105-R107 PolarHBondContact O-N 2.84Å; R107-R109 PolarHBondContact O-N 2.93Å
108	R	90.7	Very high	74.6	Confident	165 Å²	165	109.9 Å²	109.9	62%	0.623	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-58.7	128.2	173.1	-159.4	-178	-169.5	-170.2	2	109.6	T77 Y78 K110	T77-R108 HydrophobicContact CG2-CG 3.42Å; T77-R108 VanDerWaalsContact CG2-CG 3.42Å; Y78-R108 HydrophobicContact CD1-CB 4.49Å; Y78-R108 HydrophobicContact CE1-CB 4.2Å; Y78-R108 HydrophobicContact CE1-CG 4.49Å; R108-K110 PolarHBondContact O-N 3.06Å
109	R	88.8	Confident	72.4	Confident	152 Å²	152	112.7 Å²	112.7	57%	0.574	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-62.2	120.3	172.9	-67.2	-175.6	173.3	176.8	3.8	108.5	T77 G79 R107 S111	T77-R109 PolarHBondContact O-N 2.91Å; G79-R109 VanDerWaalsContact CA-NE 3.27Å; G79-R109 PolarHBondContact O-NH2 2.9Å; R107-R109 PolarHBondContact O-N 2.93Å; R109-S111 PolarHBondContact O-N 2.88Å
110	K	76.2	Confident	70.3	Confident	186 Å²	186	112 Å²	112	81%	0.809	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-70.4	120.3	169.1	-168.2	77.8	-178.7	-170.9	0	105.9	R108 T112	R108-K110 PolarHBondContact O-N 3.06Å; K110-T112 PolarHBondContact O-N 3.36Å
111	S	64.2	Low	68.2	Low	104 Å²	104	114 Å²	114	73%	0.727	64%	0.637	S	S	*	*			trans	-59.2	104.9	164.9	50.1	0	0	0	0	106.7	R109 A113	R109-S111 PolarHBondContact O-N 2.88Å; S111-A113 PolarHBondContact O-N 3.01Å
112	T	52.2	Low	65.9	Low	128 Å²	128	114.9 Å²	114.9	79%	0.785	65%	0.646	S	S	*	*			trans	-66.4	82.6	170.7	-44.4	0	0	0	0	106.7	K110 L114	K110-T112 PolarHBondContact O-N 3.36Å; T112-L114 PolarHBondContact O-N 3.17Å
113	A	52	Low	63.4	Low	80 Å²	80	116.2 Å²	116.2	66%	0.661	67%	0.673	S	S	*	*			trans	-58.1	123.2	156.9	0	0	0	0	0	105.4	S111 Q115	S111-A113 PolarHBondContact O-N 3.01Å; A113-Q115 PolarHBondContact O-N 3.44Å
114	L	50.5	Low	61.2	Low	165 Å²	165	122.4 Å²	122.4	86%	0.864	72%	0.716	S	S	*	*			trans	-39.5	104.8	-179.3	-69.6	119.4	0	0	0	111.1	T112 M116	T112-L114 PolarHBondContact O-N 3.17Å; L114-M116 PolarHBondContact O-N 3.33Å
115	Q	48.9	Very low	58.8	Low	192 Å²	192	123.5 Å²	123.5	90%	0.897	74%	0.736	S	S	*	*			trans	-75.5	86.3	163.6	-76	-170.4	-13.7	0	0	106.9	A113 S117	A113-Q115 PolarHBondContact O-N 3.44Å; Q115-S117 PolarHBondContact O-N 3.06Å
116	M	50.9	Low	56.7	Low	171 Å²	171	125 Å²	125	84%	0.842	75%	0.753	S	S	*	*			trans	-70.3	114	164.7	-154	75.8	164.9	0	0	107.1	L114	L114-M116 PolarHBondContact O-N 3.33Å
117	S	48.2	Very low	54.4	Low	96 Å²	96	130.7 Å²	130.7	67%	0.671	79%	0.787	S	S	*	*			trans	-51.2	128.9	170.3	52.2	0	0	0	0	112.4	Q115	Q115-S117 PolarHBondContact O-N 3.06Å
118	K	47.6	Very low	52.8	Low	194 Å²	194	127.5 Å²	127.5	84%	0.843	79%	0.786	S	S	*	*				174.8	118.6	127	-96.5	165.3	-179	173.5	0	111.8
119	S	44.4	Very low	50.5	Low	121 Å²	121	124.3 Å²	124.3	85%	0.846	80%	0.795	S	S	*	*			trans	-5.8	122.4	147.4	52.3	0	0	0	0	116.9
120	G	43.4	Very low	48.6	Very low	78 Å²	78	123.2 Å²	123.2	80%	0.804	81%	0.806	S	S	*	*			trans	175.8	103.6	169	0	0	0	0	0	111.7
121	S	44	Very low	47.6	Very low	132 Å²	132	123.1 Å²	123.1	92%	0.923	81%	0.805	S	S	*	*			trans	-62.7	138.5	-179.9	175.8	0	0	0	0	113.5
122	G	40.2	Very low	48	Very low	77 Å²	77	123.7 Å²	123.7	79%	0.794	81%	0.807	S	S	*	*			trans	112.8	123.7	147.8	0	0	0	0	0	117.7
123	G	39.4	Very low	49	Very low	83 Å²	83	123 Å²	123	86%	0.856	81%	0.805	S	S	*	*			trans	111.5	105	141.5	0	0	0	0	0	117.9
124	S	43.9	Very low	49.7	Very low	131 Å²	131	125.3 Å²	125.3	92%	0.916	81%	0.813	S	S	*	*			trans	-38.4	144.2	168.8	-69.1	0	0	0	0	118.2
125	G	40.6	Very low	50.5	Low	79 Å²	79	125.5 Å²	125.5	81%	0.814	81%	0.814	S	S	*	*				110.1	110.7	123.6	0	0	0	0	0	118
126	G	43.9	Very low	51.8	Low	67 Å²	67	121.8 Å²	121.8	69%	0.691	81%	0.806	S	S	*	*			trans	98.1	102.5	137.8	0	0	0	0	0	118.7
127	V	44.3	Very low	52.9	Low	130 Å²	130	119.2 Å²	119.2	79%	0.788	80%	0.803	S	S	*	*			trans	53.9	111.2	139.1	-51.8	0	0	0	0	119.7
128	N	55.5	Low	54	Low	146 Å²	146	120.2 Å²	120.2	78%	0.781	81%	0.807	S	S	*	*				172.1	142.6	100.5	-101.8	-45.5	0	0	0	111.3	T130	N128-T130 PolarHBondContact O-N 3.41Å; N128-T130 VanDerWaalsContact O-N 3.17Å
129	A	41	Very low	55.2	Low	98 Å²	98	116.6 Å²	116.6	81%	0.81	80%	0.803	S	S	*	*			trans	-68.9	105	176.3	0	0	0	0	0	110.3
130	T	48.4	Very low	56.4	Low	130 Å²	130	117 Å²	117	80%	0.798	80%	0.802	S	S	*	*			trans	-109.1	117.2	172.1	-61.8	0	0	0	0	109	N128	N128-T130 PolarHBondContact O-N 3.41Å; N128-T130 VanDerWaalsContact O-N 3.17Å
131	F	56.8	Low	56.5	Low	183 Å²	183	117.8 Å²	117.8	80%	0.803	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-52.9	142.1	172.1	-85.2	-106	0	0	0	111.3
132	P	71.4	Confident	56.5	Low	116 Å²	116	117.3 Å²	117.3	75%	0.753	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-68.7	139.5	173.6	29.2	-32.4	0	0	0	110.2
133	P	72.8	Confident	56.8	Low	115 Å²	115	118 Å²	118	75%	0.747	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-69.2	152.8	177.9	29.3	-34.4	0	0	0	111.8
134	P	67.5	Low	57.1	Low	128 Å²	128	120.2 Å²	120.2	83%	0.831	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-72.1	139	178.5	28.9	-31.6	0	0	0	111.8
135	L	67.6	Low	57.4	Low	168 Å²	168	120 Å²	120	88%	0.88	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-61.3	143.1	175.5	-78.7	143.2	0	0	0	111.9
136	P	75.3	Confident	57.8	Low	114 Å²	114	122 Å²	122	74%	0.74	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-71.5	149.9	174.8	29.1	-33.4	0	0	0	112.3
137	P	74.7	Confident	57.8	Low	118 Å²	118	122.6 Å²	122.6	77%	0.766	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-72	150.8	179.5	29.6	-34.5	0	0	0	112.6
138	P	71.1	Confident	58.1	Low	116 Å²	116	122.9 Å²	122.9	75%	0.753	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-72.3	146.7	177.8	30.4	-34.1	0	0	0	111.9
139	P	72.7	Confident	57.5	Low	119 Å²	119	123.8 Å²	123.8	77%	0.773	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-72.8	145	178.6	29.6	-33.9	0	0	0	112
140	P	70.6	Confident	57.6	Low	128 Å²	128	124.4 Å²	124.4	83%	0.831	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-70.9	131.7	174.5	28.3	-32.6	0	0	0	111.3
