A0A3Q0KKY5_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A3Q0KKY5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 247 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	35.6	Very low	57.3	Low	256 Å²	256	131 Å²	131	100%	1.261	72%	0.722	S	S	*	*				0	124.9	0	-78.9	165.2	154.6	0	0	108.7
2	G	44.9	Very low	58.6	Low	71 Å²	71	133 Å²	133	73%	0.732	71%	0.71	S	S	*	*			trans	156.1	55	179	0	0	0	0	0	112.2	K4	G2-K4 PolarHBondContact O-N 3.2Å
3	G	52.4	Low	59.9	Low	74 Å²	74	134.8 Å²	134.8	76%	0.763	70%	0.703	S	S	*	*			trans	-63	101.9	175.1	0	0	0	0	0	110.5
4	K	57	Low	61.3	Low	218 Å²	218	132.9 Å²	132.9	95%	0.948	69%	0.693	S	S	*	*			trans	-101.3	65.3	170.8	-81.5	174.1	172.5	159.5	0	108.9	G2	G2-K4 PolarHBondContact O-N 3.2Å
5	G	58.1	Low	62.6	Low	47 Å²	47	132.5 Å²	132.5	49%	0.485	68%	0.679	S	S	.	*			trans	-124.7	-24.7	178.1	0	0	0	0	0	115.2	G7	G5-G7 PolarHBondContact O-N 3.35Å
6	D	62.1	Low	63.7	Low	126 Å²	126	129.9 Å²	129.9	67%	0.674	67%	0.672	S	S	*	*	H	α-helix	trans	-86.5	-12.8	-155.8	-53.9	-20.1	0	0	0	114.9	R10	D6-R10 PolarHBondContact O-N 2.77Å
7	G	61.9	Low	65.1	Low	56 Å²	56	126.4 Å²	126.4	58%	0.577	65%	0.654	S	S	*	*	H	α-helix	trans	-75	-34.2	-175.9	0	0	0	0	0	114.1	G5 R11	G5-G7 PolarHBondContact O-N 3.35Å; G7-R11 PolarHBondContact O-N 3.27Å
8	I	62.4	Low	66.1	Low	103 Å²	103	124.1 Å²	124.1	53%	0.528	64%	0.642	S	S	.	*	H	α-helix	trans	-72.4	-38.4	-177.2	-61.4	179.5	0	0	0	110.1	R11 R12	I8-R11 PolarHBondContact O-N 2.88Å; I8-R12 WeakPolarHBondContact O-CG 3.36Å; I8-R12 PolarHBondContact O-N 2.93Å; I8-R12 VanDerWaalsContact O-N 3.12Å
9	H	63.5	Low	67.1	Low	143 Å²	143	119.4 Å²	119.4	66%	0.662	62%	0.618	S	S	*	*	H	α-helix	trans	-67.1	-42.9	179.9	-154	-77.3	0	0	0	111.8	R11 R12 Y13	H9-R11 PolarHBondContact O-N 3.11Å; H9-R12 PolarHBondContact O-N 3.22Å; H9-Y13 PolarHBondContact O-N 2.96Å; H9-Y13 VanDerWaalsContact O-N 3.09Å
10	R	65	Low	67.9	Low	198 Å²	198	116.8 Å²	116.8	75%	0.747	61%	0.61	S	S	*	*	H	α-helix	trans	-58.9	-46.2	174.4	-85.1	-171	-173.4	-114.4	2	112.5	D6 R12 Y13 L14	D6-R10 PolarHBondContact O-N 2.77Å; R10-R12 VanDerWaalsContact C-N 3.31Å; R10-R12 PolarHBondContact O-N 3.34Å; R10-Y13 PolarHBondContact O-N 3.24Å; R10-L14 WeakPolarHBondContact O-CG 3.45Å; R10-L14 PolarHBondContact O-N 2.99Å; R10-L14 VanDerWaalsContact O-N 3.12Å
11	R	67.5	Low	68.8	Low	149 Å²	149	115.3 Å²	115.3	56%	0.562	60%	0.602	S	S	*	*	H	α-helix	trans	-64.9	-37.6	-178.9	-161	-176.3	-70.7	-152.9	-1.9	111.4	G7 I8 H9 L14 W15	G7-R11 PolarHBondContact O-N 3.27Å; I8-R11 PolarHBondContact O-N 2.88Å; H9-R11 PolarHBondContact O-N 3.11Å; R11-L14 PolarHBondContact O-N 3.46Å; R11-W15 PolarHBondContact O-N 2.8Å
12	R	72.4	Confident	71.1	Confident	155 Å²	155	106.8 Å²	106.8	59%	0.585	56%	0.561	S	S	*	*	H	α-helix	trans	-62.7	-43.8	176.1	-73	176.3	-175.7	-176.6	3.4	111.8	I8 H9 R10 L14 W15 T16	I8-R12 WeakPolarHBondContact O-CG 3.36Å; I8-R12 PolarHBondContact O-N 2.93Å; I8-R12 VanDerWaalsContact O-N 3.12Å; H9-R12 PolarHBondContact O-N 3.22Å; R10-R12 VanDerWaalsContact C-N 3.31Å; R10-R12 PolarHBondContact O-N 3.34Å; R12-L14 VanDerWaalsContact C-N 3.32Å; R12-L14 PolarHBondContact O-N 3.34Å; R12-W15 PolarHBondContact O-N 2.88Å; R12-T16 PolarHBondContact O-N 3.41Å; R12-T16 VanDerWaalsContact O-N 3.14Å; R12-T16 PolarHBondContact O-OG1 3.49Å
13	Y	76.1	Confident	73.1	Confident	156 Å²	156	105.6 Å²	105.6	61%	0.612	54%	0.538	S	S	*	.	H	α-helix	trans	-59.3	-43.5	175.9	-175	-95	0	0	0	111.8	H9 R10 W15 T16 D17	H9-Y13 PolarHBondContact O-N 2.96Å; H9-Y13 VanDerWaalsContact O-N 3.09Å; R10-Y13 PolarHBondContact O-N 3.24Å; Y13-W15 VanDerWaalsContact C-N 3.34Å; Y13-W15 PolarHBondContact O-N 3.47Å; Y13-T16 PolarHBondContact O-N 3.48Å; Y13-D17 WeakPolarHBondContact O-CB 3.22Å; Y13-D17 PolarHBondContact O-N 3.24Å
14	L	78.7	Confident	74.8	Confident	109 Å²	109	107.4 Å²	107.4	57%	0.571	53%	0.528	S	S	*	.	H	α-helix	trans	-61.8	-37.9	178.2	-68.5	173	0	0	0	113.3	R10 R11 R12 D17 L18	R10-L14 WeakPolarHBondContact O-CG 3.45Å; R10-L14 PolarHBondContact O-N 2.99Å; R10-L14 VanDerWaalsContact O-N 3.12Å; R11-L14 PolarHBondContact O-N 3.46Å; R12-L14 VanDerWaalsContact C-N 3.32Å; R12-L14 PolarHBondContact O-N 3.34Å; L14-D17 PolarHBondContact O-N 2.86Å; L14-L18 WeakPolarHBondContact O-CB 3.35Å; L14-L18 PolarHBondContact O-N 3.39Å
15	W	81.6	Confident	76.4	Confident	127 Å²	127	101.7 Å²	101.7	48%	0.481	51%	0.506	S	S	.	.	H	α-helix	trans	-67.7	-39.7	175.7	-73.7	108.8	0	0	0	111.9	R11 R12 Y13 D17 L18 I19 L76	R11-W15 PolarHBondContact O-N 2.8Å; R12-W15 PolarHBondContact O-N 2.88Å; Y13-W15 VanDerWaalsContact C-N 3.34Å; Y13-W15 PolarHBondContact O-N 3.47Å; W15-D17 VanDerWaalsContact C-N 3.33Å; W15-L18 HydrophobicContact CE3-CD2 4.25Å; W15-L18 HydrophobicContact CZ3-CD2 4.23Å; W15-L18 PolarHBondContact O-N 2.71Å; W15-I19 WeakPolarHBondContact O-CG2 3.43Å; W15-I19 PolarHBondContact O-N 3.31Å; W15-L76 HydrophobicContact CH2-CD2 4.36Å; W15-L76 HydrophobicContact CZ3-CD2 4.1Å
16	T	80.6	Confident	77.6	Confident	91 Å²	91	100.9 Å²	100.9	56%	0.558	49%	0.492	S	S	*	.	H	α-helix	trans	-66	-36.2	175.3	-59.7	0	0	0	0	111.9	R12 Y13 I19 C20	R12-T16 PolarHBondContact O-N 3.41Å; R12-T16 VanDerWaalsContact O-N 3.14Å; R12-T16 PolarHBondContact O-OG1 3.49Å; Y13-T16 PolarHBondContact O-N 3.48Å; T16-I19 WeakPolarHBondContact O-CG2 3.37Å; T16-C20 WeakPolarHBondContact O-CB 3.16Å; T16-C20 PolarHBondContact O-N 3.49Å
17	D	87.1	Confident	78.7	Confident	69 Å²	69	99 Å²	99	37%	0.369	48%	0.482	S	S	.	.	H	α-helix	trans	-67.8	-45.5	174.6	-170.9	57.9	0	0	0	111.3	Y13 L14 W15 I19 C20 L21	Y13-D17 WeakPolarHBondContact O-CB 3.22Å; Y13-D17 PolarHBondContact O-N 3.24Å; L14-D17 PolarHBondContact O-N 2.86Å; W15-D17 VanDerWaalsContact C-N 3.33Å; D17-I19 PolarHBondContact O-N 2.99Å; D17-C20 WeakPolarHBondContact O-CA 3.41Å; D17-C20 VanDerWaalsContact O-CB 3.31Å; D17-C20 WeakPolarHBondContact O-CB 3.44Å; D17-C20 PolarHBondContact O-N 2.86Å; D17-C20 VanDerWaalsContact O-N 3.11Å; D17-L21 WeakPolarHBondContact O-CG 3.26Å; D17-L21 PolarHBondContact O-N 3.07Å
18	L	83.1	Confident	80	Confident	85 Å²	85	102.2 Å²	102.2	45%	0.445	49%	0.485	S	S	.	.	H	α-helix	trans	-60.1	-43.3	176.7	-176.6	67.4	0	0	0	112.4	L14 W15 C20 L21 L22	L14-L18 WeakPolarHBondContact O-CB 3.35Å; L14-L18 PolarHBondContact O-N 3.39Å; W15-L18 HydrophobicContact CE3-CD2 4.25Å; W15-L18 HydrophobicContact CZ3-CD2 4.23Å; W15-L18 PolarHBondContact O-N 2.71Å; L18-C20 VanDerWaalsContact C-N 3.35Å; L18-L21 PolarHBondContact O-N 2.9Å; L18-L22 HydrophobicContact CG-CD1 4.45Å; L18-L22 WeakPolarHBondContact O-CG 3.1Å; L18-L22 PolarHBondContact O-N 3.46Å
19	I	85.1	Confident	81.1	Confident	36 Å²	36	101.3 Å²	101.3	19%	0.185	49%	0.485	C	S	.	.	H	α-helix	trans	-66.2	-39.1	175.4	-176.7	62.5	0	0	0	111.1	W15 T16 D17 L21 L22 I23 N69	W15-I19 WeakPolarHBondContact O-CG2 3.43Å; W15-I19 PolarHBondContact O-N 3.31Å; T16-I19 WeakPolarHBondContact O-CG2 3.37Å; D17-I19 PolarHBondContact O-N 2.99Å; I19-L21 VanDerWaalsContact C-N 3.31Å; I19-L21 PolarHBondContact O-N 2.95Å; I19-L22 PolarHBondContact O-N 3.28Å; I19-I23 HydrophobicContact CD1-CD1 4.07Å; I19-I23 HydrophobicContact CD1-CG1 4.21Å; I19-I23 HydrophobicContact CG1-CD1 3.87Å; I19-I23 HydrophobicContact CG1-CG1 4.41Å; I19-I23 VanDerWaalsContact O-CG1 3.24Å; I19-I23 WeakPolarHBondContact O-CG1 3.25Å; I19-I23 PolarHBondContact O-N 2.82Å; I19-N69 HydrophobicContact CD1-CB 4.2Å
20	C	83.2	Confident	82.1	Confident	66 Å²	66	95.6 Å²	95.6	45%	0.446	46%	0.459	S	S	.	.	H	α-helix	trans	-57.2	-47.4	173.8	-171.1	0	0	0	0	110.4	T16 D17 L18 L22 I23 M24	T16-C20 WeakPolarHBondContact O-CB 3.16Å; T16-C20 PolarHBondContact O-N 3.49Å; D17-C20 WeakPolarHBondContact O-CA 3.41Å; D17-C20 VanDerWaalsContact O-CB 3.31Å; D17-C20 WeakPolarHBondContact O-CB 3.44Å; D17-C20 PolarHBondContact O-N 2.86Å; D17-C20 VanDerWaalsContact O-N 3.11Å; L18-C20 VanDerWaalsContact C-N 3.35Å; C20-L22 PolarHBondContact O-N 3.35Å; C20-I23 PolarHBondContact O-N 3.34Å; C20-M24 WeakPolarHBondContact O-CB 3.48Å; C20-M24 WeakPolarHBondContact O-CG 3.22Å; C20-M24 PolarHBondContact O-N 3.05Å
21	L	85.9	Confident	83.1	Confident	87 Å²	87	90 Å²	90	46%	0.455	45%	0.449	S	S	.	.	H	α-helix	trans	-60.6	-45.2	176	-67.1	173.5	0	0	0	112.3	D17 L18 I19 I23 M24 I25	D17-L21 WeakPolarHBondContact O-CG 3.26Å; D17-L21 PolarHBondContact O-N 3.07Å; L18-L21 PolarHBondContact O-N 2.9Å; I19-L21 VanDerWaalsContact C-N 3.31Å; I19-L21 PolarHBondContact O-N 2.95Å; L21-I23 PolarHBondContact O-N 3.3Å; L21-M24 PolarHBondContact O-N 2.87Å; L21-I25 HydrophobicContact CB-CD1 4.49Å; L21-I25 WeakPolarHBondContact O-CB 3.33Å; L21-I25 WeakPolarHBondContact O-CD1 3.4Å; L21-I25 WeakPolarHBondContact O-CG1 3.35Å; L21-I25 PolarHBondContact O-N 3.33Å
22	L	85.3	Confident	84.1	Confident	76 Å²	76	85.2 Å²	85.2	40%	0.398	44%	0.441	S	S	.	.	H	α-helix	trans	-60.8	-28.7	178.1	-77.5	171.3	0	0	0	113.4	L18 I19 C20 P26	L18-L22 HydrophobicContact CG-CD1 4.45Å; L18-L22 WeakPolarHBondContact O-CG 3.1Å; L18-L22 PolarHBondContact O-N 3.46Å; I19-L22 PolarHBondContact O-N 3.28Å; C20-L22 PolarHBondContact O-N 3.35Å; L22-P26 WeakPolarHBondContact O-CD 3.37Å; L22-P26 VanDerWaalsContact O-CG 3.28Å; L22-P26 WeakPolarHBondContact O-CG 3.41Å
23	I	85.3	Confident	84.7	Confident	47 Å²	47	84.9 Å²	84.9	24%	0.241	44%	0.44	C	S	.	.	H	α-helix	trans	-85.2	-41	176.7	-62.2	172.5	0	0	0	110.7	I19 C20 L21 P26 L27 L66	I19-I23 HydrophobicContact CD1-CD1 4.07Å; I19-I23 HydrophobicContact CD1-CG1 4.21Å; I19-I23 HydrophobicContact CG1-CD1 3.87Å; I19-I23 HydrophobicContact CG1-CG1 4.41Å; I19-I23 VanDerWaalsContact O-CG1 3.24Å; I19-I23 WeakPolarHBondContact O-CG1 3.25Å; I19-I23 PolarHBondContact O-N 2.82Å; C20-I23 PolarHBondContact O-N 3.34Å; L21-I23 PolarHBondContact O-N 3.3Å; I23-P26 VanDerWaalsContact O-CD 3.29Å; I23-P26 WeakPolarHBondContact O-CD 3.35Å; I23-P26 WeakPolarHBondContact O-CG 3.31Å; I23-L27 HydrophobicContact CG2-CD1 4.45Å; I23-L27 WeakPolarHBondContact O-CD1 3.26Å; I23-L27 PolarHBondContact O-N 3.46Å; I23-L66 HydrophobicContact CB-CD1 4.14Å; I23-L66 HydrophobicContact CD1-CD1 3.56Å; I23-L66 HydrophobicContact CG1-CD1 3.41Å; I23-L66 VanDerWaalsContact CG1-CD1 3.41Å; I23-L66 HydrophobicContact CG2-CD1 3.75Å
24	M	88.3	Confident	84.9	Confident	112 Å²	112	80.8 Å²	80.8	55%	0.552	43%	0.429	S	S	*	.	H	α-helix	trans	-67.7	-36.3	-179	-70.6	-65.4	-77.2	0	0	112.3	C20 L21 L27 L28	C20-M24 WeakPolarHBondContact O-CB 3.48Å; C20-M24 WeakPolarHBondContact O-CG 3.22Å; C20-M24 PolarHBondContact O-N 3.05Å; L21-M24 PolarHBondContact O-N 2.87Å; M24-L27 PolarHBondContact O-N 3.5Å; M24-L28 VanDerWaalsContact O-CB 3.25Å; M24-L28 WeakPolarHBondContact O-CB 3.5Å; M24-L28 PolarHBondContact O-N 3.25Å
25	I	90.1	Very high	85.2	Confident	98 Å²	98	78 Å²	78	50%	0.503	42%	0.421	S	S	.	.	H	α-helix	trans	-59.5	-55.3	-179.7	-70.6	162.2	0	0	0	113.1	L21 L27 L28 T29	L21-I25 HydrophobicContact CB-CD1 4.49Å; L21-I25 WeakPolarHBondContact O-CB 3.33Å; L21-I25 WeakPolarHBondContact O-CD1 3.4Å; L21-I25 WeakPolarHBondContact O-CG1 3.35Å; L21-I25 PolarHBondContact O-N 3.33Å; I25-L27 VanDerWaalsContact C-N 3.33Å; I25-L27 PolarHBondContact O-N 3.46Å; I25-L28 PolarHBondContact O-N 2.95Å; I25-T29 WeakPolarHBondContact O-CB 3.29Å; I25-T29 PolarHBondContact O-N 2.88Å; I25-T29 PolarHBondContact O-OG1 3.24Å
