A0A5K4FBW8_SCHMA Loading...

Tropomyosin-1

Tropomyosin, in association with the troponin complex, plays a central role in the calcium dependent regulation of muscle contraction.

AlphaFold DB , UniProt , Accession A0A5K4FBW8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 248 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	47.6	Very low	67.9	Low	225 Å²	225	109.5 Å²	109.5	100%	1.108	61%	0.613	S	S	*	*				0	-9.5	0	-67.1	-141.8	-76.9	0	0	114.2
2	S	53.3	Low	69.1	Low	92 Å²	92	111.5 Å²	111.5	64%	0.643	60%	0.604	S	S	*	*			trans	-81.9	-42.1	180	54.5	0	0	0	0	114.6	S4 N5 V6	S2-S4 PolarHBondContact O-N 3.37Å; S2-N5 WeakPolarHBondContact O-CB 3.21Å; S2-N5 PolarHBondContact O-N 3.03Å; S2-V6 PolarHBondContact O-N 3.32Å
3	E	54.9	Low	70.4	Confident	168 Å²	168	111.8 Å²	111.8	79%	0.785	60%	0.596	S	S	*	*	H	α-helix	trans	-65.1	-36.1	-179.8	-74.1	-179	158.2	0	0	113.2	N5 V6 A7	E3-N5 PolarHBondContact O-N 3.07Å; E3-V6 PolarHBondContact O-N 3.43Å; E3-A7 WeakPolarHBondContact O-CB 3.39Å; E3-A7 PolarHBondContact O-N 3.06Å
4	S	58.7	Low	71.5	Confident	85 Å²	85	109.9 Å²	109.9	59%	0.594	59%	0.585	S	S	*	*	H	α-helix	trans	-61.2	-28.7	172.7	-178.7	0	0	0	0	112.2	S2 T8	S2-S4 PolarHBondContact O-N 3.37Å; S4-T8 WeakPolarHBondContact O-CG2 3.34Å; S4-T8 PolarHBondContact O-N 3.26Å; S4-T8 PolarHBondContact O-OG1 2.89Å; S4-T8 VanDerWaalsContact O-OG1 3.07Å
5	N	64.5	Low	72.4	Confident	108 Å²	108	113.1 Å²	113.1	58%	0.578	59%	0.592	S	S	*	*	H	α-helix	trans	-83.9	-34.6	-177.6	-144.2	18.4	0	0	0	111.6	S2 E3 T8 V9	S2-N5 WeakPolarHBondContact O-CB 3.21Å; S2-N5 PolarHBondContact O-N 3.03Å; E3-N5 PolarHBondContact O-N 3.07Å; N5-T8 WeakPolarHBondContact CA-OG1 3.27Å; N5-T8 PolarHBondContact O-OG1 2.89Å; N5-V9 WeakPolarHBondContact O-CB 3.38Å; N5-V9 WeakPolarHBondContact O-CG2 3.16Å; N5-V9 PolarHBondContact O-N 3.25Å
6	V	71.4	Confident	73.4	Confident	95 Å²	95	110.1 Å²	110.1	58%	0.576	57%	0.574	S	S	*	*	H	α-helix	trans	-68.6	-44.1	173.8	-178.8	0	0	0	0	110.5	S2 E3 T8 V9 V10	S2-V6 PolarHBondContact O-N 3.32Å; E3-V6 PolarHBondContact O-N 3.43Å; V6-T8 VanDerWaalsContact C-N 3.32Å; V6-T8 PolarHBondContact O-N 2.89Å; V6-V9 PolarHBondContact O-N 3.2Å; V6-V10 HydrophobicContact CG1-CG2 4.34Å; V6-V10 WeakPolarHBondContact O-CG2 3.48Å; V6-V10 PolarHBondContact O-N 2.96Å
7	A	75.8	Confident	74.1	Confident	55 Å²	55	110.2 Å²	110.2	46%	0.455	57%	0.573	S	S	.	*	H	α-helix	trans	-62.6	-37	178.2	0	0	0	0	0	112.8	E3 K11	E3-A7 WeakPolarHBondContact O-CB 3.39Å; E3-A7 PolarHBondContact O-N 3.06Å; A7-K11 WeakPolarHBondContact O-CB 3.48Å; A7-K11 PolarHBondContact O-N 3.06Å
8	T	76.4	Confident	74.9	Confident	72 Å²	72	113.6 Å²	113.6	44%	0.442	58%	0.577	S	S	.	*	H	α-helix	trans	-71.3	-39.1	175	52.2	0	0	0	0	112.2	S4 N5 V6 R12	S4-T8 WeakPolarHBondContact O-CG2 3.34Å; S4-T8 PolarHBondContact O-N 3.26Å; S4-T8 PolarHBondContact O-OG1 2.89Å; S4-T8 VanDerWaalsContact O-OG1 3.07Å; N5-T8 WeakPolarHBondContact CA-OG1 3.27Å; N5-T8 PolarHBondContact O-OG1 2.89Å; V6-T8 VanDerWaalsContact C-N 3.32Å; V6-T8 PolarHBondContact O-N 2.89Å; T8-R12 VanDerWaalsContact O-CB 3.27Å; T8-R12 WeakPolarHBondContact O-CB 3.44Å; T8-R12 PolarHBondContact O-N 3.39Å
9	V	81.1	Confident	75.7	Confident	67 Å²	67	111.4 Å²	111.4	41%	0.406	57%	0.57	S	S	.	*	H	α-helix	trans	-63.1	-45.9	174.5	171.6	0	0	0	0	111.1	N5 V6 R12 K13	N5-V9 WeakPolarHBondContact O-CB 3.38Å; N5-V9 WeakPolarHBondContact O-CG2 3.16Å; N5-V9 PolarHBondContact O-N 3.25Å; V6-V9 PolarHBondContact O-N 3.2Å; V9-R12 PolarHBondContact O-N 2.78Å; V9-K13 WeakPolarHBondContact O-CB 3.46Å; V9-K13 PolarHBondContact O-N 3.15Å
10	V	80.4	Confident	76.4	Confident	75 Å²	75	111.8 Å²	111.8	46%	0.455	57%	0.569	S	S	.	*	H	α-helix	trans	-65.2	-45.3	177.4	173.3	0	0	0	0	111	V6 R12 K13 I14	V6-V10 HydrophobicContact CG1-CG2 4.34Å; V6-V10 WeakPolarHBondContact O-CG2 3.48Å; V6-V10 PolarHBondContact O-N 2.96Å; V10-R12 VanDerWaalsContact C-N 3.3Å; V10-R12 PolarHBondContact O-N 3.4Å; V10-K13 PolarHBondContact O-N 2.92Å; V10-I14 HydrophobicContact CG1-CD1 3.72Å; V10-I14 HydrophobicContact CG1-CG1 4.28Å; V10-I14 WeakPolarHBondContact O-CB 3.32Å; V10-I14 VanDerWaalsContact O-CG1 3.31Å; V10-I14 WeakPolarHBondContact O-CG1 3.46Å; V10-I14 PolarHBondContact O-N 3.46Å
11	K	82.4	Confident	77	Confident	162 Å²	162	111.2 Å²	111.2	70%	0.704	57%	0.567	S	S	*	*	H	α-helix	trans	-58	-42.4	174.2	-91.2	-177.1	175.6	177.2	0	111.9	A7 K15	A7-K11 WeakPolarHBondContact O-CB 3.48Å; A7-K11 PolarHBondContact O-N 3.06Å; K11-K15 VanDerWaalsContact O-CB 3.32Å; K11-K15 WeakPolarHBondContact O-CB 3.37Å; K11-K15 PolarHBondContact O-N 2.84Å
12	R	83.4	Confident	79.1	Confident	134 Å²	134	106.2 Å²	106.2	51%	0.506	54%	0.541	S	S	.	.	H	α-helix	trans	-64.7	-45	176.8	179.2	171	53.4	87	-2.8	111.3	T8 V9 V10 K15 E16	T8-R12 VanDerWaalsContact O-CB 3.27Å; T8-R12 WeakPolarHBondContact O-CB 3.44Å; T8-R12 PolarHBondContact O-N 3.39Å; V9-R12 PolarHBondContact O-N 2.78Å; V10-R12 VanDerWaalsContact C-N 3.3Å; V10-R12 PolarHBondContact O-N 3.4Å; R12-K15 CarbonylContact O-C 3.59Å; R12-K15 WeakPolarHBondContact O-CB 3.46Å; R12-K15 PolarHBondContact O-N 3.31Å; R12-K15 VanDerWaalsContact O-N 3.15Å; R12-E16 HydrophobicContact CG-CG 4.42Å; R12-E16 WeakPolarHBondContact CG-OE1 3.33Å; R12-E16 IonicContact NH1-OE1 2.65Å; R12-E16 PolarHBondContact NH1-OE1 3.27Å; R12-E16 VanDerWaalsContact NH1-OE1 3.08Å; R12-E16 WeakPolarHBondContact O-CB 3.45Å; R12-E16 WeakPolarHBondContact O-CG 3.31Å; R12-E16 PolarHBondContact O-N 2.85Å