141	A	45.8	Very low	57.4	Low	95 Å²	95	127.8 Å²	127.8	79%	0.785	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-71.1	126.8	172.2	0	0	0	0	0	111
142	S	42.8	Very low	57	Low	122 Å²	122	124.3 Å²	124.3	85%	0.853	78%	0.778	S	S	*	*			trans	158.9	149.1	132.9	-72.3	0	0	0	0	111.9
143	A	46.2	Very low	55.8	Low	91 Å²	91	124.1 Å²	124.1	75%	0.752	78%	0.78	S	S	*	*			trans	93.6	84.1	169.5	0	0	0	0	0	117.9
144	T	46.4	Very low	54.6	Low	130 Å²	130	124 Å²	124	80%	0.798	78%	0.781	S	S	*	*				53.5	113.5	122.3	-37.7	0	0	0	0	119.1
145	T	49.5	Very low	53.6	Low	126 Å²	126	123.5 Å²	123.5	77%	0.773	78%	0.781	S	S	*	*				175.8	121.9	112.4	34	0	0	0	0	111.4
146	S	49.8	Very low	52.7	Low	122 Å²	122	120.3 Å²	120.3	85%	0.853	78%	0.779	S	S	*	*			trans	17.3	117.4	149.2	55.1	0	0	0	0	120.2
147	G	43.7	Very low	51.5	Low	80 Å²	80	120 Å²	120	83%	0.825	78%	0.78	S	S	*	*			trans	-167.7	100.3	162.8	0	0	0	0	0	111.5
148	V	50.3	Low	50.3	Low	136 Å²	136	119.6 Å²	119.6	82%	0.824	78%	0.78	S	S	*	*			trans	-83.2	137	-177.4	-70.3	0	0	0	0	112.2
149	H	43.3	Very low	49.6	Very low	164 Å²	164	119.9 Å²	119.9	76%	0.759	78%	0.782	S	S	*	*			trans	153.7	121.1	144.4	-108.6	-110.2	0	0	0	107.6
150	E	43.2	Very low	48.5	Very low	112 Å²	112	119.4 Å²	119.4	52%	0.523	78%	0.778	S	S	.	*			cis	125.1	124.4	34.7	-91.1	-116.3	104.4	0	0	107.5
151	R	45	Very low	47.5	Very low	201 Å²	201	124.3 Å²	124.3	76%	0.758	78%	0.78	S	S	*	*			trans	84.5	120.4	147.3	-60.9	169.9	-157.7	-109.7	-2.3	120.7
152	S	47	Very low	48	Very low	110 Å²	110	123.6 Å²	123.6	77%	0.769	77%	0.774	S	S	*	*			trans	121.6	90	136.1	-48.3	0	0	0	0	112.8
153	S	46.4	Very low	48.8	Very low	111 Å²	111	122.3 Å²	122.3	78%	0.776	76%	0.763	S	S	*	*				66.8	103	78.7	71.5	0	0	0	0	115.5
154	S	47.5	Very low	49.9	Very low	112 Å²	112	123.3 Å²	123.3	78%	0.783	76%	0.756	S	S	*	*				171.8	100.2	126.8	58	0	0	0	0	112.8
155	S	47.1	Very low	51.4	Low	118 Å²	118	122.8 Å²	122.8	83%	0.825	75%	0.747	S	S	*	*				19.4	118.7	130	47.9	0	0	0	0	120.7
156	A	48.8	Very low	52.9	Low	101 Å²	101	119.9 Å²	119.9	84%	0.835	74%	0.736	S	S	*	*			trans	-162.5	119.7	134.9	0	0	0	0	0	112.1
157	S	48.7	Very low	54.7	Low	109 Å²	109	117.3 Å²	117.3	76%	0.762	72%	0.718	S	S	*	*			trans	-30	131.8	170.7	49.4	0	0	0	0	120.6
158	S	51	Low	56.8	Low	109 Å²	109	118.3 Å²	118.3	76%	0.762	70%	0.701	S	S	*	*			trans	48.2	138.9	137	-58.4	0	0	0	0	120.8
159	P	56.4	Low	58.6	Low	122 Å²	122	116.1 Å²	116.1	79%	0.792	69%	0.685	S	S	*	*			cis	-132.5	144.3	45.2	35.5	-18.5	0	0	0	115.7
160	P	48.5	Very low	60.8	Low	108 Å²	108	113 Å²	113	70%	0.701	67%	0.671	S	S	*	*			trans	-92.3	109.5	175.8	34.1	-26.7	0	0	0	110.6
161	R	50.1	Low	63.1	Low	232 Å²	232	111.8 Å²	111.8	88%	0.875	67%	0.665	S	S	*	*			trans	-141.9	12.4	164	-91	-168.2	175.9	-143.4	-1.5	114.4
162	A	56.7	Low	65.3	Low	80 Å²	80	106.8 Å²	106.8	66%	0.661	65%	0.653	S	S	*	*	S	Bend	trans	-90.6	-14.3	179.6	0	0	0	0	0	117.7
163	P	59.1	Low	67.4	Low	94 Å²	94	107 Å²	107	61%	0.61	64%	0.64	S	S	*	*	H	α-helix	trans	-77	-22.7	-177.9	28.2	-30.8	0	0	0	113.9	A166 S167	P163-A166 PolarHBondContact O-N 3.41Å; P163-S167 PolarHBondContact O-OG 2.95Å
164	D	69.6	Low	69.7	Low	113 Å²	113	107.6 Å²	107.6	60%	0.604	63%	0.629	S	S	*	*	H	α-helix	trans	-72.5	-34.7	-173.3	-157.5	18.4	0	0	0	113	A166 S167 E168	D164-A166 VanDerWaalsContact C-N 3.3Å; D164-A166 PolarHBondContact O-N 3.38Å; D164-S167 WeakPolarHBondContact CA-OG 3.47Å; D164-S167 PolarHBondContact O-N 3.23Å; D164-S167 PolarHBondContact O-OG 3.07Å; D164-E168 WeakPolarHBondContact O-CB 3.42Å; D164-E168 PolarHBondContact O-N 3.5Å
165	L	77.7	Confident	72	Confident	118 Å²	118	105.6 Å²	105.6	62%	0.618	61%	0.609	S	S	*	*	H	α-helix	trans	-66.3	-31.1	178.3	-66.2	175.8	0	0	0	112.7	N169	L165-N169 WeakPolarHBondContact O-CB 3.46Å; L165-N169 PolarHBondContact O-N 2.95Å
166	A	82.2	Confident	74.1	Confident	66 Å²	66	105.5 Å²	105.5	55%	0.545	60%	0.6	S	S	.	*	H	α-helix	trans	-71.7	-43.5	178.7	0	0	0	0	0	111.1	P163 D164 N169 E170	P163-A166 PolarHBondContact O-N 3.41Å; D164-A166 VanDerWaalsContact C-N 3.3Å; D164-A166 PolarHBondContact O-N 3.38Å; A166-N169 PolarHBondContact O-N 2.93Å; A166-E170 WeakPolarHBondContact O-CG 3.4Å; A166-E170 PolarHBondContact O-N 2.92Å
167	S	86.1	Confident	76.3	Confident	67 Å²	67	107 Å²	107	47%	0.469	59%	0.589	S	S	.	*	H	α-helix	trans	-65.6	-41.7	174.1	38.7	0	0	0	0	112.5	P163 D164 E170 Q171	P163-S167 PolarHBondContact O-OG 2.95Å; D164-S167 WeakPolarHBondContact CA-OG 3.47Å; D164-S167 PolarHBondContact O-N 3.23Å; D164-S167 PolarHBondContact O-OG 3.07Å; S167-E170 PolarHBondContact O-N 3.36Å; S167-Q171 WeakPolarHBondContact O-CB 3.46Å; S167-Q171 PolarHBondContact O-N 3.01Å
168	E	87.9	Confident	78.6	Confident	101 Å²	101	105.2 Å²	105.2	47%	0.472	57%	0.574	S	S	.	*	H	α-helix	trans	-63.3	-41.6	176.3	-172	-176.8	171.4	0	0	111.2	D164 Q171 L172	D164-E168 WeakPolarHBondContact O-CB 3.42Å; D164-E168 PolarHBondContact O-N 3.5Å; E168-Q171 WeakPolarHBondContact O-CB 3.29Å; E168-Q171 PolarHBondContact O-N 3.24Å; E168-L172 HydrophobicContact CG-CD1 4.25Å; E168-L172 WeakPolarHBondContact O-CB 3.23Å; E168-L172 VanDerWaalsContact O-CG 3.29Å; E168-L172 WeakPolarHBondContact O-CG 3.3Å; E168-L172 PolarHBondContact O-N 2.84Å
169	N	88	Confident	80.6	Confident	91 Å²	91	104.6 Å²	104.6	49%	0.487	56%	0.561	S	S	.	*	H	α-helix	trans	-68.1	-39.1	178.2	-160.5	-25.9	0	0	0	111.9	L165 A166 Q171 L172 K173	L165-N169 WeakPolarHBondContact O-CB 3.46Å; L165-N169 PolarHBondContact O-N 2.95Å; A166-N169 PolarHBondContact O-N 2.93Å; N169-Q171 VanDerWaalsContact C-N 3.33Å; N169-L172 PolarHBondContact O-N 3.23Å; N169-K173 VanDerWaalsContact O-CG 3.31Å; N169-K173 WeakPolarHBondContact O-CG 3.42Å; N169-K173 PolarHBondContact O-N 2.91Å
170	E	90.5	Very high	82.4	Confident	97 Å²	97	101.5 Å²	101.5	45%	0.453	54%	0.542	S	S	.	.	H	α-helix	trans	-62.9	-38.6	170.6	-75.8	-63.8	127.3	0	0	112.1	A166 S167 K173 K174	A166-E170 WeakPolarHBondContact O-CG 3.4Å; A166-E170 PolarHBondContact O-N 2.92Å; S167-E170 PolarHBondContact O-N 3.36Å; E170-K173 PolarHBondContact O-N 3.28Å; E170-K173 IonicContact OE1-NZ 3.16Å; E170-K173 PolarHBondContact OE1-NZ 2.77Å; E170-K174 WeakPolarHBondContact O-CG 3.39Å; E170-K174 PolarHBondContact O-N 2.82Å; E170-K174 VanDerWaalsContact O-N 3.12Å