26	P	84.1	Confident	85.2	Confident	29 Å²	29	76.6 Å²	76.6	19%	0.188	42%	0.422	C	S	.	.	H	α-helix	trans	-65.6	-36	179.5	24.9	-34	0	0	0	112	L22 I23 T29 L30	L22-P26 WeakPolarHBondContact O-CD 3.37Å; L22-P26 VanDerWaalsContact O-CG 3.28Å; L22-P26 WeakPolarHBondContact O-CG 3.41Å; I23-P26 VanDerWaalsContact O-CD 3.29Å; I23-P26 WeakPolarHBondContact O-CD 3.35Å; I23-P26 WeakPolarHBondContact O-CG 3.31Å; P26-T29 PolarHBondContact O-N 2.94Å; P26-L30 WeakPolarHBondContact O-CG 3.13Å; P26-L30 PolarHBondContact O-N 2.94Å
27	L	84.7	Confident	85.1	Confident	86 Å²	86	73.8 Å²	73.8	45%	0.45	41%	0.406	S	S	.	.	H	α-helix	trans	-59.2	-50.5	173.4	-100.6	69.6	0	0	0	111.3	I23 M24 I25 T29 L30 C31	I23-L27 HydrophobicContact CG2-CD1 4.45Å; I23-L27 WeakPolarHBondContact O-CD1 3.26Å; I23-L27 PolarHBondContact O-N 3.46Å; M24-L27 PolarHBondContact O-N 3.5Å; I25-L27 VanDerWaalsContact C-N 3.33Å; I25-L27 PolarHBondContact O-N 3.46Å; L27-T29 VanDerWaalsContact C-N 3.33Å; L27-T29 PolarHBondContact O-N 3.38Å; L27-L30 PolarHBondContact O-N 3.36Å; L27-C31 PolarHBondContact O-N 3.17Å; L27-C31 PolarHBondContact O-SG 3.39Å
28	L	89	Confident	84.3	Confident	124 Å²	124	74.1 Å²	74.1	65%	0.649	41%	0.414	S	S	*	.	H	α-helix	trans	-64.6	-40.1	-180	-172.9	63.8	0	0	0	111.7	M24 I25 L30 C31 A32	M24-L28 VanDerWaalsContact O-CB 3.25Å; M24-L28 WeakPolarHBondContact O-CB 3.5Å; M24-L28 PolarHBondContact O-N 3.25Å; I25-L28 PolarHBondContact O-N 2.95Å; L28-L30 VanDerWaalsContact C-N 3.33Å; L28-L30 PolarHBondContact O-N 3.46Å; L28-C31 PolarHBondContact O-N 3.41Å; L28-A32 WeakPolarHBondContact O-CB 3.34Å; L28-A32 PolarHBondContact O-N 2.94Å
29	T	86.9	Confident	83.7	Confident	84 Å²	84	75.2 Å²	75.2	52%	0.515	42%	0.42	S	S	.	.	H	α-helix	trans	-60.2	-42.8	175.6	-56.1	0	0	0	0	111	I25 P26 L27 A32 W33	I25-T29 WeakPolarHBondContact O-CB 3.29Å; I25-T29 PolarHBondContact O-N 2.88Å; I25-T29 PolarHBondContact O-OG1 3.24Å; P26-T29 PolarHBondContact O-N 2.94Å; L27-T29 VanDerWaalsContact C-N 3.33Å; L27-T29 PolarHBondContact O-N 3.38Å; T29-A32 PolarHBondContact O-N 3.49Å; T29-W33 VanDerWaalsContact O-CB 3.26Å; T29-W33 WeakPolarHBondContact O-CB 3.28Å; T29-W33 PolarHBondContact O-N 3.06Å
30	L	83.9	Confident	82.9	Confident	24 Å²	24	80 Å²	80	13%	0.126	44%	0.442	C	S	.	.	H	α-helix	trans	-66.5	-41.3	175.8	-75.9	176.2	0	0	0	112.5	P26 L27 L28 A32 W33 L34 L59 S62	P26-L30 WeakPolarHBondContact O-CG 3.13Å; P26-L30 PolarHBondContact O-N 2.94Å; L27-L30 PolarHBondContact O-N 3.36Å; L28-L30 VanDerWaalsContact C-N 3.33Å; L28-L30 PolarHBondContact O-N 3.46Å; L30-A32 VanDerWaalsContact C-N 3.33Å; L30-A32 PolarHBondContact O-N 2.87Å; L30-W33 PolarHBondContact O-N 2.75Å; L30-L34 WeakPolarHBondContact O-CB 3.38Å; L30-L34 WeakPolarHBondContact O-CG 3.46Å; L30-L34 PolarHBondContact O-N 3.33Å; L30-L59 HydrophobicContact CD1-CD1 4.02Å; L30-S62 VanDerWaalsContact CD1-OG 3.26Å; L30-S62 WeakPolarHBondContact CD1-OG 2.89Å
31	C	86.7	Confident	81.8	Confident	81 Å²	81	82 Å²	82	55%	0.547	45%	0.448	S	S	.	.	H	α-helix	trans	-60.4	-44	174.7	-67.6	0	0	0	0	111.5	L27 L28 L34 A35	L27-C31 PolarHBondContact O-N 3.17Å; L27-C31 PolarHBondContact O-SG 3.39Å; L28-C31 PolarHBondContact O-N 3.41Å; C31-L34 PolarHBondContact O-N 3.44Å; C31-A35 WeakPolarHBondContact O-CB 3.41Å; C31-A35 PolarHBondContact O-N 2.88Å
32	A	88.2	Confident	80.7	Confident	47 Å²	47	86.3 Å²	86.3	39%	0.388	47%	0.466	S	S	.	.	H	α-helix	trans	-65.3	-42.6	175.7	0	0	0	0	0	111.8	L28 T29 L30 L34 A35 I36	L28-A32 WeakPolarHBondContact O-CB 3.34Å; L28-A32 PolarHBondContact O-N 2.94Å; T29-A32 PolarHBondContact O-N 3.49Å; L30-A32 VanDerWaalsContact C-N 3.33Å; L30-A32 PolarHBondContact O-N 2.87Å; A32-L34 VanDerWaalsContact C-N 3.34Å; A32-L34 PolarHBondContact O-N 3.48Å; A32-A35 PolarHBondContact O-N 3.47Å; A32-I36 WeakPolarHBondContact O-CG1 3.22Å; A32-I36 PolarHBondContact O-N 3.2Å
33	W	85	Confident	79.2	Confident	148 Å²	148	93.6 Å²	93.6	56%	0.561	49%	0.488	S	S	*	.	H	α-helix	trans	-60.8	-43.8	177.3	-176.7	-93.4	0	0	0	111.9	T29 L30 I36 S37	T29-W33 VanDerWaalsContact O-CB 3.26Å; T29-W33 WeakPolarHBondContact O-CB 3.28Å; T29-W33 PolarHBondContact O-N 3.06Å; L30-W33 PolarHBondContact O-N 2.75Å; W33-I36 PolarHBondContact O-N 2.89Å; W33-S37 PolarHBondContact NE1-OG 3.37Å; W33-S37 WeakPolarHBondContact O-CB 3.42Å; W33-S37 PolarHBondContact O-N 3.04Å; W33-S37 PolarHBondContact O-OG 3.43Å
34	L	80.1	Confident	77.8	Confident	71 Å²	71	96.7 Å²	96.7	37%	0.372	51%	0.514	S	S	.	.	H	α-helix	trans	-61.4	-45.7	173.8	-84.9	176.7	0	0	0	112.2	L30 C31 A32 I36 S37 S38 F55	L30-L34 WeakPolarHBondContact O-CB 3.38Å; L30-L34 WeakPolarHBondContact O-CG 3.46Å; L30-L34 PolarHBondContact O-N 3.33Å; C31-L34 PolarHBondContact O-N 3.44Å; A32-L34 VanDerWaalsContact C-N 3.34Å; A32-L34 PolarHBondContact O-N 3.48Å; L34-I36 PolarHBondContact O-N 3.23Å; L34-S37 PolarHBondContact O-N 2.88Å; L34-S38 WeakPolarHBondContact O-CB 3.4Å; L34-S38 PolarHBondContact O-N 2.89Å; L34-S38 PolarHBondContact O-OG 3.48Å; L34-F55 HydrophobicContact CD1-CD2 4.17Å; L34-F55 HydrophobicContact CD1-CE2 3.3Å; L34-F55 HydrophobicContact CD1-CZ 3.63Å; L34-F55 HydrophobicContact CD2-CD1 4.39Å; L34-F55 HydrophobicContact CD2-CD2 3.16Å; L34-F55 HydrophobicContact CD2-CE1 4.39Å; L34-F55 HydrophobicContact CD2-CE2 3.21Å; L34-F55 HydrophobicContact CD2-CG 3.8Å; L34-F55 HydrophobicContact CD2-CZ 3.84Å; L34-F55 HydrophobicContact CG-CD2 3.62Å; L34-F55 HydrophobicContact CG-CE2 3.25Å; L34-F55 HydrophobicContact CG-CZ 4.03Å
35	A	84.4	Confident	76	Confident	51 Å²	51	95.6 Å²	95.6	42%	0.421	52%	0.523	S	S	.	.	H	α-helix	trans	-60.2	-45.9	179	0	0	0	0	0	111.2	C31 A32 S38 N39	C31-A35 WeakPolarHBondContact O-CB 3.41Å; C31-A35 PolarHBondContact O-N 2.88Å; A32-A35 PolarHBondContact O-N 3.47Å; A35-S38 PolarHBondContact O-OG 3.29Å; A35-N39 PolarHBondContact O-ND2 2.84Å
36	I	83	Confident	74.2	Confident	96 Å²	96	96.5 Å²	96.5	49%	0.492	54%	0.538	S	S	.	.	H	α-helix	trans	-66.6	-44.8	177.6	-64.6	163	0	0	0	110.9	A32 W33 L34 S38 N39	A32-I36 WeakPolarHBondContact O-CG1 3.22Å; A32-I36 PolarHBondContact O-N 3.2Å; W33-I36 PolarHBondContact O-N 2.89Å; L34-I36 PolarHBondContact O-N 3.23Å; I36-S38 VanDerWaalsContact C-N 3.3Å; I36-S38 PolarHBondContact O-N 3.23Å; I36-N39 PolarHBondContact O-N 2.95Å
37	S	77.4	Confident	72.9	Confident	32 Å²	32	100.2 Å²	100.2	22%	0.224	56%	0.564	C	S	.	*	H	α-helix	trans	-61.4	-39.2	-179.5	-61.1	0	0	0	0	111.6	W33 L34 N39 Q40	W33-S37 PolarHBondContact NE1-OG 3.37Å; W33-S37 WeakPolarHBondContact O-CB 3.42Å; W33-S37 PolarHBondContact O-N 3.04Å; W33-S37 PolarHBondContact O-OG 3.43Å; L34-S37 PolarHBondContact O-N 2.88Å; S37-N39 VanDerWaalsContact C-N 3.28Å; S37-N39 PolarHBondContact O-N 3.5Å; S37-Q40 PolarHBondContact O-N 3.17Å
38	S	70.2	Confident	71.4	Confident	76 Å²	76	106.4 Å²	106.4	53%	0.531	58%	0.582	S	S	.	*	H	α-helix	trans	-64.5	-29.3	179.2	69.8	0	0	0	0	113.9	L34 A35 I36	L34-S38 WeakPolarHBondContact O-CB 3.4Å; L34-S38 PolarHBondContact O-N 2.89Å; L34-S38 PolarHBondContact O-OG 3.48Å; A35-S38 PolarHBondContact O-OG 3.29Å; I36-S38 VanDerWaalsContact C-N 3.3Å; I36-S38 PolarHBondContact O-N 3.23Å
39	N	71	Confident	69.9	Low	108 Å²	108	109.7 Å²	109.7	58%	0.578	59%	0.591	S	S	*	*	H	α-helix	trans	-80.3	-15.2	179.6	-70.1	-51	0	0	0	113.1	A35 I36 S37	A35-N39 PolarHBondContact O-ND2 2.84Å; I36-N39 PolarHBondContact O-N 2.95Å; S37-N39 VanDerWaalsContact C-N 3.28Å; S37-N39 PolarHBondContact O-N 3.5Å
40	Q	67.3	Low	68.6	Low	136 Å²	136	110.9 Å²	110.9	64%	0.636	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-85.8	-11.7	-176.7	-67.6	-176.6	11.2	0	0	113.5	S37 E42	S37-Q40 PolarHBondContact O-N 3.17Å; Q40-E42 PolarHBondContact O-N 2.94Å
41	D	61.7	Low	67.8	Low	109 Å²	109	112.9 Å²	112.9	58%	0.583	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-73.1	-6.6	-175.6	-75.9	-25.6	0	0	0	114
42	E	61.2	Low	67.3	Low	177 Å²	177	115.8 Å²	115.8	83%	0.827	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-83.2	-10.7	-178.3	61.2	-172.8	166.2	0	0	115	Q40	Q40-E42 PolarHBondContact O-N 2.94Å
43	R	54.5	Low	66.9	Low	229 Å²	229	121.6 Å²	121.6	86%	0.864	62%	0.622	S	S	*	*	S	Bend	trans	-113	-18.3	-171.7	-158.7	165.4	-174	142.3	1.1	117	A45	R43-A45 PolarHBondContact O-N 3Å
44	S	55.3	Low	66.6	Low	112 Å²	112	118.1 Å²	118.1	78%	0.783	62%	0.62	S	S	*	*			trans	-96.4	82	-179.9	-81	0	0	0	0	112
45	A	50.9	Low	66.7	Low	90 Å²	90	116.7 Å²	116.7	74%	0.744	61%	0.611	S	S	*	*			trans	-50.9	141.1	155.6	0	0	0	0	0	110.4	R43	R43-A45 PolarHBondContact O-N 3Å
46	S	53	Low	66.7	Low	116 Å²	116	119.6 Å²	119.6	81%	0.811	62%	0.615	S	S	*	*	S	Bend	trans	62.5	74.8	171.4	75.5	0	0	0	0	117.8
47	S	55.9	Low	66.9	Low	107 Å²	107	120.9 Å²	120.9	75%	0.748	62%	0.622	S	S	*	*			trans	153.1	99.7	130.6	58	0	0	0	0	108.9	K49	S47-K49 PolarHBondContact O-N 3.25Å
48	R	54.2	Low	67.4	Low	217 Å²	217	120.4 Å²	120.4	82%	0.819	62%	0.622	S	S	*	*			trans	-73.8	53.5	-164.6	-148.4	178.5	-167.6	174.1	2.7	112.9	F50	R48-F50 VanDerWaalsContact C-N 3.26Å; R48-F50 HydrophobicContact CG-CD2 4.15Å; R48-F50 HydrophobicContact CG-CE2 3.8Å; R48-F50 HydrophobicContact CG-CZ 4.42Å; R48-F50 PolarHBondContact O-N 3.46Å; R48-F50 VanDerWaalsContact O-N 3.11Å
49	K	57.9	Low	68.1	Low	193 Å²	193	120.7 Å²	120.7	84%	0.839	62%	0.617	S	S	*	*			trans	-83.1	83.1	167.4	-70.5	-175.1	-178.6	173.7	0	107.5	S47	S47-K49 PolarHBondContact O-N 3.25Å
50	F	59	Low	69	Low	108 Å²	108	120.6 Å²	120.6	47%	0.474	62%	0.616	S	S	.	*			trans	-47.6	131.8	175.6	-78.3	-93.5	0	0	0	111.2	R48 W52	R48-F50 VanDerWaalsContact C-N 3.26Å; R48-F50 HydrophobicContact CG-CD2 4.15Å; R48-F50 HydrophobicContact CG-CE2 3.8Å; R48-F50 HydrophobicContact CG-CZ 4.42Å; R48-F50 PolarHBondContact O-N 3.46Å; R48-F50 VanDerWaalsContact O-N 3.11Å; F50-W52 HydrophobicContact CB-CG 4Å; F50-W52 AromaticContact CD1-CD1 3.69Å; F50-W52 AromaticContact CD1-CE2 3.91Å; F50-W52 HydrophobicContact CD1-CZ2 4.46Å; F50-W52 AromaticContact CD1-NE1 3.01Å; F50-W52 AromaticContact CE1-NE1 3.66Å; F50-W52 AromaticContact CG-CD1 3.51Å; F50-W52 AromaticContact CG-NE1 3.32Å; F50-W52 VanDerWaalsContact CG-NE1 3.32Å; F50-W52 PolarHBondContact O-N 3.12Å
51	P	67.5	Low	70	Confident	66 Å²	66	117.4 Å²	117.4	43%	0.429	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.5	19.6	179.2	32	-36.3	0	0	0	113.6	Q53 S54 F55	P51-Q53 PolarHBondContact O-N 3.34Å; P51-Q53 VanDerWaalsContact O-N 3.07Å; P51-S54 PolarHBondContact O-N 2.88Å; P51-F55 PolarHBondContact O-N 2.88Å
52	W	76.4	Confident	71.3	Confident	143 Å²	143	113 Å²	113	54%	0.542	59%	0.586	S	S	.	*	H	α-helix	trans	-50.3	-36.5	177.6	-69.4	119.4	0	0	0	112	F50 S54 F55 F56	F50-W52 HydrophobicContact CB-CG 4Å; F50-W52 AromaticContact CD1-CD1 3.69Å; F50-W52 AromaticContact CD1-CE2 3.91Å; F50-W52 HydrophobicContact CD1-CZ2 4.46Å; F50-W52 AromaticContact CD1-NE1 3.01Å; F50-W52 AromaticContact CE1-NE1 3.66Å; F50-W52 AromaticContact CG-CD1 3.51Å; F50-W52 AromaticContact CG-NE1 3.32Å; F50-W52 VanDerWaalsContact CG-NE1 3.32Å; F50-W52 PolarHBondContact O-N 3.12Å; W52-S54 VanDerWaalsContact C-N 3.34Å; W52-S54 PolarHBondContact O-N 3.44Å; W52-F55 PolarHBondContact O-N 3.43Å; W52-F56 HydrophobicContact CB-CD2 4.2Å; W52-F56 HydrophobicContact CB-CE2 4.08Å; W52-F56 HydrophobicContact CE3-CE2 4.17Å; W52-F56 WeakPolarHBondContact O-CD2 3.43Å; W52-F56 PolarHBondContact O-N 3.35Å
53	Q	79.1	Confident	72.6	Confident	169 Å²	169	109.3 Å²	109.3	79%	0.79	57%	0.571	S	S	*	*	H	α-helix	trans	-56.9	-46.3	179.8	-66.9	-177	-13.8	0	0	112.1	P51 F55 L57	P51-Q53 PolarHBondContact O-N 3.34Å; P51-Q53 VanDerWaalsContact O-N 3.07Å; Q53-F55 VanDerWaalsContact C-N 3.34Å; Q53-L57 WeakPolarHBondContact O-CB 3.43Å; Q53-L57 PolarHBondContact O-N 2.85Å