13	K	85	Confident	80.9	Confident	115 Å²	115	109 Å²	109	50%	0.5	54%	0.541	S	S	.	.	H	α-helix	trans	-64.2	-41.4	177.4	-161.3	72.5	-175.7	165.5	0	112.3	V9 V10 K15 E16 M17	V9-K13 WeakPolarHBondContact O-CB 3.46Å; V9-K13 PolarHBondContact O-N 3.15Å; V10-K13 PolarHBondContact O-N 2.92Å; K13-K15 VanDerWaalsContact C-N 3.3Å; K13-K15 PolarHBondContact O-N 3.37Å; K13-E16 IonicContact NZ-OE2 3.89Å; K13-E16 PolarHBondContact O-N 3.08Å; K13-M17 HydrophobicContact CG-SD 4.47Å; K13-M17 VanDerWaalsContact O-CB 3.31Å; K13-M17 WeakPolarHBondContact O-CB 3.36Å; K13-M17 VanDerWaalsContact O-CG 3.23Å; K13-M17 WeakPolarHBondContact O-CG 3.43Å; K13-M17 PolarHBondContact O-N 2.83Å
14	I	86	Confident	82.7	Confident	86 Å²	86	106.2 Å²	106.2	44%	0.441	53%	0.531	S	S	.	.	H	α-helix	trans	-62.4	-39.5	172.7	-70	170.8	0	0	0	110.6	V10 R18	V10-I14 HydrophobicContact CG1-CD1 3.72Å; V10-I14 HydrophobicContact CG1-CG1 4.28Å; V10-I14 WeakPolarHBondContact O-CB 3.32Å; V10-I14 VanDerWaalsContact O-CG1 3.31Å; V10-I14 WeakPolarHBondContact O-CG1 3.46Å; V10-I14 PolarHBondContact O-N 3.46Å; I14-R18 WeakPolarHBondContact O-CB 3.38Å; I14-R18 WeakPolarHBondContact O-CG 3.34Å; I14-R18 PolarHBondContact O-N 2.76Å
15	K	86	Confident	84.3	Confident	157 Å²	157	107.4 Å²	107.4	68%	0.683	53%	0.527	S	S	*	.	H	α-helix	trans	-67.8	-45.8	177.6	-148.4	-179.8	-173.3	-171.5	0	111.2	K11 R12 K13 R18 T19	K11-K15 VanDerWaalsContact O-CB 3.32Å; K11-K15 WeakPolarHBondContact O-CB 3.37Å; K11-K15 PolarHBondContact O-N 2.84Å; R12-K15 CarbonylContact O-C 3.59Å; R12-K15 WeakPolarHBondContact O-CB 3.46Å; R12-K15 PolarHBondContact O-N 3.31Å; R12-K15 VanDerWaalsContact O-N 3.15Å; K13-K15 VanDerWaalsContact C-N 3.3Å; K13-K15 PolarHBondContact O-N 3.37Å; K15-R18 PolarHBondContact O-N 3.23Å; K15-T19 PolarHBondContact O-N 3.18Å; K15-T19 PolarHBondContact O-OG1 3.24Å
16	E	87.1	Confident	85.6	Confident	66 Å²	66	108.6 Å²	108.6	31%	0.308	53%	0.528	S	S	.	.	H	α-helix	trans	-55.7	-51.6	172.6	-76.2	168.8	-164.6	0	0	110.6	R12 K13 R18 T19 E20	R12-E16 HydrophobicContact CG-CG 4.42Å; R12-E16 WeakPolarHBondContact CG-OE1 3.33Å; R12-E16 IonicContact NH1-OE1 2.65Å; R12-E16 PolarHBondContact NH1-OE1 3.27Å; R12-E16 VanDerWaalsContact NH1-OE1 3.08Å; R12-E16 WeakPolarHBondContact O-CB 3.45Å; R12-E16 WeakPolarHBondContact O-CG 3.31Å; R12-E16 PolarHBondContact O-N 2.85Å; K13-E16 IonicContact NZ-OE2 3.89Å; K13-E16 PolarHBondContact O-N 3.08Å; E16-R18 VanDerWaalsContact C-N 3.33Å; E16-R18 PolarHBondContact O-N 2.84Å; E16-T19 VanDerWaalsContact CA-OG1 3.32Å; E16-T19 WeakPolarHBondContact CA-OG1 3.43Å; E16-T19 PolarHBondContact O-N 2.93Å; E16-T19 PolarHBondContact O-OG1 2.86Å; E16-E20 PolarHBondContact O-N 2.84Å
17	M	86.8	Confident	86.7	Confident	112 Å²	112	108.2 Å²	108.2	55%	0.552	52%	0.522	S	S	*	.	H	α-helix	trans	-61.5	-37.5	177	-74.2	178.4	70.9	0	0	112.4	K13 E20 L21	K13-M17 HydrophobicContact CG-SD 4.47Å; K13-M17 VanDerWaalsContact O-CB 3.31Å; K13-M17 WeakPolarHBondContact O-CB 3.36Å; K13-M17 VanDerWaalsContact O-CG 3.23Å; K13-M17 WeakPolarHBondContact O-CG 3.43Å; K13-M17 PolarHBondContact O-N 2.83Å; M17-E20 PolarHBondContact O-N 2.81Å; M17-L21 VanDerWaalsContact O-CB 3.25Å; M17-L21 WeakPolarHBondContact O-CB 3.47Å; M17-L21 PolarHBondContact O-N 3.46Å
18	R	87.9	Confident	87.5	Confident	171 Å²	171	110.3 Å²	110.3	65%	0.645	53%	0.529	S	S	*	.	H	α-helix	trans	-64.8	-45	173.9	-82.6	-177.4	179.8	-162.4	-0.9	111.5	I14 K15 E16 L21 E22	I14-R18 WeakPolarHBondContact O-CB 3.38Å; I14-R18 WeakPolarHBondContact O-CG 3.34Å; I14-R18 PolarHBondContact O-N 2.76Å; K15-R18 PolarHBondContact O-N 3.23Å; E16-R18 VanDerWaalsContact C-N 3.33Å; E16-R18 PolarHBondContact O-N 2.84Å; R18-L21 PolarHBondContact O-N 2.86Å; R18-E22 WeakPolarHBondContact O-CB 3.25Å; R18-E22 WeakPolarHBondContact O-CG 3.33Å; R18-E22 PolarHBondContact O-N 2.95Å
19	T	89.1	Confident	88.3	Confident	72 Å²	72	112 Å²	112	44%	0.442	54%	0.535	S	S	.	.	H	α-helix	trans	-65.1	-36.2	175.1	30	0	0	0	0	113	K15 E16 K23	K15-T19 PolarHBondContact O-N 3.18Å; K15-T19 PolarHBondContact O-OG1 3.24Å; E16-T19 VanDerWaalsContact CA-OG1 3.32Å; E16-T19 WeakPolarHBondContact CA-OG1 3.43Å; E16-T19 PolarHBondContact O-N 2.93Å; E16-T19 PolarHBondContact O-OG1 2.86Å; T19-K23 WeakPolarHBondContact O-CB 3.32Å; T19-K23 WeakPolarHBondContact O-CG 3.38Å; T19-K23 PolarHBondContact O-N 3.4Å
20	E	90	Very high	88.9	Confident	118 Å²	118	110.9 Å²	110.9	55%	0.551	53%	0.528	S	S	*	.	H	α-helix	trans	-66.5	-41.7	172.3	-83.8	175.3	172.3	0	0	111.3	E16 M17 K23 L24	E16-E20 PolarHBondContact O-N 2.84Å; M17-E20 PolarHBondContact O-N 2.81Å; E20-K23 PolarHBondContact O-N 2.84Å; E20-L24 WeakPolarHBondContact O-CB 3.23Å; E20-L24 WeakPolarHBondContact O-CG 3.31Å; E20-L24 PolarHBondContact O-N 3.35Å
21	L	90.1	Very high	89.6	Confident	101 Å²	101	113.1 Å²	113.1	53%	0.529	53%	0.533	S	S	.	.	H	α-helix	trans	-64	-42.6	176.6	-162.3	107.1	0	0	0	111.3	M17 R18 L24 Q25	M17-L21 VanDerWaalsContact O-CB 3.25Å; M17-L21 WeakPolarHBondContact O-CB 3.47Å; M17-L21 PolarHBondContact O-N 3.46Å; R18-L21 PolarHBondContact O-N 2.86Å; L21-L24 PolarHBondContact O-N 2.93Å; L21-Q25 VanDerWaalsContact O-CB 3.31Å; L21-Q25 WeakPolarHBondContact O-CB 3.24Å; L21-Q25 VanDerWaalsContact O-CG 3.24Å; L21-Q25 WeakPolarHBondContact O-CG 3.31Å; L21-Q25 PolarHBondContact O-N 3.43Å