171	Q	91.9	Very high	84.6	Confident	88 Å²	88	98.7 Å²	98.7	41%	0.411	53%	0.528	S	S	.	.	H	α-helix	trans	-65	-46.6	174.3	-175	58.7	38.4	0	0	111.5	S167 E168 N169 K173 K174 D175	S167-Q171 WeakPolarHBondContact O-CB 3.46Å; S167-Q171 PolarHBondContact O-N 3.01Å; E168-Q171 WeakPolarHBondContact O-CB 3.29Å; E168-Q171 PolarHBondContact O-N 3.24Å; N169-Q171 VanDerWaalsContact C-N 3.33Å; Q171-K173 VanDerWaalsContact C-N 3.26Å; Q171-K173 PolarHBondContact O-N 3.17Å; Q171-K174 WeakPolarHBondContact O-CA 3.34Å; Q171-K174 WeakPolarHBondContact O-CB 3.33Å; Q171-K174 PolarHBondContact O-N 3.16Å; Q171-D175 PolarHBondContact NE2-OD1 3.49Å; Q171-D175 PolarHBondContact NE2-OD2 3.31Å; Q171-D175 PolarHBondContact O-N 2.86Å
172	L	89.6	Confident	86.7	Confident	96 Å²	96	93.1 Å²	93.1	50%	0.503	51%	0.512	S	S	.	.	H	α-helix	trans	-60.3	-35.9	176.5	-73.7	169.4	0	0	0	111.9	E168 N169 N176	E168-L172 HydrophobicContact CG-CD1 4.25Å; E168-L172 WeakPolarHBondContact O-CB 3.23Å; E168-L172 VanDerWaalsContact O-CG 3.29Å; E168-L172 WeakPolarHBondContact O-CG 3.3Å; E168-L172 PolarHBondContact O-N 2.84Å; N169-L172 PolarHBondContact O-N 3.23Å; L172-N176 WeakPolarHBondContact O-CB 3.28Å; L172-N176 PolarHBondContact O-N 2.87Å
173	K	92.5	Very high	88.5	Confident	113 Å²	113	94.6 Å²	94.6	49%	0.491	51%	0.508	S	S	.	.	H	α-helix	trans	-64.1	-42	172.7	-72.9	173.4	-167.1	170.4	0	111.9	N169 E170 Q171 H177	N169-K173 VanDerWaalsContact O-CG 3.31Å; N169-K173 WeakPolarHBondContact O-CG 3.42Å; N169-K173 PolarHBondContact O-N 2.91Å; E170-K173 PolarHBondContact O-N 3.28Å; E170-K173 IonicContact OE1-NZ 3.16Å; E170-K173 PolarHBondContact OE1-NZ 2.77Å; Q171-K173 VanDerWaalsContact C-N 3.26Å; Q171-K173 PolarHBondContact O-N 3.17Å; K173-H177 WeakPolarHBondContact O-CB 3.43Å; K173-H177 PolarHBondContact O-N 3.03Å
174	K	94.2	Very high	90.2	Very high	125 Å²	125	92 Å²	92	54%	0.543	49%	0.494	S	S	.	.	H	α-helix	trans	-63.6	-48	175.4	-69.6	173.8	-175.7	173.2	0	111.1	E170 Q171 N176 H177 T178	E170-K174 WeakPolarHBondContact O-CG 3.39Å; E170-K174 PolarHBondContact O-N 2.82Å; E170-K174 VanDerWaalsContact O-N 3.12Å; Q171-K174 WeakPolarHBondContact O-CA 3.34Å; Q171-K174 WeakPolarHBondContact O-CB 3.33Å; Q171-K174 PolarHBondContact O-N 3.16Å; K174-N176 PolarHBondContact O-N 3.03Å; K174-H177 WeakPolarHBondContact O-CB 3.47Å; K174-H177 PolarHBondContact O-N 3.45Å; K174-T178 PolarHBondContact O-N 2.82Å; K174-T178 PolarHBondContact O-OG1 3.03Å; K174-T178 VanDerWaalsContact O-OG1 3.06Å
175	D	95	Very high	91.5	Very high	69 Å²	69	92.6 Å²	92.6	37%	0.369	49%	0.494	S	S	.	.	H	α-helix	trans	-65.1	-40.4	-180	-64.5	-17.8	0	0	0	111.2	Q171 H177 T178 L179	Q171-D175 PolarHBondContact NE2-OD1 3.49Å; Q171-D175 PolarHBondContact NE2-OD2 3.31Å; Q171-D175 PolarHBondContact O-N 2.86Å; D175-H177 VanDerWaalsContact C-N 3.31Å; D175-H177 PolarHBondContact O-N 3.05Å; D175-T178 PolarHBondContact O-N 3.18Å; D175-L179 WeakPolarHBondContact O-CB 3.19Å; D175-L179 VanDerWaalsContact O-CG 3.24Å; D175-L179 WeakPolarHBondContact O-CG 3.36Å; D175-L179 PolarHBondContact O-N 3.14Å
176	N	92.2	Very high	92.3	Very high	117 Å²	117	89.3 Å²	89.3	63%	0.626	48%	0.484	S	S	*	.	H	α-helix	trans	-63.3	-39.5	174.6	-157.3	-89.9	0	0	0	111.6	L172 K174 S180	L172-N176 WeakPolarHBondContact O-CB 3.28Å; L172-N176 PolarHBondContact O-N 2.87Å; K174-N176 PolarHBondContact O-N 3.03Å; N176-S180 VanDerWaalsContact O-CB 3.24Å; N176-S180 WeakPolarHBondContact O-CB 3.36Å; N176-S180 PolarHBondContact O-N 2.88Å; N176-S180 PolarHBondContact O-OG 3.12Å
177	H	95.6	Very high	92.9	Very high	133 Å²	133	94.6 Å²	94.6	62%	0.616	49%	0.489	S	S	*	.	H	α-helix	trans	-62.8	-47.4	173.4	-175	68.2	0	0	0	111.6	K173 K174 D175 S180 A181	K173-H177 WeakPolarHBondContact O-CB 3.43Å; K173-H177 PolarHBondContact O-N 3.03Å; K174-H177 WeakPolarHBondContact O-CB 3.47Å; K174-H177 PolarHBondContact O-N 3.45Å; D175-H177 VanDerWaalsContact C-N 3.31Å; D175-H177 PolarHBondContact O-N 3.05Å; H177-S180 PolarHBondContact O-N 3.13Å; H177-S180 PolarHBondContact O-OG 3.06Å; H177-A181 PolarHBondContact O-N 3.15Å
178	T	95.7	Very high	93.2	Very high	71 Å²	71	97.8 Å²	97.8	44%	0.436	49%	0.491	S	S	.	.	H	α-helix	trans	-58.8	-50.9	176.2	-56.3	0	0	0	0	111.5	K174 D175 S180 A181 E182	K174-T178 PolarHBondContact O-N 2.82Å; K174-T178 PolarHBondContact O-OG1 3.03Å; K174-T178 VanDerWaalsContact O-OG1 3.06Å; D175-T178 PolarHBondContact O-N 3.18Å; T178-S180 VanDerWaalsContact C-N 3.28Å; T178-S180 PolarHBondContact O-N 3.21Å; T178-A181 WeakPolarHBondContact O-CB 3.33Å; T178-A181 PolarHBondContact O-N 3.34Å; T178-E182 PolarHBondContact O-N 3.32Å
179	L	94	Very high	93.5	Very high	96 Å²	96	98.3 Å²	98.3	50%	0.503	49%	0.493	S	S	.	.	H	α-helix	trans	-61.3	-36.4	177.5	-70.2	171.5	0	0	0	112	D175 A181 E182 L183	D175-L179 WeakPolarHBondContact O-CB 3.19Å; D175-L179 VanDerWaalsContact O-CG 3.24Å; D175-L179 WeakPolarHBondContact O-CG 3.36Å; D175-L179 PolarHBondContact O-N 3.14Å; L179-A181 VanDerWaalsContact C-N 3.33Å; L179-E182 PolarHBondContact O-N 3.09Å; L179-L183 WeakPolarHBondContact O-CB 3.33Å; L179-L183 WeakPolarHBondContact O-CG 3.39Å; L179-L183 PolarHBondContact O-N 3.26Å
180	S	93.4	Very high	93.6	Very high	57 Å²	57	97.3 Å²	97.3	40%	0.399	49%	0.493	S	S	.	.	H	α-helix	trans	-66.1	-36.6	175.3	77.8	0	0	0	0	112.1	N176 H177 T178 A184	N176-S180 VanDerWaalsContact O-CB 3.24Å; N176-S180 WeakPolarHBondContact O-CB 3.36Å; N176-S180 PolarHBondContact O-N 2.88Å; N176-S180 PolarHBondContact O-OG 3.12Å; H177-S180 PolarHBondContact O-N 3.13Å; H177-S180 PolarHBondContact O-OG 3.06Å; T178-S180 VanDerWaalsContact C-N 3.28Å; T178-S180 PolarHBondContact O-N 3.21Å; S180-A184 WeakPolarHBondContact O-CB 3.45Å; S180-A184 PolarHBondContact O-N 3.21Å
181	A	95.2	Very high	93.6	Very high	49 Å²	49	99.2 Å²	99.2	41%	0.405	50%	0.502	S	S	.	.	H	α-helix	trans	-70.2	-42.2	175.4	0	0	0	0	0	111.5	H177 T178 L179 A184 Q185	H177-A181 PolarHBondContact O-N 3.15Å; T178-A181 WeakPolarHBondContact O-CB 3.33Å; T178-A181 PolarHBondContact O-N 3.34Å; L179-A181 VanDerWaalsContact C-N 3.33Å; A181-A184 PolarHBondContact O-N 3.09Å; A181-Q185 WeakPolarHBondContact O-CB 2.96Å; A181-Q185 PolarHBondContact O-N 3.13Å