54	S	78.8	Confident	74.3	Confident	74 Å²	74	104.7 Å²	104.7	52%	0.517	56%	0.563	S	S	.	*	H	α-helix	trans	-68.1	-36.9	178.9	-59.5	0	0	0	0	111.7	P51 W52 L57 G58	P51-S54 PolarHBondContact O-N 2.88Å; W52-S54 VanDerWaalsContact C-N 3.34Å; W52-S54 PolarHBondContact O-N 3.44Å; S54-L57 PolarHBondContact O-N 2.93Å; S54-G58 PolarHBondContact O-N 3.18Å
55	F	82.3	Confident	75.8	Confident	41 Å²	41	103.3 Å²	103.3	18%	0.18	55%	0.546	C	S	.	.	H	α-helix	trans	-63.9	-50.9	177.7	176.6	-111.9	0	0	0	112.1	L34 P51 W52 Q53 L57 G58 L59	L34-F55 HydrophobicContact CD1-CD2 4.17Å; L34-F55 HydrophobicContact CD1-CE2 3.3Å; L34-F55 HydrophobicContact CD1-CZ 3.63Å; L34-F55 HydrophobicContact CD2-CD1 4.39Å; L34-F55 HydrophobicContact CD2-CD2 3.16Å; L34-F55 HydrophobicContact CD2-CE1 4.39Å; L34-F55 HydrophobicContact CD2-CE2 3.21Å; L34-F55 HydrophobicContact CD2-CG 3.8Å; L34-F55 HydrophobicContact CD2-CZ 3.84Å; L34-F55 HydrophobicContact CG-CD2 3.62Å; L34-F55 HydrophobicContact CG-CE2 3.25Å; L34-F55 HydrophobicContact CG-CZ 4.03Å; P51-F55 PolarHBondContact O-N 2.88Å; W52-F55 PolarHBondContact O-N 3.43Å; Q53-F55 VanDerWaalsContact C-N 3.34Å; F55-L57 VanDerWaalsContact C-N 3.28Å; F55-L57 PolarHBondContact O-N 3.38Å; F55-G58 PolarHBondContact O-N 3.09Å; F55-L59 WeakPolarHBondContact O-CB 3.4Å; F55-L59 PolarHBondContact O-N 3.27Å
56	F	84.7	Confident	77.6	Confident	113 Å²	113	101.2 Å²	101.2	50%	0.496	52%	0.522	S	S	.	.	H	α-helix	trans	-61.2	-38.6	177.4	-75.6	-68	0	0	0	111.8	W52 L59 L60	W52-F56 HydrophobicContact CB-CD2 4.2Å; W52-F56 HydrophobicContact CB-CE2 4.08Å; W52-F56 HydrophobicContact CE3-CE2 4.17Å; W52-F56 WeakPolarHBondContact O-CD2 3.43Å; W52-F56 PolarHBondContact O-N 3.35Å; F56-L59 PolarHBondContact O-N 3.14Å; F56-L60 WeakPolarHBondContact O-CB 3.45Å; F56-L60 WeakPolarHBondContact O-CG 3.34Å; F56-L60 PolarHBondContact O-N 3.39Å
57	L	87.1	Confident	79.4	Confident	122 Å²	122	99.7 Å²	99.7	64%	0.639	51%	0.508	S	S	*	.	H	α-helix	trans	-65.6	-41.8	177.6	-169.9	63.4	0	0	0	112.1	Q53 S54 F55 L60 C61	Q53-L57 WeakPolarHBondContact O-CB 3.43Å; Q53-L57 PolarHBondContact O-N 2.85Å; S54-L57 PolarHBondContact O-N 2.93Å; F55-L57 VanDerWaalsContact C-N 3.28Å; F55-L57 PolarHBondContact O-N 3.38Å; L57-L60 PolarHBondContact O-N 3.01Å; L57-C61 VanDerWaalsContact O-CB 3.22Å; L57-C61 WeakPolarHBondContact O-CB 3.01Å; L57-C61 PolarHBondContact O-N 3.03Å
58	G	86.4	Confident	81	Confident	23 Å²	23	100.4 Å²	100.4	24%	0.237	50%	0.498	C	S	.	.	H	α-helix	trans	-63.9	-41.1	175.1	0	0	0	0	0	112.5	S54 F55 C61 S62	S54-G58 PolarHBondContact O-N 3.18Å; F55-G58 PolarHBondContact O-N 3.09Å; G58-C61 PolarHBondContact O-N 3.29Å; G58-S62 WeakPolarHBondContact O-CB 3.24Å; G58-S62 PolarHBondContact O-N 2.93Å; G58-S62 PolarHBondContact O-OG 2.94Å
59	L	85.3	Confident	82.6	Confident	81 Å²	81	91.7 Å²	91.7	42%	0.424	47%	0.468	S	S	.	.	H	α-helix	trans	-64.2	-48.2	176.2	-174.7	65.2	0	0	0	111.6	L30 F55 F56 C61 S62 L63	L30-L59 HydrophobicContact CD1-CD1 4.02Å; F55-L59 WeakPolarHBondContact O-CB 3.4Å; F55-L59 PolarHBondContact O-N 3.27Å; F56-L59 PolarHBondContact O-N 3.14Å; L59-C61 PolarHBondContact O-N 3.45Å; L59-S62 PolarHBondContact O-N 2.76Å; L59-L63 PolarHBondContact O-N 3.11Å
60	L	90.6	Very high	84	Confident	107 Å²	107	87 Å²	87	56%	0.56	45%	0.451	S	S	*	.	H	α-helix	trans	-61.1	-44.2	177	-74.7	170	0	0	0	111.6	F56 L57 S62 L63 L64	F56-L60 WeakPolarHBondContact O-CB 3.45Å; F56-L60 WeakPolarHBondContact O-CG 3.34Å; F56-L60 PolarHBondContact O-N 3.39Å; L57-L60 PolarHBondContact O-N 3.01Å; L60-S62 VanDerWaalsContact C-N 3.35Å; L60-S62 PolarHBondContact O-N 2.83Å; L60-L63 PolarHBondContact O-N 3.44Å; L60-L64 PolarHBondContact O-N 2.89Å
61	C	88.8	Confident	85.5	Confident	68 Å²	68	90.5 Å²	90.5	46%	0.459	46%	0.461	S	S	.	.	H	α-helix	trans	-60.1	-45.3	176.4	-175.3	0	0	0	0	111.4	L57 G58 L59 L63 L64 L65	L57-C61 VanDerWaalsContact O-CB 3.22Å; L57-C61 WeakPolarHBondContact O-CB 3.01Å; L57-C61 PolarHBondContact O-N 3.03Å; G58-C61 PolarHBondContact O-N 3.29Å; L59-C61 PolarHBondContact O-N 3.45Å; C61-L63 PolarHBondContact O-N 3.22Å; C61-L64 WeakPolarHBondContact O-CB 3.35Å; C61-L64 PolarHBondContact O-N 3.39Å; C61-L64 VanDerWaalsContact O-N 3.17Å; C61-L65 WeakPolarHBondContact O-CG 3.32Å; C61-L65 PolarHBondContact O-N 3.24Å
62	S	87.4	Confident	86.3	Confident	18 Å²	18	91.4 Å²	91.4	13%	0.126	46%	0.462	C	S	.	.	H	α-helix	trans	-65.4	-38.6	179.1	-60.6	0	0	0	0	112.4	L30 G58 L59 L60 L64 L65 L66	L30-S62 VanDerWaalsContact CD1-OG 3.26Å; L30-S62 WeakPolarHBondContact CD1-OG 2.89Å; G58-S62 WeakPolarHBondContact O-CB 3.24Å; G58-S62 PolarHBondContact O-N 2.93Å; G58-S62 PolarHBondContact O-OG 2.94Å; L59-S62 PolarHBondContact O-N 2.76Å; L60-S62 VanDerWaalsContact C-N 3.35Å; L60-S62 PolarHBondContact O-N 2.83Å; S62-L64 VanDerWaalsContact C-N 3.33Å; S62-L65 PolarHBondContact O-N 3.37Å; S62-L66 WeakPolarHBondContact O-CB 3.41Å; S62-L66 PolarHBondContact O-N 3.29Å
63	L	88.6	Confident	86.7	Confident	99 Å²	99	88.5 Å²	88.5	52%	0.518	46%	0.455	S	S	.	.	H	α-helix	trans	-62.7	-41.7	172.8	-175.4	68.2	0	0	0	111.4	L59 L60 C61 L66 V67	L59-L63 PolarHBondContact O-N 3.11Å; L60-L63 PolarHBondContact O-N 3.44Å; C61-L63 PolarHBondContact O-N 3.22Å; L63-L66 HydrophobicContact CD1-CD2 4.44Å; L63-L66 WeakPolarHBondContact O-CB 3.43Å; L63-L66 PolarHBondContact O-N 3.44Å; L63-V67 WeakPolarHBondContact O-CG2 3.36Å; L63-V67 PolarHBondContact O-N 2.87Å
64	L	91	Very high	87.1	Confident	132 Å²	132	87.3 Å²	87.3	69%	0.691	45%	0.448	S	S	*	.	H	α-helix	trans	-63	-43.6	176.4	-128.9	69.1	0	0	0	111.5	L60 C61 S62 L66 V67 F68	L60-L64 PolarHBondContact O-N 2.89Å; C61-L64 WeakPolarHBondContact O-CB 3.35Å; C61-L64 PolarHBondContact O-N 3.39Å; C61-L64 VanDerWaalsContact O-N 3.17Å; S62-L64 VanDerWaalsContact C-N 3.33Å; L64-L66 VanDerWaalsContact C-N 3.33Å; L64-L66 PolarHBondContact O-N 3.26Å; L64-V67 PolarHBondContact O-N 3.46Å; L64-F68 VanDerWaalsContact O-CB 3.29Å; L64-F68 WeakPolarHBondContact O-CB 3.43Å; L64-F68 PolarHBondContact O-N 3.41Å
65	L	86.8	Confident	87.6	Confident	82 Å²	82	86 Å²	86	43%	0.429	44%	0.439	S	S	.	.	H	α-helix	trans	-61.8	-41.5	174.3	-73	173.9	0	0	0	111.3	C61 S62 F68 N69	C61-L65 WeakPolarHBondContact O-CG 3.32Å; C61-L65 PolarHBondContact O-N 3.24Å; S62-L65 PolarHBondContact O-N 3.37Å; L65-F68 PolarHBondContact O-N 3.48Å; L65-N69 WeakPolarHBondContact O-CB 3.46Å; L65-N69 PolarHBondContact O-N 3.46Å; L65-N69 PolarHBondContact O-ND2 3.2Å
66	L	88.5	Confident	87.7	Confident	46 Å²	46	88 Å²	88	24%	0.241	45%	0.451	C	S	.	.	H	α-helix	trans	-58.7	-51.8	176.4	174.7	63.3	0	0	0	111.1	I23 S62 L63 L64 F68 N69 I70	I23-L66 HydrophobicContact CB-CD1 4.14Å; I23-L66 HydrophobicContact CD1-CD1 3.56Å; I23-L66 HydrophobicContact CG1-CD1 3.41Å; I23-L66 VanDerWaalsContact CG1-CD1 3.41Å; I23-L66 HydrophobicContact CG2-CD1 3.75Å; S62-L66 WeakPolarHBondContact O-CB 3.41Å; S62-L66 PolarHBondContact O-N 3.29Å; L63-L66 HydrophobicContact CD1-CD2 4.44Å; L63-L66 WeakPolarHBondContact O-CB 3.43Å; L63-L66 PolarHBondContact O-N 3.44Å; L64-L66 VanDerWaalsContact C-N 3.33Å; L64-L66 PolarHBondContact O-N 3.26Å; L66-F68 VanDerWaalsContact C-N 3.33Å; L66-F68 PolarHBondContact O-N 3.29Å; L66-N69 PolarHBondContact O-N 3.31Å; L66-I70 HydrophobicContact CD1-CD1 4.04Å; L66-I70 HydrophobicContact CD1-CG1 4.43Å; L66-I70 HydrophobicContact CG-CD1 4.03Å; L66-I70 WeakPolarHBondContact O-CG1 3.35Å; L66-I70 PolarHBondContact O-N 2.8Å
67	V	91.4	Very high	87.6	Confident	85 Å²	85	89 Å²	89	52%	0.515	45%	0.451	S	S	.	.	H	α-helix	trans	-61.3	-43.8	178.7	174.2	0	0	0	0	110.8	L63 L64 N69 I70 W71	L63-V67 WeakPolarHBondContact O-CG2 3.36Å; L63-V67 PolarHBondContact O-N 2.87Å; L64-V67 PolarHBondContact O-N 3.46Å; V67-N69 VanDerWaalsContact C-N 3.34Å; V67-N69 PolarHBondContact O-N 3.12Å; V67-I70 PolarHBondContact O-N 3.45Å; V67-W71 WeakPolarHBondContact O-CB 3.29Å; V67-W71 PolarHBondContact O-N 3.45Å
68	F	89.5	Confident	87.4	Confident	121 Å²	121	90.5 Å²	90.5	53%	0.531	45%	0.45	S	S	.	.	H	α-helix	trans	-61.6	-40.4	176.8	-179.4	-103.9	0	0	0	112.3	L64 L65 L66 W71 L72	L64-F68 VanDerWaalsContact O-CB 3.29Å; L64-F68 WeakPolarHBondContact O-CB 3.43Å; L64-F68 PolarHBondContact O-N 3.41Å; L65-F68 PolarHBondContact O-N 3.48Å; L66-F68 VanDerWaalsContact C-N 3.33Å; L66-F68 PolarHBondContact O-N 3.29Å; F68-W71 WeakPolarHBondContact O-CB 3.47Å; F68-W71 PolarHBondContact O-N 3.1Å; F68-L72 HydrophobicContact CE1-CD2 4.45Å; F68-L72 VanDerWaalsContact O-CB 3.25Å; F68-L72 WeakPolarHBondContact O-CB 3.31Å; F68-L72 PolarHBondContact O-N 3.28Å
69	N	87.3	Confident	87.2	Confident	34 Å²	34	94.8 Å²	94.8	18%	0.182	46%	0.463	C	S	.	.	H	α-helix	trans	-68.3	-39	176.9	-84.5	-79	0	0	0	112.2	I19 L65 L66 V67 W71 L72 M73	I19-N69 HydrophobicContact CD1-CB 4.2Å; L65-N69 WeakPolarHBondContact O-CB 3.46Å; L65-N69 PolarHBondContact O-N 3.46Å; L65-N69 PolarHBondContact O-ND2 3.2Å; L66-N69 PolarHBondContact O-N 3.31Å; V67-N69 VanDerWaalsContact C-N 3.34Å; V67-N69 PolarHBondContact O-N 3.12Å; N69-W71 VanDerWaalsContact C-N 3.34Å; N69-L72 PolarHBondContact O-N 2.81Å; N69-M73 VanDerWaalsContact O-CB 3.31Å; N69-M73 WeakPolarHBondContact O-CB 3.18Å; N69-M73 PolarHBondContact O-N 3.38Å
70	I	87.4	Confident	87	Confident	94 Å²	94	94.1 Å²	94.1	48%	0.482	46%	0.458	S	S	.	.	H	α-helix	trans	-62.2	-46.2	173.8	-67.8	165.5	0	0	0	109.9	L66 V67 M73 F74	L66-I70 HydrophobicContact CD1-CD1 4.04Å; L66-I70 HydrophobicContact CD1-CG1 4.43Å; L66-I70 HydrophobicContact CG-CD1 4.03Å; L66-I70 WeakPolarHBondContact O-CG1 3.35Å; L66-I70 PolarHBondContact O-N 2.8Å; V67-I70 PolarHBondContact O-N 3.45Å; I70-M73 WeakPolarHBondContact O-CB 3.49Å; I70-M73 PolarHBondContact O-N 2.79Å; I70-F74 PolarHBondContact O-N 3.02Å
71	W	90	Very high	86.4	Confident	182 Å²	182	93.8 Å²	93.8	69%	0.689	45%	0.453	S	S	*	.	H	α-helix	trans	-58.3	-50.6	174.8	-178.4	-73.4	0	0	0	111.2	V67 F68 N69 M73 F74 S75	V67-W71 WeakPolarHBondContact O-CB 3.29Å; V67-W71 PolarHBondContact O-N 3.45Å; F68-W71 WeakPolarHBondContact O-CB 3.47Å; F68-W71 PolarHBondContact O-N 3.1Å; N69-W71 VanDerWaalsContact C-N 3.34Å; W71-M73 VanDerWaalsContact C-N 3.26Å; W71-M73 PolarHBondContact O-N 2.85Å; W71-F74 WeakPolarHBondContact O-CB 3.25Å; W71-F74 PolarHBondContact O-N 3.38Å; W71-F74 VanDerWaalsContact O-N 3.1Å; W71-S75 PolarHBondContact NE1-OG 3.43Å; W71-S75 PolarHBondContact O-N 2.98Å; W71-S75 PolarHBondContact O-OG 3.32Å
72	L	85.7	Confident	85.9	Confident	86 Å²	86	92.7 Å²	92.7	45%	0.45	45%	0.446	S	S	.	.	H	α-helix	trans	-59.9	-38.5	179.1	-173.5	66.6	0	0	0	111.1	F68 N69 S75 L76	F68-L72 HydrophobicContact CE1-CD2 4.45Å; F68-L72 VanDerWaalsContact O-CB 3.25Å; F68-L72 WeakPolarHBondContact O-CB 3.31Å; F68-L72 PolarHBondContact O-N 3.28Å; N69-L72 PolarHBondContact O-N 2.81Å; L72-S75 PolarHBondContact O-N 2.76Å; L72-L76 WeakPolarHBondContact O-CB 3.18Å; L72-L76 PolarHBondContact O-N 3.48Å
73	M	84.9	Confident	85.5	Confident	81 Å²	81	97.9 Å²	97.9	40%	0.399	46%	0.463	S	S	.	.	H	α-helix	trans	-62.8	-46.2	175	-175.4	-81	165.8	0	0	111.1	N69 I70 W71 L76 R77	N69-M73 VanDerWaalsContact O-CB 3.31Å; N69-M73 WeakPolarHBondContact O-CB 3.18Å; N69-M73 PolarHBondContact O-N 3.38Å; I70-M73 WeakPolarHBondContact O-CB 3.49Å; I70-M73 PolarHBondContact O-N 2.79Å; W71-M73 VanDerWaalsContact C-N 3.26Å; W71-M73 PolarHBondContact O-N 2.85Å; M73-L76 PolarHBondContact O-N 3.22Å; M73-R77 HydrophobicContact CE-CB 4.26Å; M73-R77 WeakPolarHBondContact O-CB 3.36Å; M73-R77 PolarHBondContact O-N 3.39Å; M73-R77 HydrophobicContact SD-CB 4.48Å