22	E	90.5	Very high	90.1	Very high	120 Å²	120	108.6 Å²	108.6	56%	0.561	52%	0.517	S	S	*	.	H	α-helix	trans	-64.2	-41.3	175.1	-76.8	170.1	-171.2	0	0	111.7	R18 Q25 F26	R18-E22 WeakPolarHBondContact O-CB 3.25Å; R18-E22 WeakPolarHBondContact O-CG 3.33Å; R18-E22 PolarHBondContact O-N 2.95Å; E22-Q25 PolarHBondContact O-N 2.84Å; E22-F26 WeakPolarHBondContact O-CB 3.46Å; E22-F26 PolarHBondContact O-N 3.47Å
23	K	92	Very high	90.7	Very high	149 Å²	149	107.6 Å²	107.6	65%	0.648	52%	0.518	S	S	*	.	H	α-helix	trans	-63	-49.7	173.6	-81.2	-176.2	176.6	-171.6	0	112	T19 E20 Q25 F26 D27	T19-K23 WeakPolarHBondContact O-CB 3.32Å; T19-K23 WeakPolarHBondContact O-CG 3.38Å; T19-K23 PolarHBondContact O-N 3.4Å; E20-K23 PolarHBondContact O-N 2.84Å; K23-Q25 VanDerWaalsContact C-N 3.27Å; K23-Q25 PolarHBondContact O-N 2.89Å; K23-F26 WeakPolarHBondContact O-CB 3.38Å; K23-F26 PolarHBondContact O-N 3.22Å; K23-F26 VanDerWaalsContact O-N 3.12Å; K23-D27 WeakPolarHBondContact O-CB 3.44Å; K23-D27 PolarHBondContact O-N 3.37Å
24	L	91.9	Very high	91.1	Very high	110 Å²	110	106.5 Å²	106.5	58%	0.576	52%	0.516	S	S	*	.	H	α-helix	trans	-61.5	-37.4	177.3	-74.5	169.3	0	0	0	111.6	E20 L21 D27 V28	E20-L24 WeakPolarHBondContact O-CB 3.23Å; E20-L24 WeakPolarHBondContact O-CG 3.31Å; E20-L24 PolarHBondContact O-N 3.35Å; L21-L24 PolarHBondContact O-N 2.93Å; L24-D27 PolarHBondContact O-N 2.85Å; L24-V28 VanDerWaalsContact O-CB 3.3Å; L24-V28 WeakPolarHBondContact O-CB 3.23Å; L24-V28 WeakPolarHBondContact O-CG2 3.32Å; L24-V28 PolarHBondContact O-N 2.89Å
25	Q	92.8	Very high	91.5	Very high	111 Å²	111	107.3 Å²	107.3	52%	0.519	52%	0.521	S	S	.	.	H	α-helix	trans	-63.6	-43.7	173.6	-81.3	177.9	-6.7	0	0	111.7	L21 E22 K23 I29	L21-Q25 VanDerWaalsContact O-CB 3.31Å; L21-Q25 WeakPolarHBondContact O-CB 3.24Å; L21-Q25 VanDerWaalsContact O-CG 3.24Å; L21-Q25 WeakPolarHBondContact O-CG 3.31Å; L21-Q25 PolarHBondContact O-N 3.43Å; E22-Q25 PolarHBondContact O-N 2.84Å; K23-Q25 VanDerWaalsContact C-N 3.27Å; K23-Q25 PolarHBondContact O-N 2.89Å; Q25-I29 WeakPolarHBondContact O-CD1 3.33Å; Q25-I29 VanDerWaalsContact O-CG1 3.23Å; Q25-I29 WeakPolarHBondContact O-CG1 3.47Å; Q25-I29 PolarHBondContact O-N 3.49Å
26	F	92	Very high	91.9	Very high	133 Å²	133	107.6 Å²	107.6	58%	0.583	52%	0.518	S	S	*	.	H	α-helix	trans	-62.9	-48.3	175.3	-177.1	-95.7	0	0	0	111.4	E22 K23 V28 I29 T30	E22-F26 WeakPolarHBondContact O-CB 3.46Å; E22-F26 PolarHBondContact O-N 3.47Å; K23-F26 WeakPolarHBondContact O-CB 3.38Å; K23-F26 PolarHBondContact O-N 3.22Å; K23-F26 VanDerWaalsContact O-N 3.12Å; F26-V28 VanDerWaalsContact C-N 3.32Å; F26-V28 PolarHBondContact O-N 3.39Å; F26-I29 PolarHBondContact O-N 3.11Å; F26-I29 VanDerWaalsContact O-N 3.11Å; F26-T30 HydrophobicContact CD1-CG2 4.06Å; F26-T30 HydrophobicContact CE1-CG2 3.6Å; F26-T30 HydrophobicContact CE2-CG2 4.29Å; F26-T30 HydrophobicContact CZ-CG2 3.73Å; F26-T30 PolarHBondContact O-N 3.05Å; F26-T30 PolarHBondContact O-OG1 3.12Å
27	D	93.5	Very high	92.3	Very high	86 Å²	86	109.9 Å²	109.9	46%	0.46	53%	0.529	S	S	.	.	H	α-helix	trans	-59.5	-42.5	179	-65.4	-18.6	0	0	0	111.2	K23 L24 T30 E31	K23-D27 WeakPolarHBondContact O-CB 3.44Å; K23-D27 PolarHBondContact O-N 3.37Å; L24-D27 PolarHBondContact O-N 2.85Å; D27-T30 VanDerWaalsContact CA-OG1 3.32Å; D27-T30 WeakPolarHBondContact CA-OG1 3.14Å; D27-T30 PolarHBondContact O-N 2.8Å; D27-T30 PolarHBondContact O-OG1 2.75Å; D27-E31 VanDerWaalsContact O-CB 3.29Å; D27-E31 WeakPolarHBondContact O-CB 3.3Å; D27-E31 PolarHBondContact O-N 2.93Å
28	V	93.9	Very high	92.7	Very high	99 Å²	99	110.4 Å²	110.4	60%	0.6	53%	0.53	S	S	*	.	H	α-helix	trans	-63.1	-41.2	175.3	166.9	0	0	0	0	111.6	L24 F26 D32	L24-V28 VanDerWaalsContact O-CB 3.3Å; L24-V28 WeakPolarHBondContact O-CB 3.23Å; L24-V28 WeakPolarHBondContact O-CG2 3.32Å; L24-V28 PolarHBondContact O-N 2.89Å; F26-V28 VanDerWaalsContact C-N 3.32Å; F26-V28 PolarHBondContact O-N 3.39Å; V28-D32 WeakPolarHBondContact O-CB 3.33Å; V28-D32 PolarHBondContact O-N 3.01Å
29	I	93.8	Very high	93	Very high	109 Å²	109	104.1 Å²	104.1	56%	0.559	51%	0.511	S	S	*	.	H	α-helix	trans	-66.4	-44.1	177.4	-69	164.4	0	0	0	110.5	Q25 F26 D32 E33	Q25-I29 WeakPolarHBondContact O-CD1 3.33Å; Q25-I29 VanDerWaalsContact O-CG1 3.23Å; Q25-I29 WeakPolarHBondContact O-CG1 3.47Å; Q25-I29 PolarHBondContact O-N 3.49Å; F26-I29 PolarHBondContact O-N 3.11Å; F26-I29 VanDerWaalsContact O-N 3.11Å; I29-D32 PolarHBondContact O-N 3.49Å; I29-E33 PolarHBondContact O-N 2.96Å
30	T	93.1	Very high	93.3	Very high	43 Å²	43	103.3 Å²	103.3	26%	0.264	51%	0.511	S	S	.	.	H	α-helix	trans	-65.6	-40.3	178.7	51.6	0	0	0	0	112.1	F26 D27 E33 I34	F26-T30 HydrophobicContact CD1-CG2 4.06Å; F26-T30 HydrophobicContact CE1-CG2 3.6Å; F26-T30 HydrophobicContact CE2-CG2 4.29Å; F26-T30 HydrophobicContact CZ-CG2 3.73Å; F26-T30 PolarHBondContact O-N 3.05Å; F26-T30 PolarHBondContact O-OG1 3.12Å; D27-T30 VanDerWaalsContact CA-OG1 3.32Å; D27-T30 WeakPolarHBondContact CA-OG1 3.14Å; D27-T30 PolarHBondContact O-N 2.8Å; D27-T30 PolarHBondContact O-OG1 2.75Å; T30-E33 PolarHBondContact O-N 3.38Å; T30-I34 WeakPolarHBondContact O-CG1 3.22Å; T30-I34 PolarHBondContact O-N 3.17Å