182	E	94.7	Very high	93.5	Very high	115 Å²	115	101.5 Å²	101.5	54%	0.537	51%	0.513	S	S	.	.	H	α-helix	trans	-62.1	-45.3	174	-72.5	-174.7	177.2	0	0	111.8	T178 L179 A184 Q185 A186	T178-E182 PolarHBondContact O-N 3.32Å; L179-E182 PolarHBondContact O-N 3.09Å; E182-A184 VanDerWaalsContact C-N 3.31Å; E182-A184 PolarHBondContact O-N 3.09Å; E182-Q185 WeakPolarHBondContact O-CB 3.41Å; E182-Q185 PolarHBondContact O-N 3.48Å; E182-Q185 VanDerWaalsContact O-N 3.17Å; E182-A186 WeakPolarHBondContact O-CB 3.48Å; E182-A186 PolarHBondContact O-N 3.45Å
183	L	93.6	Very high	93.5	Very high	110 Å²	110	100.9 Å²	100.9	58%	0.576	51%	0.509	S	S	*	.	H	α-helix	trans	-61.5	-39.8	174.4	-78.9	179.4	0	0	0	112	L179 Q185 A186 R187	L179-L183 WeakPolarHBondContact O-CB 3.33Å; L179-L183 WeakPolarHBondContact O-CG 3.39Å; L179-L183 PolarHBondContact O-N 3.26Å; L183-Q185 VanDerWaalsContact C-N 3.34Å; L183-A186 PolarHBondContact O-N 2.95Å; L183-R187 WeakPolarHBondContact O-CB 3.19Å; L183-R187 VanDerWaalsContact O-CG 3.31Å; L183-R187 WeakPolarHBondContact O-CG 3.12Å; L183-R187 PolarHBondContact O-N 3.12Å
184	A	95.1	Very high	93.1	Very high	39 Å²	39	100 Å²	100	32%	0.322	51%	0.51	S	S	.	.	H	α-helix	trans	-65.2	-38.7	175.4	0	0	0	0	0	111.6	S180 A181 E182 R188	S180-A184 WeakPolarHBondContact O-CB 3.45Å; S180-A184 PolarHBondContact O-N 3.21Å; A181-A184 PolarHBondContact O-N 3.09Å; E182-A184 VanDerWaalsContact C-N 3.31Å; E182-A184 PolarHBondContact O-N 3.09Å; A184-R188 WeakPolarHBondContact O-CG 3.33Å; A184-R188 PolarHBondContact O-N 3.39Å
185	Q	96.3	Very high	92.6	Very high	127 Å²	127	96 Å²	96	59%	0.593	50%	0.504	S	S	*	.	H	α-helix	trans	-65.5	-45.8	174.3	-179.5	177.6	-43.3	0	0	111.9	A181 E182 L183 R187 R188 H189	A181-Q185 WeakPolarHBondContact O-CB 2.96Å; A181-Q185 PolarHBondContact O-N 3.13Å; E182-Q185 WeakPolarHBondContact O-CB 3.41Å; E182-Q185 PolarHBondContact O-N 3.48Å; E182-Q185 VanDerWaalsContact O-N 3.17Å; L183-Q185 VanDerWaalsContact C-N 3.34Å; Q185-R187 VanDerWaalsContact C-N 3.31Å; Q185-R187 PolarHBondContact O-N 3.01Å; Q185-R188 PolarHBondContact O-N 3.1Å; Q185-H189 PolarHBondContact O-N 3.19Å
186	A	94.6	Very high	92.2	Very high	49 Å²	49	98.4 Å²	98.4	41%	0.405	51%	0.511	S	S	.	.	H	α-helix	trans	-61.4	-40.4	177.1	0	0	0	0	0	111.7	E182 L183 H189 C190	E182-A186 WeakPolarHBondContact O-CB 3.48Å; E182-A186 PolarHBondContact O-N 3.45Å; L183-A186 PolarHBondContact O-N 2.95Å; A186-H189 PolarHBondContact O-N 2.88Å; A186-C190 PolarHBondContact O-N 3.1Å; A186-C190 PolarHBondContact O-SG 3.34Å; A186-C190 VanDerWaalsContact O-SG 3.36Å
187	R	94.5	Very high	91.8	Very high	176 Å²	176	96.3 Å²	96.3	66%	0.664	50%	0.5	S	S	*	.	H	α-helix	trans	-61.1	-46.3	173.8	-77	177.7	177.9	-174.9	0.9	112.3	L183 Q185 H189 C190 E191	L183-R187 WeakPolarHBondContact O-CB 3.19Å; L183-R187 VanDerWaalsContact O-CG 3.31Å; L183-R187 WeakPolarHBondContact O-CG 3.12Å; L183-R187 PolarHBondContact O-N 3.12Å; Q185-R187 VanDerWaalsContact C-N 3.31Å; Q185-R187 PolarHBondContact O-N 3.01Å; R187-H189 VanDerWaalsContact C-N 3.32Å; R187-H189 PolarHBondContact O-N 2.74Å; R187-C190 PolarHBondContact O-N 3.13Å; R187-E191 WeakPolarHBondContact O-CG 3.25Å; R187-E191 PolarHBondContact O-N 3Å
188	R	92.8	Very high	91.2	Very high	135 Å²	135	93.7 Å²	93.7	51%	0.509	50%	0.496	S	S	.	.	H	α-helix	trans	-58.8	-44.3	175.3	-74.1	-170.3	-64	-101.1	1.6	111.7	A184 Q185 C190 E191 E192	A184-R188 WeakPolarHBondContact O-CG 3.33Å; A184-R188 PolarHBondContact O-N 3.39Å; Q185-R188 PolarHBondContact O-N 3.1Å; R188-C190 PolarHBondContact O-N 3.32Å; R188-E191 PolarHBondContact O-N 2.9Å; R188-E192 WeakPolarHBondContact O-CG 3.41Å; R188-E192 PolarHBondContact O-N 3.35Å
189	H	93.4	Very high	90.6	Very high	111 Å²	111	99.8 Å²	99.8	51%	0.514	51%	0.511	S	S	.	.	H	α-helix	trans	-62.5	-42.3	177.6	-170.5	-96.2	0	0	0	112	Q185 A186 R187 E192 L193	Q185-H189 PolarHBondContact O-N 3.19Å; A186-H189 PolarHBondContact O-N 2.88Å; R187-H189 VanDerWaalsContact C-N 3.32Å; R187-H189 PolarHBondContact O-N 2.74Å; H189-E192 PolarHBondContact O-N 3.08Å; H189-L193 WeakPolarHBondContact O-CB 3.32Å; H189-L193 VanDerWaalsContact O-CG 3.31Å; H189-L193 WeakPolarHBondContact O-CG 3.28Å; H189-L193 PolarHBondContact O-N 3.06Å
190	C	90.6	Very high	90	Very high	71 Å²	71	102.3 Å²	102.3	48%	0.48	52%	0.518	S	S	.	.	H	α-helix	trans	-63.8	-39.2	173.6	-70.5	0	0	0	0	112.5	A186 R187 R188 L193 L194	A186-C190 PolarHBondContact O-N 3.1Å; A186-C190 PolarHBondContact O-SG 3.34Å; A186-C190 VanDerWaalsContact O-SG 3.36Å; R187-C190 PolarHBondContact O-N 3.13Å; R188-C190 PolarHBondContact O-N 3.32Å; C190-L193 PolarHBondContact O-N 3.29Å; C190-L194 WeakPolarHBondContact O-CB 3.39Å; C190-L194 VanDerWaalsContact O-CD1 3.3Å; C190-L194 WeakPolarHBondContact O-CD1 3.39Å; C190-L194 PolarHBondContact O-N 3.16Å
191	E	90	Very high	89	Confident	136 Å²	136	103.7 Å²	103.7	64%	0.636	52%	0.521	S	S	*	.	H	α-helix	trans	-66.7	-39.6	176.2	-74.6	175.6	179.8	0	0	112.1	R187 R188 L194 G195	R187-E191 WeakPolarHBondContact O-CG 3.25Å; R187-E191 PolarHBondContact O-N 3Å; R188-E191 PolarHBondContact O-N 2.9Å; E191-L194 PolarHBondContact O-N 3Å; E191-G195 PolarHBondContact O-N 2.86Å
192	E	90.5	Very high	87.7	Confident	137 Å²	137	106.4 Å²	106.4	64%	0.64	53%	0.529	S	S	*	.	H	α-helix	trans	-64	-44.7	173.4	-74.7	175.4	-171.5	0	0	111.7	R188 H189 G195 F196	R188-E192 WeakPolarHBondContact O-CG 3.41Å; R188-E192 PolarHBondContact O-N 3.35Å; H189-E192 PolarHBondContact O-N 3.08Å; E192-G195 PolarHBondContact O-N 3.43Å; E192-F196 WeakPolarHBondContact O-CB 3.27Å; E192-F196 PolarHBondContact O-N 3.44Å