74	F	85.7	Confident	84.9	Confident	145 Å²	145	98.2 Å²	98.2	64%	0.636	46%	0.46	S	S	*	.	H	α-helix	trans	-62.1	-48.2	177.4	-175.3	-97.7	0	0	0	111.3	I70 W71 R77 Y78	I70-F74 PolarHBondContact O-N 3.02Å; W71-F74 WeakPolarHBondContact O-CB 3.25Å; W71-F74 PolarHBondContact O-N 3.38Å; W71-F74 VanDerWaalsContact O-N 3.1Å; F74-R77 PolarHBondContact O-N 3.42Å; F74-Y78 WeakPolarHBondContact O-CB 3.48Å; F74-Y78 PolarHBondContact O-N 2.81Å
75	S	89.4	Confident	84.2	Confident	47 Å²	47	95.4 Å²	95.4	33%	0.329	45%	0.446	S	S	.	.	H	α-helix	trans	-62.6	-43.7	177.2	-60.9	0	0	0	0	112.1	W71 L72 Y78 H79	W71-S75 PolarHBondContact NE1-OG 3.43Å; W71-S75 PolarHBondContact O-N 2.98Å; W71-S75 PolarHBondContact O-OG 3.32Å; L72-S75 PolarHBondContact O-N 2.76Å; S75-Y78 PolarHBondContact O-N 3.35Å; S75-H79 VanDerWaalsContact O-CB 3.24Å; S75-H79 WeakPolarHBondContact O-CB 3.17Å; S75-H79 PolarHBondContact O-N 2.77Å
76	L	84.4	Confident	83.5	Confident	83 Å²	83	96.5 Å²	96.5	44%	0.435	44%	0.444	S	S	.	.	H	α-helix	trans	-67.3	-39.1	177.9	-177.7	63.5	0	0	0	111.3	W15 L72 M73 H79 H80	W15-L76 HydrophobicContact CH2-CD2 4.36Å; W15-L76 HydrophobicContact CZ3-CD2 4.1Å; L72-L76 WeakPolarHBondContact O-CB 3.18Å; L72-L76 PolarHBondContact O-N 3.48Å; M73-L76 PolarHBondContact O-N 3.22Å; L76-H79 PolarHBondContact O-N 2.96Å; L76-H80 WeakPolarHBondContact O-CB 3.08Å; L76-H80 PolarHBondContact O-N 3.41Å
77	R	82.9	Confident	82.6	Confident	133 Å²	133	101.1 Å²	101.1	50%	0.502	46%	0.458	S	S	.	.	H	α-helix	trans	-61.9	-48.8	175.2	177.5	-174.8	172.6	100.8	-4.1	110.5	M73 F74 H80 Q81	M73-R77 HydrophobicContact CE-CB 4.26Å; M73-R77 WeakPolarHBondContact O-CB 3.36Å; M73-R77 PolarHBondContact O-N 3.39Å; M73-R77 HydrophobicContact SD-CB 4.48Å; F74-R77 PolarHBondContact O-N 3.42Å; R77-H80 PolarHBondContact O-N 2.92Å; R77-Q81 WeakPolarHBondContact O-CG 3.33Å; R77-Q81 PolarHBondContact O-N 3.34Å
78	Y	82.3	Confident	81.6	Confident	154 Å²	154	105 Å²	105	60%	0.604	47%	0.468	S	S	*	.	H	α-helix	trans	-59.4	-50.6	176.5	179	-101.7	0	0	0	110.1	F74 S75 H80 Q81 S82	F74-Y78 WeakPolarHBondContact O-CB 3.48Å; F74-Y78 PolarHBondContact O-N 2.81Å; S75-Y78 PolarHBondContact O-N 3.35Å; Y78-H80 VanDerWaalsContact C-N 3.32Å; Y78-H80 PolarHBondContact O-N 2.99Å; Y78-Q81 PolarHBondContact O-N 3.22Å; Y78-Q81 VanDerWaalsContact O-N 3.1Å; Y78-S82 PolarHBondContact O-N 3.41Å; Y78-S82 PolarHBondContact O-OG 3.41Å; Y78-S82 VanDerWaalsContact O-OG 3.08Å
79	H	84	Confident	80.6	Confident	112 Å²	112	106 Å²	106	52%	0.519	47%	0.474	S	S	.	.	H	α-helix	trans	-60.8	-40.9	179.9	-168.9	78	0	0	0	112.1	S75 L76 Q81 S82 W83	S75-H79 VanDerWaalsContact O-CB 3.24Å; S75-H79 WeakPolarHBondContact O-CB 3.17Å; S75-H79 PolarHBondContact O-N 2.77Å; L76-H79 PolarHBondContact O-N 2.96Å; H79-Q81 PolarHBondContact O-N 3.42Å; H79-S82 PolarHBondContact O-N 2.85Å; H79-W83 WeakPolarHBondContact O-CA 3.24Å; H79-W83 WeakPolarHBondContact O-CB 3.05Å; H79-W83 PolarHBondContact O-N 2.88Å
80	H	79.5	Confident	79.3	Confident	68 Å²	68	109.4 Å²	109.4	32%	0.315	49%	0.489	S	S	.	.	H	α-helix	trans	-70.2	-31.9	178.1	-176.4	-105.9	0	0	0	112.4	L76 R77 Y78 K84	L76-H80 WeakPolarHBondContact O-CB 3.08Å; L76-H80 PolarHBondContact O-N 3.41Å; R77-H80 PolarHBondContact O-N 2.92Å; Y78-H80 VanDerWaalsContact C-N 3.32Å; Y78-H80 PolarHBondContact O-N 2.99Å; H80-K84 WeakPolarHBondContact CE1-CE 3.44Å; H80-K84 PolarHBondContact CE1-NZ 2.89Å; H80-K84 WeakPolarHBondContact O-CB 3.43Å; H80-K84 VanDerWaalsContact O-CG 3.3Å; H80-K84 WeakPolarHBondContact O-CG 3.48Å; H80-K84 PolarHBondContact O-N 3.32Å
81	Q	79.8	Confident	77.8	Confident	100 Å²	100	107.7 Å²	107.7	47%	0.467	49%	0.486	S	S	.	.	H	α-helix	trans	-67.7	-49.5	170.9	-73.5	-176.7	15.1	0	0	111.1	R77 Y78 H79 W83 K84 L85	R77-Q81 WeakPolarHBondContact O-CG 3.33Å; R77-Q81 PolarHBondContact O-N 3.34Å; Y78-Q81 PolarHBondContact O-N 3.22Å; Y78-Q81 VanDerWaalsContact O-N 3.1Å; H79-Q81 PolarHBondContact O-N 3.42Å; Q81-W83 VanDerWaalsContact C-N 3.31Å; Q81-W83 PolarHBondContact O-N 3.49Å; Q81-K84 PolarHBondContact O-N 3.08Å; Q81-L85 WeakPolarHBondContact O-CB 3.3Å; Q81-L85 PolarHBondContact O-N 2.72Å
82	S	78.1	Confident	76.1	Confident	44 Å²	44	109.6 Å²	109.6	31%	0.308	50%	0.495	S	S	.	.	H	α-helix	trans	-60.6	-40.7	176.6	-56.8	0	0	0	0	111.7	Y78 H79 L85 W86	Y78-S82 PolarHBondContact O-N 3.41Å; Y78-S82 PolarHBondContact O-OG 3.41Å; Y78-S82 VanDerWaalsContact O-OG 3.08Å; H79-S82 PolarHBondContact O-N 2.85Å; S82-L85 PolarHBondContact O-N 3.13Å; S82-W86 VanDerWaalsContact O-CB 3.31Å; S82-W86 WeakPolarHBondContact O-CB 3.46Å; S82-W86 PolarHBondContact O-N 3.38Å
83	W	78.3	Confident	74.5	Confident	127 Å²	127	112.8 Å²	112.8	48%	0.481	51%	0.511	S	S	.	.	H	α-helix	trans	-64.9	-42.6	175.9	-177.6	-98.6	0	0	0	112.1	H79 Q81 L85 W86 R87	H79-W83 WeakPolarHBondContact O-CA 3.24Å; H79-W83 WeakPolarHBondContact O-CB 3.05Å; H79-W83 PolarHBondContact O-N 2.88Å; Q81-W83 VanDerWaalsContact C-N 3.31Å; Q81-W83 PolarHBondContact O-N 3.49Å; W83-L85 VanDerWaalsContact C-N 3.33Å; W83-W86 HydrophobicContact CD2-CE3 4.5Å; W83-W86 HydrophobicContact CE3-CE3 4.19Å; W83-W86 HydrophobicContact CH2-CE3 4.22Å; W83-W86 AromaticContact CH2-CZ3 3.79Å; W83-W86 HydrophobicContact CH2-CZ3 3.79Å; W83-W86 HydrophobicContact CZ2-CZ3 4.18Å; W83-W86 HydrophobicContact CZ3-CE3 4.05Å; W83-W86 HydrophobicContact CZ3-CZ3 4Å; W83-W86 PolarHBondContact O-N 3.1Å; W83-R87 VanDerWaalsContact O-CB 3.29Å; W83-R87 WeakPolarHBondContact O-CB 3.48Å; W83-R87 VanDerWaalsContact O-CG 3.26Å; W83-R87 WeakPolarHBondContact O-CG 3.46Å; W83-R87 PolarHBondContact O-N 2.81Å
84	K	75.1	Confident	72.9	Confident	106 Å²	106	114.5 Å²	114.5	46%	0.461	53%	0.525	S	S	.	.	H	α-helix	trans	-64.8	-39.5	175	-83.7	-179.2	166	-176.1	0	112.1	H80 Q81 K88	H80-K84 WeakPolarHBondContact CE1-CE 3.44Å; H80-K84 PolarHBondContact CE1-NZ 2.89Å; H80-K84 WeakPolarHBondContact O-CB 3.43Å; H80-K84 VanDerWaalsContact O-CG 3.3Å; H80-K84 WeakPolarHBondContact O-CG 3.48Å; H80-K84 PolarHBondContact O-N 3.32Å; Q81-K84 PolarHBondContact O-N 3.08Å; K84-K88 PolarHBondContact O-N 3.26Å
85	L	76.8	Confident	71.3	Confident	73 Å²	73	114.5 Å²	114.5	38%	0.382	53%	0.531	S	S	.	.	H	α-helix	trans	-63.8	-51.4	176.3	-177.7	53.5	0	0	0	110.4	Q81 S82 W83 R87 K88 E89 Y168	Q81-L85 WeakPolarHBondContact O-CB 3.3Å; Q81-L85 PolarHBondContact O-N 2.72Å; S82-L85 PolarHBondContact O-N 3.13Å; W83-L85 VanDerWaalsContact C-N 3.33Å; L85-R87 VanDerWaalsContact C-N 3.31Å; L85-R87 PolarHBondContact O-N 3.2Å; L85-K88 WeakPolarHBondContact O-CA 3.31Å; L85-K88 WeakPolarHBondContact O-CB 3.39Å; L85-K88 PolarHBondContact O-N 3.25Å; L85-E89 PolarHBondContact O-N 2.97Å; L85-Y168 WeakPolarHBondContact CD1-OH 3.45Å
86	W	71.6	Confident	69.4	Low	106 Å²	106	117.1 Å²	117.1	40%	0.402	55%	0.55	S	S	.	.	H	α-helix	trans	-56.7	-43.9	175.8	-178.4	75.3	0	0	0	112.2	S82 W83 K88 E89 Q90	S82-W86 VanDerWaalsContact O-CB 3.31Å; S82-W86 WeakPolarHBondContact O-CB 3.46Å; S82-W86 PolarHBondContact O-N 3.38Å; W83-W86 HydrophobicContact CD2-CE3 4.5Å; W83-W86 HydrophobicContact CE3-CE3 4.19Å; W83-W86 HydrophobicContact CH2-CE3 4.22Å; W83-W86 AromaticContact CH2-CZ3 3.79Å; W83-W86 HydrophobicContact CH2-CZ3 3.79Å; W83-W86 HydrophobicContact CZ2-CZ3 4.18Å; W83-W86 HydrophobicContact CZ3-CE3 4.05Å; W83-W86 HydrophobicContact CZ3-CZ3 4Å; W83-W86 PolarHBondContact O-N 3.1Å; W86-K88 VanDerWaalsContact C-N 3.29Å; W86-K88 PolarHBondContact O-N 3.49Å; W86-E89 PolarHBondContact O-N 3.33Å; W86-Q90 HydrophobicContact CZ2-CB 4.3Å; W86-Q90 HydrophobicContact CZ2-CG 4.16Å; W86-Q90 PolarHBondContact O-N 2.95Å
87	R	71.4	Confident	67.7	Low	143 Å²	143	120 Å²	120	54%	0.54	56%	0.561	S	S	.	*	H	α-helix	trans	-61.1	-36	174.4	-80.2	-74.2	-63.2	-170.9	0.8	112.7	W83 L85 E89 S91	W83-R87 VanDerWaalsContact O-CB 3.29Å; W83-R87 WeakPolarHBondContact O-CB 3.48Å; W83-R87 VanDerWaalsContact O-CG 3.26Å; W83-R87 WeakPolarHBondContact O-CG 3.46Å; W83-R87 PolarHBondContact O-N 2.81Å; L85-R87 VanDerWaalsContact C-N 3.31Å; L85-R87 PolarHBondContact O-N 3.2Å; R87-E89 VanDerWaalsContact C-N 3.35Å; R87-S91 VanDerWaalsContact O-CB 3.28Å; R87-S91 WeakPolarHBondContact O-CB 3.49Å; R87-S91 PolarHBondContact O-N 2.95Å; R87-S91 PolarHBondContact O-OG 3.42Å
88	K	69.9	Low	66	Low	166 Å²	166	119.4 Å²	119.4	72%	0.722	57%	0.572	S	S	*	*	H	α-helix	trans	-69.9	-36.2	178.2	-169.6	-179.7	175.8	-172.4	0	111.1	K84 L85 W86	K84-K88 PolarHBondContact O-N 3.26Å; L85-K88 WeakPolarHBondContact O-CA 3.31Å; L85-K88 WeakPolarHBondContact O-CB 3.39Å; L85-K88 PolarHBondContact O-N 3.25Å; W86-K88 VanDerWaalsContact C-N 3.29Å; W86-K88 PolarHBondContact O-N 3.49Å
89	E	67.4	Low	64.4	Low	141 Å²	141	116.1 Å²	116.1	66%	0.659	57%	0.568	S	S	*	*	H	α-helix	trans	-78.1	-42.9	-179	-163.5	163.5	-171.8	0	0	112.5	L85 W86 R87 S91	L85-E89 PolarHBondContact O-N 2.97Å; W86-E89 PolarHBondContact O-N 3.33Å; R87-E89 VanDerWaalsContact C-N 3.35Å; E89-S91 PolarHBondContact O-N 3.11Å
90	Q	60.7	Low	62.4	Low	106 Å²	106	120.2 Å²	120.2	50%	0.495	58%	0.584	S	S	.	*	H	α-helix	trans	-84.4	-3.2	-179.9	-126.7	83.6	-10.9	0	0	114.7	W86 Y92	W86-Q90 HydrophobicContact CZ2-CB 4.3Å; W86-Q90 HydrophobicContact CZ2-CG 4.16Å; W86-Q90 PolarHBondContact O-N 2.95Å; Q90-Y92 PolarHBondContact O-N 2.95Å
91	S	56.2	Low	60.5	Low	59 Å²	59	127.8 Å²	127.8	41%	0.413	61%	0.61	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.7	4.8	174	-67.7	0	0	0	0	113.4	R87 E89 I93 V94	R87-S91 VanDerWaalsContact O-CB 3.28Å; R87-S91 WeakPolarHBondContact O-CB 3.49Å; R87-S91 PolarHBondContact O-N 2.95Å; R87-S91 PolarHBondContact O-OG 3.42Å; E89-S91 PolarHBondContact O-N 3.11Å; S91-I93 PolarHBondContact O-N 3.02Å; S91-V94 PolarHBondContact O-N 3.35Å
92	Y	54.4	Low	58.6	Low	222 Å²	222	133 Å²	133	87%	0.871	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	5.1	173.4	-133.6	-89.5	0	0	0	114.2	Q90 V94	Q90-Y92 PolarHBondContact O-N 2.95Å; Y92-V94 PolarHBondContact O-N 2.84Å
93	I	52.6	Low	56.4	Low	153 Å²	153	140.1 Å²	140.1	79%	0.785	66%	0.656	S	S	*	*			trans	-96.5	50.8	161.2	-41.1	174.5	0	0	0	108.7	S91 L95	S91-I93 PolarHBondContact O-N 3.02Å; I93-L95 PolarHBondContact O-N 2.97Å
94	V	50.7	Low	54.5	Low	116 Å²	116	139.9 Å²	139.9	70%	0.703	67%	0.669	S	S	*	*			trans	-74.5	109.8	151.4	171.2	0	0	0	0	104.3	S91 Y92 S96	S91-V94 PolarHBondContact O-N 3.35Å; Y92-V94 PolarHBondContact O-N 2.84Å; V94-S96 VanDerWaalsContact C-N 3.32Å; V94-S96 PolarHBondContact O-N 3.49Å
95	L	52.3	Low	52.9	Low	145 Å²	145	142.4 Å²	142.4	76%	0.759	69%	0.685	S	S	*	*			trans	-37.4	98.5	166.8	-160.2	85.6	0	0	0	108.1	I93 E97	I93-L95 PolarHBondContact O-N 2.97Å; L95-E97 PolarHBondContact O-N 3.34Å
96	S	48.9	Very low	50.9	Low	103 Å²	103	146.1 Å²	146.1	72%	0.72	71%	0.706	S	S	*	*			trans	-73.8	70.5	172.4	56.4	0	0	0	0	106.4	V94 T98	V94-S96 VanDerWaalsContact C-N 3.32Å; V94-S96 PolarHBondContact O-N 3.49Å; S96-T98 VanDerWaalsContact C-N 3.3Å; S96-T98 PolarHBondContact O-N 3.04Å
97	E	49.6	Very low	49.6	Very low	144 Å²	144	146.8 Å²	146.8	67%	0.673	72%	0.721	S	S	*	*			trans	-62.8	104.6	162.1	-165.6	-174.7	160.4	0	0	104.7	L95 V99	L95-E97 PolarHBondContact O-N 3.34Å; E97-V99 HydrophobicContact CB-CG2 4.34Å; E97-V99 HydrophobicContact CG-CG2 3.79Å; E97-V99 PolarHBondContact O-N 2.82Å
98	T	46.9	Very low	47.8	Very low	120 Å²	120	148.1 Å²	148.1	74%	0.736	73%	0.731	S	S	*	*			trans	-68.7	63.9	179.7	45.1	0	0	0	0	109.4	S96 K100	S96-T98 VanDerWaalsContact C-N 3.3Å; S96-T98 PolarHBondContact O-N 3.04Å; T98-K100 PolarHBondContact O-N 3.32Å