31	E	94	Very high	93.6	Very high	121 Å²	121	102.8 Å²	102.8	57%	0.565	51%	0.511	S	S	*	.	H	α-helix	trans	-69.8	-36.9	178.4	-161.1	68.1	-167.7	0	0	111.2	D27 E33 I34 L35	D27-E31 VanDerWaalsContact O-CB 3.29Å; D27-E31 WeakPolarHBondContact O-CB 3.3Å; D27-E31 PolarHBondContact O-N 2.93Å; E31-E33 VanDerWaalsContact C-N 3.32Å; E31-E33 PolarHBondContact O-N 2.87Å; E31-I34 PolarHBondContact O-N 2.97Å; E31-L35 VanDerWaalsContact O-CB 3.24Å; E31-L35 WeakPolarHBondContact O-CB 3.38Å; E31-L35 PolarHBondContact O-N 3.41Å
32	D	94.5	Very high	93.9	Very high	68 Å²	68	104.2 Å²	104.2	36%	0.364	51%	0.51	S	S	.	.	H	α-helix	trans	-64.2	-37.5	173.1	-166.5	62	0	0	0	111.5	V28 I29 R36	V28-D32 WeakPolarHBondContact O-CB 3.33Å; V28-D32 PolarHBondContact O-N 3.01Å; I29-D32 PolarHBondContact O-N 3.49Å; D32-R36 WeakPolarHBondContact O-CB 3.37Å; D32-R36 WeakPolarHBondContact O-CG 3.24Å; D32-R36 PolarHBondContact O-N 3.36Å; D32-R36 IonicContact OD2-CZ 3.34Å; D32-R36 IonicContact OD2-NE 3.82Å; D32-R36 PolarHBondContact OD2-NE 3.32Å; D32-R36 IonicContact OD2-NH2 2.67Å; D32-R36 PolarHBondContact OD2-NH2 3.42Å
33	E	94.1	Very high	94.1	Very high	112 Å²	112	104.3 Å²	104.3	52%	0.523	51%	0.51	S	S	.	.	H	α-helix	trans	-68.2	-43.1	175.6	-169	167.7	-170.2	0	0	112.2	I29 T30 E31 R36 Q37	I29-E33 PolarHBondContact O-N 2.96Å; T30-E33 PolarHBondContact O-N 3.38Å; E31-E33 VanDerWaalsContact C-N 3.32Å; E31-E33 PolarHBondContact O-N 2.87Å; E33-R36 PolarHBondContact O-N 3Å; E33-Q37 WeakPolarHBondContact O-CG 3.43Å; E33-Q37 PolarHBondContact O-N 3.4Å
34	I	94.7	Very high	94.3	Very high	92 Å²	92	103.2 Å²	103.2	47%	0.472	51%	0.506	S	S	.	.	H	α-helix	trans	-61.4	-46.2	173.3	-68.9	162.7	0	0	0	110.4	T30 E31 R36 Q37 E38	T30-I34 WeakPolarHBondContact O-CG1 3.22Å; T30-I34 PolarHBondContact O-N 3.17Å; E31-I34 PolarHBondContact O-N 2.97Å; I34-R36 VanDerWaalsContact C-N 3.31Å; I34-R36 PolarHBondContact O-N 2.94Å; I34-Q37 PolarHBondContact O-N 2.83Å; I34-Q37 VanDerWaalsContact O-N 3.17Å; I34-E38 WeakPolarHBondContact O-CB 3.29Å; I34-E38 PolarHBondContact O-N 3.33Å
35	L	94.7	Very high	94.5	Very high	103 Å²	103	100.3 Å²	100.3	54%	0.539	50%	0.497	S	S	.	.	H	α-helix	trans	-60.1	-43.1	178.7	-173.8	69.5	0	0	0	110.9	E31 E38 T39	E31-L35 VanDerWaalsContact O-CB 3.24Å; E31-L35 WeakPolarHBondContact O-CB 3.38Å; E31-L35 PolarHBondContact O-N 3.41Å; L35-E38 PolarHBondContact O-N 2.94Å; L35-T39 WeakPolarHBondContact O-CB 3.37Å; L35-T39 VanDerWaalsContact O-CG2 3.27Å; L35-T39 WeakPolarHBondContact O-CG2 3.41Å; L35-T39 PolarHBondContact O-N 3.29Å; L35-T39 PolarHBondContact O-OG1 2.81Å; L35-T39 VanDerWaalsContact O-OG1 3.09Å
36	R	94.3	Very high	94.7	Very high	163 Å²	163	100.3 Å²	100.3	62%	0.615	50%	0.497	S	S	*	.	H	α-helix	trans	-61.2	-44.8	174.8	-75.2	174.6	-166.6	-160	6	112	D32 E33 I34 T39 A40	D32-R36 WeakPolarHBondContact O-CB 3.37Å; D32-R36 WeakPolarHBondContact O-CG 3.24Å; D32-R36 PolarHBondContact O-N 3.36Å; D32-R36 IonicContact OD2-CZ 3.34Å; D32-R36 IonicContact OD2-NE 3.82Å; D32-R36 PolarHBondContact OD2-NE 3.32Å; D32-R36 IonicContact OD2-NH2 2.67Å; D32-R36 PolarHBondContact OD2-NH2 3.42Å; E33-R36 PolarHBondContact O-N 3Å; I34-R36 VanDerWaalsContact C-N 3.31Å; I34-R36 PolarHBondContact O-N 2.94Å; R36-T39 WeakPolarHBondContact CA-OG1 3.44Å; R36-T39 PolarHBondContact O-N 2.98Å; R36-T39 PolarHBondContact O-OG1 3.09Å; R36-A40 WeakPolarHBondContact O-CB 3.27Å; R36-A40 PolarHBondContact O-N 3.43Å
37	Q	94.6	Very high	94.9	Very high	115 Å²	115	96.9 Å²	96.9	54%	0.537	49%	0.493	S	S	.	.	H	α-helix	trans	-62	-45.4	177	-71.1	178.1	13.8	0	0	111.8	E33 I34 A40 L41	E33-Q37 WeakPolarHBondContact O-CG 3.43Å; E33-Q37 PolarHBondContact O-N 3.4Å; I34-Q37 PolarHBondContact O-N 2.83Å; I34-Q37 VanDerWaalsContact O-N 3.17Å; Q37-A40 PolarHBondContact O-N 2.87Å; Q37-L41 WeakPolarHBondContact O-CG 3.48Å; Q37-L41 PolarHBondContact O-N 2.87Å
38	E	94.9	Very high	95	Very high	122 Å²	122	97.9 Å²	97.9	57%	0.57	50%	0.495	S	S	*	.	H	α-helix	trans	-64	-42.6	178.3	-173.2	61.3	-158.9	0	0	111.5	I34 L35 A40 L41 R42	I34-E38 WeakPolarHBondContact O-CB 3.29Å; I34-E38 PolarHBondContact O-N 3.33Å; L35-E38 PolarHBondContact O-N 2.94Å; E38-A40 PolarHBondContact O-N 2.86Å; E38-L41 PolarHBondContact O-N 3.39Å; E38-R42 WeakPolarHBondContact O-CB 3.49Å; E38-R42 PolarHBondContact O-N 3.46Å
39	T	95.3	Very high	95.2	Very high	40 Å²	40	97.6 Å²	97.6	25%	0.245	49%	0.494	C	S	.	.	H	α-helix	trans	-62.6	-40.8	175.1	55.6	0	0	0	0	112.3	L35 R36 R42 E43	L35-T39 WeakPolarHBondContact O-CB 3.37Å; L35-T39 VanDerWaalsContact O-CG2 3.27Å; L35-T39 WeakPolarHBondContact O-CG2 3.41Å; L35-T39 PolarHBondContact O-N 3.29Å; L35-T39 PolarHBondContact O-OG1 2.81Å; L35-T39 VanDerWaalsContact O-OG1 3.09Å; R36-T39 WeakPolarHBondContact CA-OG1 3.44Å; R36-T39 PolarHBondContact O-N 2.98Å; R36-T39 PolarHBondContact O-OG1 3.09Å; T39-R42 PolarHBondContact O-N 2.88Å; T39-E43 WeakPolarHBondContact O-CB 3.48Å; T39-E43 WeakPolarHBondContact O-CG 3.4Å; T39-E43 PolarHBondContact O-N 3.31Å
40	A	95.5	Very high	95.4	Very high	54 Å²	54	94.6 Å²	94.6	45%	0.446	49%	0.485	S	S	.	.	H	α-helix	trans	-66.3	-39.2	176.8	0	0	0	0	0	112.4	R36 Q37 E38 K44	R36-A40 WeakPolarHBondContact O-CB 3.27Å; R36-A40 PolarHBondContact O-N 3.43Å; Q37-A40 PolarHBondContact O-N 2.87Å; E38-A40 PolarHBondContact O-N 2.86Å; A40-K44 WeakPolarHBondContact O-CB 3.34Å; A40-K44 PolarHBondContact O-N 3.04Å