193	L	88.6	Confident	86.3	Confident	82 Å²	82	103.2 Å²	103.2	43%	0.429	52%	0.517	S	S	.	.	H	α-helix	trans	-61.9	-44.9	174	-74.6	175.6	0	0	0	111.7	H189 C190 G195 F196 L197	H189-L193 WeakPolarHBondContact O-CB 3.32Å; H189-L193 VanDerWaalsContact O-CG 3.31Å; H189-L193 WeakPolarHBondContact O-CG 3.28Å; H189-L193 PolarHBondContact O-N 3.06Å; C190-L193 PolarHBondContact O-N 3.29Å; L193-G195 VanDerWaalsContact C-N 3.3Å; L193-G195 PolarHBondContact O-N 3.02Å; L193-F196 PolarHBondContact O-N 2.95Å; L193-L197 WeakPolarHBondContact O-CB 3.45Å; L193-L197 VanDerWaalsContact O-CG 3.32Å; L193-L197 WeakPolarHBondContact O-CG 3.31Å; L193-L197 PolarHBondContact O-N 3.26Å
194	L	84.7	Confident	84.9	Confident	96 Å²	96	109 Å²	109	50%	0.503	53%	0.531	S	S	.	.	H	α-helix	trans	-60.9	-41.7	174.5	-104.4	79.2	0	0	0	111	C190 E191 F196 L197 S198 V203	C190-L194 WeakPolarHBondContact O-CB 3.39Å; C190-L194 VanDerWaalsContact O-CD1 3.3Å; C190-L194 WeakPolarHBondContact O-CD1 3.39Å; C190-L194 PolarHBondContact O-N 3.16Å; E191-L194 PolarHBondContact O-N 3Å; L194-F196 VanDerWaalsContact C-N 3.33Å; L194-F196 PolarHBondContact O-N 2.83Å; L194-L197 PolarHBondContact O-N 3.12Å; L194-S198 WeakPolarHBondContact O-CB 3.24Å; L194-S198 PolarHBondContact O-N 2.76Å; L194-V203 HydrophobicContact CD2-CG1 4.47Å
195	G	84.8	Confident	83.2	Confident	41 Å²	41	115.3 Å²	115.3	42%	0.423	55%	0.554	S	S	.	*	H	α-helix	trans	-63.8	-37	176.5	0	0	0	0	0	112.8	E191 E192 L193	E191-G195 PolarHBondContact O-N 2.86Å; E192-G195 PolarHBondContact O-N 3.43Å; L193-G195 VanDerWaalsContact C-N 3.3Å; L193-G195 PolarHBondContact O-N 3.02Å
196	F	86.1	Confident	81.6	Confident	118 Å²	118	113 Å²	113	52%	0.518	55%	0.545	S	S	.	.	H	α-helix	trans	-69.3	-49.6	174.3	-176.5	-95.5	0	0	0	111.6	E192 L193 L194 S198 R199 F200	E192-F196 WeakPolarHBondContact O-CB 3.27Å; E192-F196 PolarHBondContact O-N 3.44Å; L193-F196 PolarHBondContact O-N 2.95Å; L194-F196 VanDerWaalsContact C-N 3.33Å; L194-F196 PolarHBondContact O-N 2.83Å; F196-S198 VanDerWaalsContact C-N 3.3Å; F196-S198 PolarHBondContact O-N 3.21Å; F196-R199 WeakPolarHBondContact O-CB 3.29Å; F196-R199 PolarHBondContact O-N 3.39Å; F196-F200 HydrophobicContact CD1-CE2 4.45Å; F196-F200 HydrophobicContact CE1-CD2 4.32Å; F196-F200 AromaticContact CE1-CE2 3.92Å; F196-F200 HydrophobicContact CE1-CE2 3.92Å; F196-F200 HydrophobicContact CE2-CE2 4.21Å; F196-F200 AromaticContact CZ-CE2 3.79Å; F196-F200 HydrophobicContact CZ-CE2 3.79Å; F196-F200 WeakPolarHBondContact O-CD2 3.36Å
197	L	84	Confident	80.2	Confident	74 Å²	74	115.3 Å²	115.3	39%	0.387	55%	0.551	S	S	.	*	H	α-helix	trans	-64.8	-34.6	179.5	-70.3	174	0	0	0	112.2	L193 L194 R199 F200 L201	L193-L197 WeakPolarHBondContact O-CB 3.45Å; L193-L197 VanDerWaalsContact O-CG 3.32Å; L193-L197 WeakPolarHBondContact O-CG 3.31Å; L193-L197 PolarHBondContact O-N 3.26Å; L194-L197 PolarHBondContact O-N 3.12Å; L197-R199 PolarHBondContact O-N 3.31Å; L197-F200 PolarHBondContact O-N 3.27Å; L197-L201 HydrophobicContact CD2-CD1 4.41Å; L197-L201 PolarHBondContact O-N 3.35Å
198	S	82.5	Confident	78.7	Confident	77 Å²	77	111.6 Å²	111.6	54%	0.538	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-15.1	177	-174.4	0	0	0	0	113.5	L194 F196 F200 L201	L194-S198 WeakPolarHBondContact O-CB 3.24Å; L194-S198 PolarHBondContact O-N 2.76Å; F196-S198 VanDerWaalsContact C-N 3.3Å; F196-S198 PolarHBondContact O-N 3.21Å; S198-F200 VanDerWaalsContact C-N 3.34Å; S198-L201 WeakPolarHBondContact CA-O 3.45Å
199	R	83	Confident	77.4	Confident	200 Å²	200	115 Å²	115	76%	0.755	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-24.8	172.2	-59.3	179.6	-176.8	-169.6	0.3	112.7	F196 L197	F196-R199 WeakPolarHBondContact O-CB 3.29Å; F196-R199 PolarHBondContact O-N 3.39Å; L197-R199 PolarHBondContact O-N 3.31Å
200	F	80.9	Confident	75.9	Confident	149 Å²	149	115 Å²	115	65%	0.654	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.6	-26.1	-172.3	-60.5	-76.6	0	0	0	113	F196 L197 S198	F196-F200 HydrophobicContact CD1-CE2 4.45Å; F196-F200 HydrophobicContact CE1-CD2 4.32Å; F196-F200 AromaticContact CE1-CE2 3.92Å; F196-F200 HydrophobicContact CE1-CE2 3.92Å; F196-F200 HydrophobicContact CE2-CE2 4.21Å; F196-F200 AromaticContact CZ-CE2 3.79Å; F196-F200 HydrophobicContact CZ-CE2 3.79Å; F196-F200 WeakPolarHBondContact O-CD2 3.36Å; L197-F200 PolarHBondContact O-N 3.27Å; S198-F200 VanDerWaalsContact C-N 3.34Å
201	L	72.7	Confident	74.4	Confident	86 Å²	86	116.4 Å²	116.4	45%	0.45	56%	0.562	S	S	.	*	S	Bend	trans	-134.2	136.9	-172.8	-59.1	175	0	0	0	110.2	L197 S198 V203	L197-L201 HydrophobicContact CD2-CD1 4.41Å; L197-L201 PolarHBondContact O-N 3.35Å; S198-L201 WeakPolarHBondContact CA-O 3.45Å; L201-V203 PolarHBondContact O-N 3.36Å
202	D	69.2	Low	73.2	Confident	106 Å²	106	116.5 Å²	116.5	57%	0.567	56%	0.564	S	S	*	*			trans	-75.9	95.1	166.2	-163	-11.3	0	0	0	108.2	R204 Q205	D202-R204 PolarHBondContact O-N 2.88Å; D202-R204 WeakPolarHBondContact OD1-CB 3.3Å; D202-R204 PolarHBondContact OD1-N 3.08Å; D202-Q205 WeakPolarHBondContact O-CB 3.42Å; D202-Q205 PolarHBondContact O-N 3.38Å
203	V	64.1	Low	71.6	Confident	48 Å²	48	116.3 Å²	116.3	29%	0.291	56%	0.563	S	S	.	*	G	3₁₀ helix	trans	-58.1	-19.1	-175.3	-172.5	0	0	0	0	111.8	L194 L201 Q205 L206	L194-V203 HydrophobicContact CD2-CG1 4.47Å; L201-V203 PolarHBondContact O-N 3.36Å; V203-Q205 PolarHBondContact O-N 2.88Å; V203-L206 PolarHBondContact O-N 2.68Å
204	R	63.8	Low	70	Confident	230 Å²	230	118.6 Å²	118.6	87%	0.868	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-66.3	-22.8	174.1	-60.6	-176.5	63.5	-167.9	-3.5	113.6	D202	D202-R204 PolarHBondContact O-N 2.88Å; D202-R204 WeakPolarHBondContact OD1-CB 3.3Å; D202-R204 PolarHBondContact OD1-N 3.08Å
205	Q	59.3	Low	68.4	Low	173 Å²	173	120.8 Å²	120.8	81%	0.808	58%	0.583	S	S	*	*	G	3₁₀ helix	trans	-90.2	-12.9	176.9	-106.1	-163.9	1.6	0	0	113.5	D202 V203 D207	D202-Q205 WeakPolarHBondContact O-CB 3.42Å; D202-Q205 PolarHBondContact O-N 3.38Å; V203-Q205 PolarHBondContact O-N 2.88Å; Q205-D207 PolarHBondContact O-N 2.9Å
206	L	63.4	Low	67	Low	79 Å²	79	125 Å²	125	41%	0.414	60%	0.601	S	S	.	*			trans	-69.2	108.7	174.7	-111.9	75.7	0	0	0	108.7	V203 L208	V203-L206 PolarHBondContact O-N 2.68Å; L206-L208 PolarHBondContact O-N 3.34Å