99	V	47.7	Very low	46.2	Very low	85 Å²	85	151.7 Å²	151.7	52%	0.515	74%	0.74	S	S	.	*			trans	-75.6	84.5	169.3	-173.7	0	0	0	0	106.5	E97 R101	E97-V99 HydrophobicContact CB-CG2 4.34Å; E97-V99 HydrophobicContact CG-CG2 3.79Å; E97-V99 PolarHBondContact O-N 2.82Å; V99-R101 HydrophobicContact CG1-CB 4.33Å; V99-R101 HydrophobicContact CG1-CG 4.36Å; V99-R101 PolarHBondContact O-N 3.11Å
100	K	42.9	Very low	44.5	Very low	198 Å²	198	151.7 Å²	151.7	86%	0.861	74%	0.744	S	S	*	*			trans	-57.5	73.7	166.3	-70.1	179.7	178.5	179.2	0	109.4	T98 K102	T98-K100 PolarHBondContact O-N 3.32Å; K100-K102 VanDerWaalsContact C-N 3.28Å; K100-K102 PolarHBondContact O-N 3.23Å; K100-K102 VanDerWaalsContact O-N 3.14Å
101	R	39.1	Very low	43.4	Very low	226 Å²	226	151.8 Å²	151.8	85%	0.853	76%	0.757	S	S	*	*			trans	-87.9	67.9	174.5	-125.3	-159.8	-76.6	-178.4	-4.4	109.3	V99	V99-R101 HydrophobicContact CG1-CB 4.33Å; V99-R101 HydrophobicContact CG1-CG 4.36Å; V99-R101 PolarHBondContact O-N 3.11Å
102	K	40	Very low	42.6	Very low	211 Å²	211	157.9 Å²	157.9	92%	0.917	78%	0.779	S	S	*	*			trans	-97.3	78.6	164.9	-164.1	177	-175	-179.1	0	107.8	K100	K100-K102 VanDerWaalsContact C-N 3.28Å; K100-K102 PolarHBondContact O-N 3.23Å; K100-K102 VanDerWaalsContact O-N 3.14Å
103	K	32.8	Very low	41.7	Very low	193 Å²	193	152.8 Å²	152.8	84%	0.839	77%	0.767	S	S	*	*			trans	-140.1	123.5	170.2	-159.7	175.9	-169.9	179.9	0	109.2
104	V	36.8	Very low	41.4	Very low	122 Å²	122	150.5 Å²	150.5	74%	0.739	76%	0.762	S	S	*	*			trans	126.5	79.5	162.3	-175.6	0	0	0	0	110
105	I	42.1	Very low	41	Very low	158 Å²	158	150.6 Å²	150.6	81%	0.81	76%	0.758	S	S	*	*			trans	-114.8	111.1	139	-52.5	-179.6	0	0	0	104.8	V107	I105-V107 VanDerWaalsContact C-N 3.34Å; I105-V107 HydrophobicContact CG2-CG2 3.88Å; I105-V107 PolarHBondContact O-N 3.23Å; I105-V107 VanDerWaalsContact O-N 3.11Å
106	N	35.8	Very low	40.8	Very low	152 Å²	152	150 Å²	150	81%	0.813	76%	0.756	S	S	*	*			trans	-79.6	81.5	-175.2	-156.7	-25.2	0	0	0	107.2
107	V	42.6	Very low	40.9	Very low	120 Å²	120	151.4 Å²	151.4	73%	0.727	75%	0.754	S	S	*	*			trans	-101.3	101.1	172.5	-175.5	0	0	0	0	108	I105 R109	I105-V107 VanDerWaalsContact C-N 3.34Å; I105-V107 HydrophobicContact CG2-CG2 3.88Å; I105-V107 PolarHBondContact O-N 3.23Å; I105-V107 VanDerWaalsContact O-N 3.11Å; V107-R109 PolarHBondContact O-N 3.25Å
108	K	34.9	Very low	40.9	Very low	171 Å²	171	150.7 Å²	150.7	74%	0.743	75%	0.753	S	S	*	*			trans	-25.7	119.7	161.4	-170.9	178.1	179.2	-165.9	0	111.1	D110	K108-D110 PolarHBondContact O-N 2.91Å
109	R	35.5	Very low	41.1	Very low	241 Å²	241	151 Å²	151	91%	0.909	75%	0.746	S	S	*	*			trans	-59.1	102.6	174.1	-62.4	-177.6	-157.2	96.1	0.3	108.5	V107	V107-R109 PolarHBondContact O-N 3.25Å
110	D	33	Very low	41.1	Very low	140 Å²	140	150.3 Å²	150.3	75%	0.749	75%	0.745	S	S	*	*			trans	-109.7	113	151.4	-89.3	-44.1	0	0	0	108	K108 Q112	K108-D110 PolarHBondContact O-N 2.91Å; D110-Q112 PolarHBondContact O-N 3.19Å
111	S	36.8	Very low	41.5	Very low	109 Å²	109	146.1 Å²	146.1	76%	0.762	73%	0.732	S	S	*	*			trans	-69.2	99	178	167.6	0	0	0	0	109.1
112	Q	39	Very low	41.9	Very low	187 Å²	187	142.5 Å²	142.5	87%	0.874	72%	0.722	S	S	*	*			trans	178.3	132.5	140.6	-103.6	159	-20.5	0	0	111.7	D110	D110-Q112 PolarHBondContact O-N 3.19Å
113	N	36.2	Very low	42.2	Very low	114 Å²	114	137.6 Å²	137.6	61%	0.61	70%	0.703	S	S	*	*			trans	94.2	89.8	162.8	-148.8	-22.7	0	0	0	118.1	N115	N113-N115 PolarHBondContact O-N 3.42Å; N113-N115 WeakPolarHBondContact OD1-CB 3.26Å; N113-N115 PolarHBondContact OD1-N 3.01Å; N113-N115 PolarHBondContact OD1-ND2 2.84Å
114	P	45.6	Very low	43.1	Very low	106 Å²	106	135.5 Å²	135.5	69%	0.688	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	4.7	175.5	27.6	-32.5	0	0	0	115.8	L116	P114-L116 VanDerWaalsContact C-N 3.28Å; P114-L116 PolarHBondContact O-N 3.34Å
115	N	43.4	Very low	43.7	Very low	117 Å²	117	136.5 Å²	136.5	63%	0.626	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-7.5	178.7	-78.8	-63.4	0	0	0	115.2	N113	N113-N115 PolarHBondContact O-N 3.42Å; N113-N115 WeakPolarHBondContact OD1-CB 3.26Å; N113-N115 PolarHBondContact OD1-N 3.01Å; N113-N115 PolarHBondContact OD1-ND2 2.84Å
116	L	47.4	Very low	43.9	Very low	134 Å²	134	133.8 Å²	133.8	70%	0.702	68%	0.679	S	S	*	*	H	α-helix	trans	-84.9	-15.5	-179.2	-129.9	142.6	0	0	0	113.7	P114	P114-L116 VanDerWaalsContact C-N 3.28Å; P114-L116 PolarHBondContact O-N 3.34Å
117	I	50.3	Low	44.5	Very low	132 Å²	132	133.1 Å²	133.1	68%	0.677	67%	0.672	S	S	*	*	H	α-helix	trans	-75.1	-33.4	179.5	-58.5	179.2	0	0	0	111.3	Q119	I117-Q119 VanDerWaalsContact C-N 3.34Å; I117-Q119 PolarHBondContact O-N 3.46Å
118	I	50	Low	44.6	Very low	129 Å²	129	135.5 Å²	135.5	66%	0.662	68%	0.675	S	S	*	*	H	α-helix	trans	-74.1	-27.1	-178.5	-58.6	179	0	0	0	111.4
119	Q	50.5	Low	45	Very low	127 Å²	127	135.7 Å²	135.7	59%	0.593	68%	0.676	S	S	*	*	H	α-helix	trans	-79.3	-31.4	-179.1	-151.6	-175	54.8	0	0	113.3	I117 N121 K122 Q123	I117-Q119 VanDerWaalsContact C-N 3.34Å; I117-Q119 PolarHBondContact O-N 3.46Å; Q119-N121 VanDerWaalsContact C-N 3.34Å; Q119-N121 PolarHBondContact O-N 3.2Å; Q119-K122 PolarHBondContact O-N 3.17Å; Q119-Q123 PolarHBondContact O-N 3.38Å; Q119-Q123 VanDerWaalsContact O-N 3.08Å
120	S	49.2	Very low	45.2	Very low	70 Å²	70	132 Å²	132	49%	0.49	67%	0.667	S	S	.	*	H	α-helix	trans	-67	-34.8	-179	78.8	0	0	0	0	112.8	Q123 E124	S120-Q123 PolarHBondContact O-N 3.06Å; S120-E124 PolarHBondContact O-N 3.25Å
121	N	50.2	Low	45.4	Very low	110 Å²	110	136.2 Å²	136.2	59%	0.588	67%	0.672	S	S	*	*	H	α-helix	trans	-71	-35.9	178.6	-162	-42.6	0	0	0	111.6	Q119	Q119-N121 VanDerWaalsContact C-N 3.34Å; Q119-N121 PolarHBondContact O-N 3.2Å
122	K	47.6	Very low	45.4	Very low	150 Å²	150	137.7 Å²	137.7	65%	0.652	67%	0.67	S	S	*	*	H	α-helix	trans	-75.1	-25.8	178.1	-137.5	177.9	-173.1	-177.1	0	113	Q119 N126	Q119-K122 PolarHBondContact O-N 3.17Å; K122-N126 PolarHBondContact O-N 3.32Å; K122-N126 PolarHBondContact O-ND2 3.49Å
123	Q	47.3	Very low	45.2	Very low	108 Å²	108	135.7 Å²	135.7	51%	0.505	67%	0.666	S	S	.	*	H	α-helix	trans	-80.4	-33.3	179	-163.9	171.6	-39.9	0	0	112.6	Q119 S120 N126 Q127	Q119-Q123 PolarHBondContact O-N 3.38Å; Q119-Q123 VanDerWaalsContact O-N 3.08Å; S120-Q123 PolarHBondContact O-N 3.06Å; Q123-N126 PolarHBondContact O-N 3.44Å; Q123-Q127 PolarHBondContact O-N 3.32Å; Q123-Q127 VanDerWaalsContact O-N 3.14Å
124	E	50.6	Low	45.2	Very low	149 Å²	149	137 Å²	137	70%	0.696	67%	0.672	S	S	*	*	H	α-helix	trans	-67.7	-36.7	175.1	-72.3	-163.8	126.3	0	0	112.5	S120 Q128	S120-E124 PolarHBondContact O-N 3.25Å; E124-Q128 PolarHBondContact O-N 3.16Å
125	Q	50.8	Low	44.9	Very low	142 Å²	142	137.6 Å²	137.6	66%	0.664	68%	0.675	S	S	*	*	H	α-helix	trans	-67.8	-38.7	174.1	-79.1	-164.4	-15.9	0	0	112.9	Q127 Q128 F129	Q125-Q127 VanDerWaalsContact C-N 3.34Å; Q125-Q127 PolarHBondContact O-N 2.83Å; Q125-Q128 PolarHBondContact O-N 3.49Å; Q125-F129 PolarHBondContact O-N 3.2Å
126	N	45	Very low	44.4	Very low	101 Å²	101	140.9 Å²	140.9	54%	0.54	69%	0.687	S	S	.	*	H	α-helix	trans	-73.8	-22.6	-179.8	-79.8	-64.4	0	0	0	113.6	K122 Q123 K130	K122-N126 PolarHBondContact O-N 3.32Å; K122-N126 PolarHBondContact O-ND2 3.49Å; Q123-N126 PolarHBondContact O-N 3.44Å; N126-K130 PolarHBondContact O-N 2.84Å
127	Q	48.2	Very low	43.8	Very low	139 Å²	139	139.6 Å²	139.6	65%	0.65	69%	0.689	S	S	*	*	H	α-helix	trans	-79.6	-26.7	174.2	-76.4	-170	-6	0	0	113.6	Q123 Q125	Q123-Q127 PolarHBondContact O-N 3.32Å; Q123-Q127 VanDerWaalsContact O-N 3.14Å; Q125-Q127 VanDerWaalsContact C-N 3.34Å; Q125-Q127 PolarHBondContact O-N 2.83Å
128	Q	45.4	Very low	42.8	Very low	170 Å²	170	139.6 Å²	139.6	79%	0.794	69%	0.69	S	S	*	*	H	α-helix	trans	-75.2	-32.4	169.5	-71.2	-144.8	-0.3	0	0	112.2	E124 Q125	E124-Q128 PolarHBondContact O-N 3.16Å; Q125-Q128 PolarHBondContact O-N 3.49Å
129	F	43.5	Very low	41.9	Very low	175 Å²	175	142 Å²	142	77%	0.768	70%	0.699	S	S	*	*	H	α-helix	trans	-77.8	-19	-178.6	-150.8	-98.1	0	0	0	114	Q125 R131	Q125-F129 PolarHBondContact O-N 3.2Å; F129-R131 VanDerWaalsContact C-N 3.3Å; F129-R131 PolarHBondContact O-N 3.17Å
130	K	40	Very low	40.9	Very low	164 Å²	164	143 Å²	143	71%	0.713	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	18.9	-178.9	-150	178	-176.1	177.3	0	115.1	N126	N126-K130 PolarHBondContact O-N 2.84Å
131	R	35.8	Very low	39.8	Very low	228 Å²	228	145.6 Å²	145.6	86%	0.86	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.7	19.7	175.2	-102.3	-144	-88.2	-169.2	-5.8	115.3	F129	F129-R131 VanDerWaalsContact C-N 3.3Å; F129-R131 PolarHBondContact O-N 3.17Å
132	L	38.1	Very low	38.7	Very low	139 Å²	139	149 Å²	149	73%	0.728	75%	0.747	S	S	*	*			trans	-131.4	70.1	164.6	-83.7	97.2	0	0	0	109.9
133	D	33.5	Very low	37.8	Very low	145 Å²	145	151.2 Å²	151.2	78%	0.775	76%	0.756	S	S	*	*			trans	-90.3	96.2	160.4	-67.8	-37.5	0	0	0	106.8
134	I	36.3	Very low	37.1	Very low	143 Å²	143	151.9 Å²	151.9	73%	0.733	77%	0.77	S	S	*	*			trans	-113.1	139.9	167.4	-67.4	175.3	0	0	0	107
135	P	39.2	Very low	36.4	Very low	118 Å²	118	150.7 Å²	150.7	77%	0.766	77%	0.768	S	S	*	*			trans	-75.1	142.2	-163	-9.1	26.3	0	0	0	113.2
136	E	33.2	Very low	35.8	Very low	186 Å²	186	152.9 Å²	152.9	87%	0.869	78%	0.776	S	S	*	*			trans	-54.4	119.3	164.6	-170.3	175.3	128.8	0	0	111.2
137	S	35.9	Very low	35.8	Very low	106 Å²	106	152.5 Å²	152.5	74%	0.741	78%	0.777	S	S	*	*			trans	-150.7	95.9	159	65.4	0	0	0	0	109.5
138	D	29.4	Very low	35.6	Very low	133 Å²	133	151.3 Å²	151.3	71%	0.711	77%	0.774	S	S	*	*			trans	33.6	119.9	139.3	-56.6	-27.6	0	0	0	120.5
139	E	30.5	Very low	35.7	Very low	178 Å²	178	145.9 Å²	145.9	83%	0.832	76%	0.764	S	S	*	*			trans	38.4	105.8	135.4	-65.2	-169.8	109.8	0	0	117.8
140	T	29.8	Very low	36.1	Very low	148 Å²	148	143.1 Å²	143.1	91%	0.908	76%	0.757	S	S	*	*				-162.7	108.3	121.9	14	0	0	0	0	110.6	M142	T140-M142 PolarHBondContact O-N 2.99Å
141	S	25.9	Very low	36.8	Very low	125 Å²	125	137.5 Å²	137.5	87%	0.874	74%	0.738	S	S	*	*			trans	-58.3	106.8	166.4	175.5	0	0	0	0	110.9
142	M	27.4	Very low	37.9	Very low	183 Å²	183	132.7 Å²	132.7	90%	0.901	73%	0.725	S	S	*	*			trans	-166.2	99.8	145.7	-119.4	177.9	163.9	0	0	112.3	T140	T140-M142 PolarHBondContact O-N 2.99Å
143	K	27.7	Very low	39	Very low	195 Å²	195	131.5 Å²	131.5	85%	0.848	72%	0.719	S	S	*	*			trans	52	104.6	147.5	-143.3	169	-173.8	178.6	0	118.2	N145	K143-N145 PolarHBondContact O-N 2.97Å
144	P	33.7	Very low	40.2	Very low	122 Å²	122	126.9 Å²	126.9	79%	0.792	70%	0.701	S	S	*	*			trans	-77.4	121.9	-176.2	30.5	-32	0	0	0	112.2	K146	P144-K146 VanDerWaalsContact C-N 3.34Å; P144-K146 PolarHBondContact O-N 3.37Å; P144-K146 VanDerWaalsContact O-N 3.08Å
145	N	35.2	Very low	41.4	Very low	124 Å²	124	123.4 Å²	123.4	66%	0.663	68%	0.683	S	S	*	*			trans	-72	91	161	-172.1	1.2	0	0	0	108.4	K143 T147	K143-N145 PolarHBondContact O-N 2.97Å; N145-T147 VanDerWaalsContact C-N 3.32Å; N145-T147 PolarHBondContact O-N 2.63Å; N145-T147 PolarHBondContact OD1-OG1 2.59Å
146	K	39.1	Very low	42.4	Very low	189 Å²	189	121.2 Å²	121.2	82%	0.822	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	75.3	-175.4	-168.3	-177.7	-176	177.8	0	110.5	P144	P144-K146 VanDerWaalsContact C-N 3.34Å; P144-K146 PolarHBondContact O-N 3.37Å; P144-K146 VanDerWaalsContact O-N 3.08Å
147	T	45.2	Very low	43.8	Very low	93 Å²	93	115.6 Å²	115.6	57%	0.571	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-158.9	-11.9	167.9	5.1	0	0	0	0	115.3	N145	N145-T147 VanDerWaalsContact C-N 3.32Å; N145-T147 PolarHBondContact O-N 2.63Å; N145-T147 PolarHBondContact OD1-OG1 2.59Å
148	I	42.9	Very low	44.8	Very low	114 Å²	114	114.9 Å²	114.9	59%	0.585	63%	0.631	S	S	*	*	H	α-helix	trans	-80.9	-28.4	-174.2	-67	172.5	0	0	0	112.9	D150 S151	I148-D150 VanDerWaalsContact C-N 3.33Å; I148-D150 PolarHBondContact O-N 3.23Å; I148-S151 PolarHBondContact O-OG 3.46Å; I148-S151 VanDerWaalsContact O-OG 3.04Å