41	L	95.7	Very high	95.6	Very high	108 Å²	108	95.2 Å²	95.2	57%	0.565	49%	0.494	S	S	*	.	H	α-helix	trans	-65.8	-42.5	173.9	-73.4	174.7	0	0	0	111.7	Q37 E38 K44 A45	Q37-L41 WeakPolarHBondContact O-CG 3.48Å; Q37-L41 PolarHBondContact O-N 2.87Å; E38-L41 PolarHBondContact O-N 3.39Å; L41-K44 PolarHBondContact O-N 3.38Å; L41-A45 WeakPolarHBondContact O-CB 3.32Å; L41-A45 PolarHBondContact O-N 2.79Å
42	R	96	Very high	95.7	Very high	131 Å²	131	95.4 Å²	95.4	49%	0.494	50%	0.497	S	S	.	.	H	α-helix	trans	-61.4	-47.6	175.7	-172.7	-175.2	69.4	-151.2	-4.6	111.3	E38 T39 K44 A45 E46	E38-R42 WeakPolarHBondContact O-CB 3.49Å; E38-R42 PolarHBondContact O-N 3.46Å; T39-R42 PolarHBondContact O-N 2.88Å; R42-K44 VanDerWaalsContact C-N 3.29Å; R42-K44 PolarHBondContact O-N 2.88Å; R42-A45 PolarHBondContact O-N 3.35Å; R42-E46 WeakPolarHBondContact CD-OE1 3.44Å; R42-E46 HydrophobicContact CG-CG 4.34Å; R42-E46 WeakPolarHBondContact CG-OE1 3.45Å; R42-E46 IonicContact NE-OE1 3.08Å; R42-E46 WeakPolarHBondContact O-CB 3.46Å; R42-E46 WeakPolarHBondContact O-CG 3.25Å; R42-E46 PolarHBondContact O-N 3.18Å
43	E	95.9	Very high	95.9	Very high	121 Å²	121	96.3 Å²	96.3	57%	0.565	51%	0.505	S	S	*	.	H	α-helix	trans	-59.7	-40.1	176.9	-76	176.2	-178	0	0	111.7	T39 A47	T39-E43 WeakPolarHBondContact O-CB 3.48Å; T39-E43 WeakPolarHBondContact O-CG 3.4Å; T39-E43 PolarHBondContact O-N 3.31Å; E43-A47 WeakPolarHBondContact O-CB 3.36Å; E43-A47 PolarHBondContact O-N 2.93Å
44	K	96	Very high	96	Very high	127 Å²	127	99.8 Å²	99.8	55%	0.552	51%	0.513	S	S	*	.	H	α-helix	trans	-64.2	-46	174.2	-174.3	-177.5	174.7	-170.6	0	111.9	A40 L41 R42 A47 E48	A40-K44 WeakPolarHBondContact O-CB 3.34Å; A40-K44 PolarHBondContact O-N 3.04Å; L41-K44 PolarHBondContact O-N 3.38Å; R42-K44 VanDerWaalsContact C-N 3.29Å; R42-K44 PolarHBondContact O-N 2.88Å; K44-A47 PolarHBondContact O-N 3.49Å; K44-E48 VanDerWaalsContact CE-OE1 3.25Å; K44-E48 WeakPolarHBondContact CE-OE1 3.41Å; K44-E48 WeakPolarHBondContact O-CG 3.31Å; K44-E48 PolarHBondContact O-N 2.95Å
45	A	95.7	Very high	96.2	Very high	48 Å²	48	101.7 Å²	101.7	40%	0.397	51%	0.514	S	S	.	.	H	α-helix	trans	-64.5	-41	177.9	0	0	0	0	0	111.9	L41 R42 A47 E48 V49	L41-A45 WeakPolarHBondContact O-CB 3.32Å; L41-A45 PolarHBondContact O-N 2.79Å; R42-A45 PolarHBondContact O-N 3.35Å; A45-A47 VanDerWaalsContact C-N 3.34Å; A45-A47 PolarHBondContact O-N 3.31Å; A45-E48 PolarHBondContact O-N 2.83Å; A45-V49 VanDerWaalsContact O-CG2 3.31Å; A45-V49 WeakPolarHBondContact O-CG2 3.4Å; A45-V49 PolarHBondContact O-N 3.26Å
46	E	95.9	Very high	96.3	Very high	112 Å²	112	101.1 Å²	101.1	52%	0.523	51%	0.511	S	S	.	.	H	α-helix	trans	-62.2	-40.7	174.5	-75.6	175.5	-170.9	0	0	111.4	R42 V49 A50	R42-E46 WeakPolarHBondContact CD-OE1 3.44Å; R42-E46 HydrophobicContact CG-CG 4.34Å; R42-E46 WeakPolarHBondContact CG-OE1 3.45Å; R42-E46 IonicContact NE-OE1 3.08Å; R42-E46 WeakPolarHBondContact O-CB 3.46Å; R42-E46 WeakPolarHBondContact O-CG 3.25Å; R42-E46 PolarHBondContact O-N 3.18Å; E46-V49 PolarHBondContact O-N 3.2Å; E46-A50 WeakPolarHBondContact O-CB 3.33Å; E46-A50 PolarHBondContact O-N 2.94Å
47	A	96.4	Very high	96.5	Very high	61 Å²	61	101.2 Å²	101.2	50%	0.504	51%	0.511	S	S	.	.	H	α-helix	trans	-65.1	-40.6	174	0	0	0	0	0	112.4	E43 K44 A45 A50 A51	E43-A47 WeakPolarHBondContact O-CB 3.36Å; E43-A47 PolarHBondContact O-N 2.93Å; K44-A47 PolarHBondContact O-N 3.49Å; A45-A47 VanDerWaalsContact C-N 3.34Å; A45-A47 PolarHBondContact O-N 3.31Å; A47-A50 PolarHBondContact O-N 3.45Å; A47-A51 WeakPolarHBondContact O-CB 3.49Å; A47-A51 PolarHBondContact O-N 3.46Å
48	E	97.1	Very high	96.6	Very high	106 Å²	106	100 Å²	100	50%	0.495	51%	0.508	S	S	.	.	H	α-helix	trans	-65.2	-45.7	175	-76	177.6	-167.7	0	0	111.7	K44 A45 A50 A51 M52	K44-E48 VanDerWaalsContact CE-OE1 3.25Å; K44-E48 WeakPolarHBondContact CE-OE1 3.41Å; K44-E48 WeakPolarHBondContact O-CG 3.31Å; K44-E48 PolarHBondContact O-N 2.95Å; A45-E48 PolarHBondContact O-N 2.83Å; E48-A50 VanDerWaalsContact C-N 3.34Å; E48-A50 PolarHBondContact O-N 2.84Å; E48-A51 PolarHBondContact O-N 2.92Å; E48-M52 WeakPolarHBondContact O-CB 3.27Å; E48-M52 VanDerWaalsContact O-CG 3.27Å; E48-M52 WeakPolarHBondContact O-CG 3.45Å; E48-M52 PolarHBondContact O-N 2.83Å
49	V	97.4	Very high	96.8	Very high	94 Å²	94	98.2 Å²	98.2	57%	0.57	50%	0.502	S	S	*	.	H	α-helix	trans	-59	-46.5	174.8	170.7	0	0	0	0	110.2	A45 E46 A51 M52 T53	A45-V49 VanDerWaalsContact O-CG2 3.31Å; A45-V49 WeakPolarHBondContact O-CG2 3.4Å; A45-V49 PolarHBondContact O-N 3.26Å; E46-V49 PolarHBondContact O-N 3.2Å; V49-A51 VanDerWaalsContact C-N 3.33Å; V49-A51 PolarHBondContact O-N 2.99Å; V49-M52 PolarHBondContact O-N 3.5Å; V49-T53 PolarHBondContact O-N 3.21Å; V49-T53 PolarHBondContact O-OG1 3.39Å
50	A	96.8	Very high	96.9	Very high	45 Å²	45	102 Å²	102	37%	0.372	52%	0.517	S	S	.	.	H	α-helix	trans	-61.3	-39.4	177.3	0	0	0	0	0	112.6	E46 A47 E48 R54	E46-A50 WeakPolarHBondContact O-CB 3.33Å; E46-A50 PolarHBondContact O-N 2.94Å; A47-A50 PolarHBondContact O-N 3.45Å; E48-A50 VanDerWaalsContact C-N 3.34Å; E48-A50 PolarHBondContact O-N 2.84Å; A50-R54 WeakPolarHBondContact O-CG 3.33Å; A50-R54 PolarHBondContact O-N 2.83Å; A50-R54 VanDerWaalsContact O-N 3.12Å