207	D	64.6	Low	65.3	Low	96 Å²	96	129.4 Å²	129.4	51%	0.513	61%	0.614	S	S	.	*			trans	-71.4	86.7	168.7	-164.8	-4.4	0	0	0	108.6	Q205 R209 L210 L211	Q205-D207 PolarHBondContact O-N 2.9Å; D207-R209 PolarHBondContact O-N 3.25Å; D207-R209 WeakPolarHBondContact OD1-CB 3.39Å; D207-R209 PolarHBondContact OD1-N 3.26Å; D207-L210 HydrophobicContact CB-CB 4.23Å; D207-L210 WeakPolarHBondContact O-CB 3.35Å; D207-L210 PolarHBondContact O-N 3.27Å; D207-L211 PolarHBondContact O-N 3.19Å
208	L	63.9	Low	63.6	Low	99 Å²	99	130.3 Å²	130.3	52%	0.518	63%	0.632	S	S	.	*	H	α-helix	trans	-57.2	-22.9	-178.8	-136.6	74.2	0	0	0	111.9	L206 M212	L206-L208 PolarHBondContact O-N 3.34Å; L208-M212 WeakPolarHBondContact O-CB 3.1Å; L208-M212 VanDerWaalsContact O-CG 3.31Å; L208-M212 WeakPolarHBondContact O-CG 3.42Å; L208-M212 PolarHBondContact O-N 3.38Å
209	R	64.3	Low	62	Low	207 Å²	207	130.4 Å²	130.4	78%	0.781	65%	0.645	S	S	*	*	H	α-helix	trans	-67.8	-39.4	173.6	-70.1	-171.9	169.6	133.8	-2.4	111.9	D207 Q213	D207-R209 PolarHBondContact O-N 3.25Å; D207-R209 WeakPolarHBondContact OD1-CB 3.39Å; D207-R209 PolarHBondContact OD1-N 3.26Å; R209-Q213 VanDerWaalsContact O-CB 3.25Å; R209-Q213 WeakPolarHBondContact O-CB 3.5Å; R209-Q213 PolarHBondContact O-N 3.17Å
210	L	62.3	Low	60.4	Low	110 Å²	110	124.6 Å²	124.6	58%	0.576	64%	0.64	S	S	*	*	H	α-helix	trans	-66.9	-42.2	178.7	-148.9	76.2	0	0	0	110.3	D207 Q213	D207-L210 HydrophobicContact CB-CB 4.23Å; D207-L210 WeakPolarHBondContact O-CB 3.35Å; D207-L210 PolarHBondContact O-N 3.27Å; L210-Q213 PolarHBondContact O-N 3.24Å
211	L	59.3	Low	58.7	Low	101 Å²	101	123.2 Å²	123.2	53%	0.529	65%	0.649	S	S	.	*	H	α-helix	trans	-68.5	-37	-179.5	-156.2	74.4	0	0	0	112.9	D207 Q213	D207-L211 PolarHBondContact O-N 3.19Å; L211-Q213 VanDerWaalsContact C-N 3.31Å
212	M	64.4	Low	57.4	Low	138 Å²	138	126.6 Å²	126.6	68%	0.68	67%	0.667	S	S	*	*	H	α-helix	trans	-77.6	-14.8	176.3	-69	-174.7	73.8	0	0	113.6	L208	L208-M212 WeakPolarHBondContact O-CB 3.1Å; L208-M212 VanDerWaalsContact O-CG 3.31Å; L208-M212 WeakPolarHBondContact O-CG 3.42Å; L208-M212 PolarHBondContact O-N 3.38Å
213	Q	58	Low	56.4	Low	133 Å²	133	129 Å²	129	62%	0.621	68%	0.68	S	S	*	*	H	α-helix	trans	-86.4	-20.6	-178.3	-165.5	165.5	22.6	0	0	112.6	R209 L210 L211	R209-Q213 VanDerWaalsContact O-CB 3.25Å; R209-Q213 WeakPolarHBondContact O-CB 3.5Å; R209-Q213 PolarHBondContact O-N 3.17Å; L210-Q213 PolarHBondContact O-N 3.24Å; L211-Q213 VanDerWaalsContact C-N 3.31Å
214	E	54	Low	55.3	Low	129 Å²	129	130.2 Å²	130.2	60%	0.603	70%	0.703	S	S	*	*	H	α-helix	trans	-71.9	-32.9	178.8	-72	-174.9	113	0	0	112.9	V216 R217 A218	E214-V216 VanDerWaalsContact C-N 3.26Å; E214-V216 PolarHBondContact O-N 2.77Å; E214-R217 PolarHBondContact O-N 3.41Å; E214-R217 VanDerWaalsContact O-N 3.14Å; E214-A218 PolarHBondContact O-N 3.31Å; E214-A218 VanDerWaalsContact O-N 3.1Å
215	D	51.5	Low	54.3	Low	142 Å²	142	123.4 Å²	123.4	76%	0.759	70%	0.695	S	S	*	*	H	α-helix	trans	-68.1	-21.6	177.7	-81.5	-46.7	0	0	0	113.9
216	V	55	Low	53.7	Low	129 Å²	129	123 Å²	123	78%	0.782	69%	0.693	S	S	*	*	H	α-helix	trans	-86.4	-18.2	176.6	-177.3	0	0	0	0	111.7	E214	E214-V216 VanDerWaalsContact C-N 3.26Å; E214-V216 PolarHBondContact O-N 2.77Å
217	R	50.3	Low	52.9	Low	212 Å²	212	129.4 Å²	129.4	80%	0.8	71%	0.712	S	S	*	*	H	α-helix	trans	-104.5	-18.8	-175.1	-154.4	170.5	-175.1	175.6	0.3	114	E214 G219	E214-R217 PolarHBondContact O-N 3.41Å; E214-R217 VanDerWaalsContact O-N 3.14Å; R217-G219 PolarHBondContact O-N 3.11Å
218	A	49.3	Very low	51.7	Low	92 Å²	92	135.4 Å²	135.4	76%	0.76	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	-1.5	178.4	0	0	0	0	0	115	E214	E214-A218 PolarHBondContact O-N 3.31Å; E214-A218 VanDerWaalsContact O-N 3.1Å
219	G	48.2	Very low	50.4	Low	79 Å²	79	135.1 Å²	135.1	81%	0.814	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	2.2	177.9	0	0	0	0	0	116.1	R217	R217-G219 PolarHBondContact O-N 3.11Å
220	A	50.2	Low	49.2	Very low	78 Å²	78	134 Å²	134	65%	0.645	74%	0.742	S	S	*	*	S	Bend	trans	-136.9	109.8	-174.3	0	0	0	0	0	112.6
221	S	44.1	Very low	48.4	Very low	120 Å²	120	132.9 Å²	132.9	84%	0.839	75%	0.749	S	S	*	*			trans	72.7	93.1	163.3	-71.7	0	0	0	0	118.5	D223	S221-D223 PolarHBondContact O-N 3.25Å
222	D	45.2	Very low	47.5	Very low	157 Å²	157	133.9 Å²	133.9	84%	0.84	76%	0.759	S	S	*	*			trans	-53.3	108.8	137.8	-175.1	56.7	0	0	0	109.4
223	D	49.5	Very low	46.2	Very low	157 Å²	157	131 Å²	131	84%	0.84	76%	0.758	S	S	*	*			trans	164.3	127.1	149.8	-109.8	-59.8	0	0	0	109.8	S221	S221-D223 PolarHBondContact O-N 3.25Å
224	G	41.4	Very low	45.1	Very low	74 Å²	74	129.6 Å²	129.6	76%	0.763	76%	0.762	S	S	*	*			trans	123.7	73.1	163	0	0	0	0	0	115.8
225	A	42.5	Very low	44.3	Very low	86 Å²	86	132 Å²	132	71%	0.711	77%	0.774	S	S	*	*			trans	-55.3	158.3	164.2	0	0	0	0	0	114.1
226	Q	45.3	Very low	43.9	Very low	165 Å²	165	132.2 Å²	132.2	77%	0.771	77%	0.774	S	S	*	*			trans	92.5	124	144.9	-134.1	100.3	-17.9	0	0	118.9
227	R	46.6	Very low	43	Very low	213 Å²	213	134.1 Å²	134.1	80%	0.804	77%	0.774	S	S	*	*			trans	92.8	136.9	154.7	-55.2	171.3	-175.3	-109	0.5	115.5
228	R	40.7	Very low	42.4	Very low	222 Å²	222	135.7 Å²	135.7	84%	0.838	78%	0.78	S	S	*	*			cis	-174.5	135.7	-11.7	178.9	179.1	-88	-142.3	-3.6	103.9
229	A	37	Very low	41.6	Very low	93 Å²	93	135 Å²	135	77%	0.769	78%	0.783	S	S	*	*			trans	-61.3	138.3	176.2	0	0	0	0	0	113.1
230	H	38.9	Very low	40.8	Very low	183 Å²	183	135.4 Å²	135.4	85%	0.847	79%	0.787	S	S	*	*			trans	-179.5	155.1	137.4	-138.1	-108	0	0	0	113
231	A	43.9	Very low	40.3	Very low	87 Å²	87	135.1 Å²	135.1	72%	0.719	79%	0.791	S	S	*	*			trans	92.9	92	167	0	0	0	0	0	116.2
232	V	41.7	Very low	40.3	Very low	123 Å²	123	137.6 Å²	137.6	75%	0.745	79%	0.789	S	S	*	*				84.8	101	68.6	175.1	0	0	0	0	112.6
233	A	36.9	Very low	40.7	Very low	78 Å²	78	139 Å²	139	65%	0.645	79%	0.791	S	S	*	*			trans	51.3	132	130.7	0	0	0	0	0	121.6
234	S	35.9	Very low	40.8	Very low	102 Å²	102	134.5 Å²	134.5	71%	0.713	78%	0.782	S	S	*	*			trans	79.4	106.1	142.4	-48.4	0	0	0	0	116.9
235	Q	37.2	Very low	41.4	Very low	180 Å²	180	140 Å²	140	84%	0.841	79%	0.785	S	S	*	*				168	145.5	103.9	-90.6	-179.3	63.7	0	0	112.1
236	L	42.2	Very low	42.4	Very low	147 Å²	147	138.2 Å²	138.2	77%	0.77	77%	0.767	S	S	*	*			trans	90.6	97.3	144.4	-141.3	68.8	0	0	0	117.9