149	G	48.5	Very low	46.1	Very low	56 Å²	56	116.3 Å²	116.3	58%	0.577	63%	0.626	S	S	*	*	H	α-helix	trans	-68.7	-30.7	179.7	0	0	0	0	0	113.9	L153	G149-L153 PolarHBondContact O-N 2.86Å
150	D	51.9	Low	47.2	Very low	116 Å²	116	112.9 Å²	112.9	62%	0.62	61%	0.61	S	S	*	*	H	α-helix	trans	-78.5	-32.2	-175.3	-62.1	-26.7	0	0	0	111.9	I148 A154	I148-D150 VanDerWaalsContact C-N 3.33Å; I148-D150 PolarHBondContact O-N 3.23Å; D150-A154 WeakPolarHBondContact O-CB 3.29Å; D150-A154 PolarHBondContact O-N 3.21Å
151	S	53.3	Low	48.3	Very low	47 Å²	47	112 Å²	112	33%	0.329	60%	0.596	S	S	.	*	H	α-helix	trans	-71.4	-41	178.9	55.9	0	0	0	0	111.9	I148 A154 I155	I148-S151 PolarHBondContact O-OG 3.46Å; I148-S151 VanDerWaalsContact O-OG 3.04Å; S151-A154 PolarHBondContact O-N 3.45Å; S151-I155 VanDerWaalsContact O-CG1 3.25Å; S151-I155 WeakPolarHBondContact O-CG1 3.1Å; S151-I155 PolarHBondContact O-N 3.07Å
152	E	60.1	Low	49.6	Very low	126 Å²	126	108 Å²	108	59%	0.589	57%	0.568	S	S	*	*	H	α-helix	trans	-68.2	-38.1	178.7	-136.2	-161.8	141.5	0	0	111.7	A154 I155 N156	E152-A154 VanDerWaalsContact C-N 3.34Å; E152-I155 PolarHBondContact O-N 3.42Å; E152-N156 WeakPolarHBondContact O-CB 3.31Å; E152-N156 PolarHBondContact O-N 3.48Å; E152-N156 PolarHBondContact O-ND2 3.08Å
153	L	59.8	Low	50.5	Low	115 Å²	115	103.5 Å²	103.5	60%	0.602	55%	0.547	S	S	*	.	H	α-helix	trans	-63.3	-40.9	172.8	-173.2	69.6	0	0	0	111.3	G149 T157	G149-L153 PolarHBondContact O-N 2.86Å; L153-T157 VanDerWaalsContact O-CB 3.29Å; L153-T157 WeakPolarHBondContact O-CB 3.46Å; L153-T157 PolarHBondContact O-N 3.27Å; L153-T157 PolarHBondContact O-OG1 2.91Å
154	A	59.2	Low	51.6	Low	48 Å²	48	100.4 Å²	100.4	40%	0.397	54%	0.539	S	S	.	.	H	α-helix	trans	-64.6	-44.6	176.2	0	0	0	0	0	111.8	D150 S151 E152 T157 I158	D150-A154 WeakPolarHBondContact O-CB 3.29Å; D150-A154 PolarHBondContact O-N 3.21Å; S151-A154 PolarHBondContact O-N 3.45Å; E152-A154 VanDerWaalsContact C-N 3.34Å; A154-T157 PolarHBondContact O-N 3Å; A154-I158 VanDerWaalsContact O-CG1 3.26Å; A154-I158 WeakPolarHBondContact O-CG1 3.41Å; A154-I158 PolarHBondContact O-N 3.43Å
155	I	62.2	Low	52.1	Low	69 Å²	69	97.9 Å²	97.9	35%	0.354	52%	0.522	S	S	.	.	H	α-helix	trans	-63.3	-45.6	178	-67.1	164.1	0	0	0	110.5	S151 E152 T157 I158 R159	S151-I155 VanDerWaalsContact O-CG1 3.25Å; S151-I155 WeakPolarHBondContact O-CG1 3.1Å; S151-I155 PolarHBondContact O-N 3.07Å; E152-I155 PolarHBondContact O-N 3.42Å; I155-T157 VanDerWaalsContact C-N 3.31Å; I155-T157 PolarHBondContact O-N 3.17Å; I155-I158 PolarHBondContact O-N 3.11Å; I155-R159 WeakPolarHBondContact O-CB 3.28Å; I155-R159 PolarHBondContact O-N 3.09Å
156	N	60	Low	52.5	Low	72 Å²	72	99.3 Å²	99.3	39%	0.385	52%	0.524	S	S	.	.	H	α-helix	trans	-65	-36	177.3	-76.2	-34.8	0	0	0	112	E152 R159 Q160	E152-N156 WeakPolarHBondContact O-CB 3.31Å; E152-N156 PolarHBondContact O-N 3.48Å; E152-N156 PolarHBondContact O-ND2 3.08Å; N156-R159 PolarHBondContact O-N 3.45Å; N156-Q160 WeakPolarHBondContact O-CB 3.46Å; N156-Q160 VanDerWaalsContact O-CG 3.31Å; N156-Q160 WeakPolarHBondContact O-CG 3.45Å; N156-Q160 PolarHBondContact O-N 3Å
157	T	61.9	Low	52.6	Low	69 Å²	69	97.9 Å²	97.9	42%	0.423	53%	0.526	S	S	.	.	H	α-helix	trans	-64.4	-42.9	173.8	-59.3	0	0	0	0	111.4	L153 A154 I155 R159 Q160 Q161	L153-T157 VanDerWaalsContact O-CB 3.29Å; L153-T157 WeakPolarHBondContact O-CB 3.46Å; L153-T157 PolarHBondContact O-N 3.27Å; L153-T157 PolarHBondContact O-OG1 2.91Å; A154-T157 PolarHBondContact O-N 3Å; I155-T157 VanDerWaalsContact C-N 3.31Å; I155-T157 PolarHBondContact O-N 3.17Å; T157-R159 VanDerWaalsContact C-N 3.35Å; T157-Q160 PolarHBondContact O-N 3.11Å; T157-Q161 WeakPolarHBondContact O-CG 3.28Å; T157-Q161 PolarHBondContact O-N 2.85Å
158	I	56.3	Low	52.2	Low	91 Å²	91	100.1 Å²	100.1	47%	0.467	53%	0.525	S	S	.	.	H	α-helix	trans	-63	-43.5	175.1	-67.3	163.6	0	0	0	110.3	A154 I155 Q160 Q161 C162	A154-I158 VanDerWaalsContact O-CG1 3.26Å; A154-I158 WeakPolarHBondContact O-CG1 3.41Å; A154-I158 PolarHBondContact O-N 3.43Å; I155-I158 PolarHBondContact O-N 3.11Å; I158-Q160 VanDerWaalsContact C-N 3.34Å; I158-Q160 PolarHBondContact O-N 3.46Å; I158-Q161 PolarHBondContact O-N 3.06Å; I158-Q161 VanDerWaalsContact O-N 3.17Å; I158-C162 PolarHBondContact O-N 3.06Å; I158-C162 VanDerWaalsContact O-N 3.08Å
159	R	56.6	Low	52	Low	162 Å²	162	101 Å²	101	61%	0.611	54%	0.541	S	S	*	.	H	α-helix	trans	-61.5	-42.2	178	-155.8	176.4	-163.7	176.1	5.2	112	I155 N156 T157 C162 L163	I155-R159 WeakPolarHBondContact O-CB 3.28Å; I155-R159 PolarHBondContact O-N 3.09Å; N156-R159 PolarHBondContact O-N 3.45Å; T157-R159 VanDerWaalsContact C-N 3.35Å; R159-C162 PolarHBondContact O-N 3.36Å; R159-L163 PolarHBondContact O-N 3.01Å; R159-L163 VanDerWaalsContact O-N 3.11Å
160	Q	53.8	Low	52	Low	106 Å²	106	99.5 Å²	99.5	50%	0.495	53%	0.526	S	S	.	.	H	α-helix	trans	-65.2	-36.6	175.1	-76.1	-68.6	-31	0	0	112.6	N156 T157 I158 C162 L163 N164	N156-Q160 WeakPolarHBondContact O-CB 3.46Å; N156-Q160 VanDerWaalsContact O-CG 3.31Å; N156-Q160 WeakPolarHBondContact O-CG 3.45Å; N156-Q160 PolarHBondContact O-N 3Å; T157-Q160 PolarHBondContact O-N 3.11Å; I158-Q160 VanDerWaalsContact C-N 3.34Å; I158-Q160 PolarHBondContact O-N 3.46Å; Q160-C162 VanDerWaalsContact C-N 3.32Å; Q160-C162 PolarHBondContact O-N 3.27Å; Q160-L163 PolarHBondContact O-N 2.99Å; Q160-N164 WeakPolarHBondContact O-CB 3.13Å; Q160-N164 PolarHBondContact O-N 3.06Å; Q160-N164 PolarHBondContact O-ND2 2.72Å
161	Q	54.2	Low	51.8	Low	129 Å²	129	99.6 Å²	99.6	60%	0.603	53%	0.533	S	S	*	.	H	α-helix	trans	-65.1	-35.4	174.3	-74.7	-179	-8.8	0	0	112.4	T157 I158 T165	T157-Q161 WeakPolarHBondContact O-CG 3.28Å; T157-Q161 PolarHBondContact O-N 2.85Å; I158-Q161 PolarHBondContact O-N 3.06Å; I158-Q161 VanDerWaalsContact O-N 3.17Å; Q161-T165 PolarHBondContact O-OG1 3.48Å
162	C	52.5	Low	51.6	Low	42 Å²	42	102.9 Å²	102.9	28%	0.284	55%	0.55	S	S	.	*	H	α-helix	trans	-68.7	-42.4	175	-69.3	0	0	0	0	112.5	I158 R159 Q160 T165	I158-C162 PolarHBondContact O-N 3.06Å; I158-C162 VanDerWaalsContact O-N 3.08Å; R159-C162 PolarHBondContact O-N 3.36Å; Q160-C162 VanDerWaalsContact C-N 3.32Å; Q160-C162 PolarHBondContact O-N 3.27Å; C162-T165 PolarHBondContact O-OG1 3.32Å
163	L	47.1	Very low	50.9	Low	89 Å²	89	101.6 Å²	101.6	47%	0.466	54%	0.54	S	S	.	.	H	α-helix	trans	-71.6	-33.7	-178.7	-68.8	172.2	0	0	0	113.2	R159 Q160 T165 E166	R159-L163 PolarHBondContact O-N 3.01Å; R159-L163 VanDerWaalsContact O-N 3.11Å; Q160-L163 PolarHBondContact O-N 2.99Å; L163-T165 PolarHBondContact O-N 2.78Å; L163-T165 VanDerWaalsContact O-N 3.11Å; L163-E166 WeakPolarHBondContact O-CG 3.32Å
164	N	49.8	Very low	50	Low	130 Å²	130	100.6 Å²	100.6	70%	0.695	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	1	-178.4	-74	-20.8	0	0	0	114.5	Q160	Q160-N164 WeakPolarHBondContact O-CB 3.13Å; Q160-N164 PolarHBondContact O-N 3.06Å; Q160-N164 PolarHBondContact O-ND2 2.72Å
165	T	44.7	Very low	49.5	Very low	69 Å²	69	104.4 Å²	104.4	42%	0.423	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-114	28.3	-179	48.2	0	0	0	0	114.1	Q161 C162 L163 N167	Q161-T165 PolarHBondContact O-OG1 3.48Å; C162-T165 PolarHBondContact O-OG1 3.32Å; L163-T165 PolarHBondContact O-N 2.78Å; L163-T165 VanDerWaalsContact O-N 3.11Å; T165-N167 PolarHBondContact O-N 3.34Å
166	E	43.7	Very low	48.6	Very low	153 Å²	153	107.7 Å²	107.7	72%	0.715	57%	0.565	S	S	*	*			trans	-62.4	7.3	-180	-85.9	-177.2	161.8	0	0	117.1	L163	L163-E166 WeakPolarHBondContact O-CG 3.32Å
167	N	41.6	Very low	48.4	Very low	159 Å²	159	106.1 Å²	106.1	85%	0.85	56%	0.559	S	S	*	*	S	Bend	trans	-124.4	42.9	-178.7	-79.7	-50.8	0	0	0	113.5	T165	T165-N167 PolarHBondContact O-N 3.34Å
168	Y	35	Very low	48	Very low	140 Å²	140	105.3 Å²	105.3	55%	0.549	56%	0.56	S	S	.	*			trans	-138.3	116	175.6	-119.4	-98.2	0	0	0	112.4	L85	L85-Y168 WeakPolarHBondContact CD1-OH 3.45Å
169	S	40.4	Very low	47.9	Very low	133 Å²	133	103.7 Å²	103.7	93%	0.93	55%	0.552	S	S	*	*			trans	-105.9	100.7	168.6	-177.4	0	0	0	0	107.8
170	G	47.8	Very low	47.9	Very low	25 Å²	25	98 Å²	98	26%	0.258	54%	0.536	S	S	.	.	S	Bend	trans	-154.3	156.4	177.8	0	0	0	0	0	110.8	V172 W173	G170-V172 PolarHBondContact O-N 3.21Å; G170-V172 VanDerWaalsContact O-N 3.13Å; G170-W173 WeakPolarHBondContact O-CB 3.31Å; G170-W173 PolarHBondContact O-N 3.19Å
171	P	47.5	Very low	48	Very low	118 Å²	118	97.5 Å²	97.5	77%	0.766	54%	0.537	S	S	*	.	H	α-helix	trans	-61.2	-27	-171.6	21.1	-31.5	0	0	0	113.8	W173 C174	P171-W173 PolarHBondContact O-N 3.1Å; P171-C174 PolarHBondContact O-N 3.24Å
172	V	50	Low	48.1	Very low	115 Å²	115	95.9 Å²	95.9	70%	0.697	53%	0.53	S	S	*	.	H	α-helix	trans	-64.3	-29.4	176.2	-177.6	0	0	0	0	111.8	G170 M175 K176	G170-V172 PolarHBondContact O-N 3.21Å; G170-V172 VanDerWaalsContact O-N 3.13Å; V172-M175 PolarHBondContact O-N 2.87Å; V172-K176 PolarHBondContact O-N 3.43Å
173	W	44.5	Very low	48.2	Very low	99 Å²	99	96.9 Å²	96.9	38%	0.375	53%	0.531	S	S	.	.	H	α-helix	trans	-75.1	-35.5	-179.3	-129.1	84.4	0	0	0	112.3	G170 P171 M175 K176 S177	G170-W173 WeakPolarHBondContact O-CB 3.31Å; G170-W173 PolarHBondContact O-N 3.19Å; P171-W173 PolarHBondContact O-N 3.1Å; W173-M175 PolarHBondContact O-N 3.38Å; W173-K176 PolarHBondContact O-N 2.99Å; W173-S177 WeakPolarHBondContact O-CB 3.44Å; W173-S177 PolarHBondContact O-N 3.04Å; W173-S177 PolarHBondContact O-OG 2.88Å
174	C	42.1	Very low	48.7	Very low	94 Å²	94	97.2 Å²	97.2	64%	0.635	54%	0.537	S	S	*	.	H	α-helix	trans	-59.8	-32.8	175.1	-71.4	0	0	0	0	112.3	P171 S177 A178	P171-C174 PolarHBondContact O-N 3.24Å; C174-S177 PolarHBondContact O-OG 2.91Å; C174-S177 VanDerWaalsContact O-OG 3.11Å; C174-A178 PolarHBondContact O-N 3.35Å
175	M	48.8	Very low	48.9	Very low	129 Å²	129	97.4 Å²	97.4	64%	0.635	54%	0.538	S	S	*	.	H	α-helix	trans	-79.3	-38.7	177.7	-152	169	-171	0	0	111.6	V172 W173 A178 I179	V172-M175 PolarHBondContact O-N 2.87Å; W173-M175 PolarHBondContact O-N 3.38Å; M175-A178 PolarHBondContact O-N 3.23Å; M175-I179 WeakPolarHBondContact O-CG1 3.36Å; M175-I179 PolarHBondContact O-N 2.84Å
176	K	42.6	Very low	49.2	Very low	137 Å²	137	96.9 Å²	96.9	60%	0.596	54%	0.535	S	S	*	.	H	α-helix	trans	-66.5	-38.4	174.4	-101.6	-169.8	172.8	-150.3	0	113.2	V172 W173 A178 I179 C180	V172-K176 PolarHBondContact O-N 3.43Å; W173-K176 PolarHBondContact O-N 2.99Å; K176-A178 VanDerWaalsContact C-N 3.32Å; K176-A178 PolarHBondContact O-N 2.91Å; K176-I179 PolarHBondContact O-N 3.46Å; K176-C180 PolarHBondContact O-N 2.86Å
177	S	55.4	Low	49.5	Very low	39 Å²	39	93.4 Å²	93.4	27%	0.273	54%	0.54	S	S	.	.	H	α-helix	trans	-64.7	-38.5	177.3	65.4	0	0	0	0	111.3	W173 C174 I179 C180 D181	W173-S177 WeakPolarHBondContact O-CB 3.44Å; W173-S177 PolarHBondContact O-N 3.04Å; W173-S177 PolarHBondContact O-OG 2.88Å; C174-S177 PolarHBondContact O-OG 2.91Å; C174-S177 VanDerWaalsContact O-OG 3.11Å; S177-I179 VanDerWaalsContact C-N 3.3Å; S177-I179 PolarHBondContact O-N 2.89Å; S177-C180 PolarHBondContact O-N 3.27Å; S177-C180 VanDerWaalsContact O-N 3.17Å; S177-D181 PolarHBondContact O-N 3.48Å
178	A	53.2	Low	49.9	Very low	53 Å²	53	91.1 Å²	91.1	44%	0.438	52%	0.524	S	S	.	.	H	α-helix	trans	-60.7	-39.3	174.9	0	0	0	0	0	112.3	C174 M175 K176 D181 E182	C174-A178 PolarHBondContact O-N 3.35Å; M175-A178 PolarHBondContact O-N 3.23Å; K176-A178 VanDerWaalsContact C-N 3.32Å; K176-A178 PolarHBondContact O-N 2.91Å; A178-D181 PolarHBondContact O-N 3.28Å; A178-E182 PolarHBondContact O-N 3.23Å