51	A	97.5	Very high	97	Very high	56 Å²	56	103.2 Å²	103.2	46%	0.463	51%	0.513	S	S	.	.	H	α-helix	trans	-65.8	-42.9	174.8	0	0	0	0	0	111.9	A47 E48 V49 R54 R55	A47-A51 WeakPolarHBondContact O-CB 3.49Å; A47-A51 PolarHBondContact O-N 3.46Å; E48-A51 PolarHBondContact O-N 2.92Å; V49-A51 VanDerWaalsContact C-N 3.33Å; V49-A51 PolarHBondContact O-N 2.99Å; A51-R54 PolarHBondContact O-N 3.49Å; A51-R55 PolarHBondContact O-N 2.98Å
52	M	97.6	Very high	97.1	Very high	125 Å²	125	102.7 Å²	102.7	62%	0.616	51%	0.511	S	S	*	.	H	α-helix	trans	-65.6	-42.2	176.9	-68.7	-60.4	179.2	0	0	111.8	E48 V49 R54 R55 I56	E48-M52 WeakPolarHBondContact O-CB 3.27Å; E48-M52 VanDerWaalsContact O-CG 3.27Å; E48-M52 WeakPolarHBondContact O-CG 3.45Å; E48-M52 PolarHBondContact O-N 2.83Å; V49-M52 PolarHBondContact O-N 3.5Å; M52-R54 VanDerWaalsContact C-N 3.33Å; M52-R54 PolarHBondContact O-N 3.1Å; M52-R55 PolarHBondContact O-N 3.42Å; M52-R55 VanDerWaalsContact O-N 3.1Å; M52-I56 WeakPolarHBondContact O-CG1 3.35Å; M52-I56 PolarHBondContact O-N 3.1Å
53	T	97.3	Very high	97.2	Very high	87 Å²	87	102.1 Å²	102.1	53%	0.534	52%	0.517	S	S	.	.	H	α-helix	trans	-60.4	-41.8	175.1	-57.2	0	0	0	0	111.6	V49 R55 I56 R57	V49-T53 PolarHBondContact O-N 3.21Å; V49-T53 PolarHBondContact O-OG1 3.39Å; T53-R55 VanDerWaalsContact C-N 3.34Å; T53-R55 PolarHBondContact O-N 3.36Å; T53-I56 PolarHBondContact O-N 2.97Å; T53-R57 PolarHBondContact O-N 3.48Å; T53-R57 VanDerWaalsContact O-N 3.1Å
54	R	97.1	Very high	97.3	Very high	185 Å²	185	103.1 Å²	103.1	70%	0.698	52%	0.522	S	S	*	.	H	α-helix	trans	-62.6	-41	173.3	-71.8	173.1	-172.6	172.5	3.9	111.7	A50 A51 M52 R57 L58	A50-R54 WeakPolarHBondContact O-CG 3.33Å; A50-R54 PolarHBondContact O-N 2.83Å; A50-R54 VanDerWaalsContact O-N 3.12Å; A51-R54 PolarHBondContact O-N 3.49Å; M52-R54 VanDerWaalsContact C-N 3.33Å; M52-R54 PolarHBondContact O-N 3.1Å; R54-R57 PolarHBondContact O-N 3.1Å; R54-L58 WeakPolarHBondContact O-CG 3.36Å; R54-L58 PolarHBondContact O-N 3.34Å; R54-L58 VanDerWaalsContact O-N 3.08Å
55	R	97.9	Very high	97.4	Very high	133 Å²	133	101.5 Å²	101.5	50%	0.502	52%	0.522	S	S	.	.	H	α-helix	trans	-66.7	-42.5	178.6	-177.3	56.1	172.2	159.8	0	112.4	A51 M52 T53 R57 L58 L59	A51-R55 PolarHBondContact O-N 2.98Å; M52-R55 PolarHBondContact O-N 3.42Å; M52-R55 VanDerWaalsContact O-N 3.1Å; T53-R55 VanDerWaalsContact C-N 3.34Å; T53-R55 PolarHBondContact O-N 3.36Å; R55-R57 VanDerWaalsContact C-N 3.34Å; R55-L58 PolarHBondContact O-N 3.12Å; R55-L59 HydrophobicContact CG-CD1 4.13Å; R55-L59 WeakPolarHBondContact O-CG 3.47Å; R55-L59 PolarHBondContact O-N 3.08Å
56	I	98	Very high	97.4	Very high	91 Å²	91	101.5 Å²	101.5	47%	0.467	52%	0.52	S	S	.	.	H	α-helix	trans	-57.3	-50.3	175.3	-71.8	166.3	0	0	0	109.4	M52 T53 L58 L59 E60	M52-I56 WeakPolarHBondContact O-CG1 3.35Å; M52-I56 PolarHBondContact O-N 3.1Å; T53-I56 PolarHBondContact O-N 2.97Å; I56-L58 PolarHBondContact O-N 3.37Å; I56-L59 PolarHBondContact O-N 3.47Å; I56-L59 VanDerWaalsContact O-N 3.1Å; I56-E60 HydrophobicContact CG2-CG 4.29Å; I56-E60 WeakPolarHBondContact O-CG 3.39Å; I56-E60 PolarHBondContact O-N 3.44Å
57	R	97.2	Very high	97.5	Very high	164 Å²	164	99.1 Å²	99.1	62%	0.619	52%	0.516	S	S	*	.	H	α-helix	trans	-58.1	-45.1	178.4	-177.4	179.3	170.3	166.6	3.1	113	T53 R54 R55 L59 E60 E61	T53-R57 PolarHBondContact O-N 3.48Å; T53-R57 VanDerWaalsContact O-N 3.1Å; R54-R57 PolarHBondContact O-N 3.1Å; R55-R57 VanDerWaalsContact C-N 3.34Å; R57-L59 VanDerWaalsContact C-N 3.31Å; R57-L59 PolarHBondContact O-N 2.85Å; R57-E60 PolarHBondContact O-N 3.44Å; R57-E61 WeakPolarHBondContact CG-OE1 3.37Å; R57-E61 IonicContact CZ-OE1 2.93Å; R57-E61 IonicContact NE-OE1 3.76Å; R57-E61 PolarHBondContact NE-OE1 3.31Å; R57-E61 IonicContact NH2-OE1 3.96Å; R57-E61 PolarHBondContact NH2-OE1 3.3Å; R57-E61 WeakPolarHBondContact O-CB 3.35Å; R57-E61 WeakPolarHBondContact O-CG 3.31Å; R57-E61 PolarHBondContact O-N 2.89Å
58	L	97.5	Very high	97.5	Very high	89 Å²	89	98.8 Å²	98.8	47%	0.466	51%	0.509	S	S	.	.	H	α-helix	trans	-62.5	-39.2	176.7	-71.5	171.7	0	0	0	112	R54 R55 I56 D62	R54-L58 WeakPolarHBondContact O-CG 3.36Å; R54-L58 PolarHBondContact O-N 3.34Å; R54-L58 VanDerWaalsContact O-N 3.08Å; R55-L58 PolarHBondContact O-N 3.12Å; I56-L58 PolarHBondContact O-N 3.37Å; L58-D62 WeakPolarHBondContact O-CB 3.49Å; L58-D62 VanDerWaalsContact O-CG 3.27Å; L58-D62 PolarHBondContact O-N 2.88Å
59	L	98.2	Very high	97.5	Very high	86 Å²	86	101.7 Å²	101.7	45%	0.45	52%	0.516	S	S	.	.	H	α-helix	trans	-69.5	-35.4	176.8	-73.2	172.2	0	0	0	112.5	R55 I56 R57 L63	R55-L59 HydrophobicContact CG-CD1 4.13Å; R55-L59 WeakPolarHBondContact O-CG 3.47Å; R55-L59 PolarHBondContact O-N 3.08Å; I56-L59 PolarHBondContact O-N 3.47Å; I56-L59 VanDerWaalsContact O-N 3.1Å; R57-L59 VanDerWaalsContact C-N 3.31Å; R57-L59 PolarHBondContact O-N 2.85Å; L59-L63 VanDerWaalsContact O-CB 3.22Å; L59-L63 WeakPolarHBondContact O-CB 3.38Å; L59-L63 PolarHBondContact O-N 2.93Å
60	E	97.8	Very high	97.6	Very high	119 Å²	119	101.9 Å²	101.9	56%	0.556	51%	0.513	S	S	*	.	H	α-helix	trans	-65.7	-45.3	173.8	-72.5	172.1	159.4	0	0	111	I56 R57 L63 E64	I56-E60 HydrophobicContact CG2-CG 4.29Å; I56-E60 WeakPolarHBondContact O-CG 3.39Å; I56-E60 PolarHBondContact O-N 3.44Å; R57-E60 PolarHBondContact O-N 3.44Å; E60-L63 PolarHBondContact O-N 2.94Å; E60-E64 PolarHBondContact O-N 2.83Å