237	E	36	Very low	43.4	Very low	169 Å²	169	134.9 Å²	134.9	79%	0.79	76%	0.758	S	S	*	*				41.1	123.1	122.3	-56.7	-81.6	116.2	0	0	117.7
238	R	38.5	Very low	44.9	Very low	244 Å²	244	131.8 Å²	131.8	92%	0.921	75%	0.75	S	S	*	*				150.3	109.2	107.2	-161.9	171	-141.2	-117.2	3	111.8
239	G	30.7	Very low	46.5	Very low	79 Å²	79	126.6 Å²	126.6	81%	0.814	74%	0.739	S	S	*	*			trans	71.6	78.2	141.1	0	0	0	0	0	118.7	G241	G239-G241 PolarHBondContact O-N 3.1Å
240	G	32.5	Very low	47.8	Very low	87 Å²	87	131.8 Å²	131.8	90%	0.897	74%	0.744	S	S	*	*			trans	-87.5	93.4	161.3	0	0	0	0	0	111.1
241	G	39.6	Very low	49.4	Very low	71 Å²	71	126.4 Å²	126.4	73%	0.732	74%	0.739	S	S	*	*			trans	-75.1	134.2	173.3	0	0	0	0	0	112.2	G239 E243	G239-G241 PolarHBondContact O-N 3.1Å; G241-E243 PolarHBondContact O-N 2.93Å
242	E	44.4	Very low	51	Low	173 Å²	173	126.9 Å²	126.9	81%	0.808	73%	0.732	S	S	*	*			trans	-58.5	111.9	177.2	-61.3	174.1	102.3	0	0	111.7	R259	E242-R259 IonicContact OE2-NH2 3.94Å; E242-R259 PolarHBondContact OE2-NH2 3.47Å
243	E	52.3	Low	52.5	Low	185 Å²	185	125.7 Å²	125.7	86%	0.864	72%	0.721	S	S	*	*			trans	-93.4	102.3	172.9	-158.6	-172	154	0	0	110.3	G241 K245	G241-E243 PolarHBondContact O-N 2.93Å; E243-K245 PolarHBondContact O-N 3.42Å
244	G	52.8	Low	54	Low	64 Å²	64	126.3 Å²	126.3	66%	0.66	71%	0.713	S	S	*	*			trans	-65.1	119.1	172	0	0	0	0	0	111.3	S246	G244-S246 PolarHBondContact O-N 3.04Å
245	K	53.2	Low	55.6	Low	188 Å²	188	130.6 Å²	130.6	82%	0.817	72%	0.719	S	S	*	*			trans	-68.5	93.4	178.8	-61.7	169.6	-177.2	174.1	0	110.2	E243 V247	E243-K245 PolarHBondContact O-N 3.42Å; K245-V247 PolarHBondContact O-N 3.25Å
246	S	63.8	Low	56.6	Low	50 Å²	50	126.8 Å²	126.8	35%	0.35	70%	0.704	S	S	.	*	P	Polyproline II helix	trans	-68.2	116.6	174.4	-176.5	0	0	0	0	110.8	G244 L253 L254	G244-S246 PolarHBondContact O-N 3.04Å; S246-L253 WeakPolarHBondContact OG-CD1 3.25Å; S246-L253 VanDerWaalsContact OG-CG 3.22Å; S246-L253 WeakPolarHBondContact OG-CG 3.37Å; S246-L254 PolarHBondContact OG-O 3.16Å
247	V	66	Low	56.9	Low	95 Å²	95	125 Å²	125	58%	0.576	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-81.1	131.4	172.5	-92.3	0	0	0	0	110.4	K245 L254	K245-V247 PolarHBondContact O-N 3.25Å; V247-L254 WeakPolarHBondContact O-CB 3.3Å; V247-L254 PolarHBondContact O-N 3.31Å
248	K	79.4	Confident	57.5	Low	147 Å²	147	121.1 Å²	121.1	64%	0.639	71%	0.708	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97.8	122.2	170.9	-81	171.9	168.1	141.1	0	109.6	V252 L253	K248-V252 VanDerWaalsContact CA-O 3.29Å; K248-V252 WeakPolarHBondContact CA-O 3.07Å; K248-L253 HydrophobicContact CD-CD1 4.15Å; K248-L253 VanDerWaalsContact CE-CD1 3.45Å; K248-L253 HydrophobicContact CG-CB 4.27Å; K248-L253 HydrophobicContact CG-CD1 3.78Å
249	L	73.5	Confident	58	Low	114 Å²	114	120.3 Å²	120.3	60%	0.597	71%	0.705	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-110.5	126.1	167.8	-144.6	83.1	0	0	0	108.4	G251 V252 L254	L249-G251 PolarHBondContact O-N 3.31Å; L249-V252 PolarHBondContact N-O 3.46Å; L249-V252 VanDerWaalsContact N-O 3.13Å; L249-V252 PolarHBondContact O-N 2.98Å; L249-L254 HydrophobicContact CB-CD1 3.84Å
250	F	64.8	Low	59	Low	201 Å²	201	125.7 Å²	125.7	88%	0.882	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	53.5	34.4	-179.5	-64.3	-84.6	0	0	0	115.4	V252	F250-V252 PolarHBondContact O-N 3.04Å
251	G	72.3	Confident	59.4	Low	71 Å²	71	133 Å²	133	73%	0.732	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	76.3	3.9	-179.1	0	0	0	0	0	114.7	L249	L249-G251 PolarHBondContact O-N 3.31Å
252	V	76.5	Confident	59.4	Low	97 Å²	97	133.5 Å²	133.5	59%	0.588	71%	0.711	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-96.2	124.1	170.7	-176.3	0	0	0	0	108.6	K248 L249 F250 L254	K248-V252 VanDerWaalsContact CA-O 3.29Å; K248-V252 WeakPolarHBondContact CA-O 3.07Å; L249-V252 PolarHBondContact N-O 3.46Å; L249-V252 VanDerWaalsContact N-O 3.13Å; L249-V252 PolarHBondContact O-N 2.98Å; F250-V252 PolarHBondContact O-N 3.04Å; V252-L254 PolarHBondContact O-N 3.26Å
253	L	73.9	Confident	59	Low	98 Å²	98	135.9 Å²	135.9	51%	0.513	71%	0.712	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.1	107.5	175.6	-169.9	83.1	0	0	0	108.3	S246 K248 K255	S246-L253 WeakPolarHBondContact OG-CD1 3.25Å; S246-L253 VanDerWaalsContact OG-CG 3.22Å; S246-L253 WeakPolarHBondContact OG-CG 3.37Å; K248-L253 HydrophobicContact CD-CD1 4.15Å; K248-L253 VanDerWaalsContact CE-CD1 3.45Å; K248-L253 HydrophobicContact CG-CB 4.27Å; K248-L253 HydrophobicContact CG-CD1 3.78Å; L253-K255 PolarHBondContact O-N 3.2Å
254	L	69.3	Low	58.5	Low	91 Å²	91	133.4 Å²	133.4	48%	0.476	71%	0.714	S	S	.	*			trans	-75.8	111.6	168.7	-81.7	89.3	0	0	0	107.7	S246 V247 L249 V252 D256	S246-L254 PolarHBondContact OG-O 3.16Å; V247-L254 WeakPolarHBondContact O-CB 3.3Å; V247-L254 PolarHBondContact O-N 3.31Å; L249-L254 HydrophobicContact CB-CD1 3.84Å; V252-L254 PolarHBondContact O-N 3.26Å; L254-D256 PolarHBondContact O-N 2.84Å
255	K	69.6	Low	57.9	Low	192 Å²	192	137.6 Å²	137.6	84%	0.835	72%	0.717	S	S	*	*			trans	-82.6	109.9	172	-177.8	157.9	-179.3	169.1	0	108	L253 A257	L253-K255 PolarHBondContact O-N 3.2Å; K255-A257 PolarHBondContact O-N 3.48Å; K255-A257 VanDerWaalsContact O-N 3.12Å
256	D	58.4	Low	57.2	Low	99 Å²	99	136.9 Å²	136.9	53%	0.529	72%	0.716	S	S	.	*			trans	-55.8	115.5	174.2	-73.5	-71.7	0	0	0	110.8	L254 A258	L254-D256 PolarHBondContact O-N 2.84Å; D256-A258 VanDerWaalsContact C-N 3.29Å; D256-A258 PolarHBondContact O-N 3.48Å; D256-A258 VanDerWaalsContact O-N 3.14Å
257	A	47.9	Very low	56.1	Low	111 Å²	111	138.9 Å²	138.9	92%	0.917	74%	0.736	S	S	*	*			trans	-83.7	73.9	172.4	0	0	0	0	0	109	K255	K255-A257 PolarHBondContact O-N 3.48Å; K255-A257 VanDerWaalsContact O-N 3.12Å
258	A	47.7	Very low	55	Low	86 Å²	86	139 Å²	139	71%	0.711	75%	0.747	S	S	*	*			trans	-129	73.3	177.1	0	0	0	0	0	111.1	D256	D256-A258 VanDerWaalsContact C-N 3.29Å; D256-A258 PolarHBondContact O-N 3.48Å; D256-A258 VanDerWaalsContact O-N 3.14Å