179	I	55.7	Low	50.9	Low	56 Å²	56	91.4 Å²	91.4	29%	0.287	54%	0.535	S	S	.	.	H	α-helix	trans	-66.3	-41.5	176	-62.6	166.8	0	0	0	110.7	M175 K176 S177 E182 I183 L198	M175-I179 WeakPolarHBondContact O-CG1 3.36Å; M175-I179 PolarHBondContact O-N 2.84Å; K176-I179 PolarHBondContact O-N 3.46Å; S177-I179 VanDerWaalsContact C-N 3.3Å; S177-I179 PolarHBondContact O-N 2.89Å; I179-E182 PolarHBondContact O-N 3.34Å; I179-I183 HydrophobicContact CG2-CD1 3.98Å; I179-I183 VanDerWaalsContact O-CG1 3.28Å; I179-I183 WeakPolarHBondContact O-CG1 3.42Å; I179-I183 PolarHBondContact O-N 2.86Å; I179-I183 VanDerWaalsContact O-N 3.09Å; I179-L198 HydrophobicContact CG2-CD2 3.92Å
180	C	56.2	Low	51.7	Low	43 Å²	43	88.9 Å²	88.9	29%	0.291	51%	0.512	S	S	.	.	H	α-helix	trans	-64.3	-42.9	175.7	-73	0	0	0	0	112.1	K176 S177 E182 I183 T184	K176-C180 PolarHBondContact O-N 2.86Å; S177-C180 PolarHBondContact O-N 3.27Å; S177-C180 VanDerWaalsContact O-N 3.17Å; C180-E182 VanDerWaalsContact C-N 3.32Å; C180-E182 PolarHBondContact O-N 3.12Å; C180-I183 PolarHBondContact O-N 3.48Å; C180-T184 PolarHBondContact O-N 2.82Å; C180-T184 PolarHBondContact O-OG1 3.31Å
181	D	55.9	Low	52.1	Low	96 Å²	96	89.3 Å²	89.3	51%	0.513	52%	0.516	S	S	.	.	H	α-helix	trans	-63.4	-39.5	178.7	-73.8	-20.2	0	0	0	111	S177 A178 T184 N185	S177-D181 PolarHBondContact O-N 3.48Å; A178-D181 PolarHBondContact O-N 3.28Å; D181-T184 WeakPolarHBondContact CA-OG1 3.26Å; D181-T184 PolarHBondContact O-N 2.85Å; D181-T184 PolarHBondContact O-OG1 2.81Å; D181-N185 PolarHBondContact O-N 3.43Å; D181-N185 VanDerWaalsContact O-N 3.16Å; D181-N185 PolarHBondContact O-ND2 2.77Å
182	E	55.6	Low	52.6	Low	95 Å²	95	87.7 Å²	87.7	44%	0.444	50%	0.504	S	S	.	.	H	α-helix	trans	-67.6	-42.1	177.2	-166.2	164.5	172.9	0	0	112.1	A178 I179 C180 T184 N185 T186 K197	A178-E182 PolarHBondContact O-N 3.23Å; I179-E182 PolarHBondContact O-N 3.34Å; C180-E182 VanDerWaalsContact C-N 3.32Å; C180-E182 PolarHBondContact O-N 3.12Å; E182-T184 VanDerWaalsContact C-N 3.29Å; E182-T184 PolarHBondContact O-N 3.25Å; E182-N185 PolarHBondContact O-N 3.08Å; E182-N185 VanDerWaalsContact O-N 3.17Å; E182-T186 PolarHBondContact O-N 2.64Å; E182-T186 PolarHBondContact O-OG1 3.49Å; E182-K197 VanDerWaalsContact CD-NZ 3.27Å; E182-K197 IonicContact OE1-NZ 2.63Å; E182-K197 PolarHBondContact OE1-NZ 2.89Å; E182-K197 IonicContact OE2-NZ 3.88Å
183	I	55.2	Low	52.8	Low	62 Å²	62	83.5 Å²	83.5	32%	0.318	48%	0.481	S	S	.	.	H	α-helix	trans	-61.3	-38	175.6	-66	166.3	0	0	0	111.2	I179 C180 N185 I194 L198	I179-I183 HydrophobicContact CG2-CD1 3.98Å; I179-I183 VanDerWaalsContact O-CG1 3.28Å; I179-I183 WeakPolarHBondContact O-CG1 3.42Å; I179-I183 PolarHBondContact O-N 2.86Å; I179-I183 VanDerWaalsContact O-N 3.09Å; C180-I183 PolarHBondContact O-N 3.48Å; I183-N185 VanDerWaalsContact C-N 3.33Å; I183-N185 PolarHBondContact O-N 2.78Å; I183-I194 HydrophobicContact CD1-CG2 4.3Å; I183-I194 HydrophobicContact CG1-CG2 4.39Å; I183-I194 HydrophobicContact CG2-CD1 4.35Å; I183-L198 HydrophobicContact CD1-CD2 4.38Å
184	T	57.1	Low	53.4	Low	96 Å²	96	80.5 Å²	80.5	59%	0.589	47%	0.472	S	S	*	.	H	α-helix	trans	-71.1	-26.9	178.1	49.1	0	0	0	0	113.9	C180 D181 E182	C180-T184 PolarHBondContact O-N 2.82Å; C180-T184 PolarHBondContact O-OG1 3.31Å; D181-T184 WeakPolarHBondContact CA-OG1 3.26Å; D181-T184 PolarHBondContact O-N 2.85Å; D181-T184 PolarHBondContact O-OG1 2.81Å; E182-T184 VanDerWaalsContact C-N 3.29Å; E182-T184 PolarHBondContact O-N 3.25Å
185	N	53.8	Low	53.9	Low	135 Å²	135	82.1 Å²	82.1	72%	0.722	47%	0.466	S	S	*	.	H	α-helix	trans	-88.1	-34.1	-178.7	-76.5	-59.9	0	0	0	112.8	D181 E182 I183 G187	D181-N185 PolarHBondContact O-N 3.43Å; D181-N185 VanDerWaalsContact O-N 3.16Å; D181-N185 PolarHBondContact O-ND2 2.77Å; E182-N185 PolarHBondContact O-N 3.08Å; E182-N185 VanDerWaalsContact O-N 3.17Å; I183-N185 VanDerWaalsContact C-N 3.33Å; I183-N185 PolarHBondContact O-N 2.78Å; N185-G187 PolarHBondContact O-N 2.98Å
186	T	50.3	Low	54.3	Low	57 Å²	57	79.9 Å²	79.9	35%	0.35	46%	0.457	S	S	.	.	S	Bend	trans	-79.5	90.5	168.5	51.5	0	0	0	0	107.9	E182 E188	E182-T186 PolarHBondContact O-N 2.64Å; E182-T186 PolarHBondContact O-OG1 3.49Å; T186-E188 PolarHBondContact O-N 3.13Å
187	G	51.2	Low	54.9	Low	80 Å²	80	77.2 Å²	77.2	83%	0.825	45%	0.445	S	S	*	.			trans	-64.2	36	173.1	0	0	0	0	0	114.3	N185 N189	N185-G187 PolarHBondContact O-N 2.98Å; G187-N189 PolarHBondContact O-N 3.04Å
188	E	49.5	Very low	54.9	Low	112 Å²	112	78.7 Å²	78.7	52%	0.523	45%	0.449	S	S	.	.			trans	-89.7	97.8	-179.9	-162.5	171.7	-175.2	0	0	108	T186 D190	T186-E188 PolarHBondContact O-N 3.13Å; E188-D190 PolarHBondContact O-N 2.7Å; E188-D190 VanDerWaalsContact O-N 3.08Å
189	N	56.1	Low	55.1	Low	145 Å²	145	83.3 Å²	83.3	78%	0.775	46%	0.455	S	S	*	.			trans	-77.1	14.6	-174.2	-151.3	14.2	0	0	0	113.4	G187 G191	G187-N189 PolarHBondContact O-N 3.04Å; N189-G191 PolarHBondContact O-N 3.03Å
190	D	58.1	Low	55	Low	81 Å²	81	84.9 Å²	84.9	43%	0.433	47%	0.468	S	S	.	.			trans	-87.8	97.5	174.2	-171.3	-5	0	0	0	109	E188 T192 A193 I194	E188-D190 PolarHBondContact O-N 2.7Å; E188-D190 VanDerWaalsContact O-N 3.08Å; D190-T192 PolarHBondContact O-N 3.25Å; D190-T192 WeakPolarHBondContact OD1-CB 3.38Å; D190-T192 PolarHBondContact OD1-N 2.89Å; D190-T192 PolarHBondContact OD1-OG1 2.94Å; D190-A193 HydrophobicContact CB-CB 4.15Å; D190-A193 WeakPolarHBondContact O-CB 3.25Å; D190-A193 PolarHBondContact O-N 3.37Å; D190-I194 PolarHBondContact O-N 3.39Å
191	G	55.7	Low	54.7	Low	33 Å²	33	86.1 Å²	86.1	34%	0.34	47%	0.471	S	S	.	.	H	α-helix	trans	-53.5	-23.3	176.8	0	0	0	0	0	113.3	N189 Y195	N189-G191 PolarHBondContact O-N 3.03Å; G191-Y195 VanDerWaalsContact O-CB 3.3Å; G191-Y195 WeakPolarHBondContact O-CB 3.32Å; G191-Y195 PolarHBondContact O-N 3Å
192	T	57.2	Low	54.5	Low	85 Å²	85	84.7 Å²	84.7	52%	0.521	47%	0.469	S	S	.	.	H	α-helix	trans	-71.7	-42.1	175.8	-32.7	0	0	0	0	111.7	D190 Y195 N196	D190-T192 PolarHBondContact O-N 3.25Å; D190-T192 WeakPolarHBondContact OD1-CB 3.38Å; D190-T192 PolarHBondContact OD1-N 2.89Å; D190-T192 PolarHBondContact OD1-OG1 2.94Å; T192-Y195 PolarHBondContact O-N 3.35Å; T192-N196 WeakPolarHBondContact O-CB 3.23Å; T192-N196 VanDerWaalsContact O-CG 3.3Å; T192-N196 PolarHBondContact O-N 2.92Å; T192-N196 PolarHBondContact O-ND2 3.36Å
193	A	54.3	Low	54.1	Low	27 Å²	27	83.7 Å²	83.7	22%	0.223	47%	0.472	C	S	.	.	H	α-helix	trans	-65.4	-44	176.7	0	0	0	0	0	110.7	D190 Y195 N196 K197	D190-A193 HydrophobicContact CB-CB 4.15Å; D190-A193 WeakPolarHBondContact O-CB 3.25Å; D190-A193 PolarHBondContact O-N 3.37Å; A193-Y195 PolarHBondContact O-N 3.19Å; A193-N196 PolarHBondContact O-N 2.99Å; A193-K197 WeakPolarHBondContact O-CB 3.33Å; A193-K197 PolarHBondContact O-N 3.39Å
194	I	57.5	Low	53.7	Low	35 Å²	35	86.2 Å²	86.2	18%	0.179	48%	0.483	C	S	.	.	H	α-helix	trans	-61.5	-45	175.5	-60.2	174.2	0	0	0	110.5	I183 D190 N196 K197 L198	I183-I194 HydrophobicContact CD1-CG2 4.3Å; I183-I194 HydrophobicContact CG1-CG2 4.39Å; I183-I194 HydrophobicContact CG2-CD1 4.35Å; D190-I194 PolarHBondContact O-N 3.39Å; I194-N196 PolarHBondContact O-N 2.96Å; I194-K197 PolarHBondContact O-N 3.25Å; I194-L198 HydrophobicContact CG2-CD1 3.74Å; I194-L198 HydrophobicContact CG2-CG 4.38Å; I194-L198 VanDerWaalsContact O-CB 3.32Å; I194-L198 WeakPolarHBondContact O-CB 3.31Å; I194-L198 WeakPolarHBondContact O-CG 3.29Å; I194-L198 PolarHBondContact O-N 2.92Å
195	Y	52.6	Low	53.2	Low	128 Å²	128	89 Å²	89	50%	0.502	49%	0.489	S	S	.	.	H	α-helix	trans	-61.1	-44.5	176.7	179.6	-95.2	0	0	0	112.1	G191 T192 A193 L198 R199	G191-Y195 VanDerWaalsContact O-CB 3.3Å; G191-Y195 WeakPolarHBondContact O-CB 3.32Å; G191-Y195 PolarHBondContact O-N 3Å; T192-Y195 PolarHBondContact O-N 3.35Å; A193-Y195 PolarHBondContact O-N 3.19Å; Y195-L198 PolarHBondContact O-N 2.72Å; Y195-R199 VanDerWaalsContact O-CB 3.29Å; Y195-R199 WeakPolarHBondContact O-CB 3.29Å; Y195-R199 PolarHBondContact O-N 3.45Å; Y195-R199 PolarHBondContact OH-NH2 3.11Å
196	N	57.1	Low	52.8	Low	83 Å²	83	88.4 Å²	88.4	44%	0.444	49%	0.49	S	S	.	.	H	α-helix	trans	-66.7	-37.4	178.3	-73.4	-28.5	0	0	0	111.9	T192 A193 I194 R199 T200	T192-N196 WeakPolarHBondContact O-CB 3.23Å; T192-N196 VanDerWaalsContact O-CG 3.3Å; T192-N196 PolarHBondContact O-N 2.92Å; T192-N196 PolarHBondContact O-ND2 3.36Å; A193-N196 PolarHBondContact O-N 2.99Å; I194-N196 PolarHBondContact O-N 2.96Å; N196-R199 PolarHBondContact O-N 3.42Å; N196-T200 PolarHBondContact O-N 3.14Å; N196-T200 PolarHBondContact O-OG1 3.3Å
197	K	55.6	Low	51.9	Low	81 Å²	81	90.7 Å²	90.7	35%	0.352	50%	0.504	S	S	.	.	H	α-helix	trans	-69.6	-42.7	176.7	-157.9	163.5	-173.4	-86.3	0	111.6	E182 A193 I194 R199 T200 L201	E182-K197 VanDerWaalsContact CD-NZ 3.27Å; E182-K197 IonicContact OE1-NZ 2.63Å; E182-K197 PolarHBondContact OE1-NZ 2.89Å; E182-K197 IonicContact OE2-NZ 3.88Å; A193-K197 WeakPolarHBondContact O-CB 3.33Å; A193-K197 PolarHBondContact O-N 3.39Å; I194-K197 PolarHBondContact O-N 3.25Å; K197-R199 VanDerWaalsContact C-N 3.32Å; K197-R199 PolarHBondContact O-N 3.44Å; K197-T200 VanDerWaalsContact CA-OG1 3.29Å; K197-T200 WeakPolarHBondContact CA-OG1 3.29Å; K197-T200 PolarHBondContact O-N 2.72Å; K197-T200 PolarHBondContact O-OG1 3.48Å; K197-L201 WeakPolarHBondContact O-CB 3.47Å; K197-L201 VanDerWaalsContact O-CG 3.32Å; K197-L201 WeakPolarHBondContact O-CG 3.3Å; K197-L201 PolarHBondContact O-N 2.86Å
198	L	55.8	Low	51.2	Low	69 Å²	69	93.1 Å²	93.1	36%	0.361	50%	0.497	S	S	.	.	H	α-helix	trans	-59.6	-42	169.8	-80.5	162.3	0	0	0	111.5	I179 I183 I194 Y195 S202	I179-L198 HydrophobicContact CG2-CD2 3.92Å; I183-L198 HydrophobicContact CD1-CD2 4.38Å; I194-L198 HydrophobicContact CG2-CD1 3.74Å; I194-L198 HydrophobicContact CG2-CG 4.38Å; I194-L198 VanDerWaalsContact O-CB 3.32Å; I194-L198 WeakPolarHBondContact O-CB 3.31Å; I194-L198 WeakPolarHBondContact O-CG 3.29Å; I194-L198 PolarHBondContact O-N 2.92Å; Y195-L198 PolarHBondContact O-N 2.72Å; L198-S202 VanDerWaalsContact O-CB 3.23Å; L198-S202 WeakPolarHBondContact O-CB 3.33Å; L198-S202 PolarHBondContact O-N 2.97Å
199	R	55.7	Low	50.3	Low	150 Å²	150	95.6 Å²	95.6	57%	0.566	51%	0.506	S	S	*	.	H	α-helix	trans	-67	-38.9	176	-178.2	-176.4	-86.9	-165.3	-3.3	111.7	Y195 N196 K197 S203	Y195-R199 VanDerWaalsContact O-CB 3.29Å; Y195-R199 WeakPolarHBondContact O-CB 3.29Å; Y195-R199 PolarHBondContact O-N 3.45Å; Y195-R199 PolarHBondContact OH-NH2 3.11Å; N196-R199 PolarHBondContact O-N 3.42Å; K197-R199 VanDerWaalsContact C-N 3.32Å; K197-R199 PolarHBondContact O-N 3.44Å; R199-S203 WeakPolarHBondContact O-CB 3.37Å; R199-S203 PolarHBondContact O-N 3.43Å
200	T	53.9	Low	49.2	Very low	90 Å²	90	92.3 Å²	92.3	55%	0.552	51%	0.506	S	S	*	.	H	α-helix	trans	-68.1	-42.4	176.8	12	0	0	0	0	111.1	N196 K197 S203 E204	N196-T200 PolarHBondContact O-N 3.14Å; N196-T200 PolarHBondContact O-OG1 3.3Å; K197-T200 VanDerWaalsContact CA-OG1 3.29Å; K197-T200 WeakPolarHBondContact CA-OG1 3.29Å; K197-T200 PolarHBondContact O-N 2.72Å; K197-T200 PolarHBondContact O-OG1 3.48Å; T200-S203 CarbonylContact O-C 3.5Å; T200-S203 PolarHBondContact O-N 2.8Å; T200-S203 VanDerWaalsContact O-N 3.12Å; T200-E204 PolarHBondContact O-N 3Å
201	L	51.2	Low	47.7	Very low	68 Å²	68	94.5 Å²	94.5	36%	0.356	52%	0.518	S	S	.	.	H	α-helix	trans	-66.6	-38.5	175.8	-69.1	170.6	0	0	0	112.2	K197 S203 E204 E205	K197-L201 WeakPolarHBondContact O-CB 3.47Å; K197-L201 VanDerWaalsContact O-CG 3.32Å; K197-L201 WeakPolarHBondContact O-CG 3.3Å; K197-L201 PolarHBondContact O-N 2.86Å; L201-S203 VanDerWaalsContact C-N 3.28Å; L201-S203 PolarHBondContact O-N 3.3Å; L201-E204 PolarHBondContact O-N 3.04Å; L201-E205 PolarHBondContact O-N 3.23Å