61	E	97.5	Very high	97.6	Very high	79 Å²	79	103.4 Å²	103.4	37%	0.369	52%	0.518	S	S	.	.	H	α-helix	trans	-61.3	-45.7	174.4	-71.6	172	-171.7	0	0	111	R57 L63 E64 V65	R57-E61 WeakPolarHBondContact CG-OE1 3.37Å; R57-E61 IonicContact CZ-OE1 2.93Å; R57-E61 IonicContact NE-OE1 3.76Å; R57-E61 PolarHBondContact NE-OE1 3.31Å; R57-E61 IonicContact NH2-OE1 3.96Å; R57-E61 PolarHBondContact NH2-OE1 3.3Å; R57-E61 WeakPolarHBondContact O-CB 3.35Å; R57-E61 WeakPolarHBondContact O-CG 3.31Å; R57-E61 PolarHBondContact O-N 2.89Å; E61-L63 VanDerWaalsContact C-N 3.35Å; E61-L63 PolarHBondContact O-N 3.29Å; E61-E64 PolarHBondContact O-N 2.9Å; E61-V65 WeakPolarHBondContact O-CG2 3.38Å; E61-V65 PolarHBondContact O-N 3.02Å
62	D	98.2	Very high	97.6	Very high	98 Å²	98	105.8 Å²	105.8	52%	0.524	52%	0.519	S	S	.	.	H	α-helix	trans	-61.9	-40.2	175.4	-77.9	-21.5	0	0	0	112.1	L58 S66	L58-D62 WeakPolarHBondContact O-CB 3.49Å; L58-D62 VanDerWaalsContact O-CG 3.27Å; L58-D62 PolarHBondContact O-N 2.88Å; D62-S66 VanDerWaalsContact O-CB 3.31Å; D62-S66 WeakPolarHBondContact O-CB 3.22Å; D62-S66 PolarHBondContact O-N 3.45Å; D62-S66 PolarHBondContact O-OG 2.9Å
63	L	98	Very high	97.6	Very high	118 Å²	118	103.1 Å²	103.1	62%	0.618	51%	0.51	S	S	*	.	H	α-helix	trans	-64.4	-45.3	177.5	179.4	62.3	0	0	0	110.8	L59 E60 E61 S66 S67	L59-L63 VanDerWaalsContact O-CB 3.22Å; L59-L63 WeakPolarHBondContact O-CB 3.38Å; L59-L63 PolarHBondContact O-N 2.93Å; E60-L63 PolarHBondContact O-N 2.94Å; E61-L63 VanDerWaalsContact C-N 3.35Å; E61-L63 PolarHBondContact O-N 3.29Å; L63-S66 PolarHBondContact O-N 3.39Å; L63-S66 PolarHBondContact O-OG 2.86Å; L63-S67 VanDerWaalsContact O-CB 3.3Å; L63-S67 WeakPolarHBondContact O-CB 3.3Å; L63-S67 PolarHBondContact O-N 2.84Å
64	E	97.9	Very high	97.6	Very high	142 Å²	142	103 Å²	103	66%	0.664	51%	0.506	S	S	*	.	H	α-helix	trans	-62.3	-43.8	177.8	-171.8	175.1	-173.5	0	0	111.9	E60 E61 S67 S68	E60-E64 PolarHBondContact O-N 2.83Å; E61-E64 PolarHBondContact O-N 2.9Å; E64-S67 PolarHBondContact O-N 3.29Å; E64-S68 WeakPolarHBondContact O-CB 3.33Å; E64-S68 PolarHBondContact O-N 3.05Å; E64-S68 PolarHBondContact O-OG 2.9Å
65	V	97.5	Very high	97.7	Very high	93 Å²	93	97.5 Å²	97.5	56%	0.564	49%	0.493	S	S	*	.	H	α-helix	trans	-63.9	-42.1	175.1	172.9	0	0	0	0	111.5	E61 S68 R69	E61-V65 WeakPolarHBondContact O-CG2 3.38Å; E61-V65 PolarHBondContact O-N 3.02Å; V65-S68 WeakPolarHBondContact CA-OG 3.35Å; V65-S68 PolarHBondContact O-OG 2.9Å; V65-R69 WeakPolarHBondContact O-CB 3.36Å; V65-R69 PolarHBondContact O-N 2.92Å
66	S	97.3	Very high	97.7	Very high	49 Å²	49	97.1 Å²	97.1	34%	0.343	50%	0.495	S	S	.	.	H	α-helix	trans	-68	-37.8	178.6	74.9	0	0	0	0	112.3	D62 L63 L70	D62-S66 VanDerWaalsContact O-CB 3.31Å; D62-S66 WeakPolarHBondContact O-CB 3.22Å; D62-S66 PolarHBondContact O-N 3.45Å; D62-S66 PolarHBondContact O-OG 2.9Å; L63-S66 PolarHBondContact O-N 3.39Å; L63-S66 PolarHBondContact O-OG 2.86Å; S66-L70 WeakPolarHBondContact O-CB 3.45Å; S66-L70 PolarHBondContact O-N 3.34Å
67	S	97.1	Very high	97.7	Very high	62 Å²	62	97.8 Å²	97.8	43%	0.434	50%	0.499	S	S	.	.	H	α-helix	trans	-68.7	-46.5	178.4	-175.3	0	0	0	0	111.3	L63 E64 R69 L70 T71	L63-S67 VanDerWaalsContact O-CB 3.3Å; L63-S67 WeakPolarHBondContact O-CB 3.3Å; L63-S67 PolarHBondContact O-N 2.84Å; E64-S67 PolarHBondContact O-N 3.29Å; S67-R69 PolarHBondContact O-N 2.95Å; S67-L70 WeakPolarHBondContact O-CB 3.35Å; S67-L70 PolarHBondContact O-N 2.98Å; S67-T71 WeakPolarHBondContact O-CG2 3.48Å; S67-T71 PolarHBondContact O-N 2.95Å; S67-T71 PolarHBondContact O-OG1 3.25Å
68	S	97.1	Very high	97.7	Very high	53 Å²	53	95.5 Å²	95.5	37%	0.371	50%	0.495	S	S	.	.	H	α-helix	trans	-59.2	-47.7	174.9	51.7	0	0	0	0	111.3	E64 V65 L70 T71 E72	E64-S68 WeakPolarHBondContact O-CB 3.33Å; E64-S68 PolarHBondContact O-N 3.05Å; E64-S68 PolarHBondContact O-OG 2.9Å; V65-S68 WeakPolarHBondContact CA-OG 3.35Å; V65-S68 PolarHBondContact O-OG 2.9Å; S68-L70 VanDerWaalsContact C-N 3.33Å; S68-L70 PolarHBondContact O-N 2.67Å; S68-T71 WeakPolarHBondContact CA-OG1 3.46Å; S68-T71 PolarHBondContact O-N 2.77Å; S68-T71 PolarHBondContact O-OG1 3.21Å; S68-E72 PolarHBondContact O-N 3.36Å
69	R	97.5	Very high	97.7	Very high	167 Å²	167	97.1 Å²	97.1	63%	0.63	50%	0.5	S	S	*	.	H	α-helix	trans	-58.9	-42.6	174.6	-172.7	178.2	68.5	-169.9	-0.7	112.4	V65 S67 E72 T73	V65-R69 WeakPolarHBondContact O-CB 3.36Å; V65-R69 PolarHBondContact O-N 2.92Å; S67-R69 PolarHBondContact O-N 2.95Å; R69-E72 PolarHBondContact O-N 3.35Å; R69-T73 WeakPolarHBondContact O-CG2 3.46Å; R69-T73 PolarHBondContact O-N 3.49Å; R69-T73 PolarHBondContact O-OG1 3.42Å
70	L	97.7	Very high	97.7	Very high	99 Å²	99	95.8 Å²	95.8	52%	0.518	50%	0.502	S	S	.	.	H	α-helix	trans	-59.7	-47.5	176.7	178.3	62.3	0	0	0	110.7	S66 S67 S68 E72 T73 L74	S66-L70 WeakPolarHBondContact O-CB 3.45Å; S66-L70 PolarHBondContact O-N 3.34Å; S67-L70 WeakPolarHBondContact O-CB 3.35Å; S67-L70 PolarHBondContact O-N 2.98Å; S68-L70 VanDerWaalsContact C-N 3.33Å; S68-L70 PolarHBondContact O-N 2.67Å; L70-E72 PolarHBondContact O-N 2.92Å; L70-T73 WeakPolarHBondContact CA-OG1 3.46Å; L70-T73 PolarHBondContact O-N 3.44Å; L70-T73 PolarHBondContact O-OG1 2.98Å; L70-L74 HydrophobicContact CD1-CD1 4.28Å; L70-L74 HydrophobicContact CD1-CG 4.3Å; L70-L74 HydrophobicContact CG-CD1 4.12Å; L70-L74 WeakPolarHBondContact O-CG 3.48Å; L70-L74 PolarHBondContact O-N 3.18Å