259	R	50.6	Low	53.3	Low	228 Å²	228	136.6 Å²	136.6	86%	0.86	75%	0.754	S	S	*	*			trans	-146.9	113.9	148.7	-112.2	-179.9	-167.6	-101.7	-1.4	111	E242	E242-R259 IonicContact OE2-NH2 3.94Å; E242-R259 PolarHBondContact OE2-NH2 3.47Å
260	K	50.2	Low	52.3	Low	192 Å²	192	137 Å²	137	84%	0.835	77%	0.766	S	S	*	*			trans	-77.8	139.8	-175.8	-156.7	177.5	-173.3	178.7	0	109.7
261	R	41.1	Very low	51.2	Low	241 Å²	241	136.3 Å²	136.3	91%	0.909	77%	0.766	S	S	*	*			trans	48.7	111	149.7	-82.4	177.5	163.5	-109.2	-0.5	118.9
262	G	39.5	Very low	50.3	Low	80 Å²	80	144.1 Å²	144.1	83%	0.825	77%	0.773	S	S	*	*			trans	-154	106.8	156.5	0	0	0	0	0	109.6
263	R	35.6	Very low	49	Very low	223 Å²	223	145.1 Å²	145.1	84%	0.842	78%	0.782	S	S	*	*			trans	-66.3	131.7	-178.5	176.2	-175.9	-164.8	165	4.2	111.1
264	C	42.6	Very low	47.8	Very low	134 Å²	134	148.4 Å²	148.4	91%	0.905	80%	0.798	S	S	*	*			trans	-154.1	139.2	147.2	-95.2	0	0	0	0	109.4
265	E	40.1	Very low	47.1	Very low	152 Å²	152	153 Å²	153	71%	0.71	81%	0.814	S	S	*	*			trans	-84.1	162.7	-163.1	-144.1	163.1	126.1	0	0	112.3
266	E	38.4	Very low	45.9	Very low	172 Å²	172	152.8 Å²	152.8	80%	0.804	82%	0.819	S	S	*	*			trans	79.1	103	146.6	-155.2	155.1	118.5	0	0	119.2
267	A	40.6	Very low	45.7	Very low	92 Å²	92	155.1 Å²	155.1	76%	0.76	83%	0.83	S	S	*	*				167.1	123.7	103.3	0	0	0	0	0	112.8
268	A	43.6	Very low	46	Very low	98 Å²	98	161.2 Å²	161.2	81%	0.81	83%	0.829	S	S	*	*			trans	72.5	102.3	140.2	0	0	0	0	0	121.7
269	A	44.3	Very low	45.9	Very low	96 Å²	96	164.3 Å²	164.3	79%	0.793	84%	0.838	S	S	*	*				65.4	99.1	117.3	0	0	0	0	0	120
270	S	50.9	Low	45.7	Very low	122 Å²	122	156.6 Å²	156.6	85%	0.853	83%	0.829	S	S	*	*				-179.2	127	97	61.4	0	0	0	0	110.5
271	E	41.8	Very low	45.5	Very low	187 Å²	187	155.5 Å²	155.5	87%	0.874	83%	0.828	S	S	*	*			trans	-75.8	134.1	-175.7	-61.6	161	103.4	0	0	111.5
272	R	53.7	Low	46	Very low	236 Å²	236	149.3 Å²	149.3	89%	0.891	82%	0.819	S	S	*	*			trans	-146.7	125.4	136.7	-66.7	-163.4	179.6	-175.1	-0.8	110.3
273	P	48.6	Very low	46.4	Very low	118 Å²	118	157 Å²	157	77%	0.766	82%	0.823	S	S	*	*			trans	-80.3	130.4	-172.9	31.1	-32.9	0	0	0	111.8	K275	P273-K275 PolarHBondContact O-N 2.99Å
274	I	50.6	Low	47	Very low	166 Å²	166	153 Å²	153	85%	0.851	82%	0.823	S	S	*	*			trans	-71.7	109	170.2	-63	172.6	0	0	0	107.8	M276	I274-M276 PolarHBondContact O-N 2.75Å
275	K	53.4	Low	47.4	Very low	188 Å²	188	150.1 Å²	150.1	82%	0.817	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-66.6	119.2	170.5	-75.5	175.7	177.7	171.7	0	109.1	P273 I277	P273-K275 PolarHBondContact O-N 2.99Å; K275-I277 PolarHBondContact O-N 2.77Å
276	M	43.9	Very low	48.1	Very low	188 Å²	188	149.3 Å²	149.3	93%	0.926	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-58.4	116	165.4	-74.4	174.3	36.9	0	0	109.7	I274	I274-M276 PolarHBondContact O-N 2.75Å
277	I	54.6	Low	49	Very low	148 Å²	148	147 Å²	147	76%	0.759	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-93.6	117.4	169	-67.3	170.1	0	0	0	107.7	K275	K275-I277 PolarHBondContact O-N 2.77Å
278	R	54.3	Low	49.2	Very low	239 Å²	239	148.2 Å²	148.2	90%	0.902	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-65.2	128	176.8	-162.2	172.4	-170.2	136.3	-1.4	109	G280	R278-G280 PolarHBondContact O-N 3.44Å
279	V	45.9	Very low	49.7	Very low	151 Å²	151	149.5 Å²	149.5	92%	0.915	83%	0.826	S	S	*	*	S	Bend	trans	-70.8	121.9	176	175.4	0	0	0	0	108.9
280	G	46.1	Very low	49.9	Very low	65 Å²	65	148.1 Å²	148.1	67%	0.67	82%	0.822	S	S	*	*			trans	127.9	72	163.9	0	0	0	0	0	115.1	R278	R278-G280 PolarHBondContact O-N 3.44Å
281	E	45.9	Very low	49.9	Very low	170 Å²	170	149 Å²	149	79%	0.794	82%	0.824	S	S	*	*			trans	-156.6	147.9	148.4	-80.8	-142.4	140.1	0	0	111
282	P	50.9	Low	50.4	Low	111 Å²	111	144 Å²	144	72%	0.721	82%	0.824	S	S	*	*			trans	-85.2	130.9	-168.1	33.7	-31.7	0	0	0	112.1	V284	P282-V284 VanDerWaalsContact C-N 3.34Å; P282-V284 PolarHBondContact O-N 3.04Å
283	W	48.3	Very low	50.4	Low	242 Å²	242	144.4 Å²	144.4	92%	0.917	83%	0.825	S	S	*	*			trans	-84.2	77.1	-177.3	-55.9	64.2	0	0	0	109.3
284	V	49	Very low	50.7	Low	139 Å²	139	144.9 Å²	144.9	84%	0.842	83%	0.83	S	S	*	*			trans	-118.9	105.7	166	-169.5	0	0	0	0	107.2	P282	P282-V284 VanDerWaalsContact C-N 3.34Å; P282-V284 PolarHBondContact O-N 3.04Å
285	G	50.1	Low	50.7	Low	72 Å²	72	140.7 Å²	140.7	74%	0.742	83%	0.828	S	S	*	*			trans	-174.4	75.5	-177.9	0	0	0	0	0	111.3
286	V	55.2	Low	50.7	Low	136 Å²	136	134.7 Å²	134.7	82%	0.824	82%	0.819	S	S	*	*			trans	-73.5	124.5	165.7	179.7	0	0	0	0	107.7	S288	V286-S288 PolarHBondContact O-N 3.4Å
287	P	56.5	Low	51.2	Low	123 Å²	123	135.1 Å²	135.1	80%	0.799	82%	0.819	S	S	*	*			trans	-81.3	110.7	172.5	27.5	-22.8	0	0	0	109.6
288	S	46.4	Very low	51	Low	117 Å²	117	139.2 Å²	139.2	82%	0.818	84%	0.842	S	S	*	*			trans	-82.7	116.3	166.2	-177.9	0	0	0	0	109.8	V286	V286-S288 PolarHBondContact O-N 3.4Å
289	S	54	Low	50.8	Low	125 Å²	125	134.3 Å²	134.3	87%	0.874	84%	0.839	S	S	*	*			trans	-170.6	124.6	166.3	-78.2	0	0	0	0	106.1
290	G	48.6	Very low	51.1	Low	68 Å²	68	133.4 Å²	133.4	70%	0.701	84%	0.835	S	S	*	*			cis	-174.4	168.1	1.8	0	0	0	0	0	106.4
291	P	50.7	Low	51.4	Low	140 Å²	140	137.2 Å²	137.2	91%	0.909	85%	0.845	S	S	*	*			trans	-87.5	122.6	-170.7	32.9	-29.6	0	0	0	111.7
292	G	52.5	Low	51.7	Low	83 Å²	83	135.2 Å²	135.2	86%	0.856	85%	0.847	S	S	*	*			trans	-113.1	96.4	174.5	0	0	0	0	0	111.3
293	R	53.6	Low	51.7	Low	243 Å²	243	136.8 Å²	136.8	92%	0.917	86%	0.855	S	S	*	*			trans	-74.6	129.8	174.6	-129	-178.3	-172.4	-100.9	3.2	110.4
294	C	54.7	Low	52	Low	129 Å²	129	129.7 Å²	129.7	87%	0.872	85%	0.851	S	S	*	*			trans	-165.1	113.8	149.2	-84.4	0	0	0	0	104.2
295	G	49.9	Very low	52.2	Low	78 Å²	78	129.1 Å²	129.1	80%	0.804	85%	0.852	S	S	*	*			cis	67.9	110.2	35.3	0	0	0	0	0	108.9
296	G	54.3	Low	52.3	Low	62 Å²	62	133.5 Å²	133.5	64%	0.639	86%	0.86	S	S	*	*			cis	-177.2	173.4	1.7	0	0	0	0	0	107.5
297	E	54.2	Low	52.1	Low	197 Å²	197	133.3 Å²	133.3	92%	0.921	86%	0.863	S	S	*	*			trans	45.3	123	151.4	-63	158.4	90.3	0	0	117.9
298	N	50	Low	51.7	Low	234 Å²	234	134.2 Å²	134.2	100%	1.251	87%	0.869	S	S	*	*			cis	-165.8	0	40.8	-162.9	29.3	0	0	0	108.1

Retrieved 298 of 298 residues in 44.9 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).