202	S	50.4	Low	46.6	Very low	67 Å²	67	99.2 Å²	99.2	47%	0.469	54%	0.54	S	S	.	.	H	α-helix	trans	-69	-25.2	171.9	-177.4	0	0	0	0	112.6	L198 E205	L198-S202 VanDerWaalsContact O-CB 3.23Å; L198-S202 WeakPolarHBondContact O-CB 3.33Å; L198-S202 PolarHBondContact O-N 2.97Å; S202-E205 WeakPolarHBondContact O-CB 3.42Å
203	S	48.5	Very low	45.3	Very low	74 Å²	74	104.6 Å²	104.6	52%	0.517	56%	0.556	S	S	.	*	H	α-helix	trans	-82.4	-27.7	171.5	-158.7	0	0	0	0	112.1	R199 T200 L201 V206	R199-S203 WeakPolarHBondContact O-CB 3.37Å; R199-S203 PolarHBondContact O-N 3.43Å; T200-S203 CarbonylContact O-C 3.5Å; T200-S203 PolarHBondContact O-N 2.8Å; T200-S203 VanDerWaalsContact O-N 3.12Å; L201-S203 VanDerWaalsContact C-N 3.28Å; L201-S203 PolarHBondContact O-N 3.3Å; S203-V206 VanDerWaalsContact O-CB 3.31Å; S203-V206 WeakPolarHBondContact O-CB 3.19Å; S203-V206 PolarHBondContact O-N 3.26Å
204	E	46.5	Very low	44.1	Very low	115 Å²	115	111.8 Å²	111.8	54%	0.537	59%	0.585	S	S	.	*	H	α-helix	trans	-71.6	-23.3	171	-162.3	172.6	157.4	0	0	111.5	T200 L201 V206 T207 I208	T200-E204 PolarHBondContact O-N 3Å; L201-E204 PolarHBondContact O-N 3.04Å; E204-V206 PolarHBondContact O-N 3.43Å; E204-T207 CarbonylContact O-C 3.52Å; E204-T207 PolarHBondContact O-N 3.33Å; E204-I208 PolarHBondContact O-N 3.4Å
205	E	47.2	Very low	42.7	Very low	153 Å²	153	115.4 Å²	115.4	72%	0.715	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51	-26.8	162.9	-159.8	179.9	168	0	0	112.1	L201 S202	L201-E205 PolarHBondContact O-N 3.23Å; S202-E205 WeakPolarHBondContact O-CB 3.42Å
206	V	43.7	Very low	41.7	Very low	123 Å²	123	114.6 Å²	114.6	75%	0.745	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-14.1	177.5	-176.1	0	0	0	0	112.7	S203 E204	S203-V206 VanDerWaalsContact O-CB 3.31Å; S203-V206 WeakPolarHBondContact O-CB 3.19Å; S203-V206 PolarHBondContact O-N 3.26Å; E204-V206 PolarHBondContact O-N 3.43Å
207	T	31.7	Very low	40.4	Very low	106 Å²	106	120 Å²	120	65%	0.65	65%	0.651	S	S	*	*			trans	-128	30.7	-173.7	-25.5	0	0	0	0	114.4	E204 K209	E204-T207 CarbonylContact O-C 3.52Å; E204-T207 PolarHBondContact O-N 3.33Å; T207-K209 VanDerWaalsContact C-N 3.26Å; T207-K209 PolarHBondContact O-N 3.08Å
208	I	36.6	Very low	39.2	Very low	130 Å²	130	121.6 Å²	121.6	67%	0.667	67%	0.668	S	S	*	*			trans	-78.2	90	160.2	-56.4	-165.8	0	0	0	109.3	E204 G210	E204-I208 PolarHBondContact O-N 3.4Å; I208-G210 PolarHBondContact O-N 3.41Å
209	K	30.8	Very low	38	Very low	165 Å²	165	126.3 Å²	126.3	72%	0.717	69%	0.688	S	S	*	*			trans	-43	98.7	169.6	-157.8	179.4	-172.2	-173.2	0	113.2	T207 D211	T207-K209 VanDerWaalsContact C-N 3.26Å; T207-K209 PolarHBondContact O-N 3.08Å; K209-D211 VanDerWaalsContact CE-OD2 3.31Å; K209-D211 WeakPolarHBondContact CE-OD2 3.43Å
210	G	32.5	Very low	37	Very low	76 Å²	76	125 Å²	125	78%	0.784	70%	0.699	S	S	*	*			trans	-95.6	78.5	161.2	0	0	0	0	0	110.4	I208 T212	I208-G210 PolarHBondContact O-N 3.41Å; G210-T212 VanDerWaalsContact C-N 3.35Å; G210-T212 PolarHBondContact O-N 3.14Å
211	D	28.1	Very low	35.9	Very low	126 Å²	126	127.4 Å²	127.4	67%	0.674	71%	0.707	S	S	*	*			trans	-63.1	89.6	169.3	-92.6	-42.4	0	0	0	109.7	K209	K209-D211 VanDerWaalsContact CE-OD2 3.31Å; K209-D211 WeakPolarHBondContact CE-OD2 3.43Å
212	T	32	Very low	34.9	Very low	133 Å²	133	128.8 Å²	128.8	82%	0.816	72%	0.722	S	S	*	*			trans	-154.3	110.3	150	-20.2	0	0	0	0	111.2	G210 H214	G210-T212 VanDerWaalsContact C-N 3.35Å; G210-T212 PolarHBondContact O-N 3.14Å; T212-H214 PolarHBondContact O-N 2.86Å
213	K	28.5	Very low	34	Very low	197 Å²	197	133.2 Å²	133.2	86%	0.857	73%	0.733	S	S	*	*			trans	-37	96.2	174	-58.5	169.6	-178.4	179.6	0	113.1
214	H	29.7	Very low	33.2	Very low	179 Å²	179	138.2 Å²	138.2	83%	0.829	75%	0.746	S	S	*	*			trans	-152.4	109.6	147.8	-90	-61.6	0	0	0	108.5	T212 V216	T212-H214 PolarHBondContact O-N 2.86Å; H214-V216 PolarHBondContact O-N 3.4Å
215	A	27.7	Very low	32.7	Very low	111 Å²	111	137.9 Å²	137.9	92%	0.917	76%	0.756	S	S	*	*			trans	-62.4	97.9	174.1	0	0	0	0	0	109.5
216	V	31.7	Very low	32.1	Very low	110 Å²	110	135.5 Å²	135.5	67%	0.667	76%	0.756	S	S	*	*			trans	-126.8	105.8	161.5	179.1	0	0	0	0	105.9	H214 T218	H214-V216 PolarHBondContact O-N 3.4Å; V216-T218 PolarHBondContact O-N 3.31Å; V216-T218 PolarHBondContact O-OG1 3.21Å
217	Q	29.5	Very low	31.6	Very low	196 Å²	196	137 Å²	137	92%	0.916	76%	0.759	S	S	*	*			trans	-49	105.8	169.3	-76	179.3	40.2	0	0	108.3
218	T	31.5	Very low	31.7	Very low	116 Å²	116	136.2 Å²	136.2	71%	0.712	76%	0.758	S	S	*	*			trans	-117	102.9	168.7	-47	0	0	0	0	104.7	V216	V216-T218 PolarHBondContact O-N 3.31Å; V216-T218 PolarHBondContact O-OG1 3.21Å
219	E	29.6	Very low	31.6	Very low	167 Å²	167	135.6 Å²	135.6	78%	0.78	76%	0.76	S	S	*	*			trans	-59	135.5	174.4	-68.4	-148.7	132.1	0	0	109.6	I221	E219-I221 PolarHBondContact O-N 3.44Å; E219-I221 VanDerWaalsContact O-N 3.11Å
220	P	35.5	Very low	31.4	Very low	123 Å²	123	136.4 Å²	136.4	80%	0.799	76%	0.764	S	S	*	*			trans	-69.4	111.9	-175.2	26.7	-32.8	0	0	0	109.9	S222	P220-S222 VanDerWaalsContact C-N 3.31Å; P220-S222 PolarHBondContact O-N 3.35Å
221	I	30.9	Very low	31.6	Very low	141 Å²	141	139 Å²	139	72%	0.723	77%	0.765	S	S	*	*			trans	-66.8	94.4	170.6	-53.6	172	0	0	0	106.9	E219 F223	E219-I221 PolarHBondContact O-N 3.44Å; E219-I221 VanDerWaalsContact O-N 3.11Å; I221-F223 HydrophobicContact CG2-CD2 4.14Å; I221-F223 HydrophobicContact CG2-CE2 3.85Å; I221-F223 PolarHBondContact O-N 3.2Å
222	S	29.5	Very low	31.9	Very low	97 Å²	97	139.2 Å²	139.2	68%	0.678	77%	0.771	S	S	*	*			trans	-66	98.6	179.1	-175.7	0	0	0	0	110.3	P220 K224	P220-S222 VanDerWaalsContact C-N 3.31Å; P220-S222 PolarHBondContact O-N 3.35Å; S222-K224 VanDerWaalsContact C-N 3.29Å; S222-K224 PolarHBondContact O-N 3.02Å; S222-K224 VanDerWaalsContact O-N 3.1Å
223	F	32.3	Very low	32.1	Very low	159 Å²	159	138.6 Å²	138.6	70%	0.697	77%	0.768	S	S	*	*			trans	-79.1	81.2	164.6	-84.6	-91	0	0	0	109	I221 S225	I221-F223 HydrophobicContact CG2-CD2 4.14Å; I221-F223 HydrophobicContact CG2-CE2 3.85Å; I221-F223 PolarHBondContact O-N 3.2Å; F223-S225 VanDerWaalsContact C-N 3.28Å; F223-S225 PolarHBondContact O-N 3.27Å
224	K	31.8	Very low	32.6	Very low	180 Å²	180	135.8 Å²	135.8	78%	0.783	77%	0.768	S	S	*	*			trans	-70.9	86.9	163.5	-97.8	-175.8	174.1	-179.6	0	108.8	S222 S226	S222-K224 VanDerWaalsContact C-N 3.29Å; S222-K224 PolarHBondContact O-N 3.02Å; S222-K224 VanDerWaalsContact O-N 3.1Å; K224-S226 VanDerWaalsContact C-N 3.27Å; K224-S226 PolarHBondContact O-N 3.18Å
225	S	35.5	Very low	32.8	Very low	107 Å²	107	136 Å²	136	75%	0.748	77%	0.77	S	S	*	*			trans	-72.6	86.2	166.3	-62.1	0	0	0	0	108.7	F223 L227	F223-S225 VanDerWaalsContact C-N 3.28Å; F223-S225 PolarHBondContact O-N 3.27Å; S225-L227 PolarHBondContact O-N 3.35Å
226	S	34.7	Very low	33.4	Very low	103 Å²	103	136.6 Å²	136.6	72%	0.72	76%	0.764	S	S	*	*			trans	-67.8	95.3	176.7	-53.2	0	0	0	0	110.2	K224 S228	K224-S226 VanDerWaalsContact C-N 3.27Å; K224-S226 PolarHBondContact O-N 3.18Å; S226-S228 PolarHBondContact O-N 3.48Å; S226-S228 VanDerWaalsContact O-N 3.13Å
227	L	32.8	Very low	33.5	Very low	155 Å²	155	137.1 Å²	137.1	81%	0.812	77%	0.771	S	S	*	*			trans	-79.5	87	172.8	-155.5	150.3	0	0	0	108.3	S225 V229	S225-L227 PolarHBondContact O-N 3.35Å; L227-V229 HydrophobicContact CD2-CG2 3.69Å; L227-V229 PolarHBondContact O-N 3.41Å
228	S	34.3	Very low	33.9	Very low	90 Å²	90	132.4 Å²	132.4	63%	0.629	77%	0.766	S	S	*	*			trans	-80.7	101.2	176	61.7	0	0	0	0	110.2	S226 F230	S226-S228 PolarHBondContact O-N 3.48Å; S226-S228 VanDerWaalsContact O-N 3.13Å; S228-F230 PolarHBondContact O-N 3.29Å
229	V	35.5	Very low	34.4	Very low	117 Å²	117	134.3 Å²	134.3	71%	0.709	77%	0.771	S	S	*	*			trans	-75.6	115.8	168.4	178.9	0	0	0	0	107.8	L227 T231	L227-V229 HydrophobicContact CD2-CG2 3.69Å; L227-V229 PolarHBondContact O-N 3.41Å; V229-T231 PolarHBondContact O-N 3.22Å
230	F	26.8	Very low	34.8	Very low	182 Å²	182	133.4 Å²	133.4	80%	0.798	77%	0.772	S	S	*	*			trans	-80.8	109.5	174.4	-82.6	-93.9	0	0	0	109.8	S228	S228-F230 PolarHBondContact O-N 3.29Å
231	T	35.5	Very low	35	Very low	130 Å²	130	133.6 Å²	133.6	80%	0.798	77%	0.771	S	S	*	*			trans	-83.2	113.4	164.3	16.9	0	0	0	0	109.1	V229	V229-T231 PolarHBondContact O-N 3.22Å
232	V	34.4	Very low	35.5	Very low	131 Å²	131	133 Å²	133	79%	0.794	77%	0.774	S	S	*	*			trans	-71.2	128.5	175.3	175.7	0	0	0	0	109	T234	V232-T234 PolarHBondContact O-N 3.08Å
233	P	35.9	Very low	36.1	Very low	119 Å²	119	135.1 Å²	135.1	77%	0.773	78%	0.778	S	S	*	*			trans	-71.8	123.2	-179.4	-12.7	27.1	0	0	0	111.6	E235	P233-E235 PolarHBondContact O-N 3.42Å
234	T	40	Very low	36.5	Very low	139 Å²	139	134.3 Å²	134.3	85%	0.853	78%	0.78	S	S	*	*			trans	-65.4	108.6	165.2	23.4	0	0	0	0	110	V232	V232-T234 PolarHBondContact O-N 3.08Å
235	E	34.2	Very low	36.6	Very low	183 Å²	183	130.6 Å²	130.6	86%	0.855	78%	0.783	S	S	*	*			trans	-68.5	129.9	165.1	-109.4	-178.2	141.7	0	0	109.6	P233 C237	P233-E235 PolarHBondContact O-N 3.42Å; E235-C237 PolarHBondContact O-N 3.39Å
236	P	39	Very low	36.8	Very low	124 Å²	124	131 Å²	131	81%	0.805	78%	0.781	S	S	*	*			trans	-78.2	114.1	179.3	28.6	-30.2	0	0	0	110.8	A238	P236-A238 PolarHBondContact O-N 3.4Å
237	C	34.9	Very low	37.2	Very low	121 Å²	121	137.4 Å²	137.4	82%	0.818	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-63.3	126.7	170.5	-70.3	0	0	0	0	110.3	E235	E235-C237 PolarHBondContact O-N 3.39Å
238	A	37.8	Very low	37.4	Very low	96 Å²	96	136.5 Å²	136.5	79%	0.793	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-59.3	135.1	179.4	0	0	0	0	0	111.8	P236	P236-A238 PolarHBondContact O-N 3.4Å
239	N	41	Very low	37.6	Very low	156 Å²	156	138.9 Å²	138.9	83%	0.834	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-61.2	130.8	-173.9	-63.7	-25.5	0	0	0	112.8
240	D	39.6	Very low	37.7	Very low	149 Å²	149	140.2 Å²	140.2	80%	0.797	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-56.6	128.2	171.4	-64.8	-54.3	0	0	0	111.7	V242	D240-V242 PolarHBondContact O-N 3.18Å; D240-V242 VanDerWaalsContact O-N 3.12Å
241	T	38.7	Very low	38.3	Very low	127 Å²	127	137.7 Å²	137.7	78%	0.779	82%	0.824	S	S	*	*			trans	-79.1	90	170.7	-19.9	0	0	0	0	107.9	N243	T241-N243 PolarHBondContact O-N 3.34Å
242	V	41	Very low	38.5	Very low	129 Å²	129	138.2 Å²	138.2	78%	0.782	83%	0.826	S	S	*	*			trans	-74.4	96.5	169.4	174.1	0	0	0	0	107.6	D240 D244	D240-V242 PolarHBondContact O-N 3.18Å; D240-V242 VanDerWaalsContact O-N 3.12Å; V242-D244 PolarHBondContact O-N 3.12Å
243	N	41.8	Very low	38.8	Very low	141 Å²	141	138.7 Å²	138.7	75%	0.754	83%	0.828	S	S	*	*			trans	-86.4	98.7	170.4	-70.9	-22.6	0	0	0	109.1	T241	T241-N243 PolarHBondContact O-N 3.34Å
244	D	41.1	Very low	39	Very low	141 Å²	141	140.1 Å²	140.1	75%	0.754	83%	0.832	S	S	*	*			trans	13.6	108.5	143.6	-111.4	-39.7	0	0	0	117	V242 T246	V242-D244 PolarHBondContact O-N 3.12Å; D244-T246 PolarHBondContact OD1-OG1 3.02Å
245	A	34.9	Very low	38.9	Very low	102 Å²	102	140.2 Å²	140.2	84%	0.843	83%	0.83	S	S	*	*			trans	-121.1	91	155.7	0	0	0	0	0	106.7
246	T	38.5	Very low	39.3	Very low	116 Å²	116	136.6 Å²	136.6	71%	0.712	83%	0.828	S	S	*	*			trans	-142.3	103.6	171.2	-11.4	0	0	0	0	110.9	D244	D244-T246 PolarHBondContact OD1-OG1 3.02Å
247	N	43.1	Very low	39.3	Very low	237 Å²	237	137.7 Å²	137.7	100%	1.267	83%	0.83	S	S	*	*			trans	60.5	0	152.4	-132.5	-20.5	0	0	0	119.4

Retrieved 247 of 247 residues in 417.8 ms (Link to these results)

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