71	T	97.5	Very high	97.7	Very high	76 Å²	76	92.8 Å²	92.8	47%	0.466	49%	0.494	S	S	.	.	H	α-helix	trans	-59.8	-43.4	177.5	57.8	0	0	0	0	112.2	S67 S68 T73 L74 T75	S67-T71 WeakPolarHBondContact O-CG2 3.48Å; S67-T71 PolarHBondContact O-N 2.95Å; S67-T71 PolarHBondContact O-OG1 3.25Å; S68-T71 WeakPolarHBondContact CA-OG1 3.46Å; S68-T71 PolarHBondContact O-N 2.77Å; S68-T71 PolarHBondContact O-OG1 3.21Å; T71-T73 VanDerWaalsContact C-N 3.35Å; T71-T73 PolarHBondContact O-N 3.13Å; T71-L74 PolarHBondContact O-N 3.29Å; T71-T75 WeakPolarHBondContact O-CG2 3.4Å; T71-T75 PolarHBondContact O-N 2.95Å; T71-T75 PolarHBondContact O-OG1 2.96Å
72	E	97.6	Very high	97.7	Very high	106 Å²	106	94.9 Å²	94.9	50%	0.495	50%	0.502	S	S	.	.	H	α-helix	trans	-64.1	-36.4	175.7	-70.8	-179.2	-170.5	0	0	113.3	S68 R69 L70 T75 K76	S68-E72 PolarHBondContact O-N 3.36Å; R69-E72 PolarHBondContact O-N 3.35Å; L70-E72 PolarHBondContact O-N 2.92Å; E72-T75 WeakPolarHBondContact CA-OG1 3.42Å; E72-T75 PolarHBondContact O-OG1 3.4Å; E72-K76 WeakPolarHBondContact O-CB 3.49Å; E72-K76 WeakPolarHBondContact O-CD 3.42Å; E72-K76 VanDerWaalsContact O-CG 3.26Å; E72-K76 WeakPolarHBondContact O-CG 3.26Å; E72-K76 PolarHBondContact O-N 3.18Å; E72-K76 VanDerWaalsContact O-N 3.13Å
73	T	97.4	Very high	97.6	Very high	70 Å²	70	94 Å²	94	43%	0.429	50%	0.5	S	S	.	.	H	α-helix	trans	-71.5	-34.7	176.9	55.7	0	0	0	0	112.2	R69 L70 T71 L77	R69-T73 WeakPolarHBondContact O-CG2 3.46Å; R69-T73 PolarHBondContact O-N 3.49Å; R69-T73 PolarHBondContact O-OG1 3.42Å; L70-T73 WeakPolarHBondContact CA-OG1 3.46Å; L70-T73 PolarHBondContact O-N 3.44Å; L70-T73 PolarHBondContact O-OG1 2.98Å; T71-T73 VanDerWaalsContact C-N 3.35Å; T71-T73 PolarHBondContact O-N 3.13Å; T73-L77 WeakPolarHBondContact O-CB 3.34Å; T73-L77 PolarHBondContact O-N 2.93Å
74	L	98	Very high	97.6	Very high	83 Å²	83	90.9 Å²	90.9	44%	0.435	49%	0.491	S	S	.	.	H	α-helix	trans	-68.1	-43.7	175.7	-73.2	173.1	0	0	0	111.2	L70 T71 K76 L77 E78	L70-L74 HydrophobicContact CD1-CD1 4.28Å; L70-L74 HydrophobicContact CD1-CG 4.3Å; L70-L74 HydrophobicContact CG-CD1 4.12Å; L70-L74 WeakPolarHBondContact O-CG 3.48Å; L70-L74 PolarHBondContact O-N 3.18Å; T71-L74 PolarHBondContact O-N 3.29Å; L74-K76 PolarHBondContact O-N 3.47Å; L74-L77 PolarHBondContact O-N 2.74Å; L74-E78 WeakPolarHBondContact O-CG 3.32Å; L74-E78 PolarHBondContact O-N 2.91Å
75	T	98.1	Very high	97.6	Very high	70 Å²	70	88.7 Å²	88.7	43%	0.429	48%	0.481	S	S	.	.	H	α-helix	trans	-62.1	-43.8	175.9	55.7	0	0	0	0	111.7	T71 E72 L77 E78 E79	T71-T75 WeakPolarHBondContact O-CG2 3.4Å; T71-T75 PolarHBondContact O-N 2.95Å; T71-T75 PolarHBondContact O-OG1 2.96Å; E72-T75 WeakPolarHBondContact CA-OG1 3.42Å; E72-T75 PolarHBondContact O-OG1 3.4Å; T75-L77 VanDerWaalsContact C-N 3.33Å; T75-L77 PolarHBondContact O-N 2.93Å; T75-E78 PolarHBondContact O-N 3.47Å; T75-E79 WeakPolarHBondContact O-CG 3.34Å; T75-E79 PolarHBondContact O-N 3.42Å
76	K	98	Very high	97.6	Very high	126 Å²	126	89.8 Å²	89.8	55%	0.548	48%	0.48	S	S	.	.	H	α-helix	trans	-61.2	-39.3	174.4	-74.1	170.5	-176.6	165.5	0	112.7	E72 L74 A80	E72-K76 WeakPolarHBondContact O-CB 3.49Å; E72-K76 WeakPolarHBondContact O-CD 3.42Å; E72-K76 VanDerWaalsContact O-CG 3.26Å; E72-K76 WeakPolarHBondContact O-CG 3.26Å; E72-K76 PolarHBondContact O-N 3.18Å; E72-K76 VanDerWaalsContact O-N 3.13Å; L74-K76 PolarHBondContact O-N 3.47Å; K76-A80 WeakPolarHBondContact O-CB 3.41Å; K76-A80 PolarHBondContact O-N 3.35Å
77	L	98	Very high	97.7	Very high	104 Å²	104	90.8 Å²	90.8	55%	0.545	49%	0.487	S	S	.	.	H	α-helix	trans	-66.8	-42	176.8	178.5	63	0	0	0	111.5	T73 L74 T75 A80 S81	T73-L77 WeakPolarHBondContact O-CB 3.34Å; T73-L77 PolarHBondContact O-N 2.93Å; L74-L77 PolarHBondContact O-N 2.74Å; T75-L77 VanDerWaalsContact C-N 3.33Å; T75-L77 PolarHBondContact O-N 2.93Å; L77-A80 PolarHBondContact O-N 3.27Å; L77-S81 WeakPolarHBondContact O-CB 3.37Å; L77-S81 PolarHBondContact O-N 2.88Å; L77-S81 PolarHBondContact O-OG 3.32Å
78	E	97.9	Very high	97.7	Very high	116 Å²	116	92.8 Å²	92.8	54%	0.542	49%	0.489	S	S	.	.	H	α-helix	trans	-63.3	-43.3	175.5	-75	-179.9	-172.4	0	0	111.8	L74 T75 S81 K82	L74-E78 WeakPolarHBondContact O-CG 3.32Å; L74-E78 PolarHBondContact O-N 2.91Å; T75-E78 PolarHBondContact O-N 3.47Å; E78-S81 PolarHBondContact O-N 3.17Å; E78-K82 WeakPolarHBondContact O-CG 3.45Å; E78-K82 PolarHBondContact O-N 3.28Å
79	E	97.4	Very high	97.7	Very high	123 Å²	123	96.3 Å²	96.3	58%	0.575	50%	0.495	S	S	*	.	H	α-helix	trans	-61.9	-48.2	175.3	-74	174.3	178.3	0	0	111.6	T75 S81 K82 T83	T75-E79 WeakPolarHBondContact O-CG 3.34Å; T75-E79 PolarHBondContact O-N 3.42Å; E79-S81 VanDerWaalsContact C-N 3.29Å; E79-S81 PolarHBondContact O-N 2.97Å; E79-K82 PolarHBondContact O-N 2.92Å; E79-T83 PolarHBondContact O-N 3.43Å; E79-T83 PolarHBondContact O-OG1 3.42Å
80	A	97.6	Very high	97.8	Very high	59 Å²	59	90.6 Å²	90.6	49%	0.488	48%	0.483	S	S	.	.	H	α-helix	trans	-60.7	-39	176.7	0	0	0	0	0	112.1	K76 L77 T83 A84	K76-A80 WeakPolarHBondContact O-CB 3.41Å; K76-A80 PolarHBondContact O-N 3.35Å; L77-A80 PolarHBondContact O-N 3.27Å; A80-T83 PolarHBondContact O-N 3.21Å; A80-A84 WeakPolarHBondContact O-CB 3.35Å; A80-A84 PolarHBondContact O-N 2.94Å
81	S	97.7	Very high	97.8	Very high	55 Å²	55	94 Å²	94	39%	0.385	49%	0.489	S	S	.	.	H	α-helix	trans	-65	-43.9	176.6	-58.8	0	0	0	0	111.4	L77 E78 E79 A84 E85	L77-S81 WeakPolarHBondContact O-CB 3.37Å; L77-S81 PolarHBondContact O-N 2.88Å; L77-S81 PolarHBondContact O-OG 3.32Å; E78-S81 PolarHBondContact O-N 3.17Å; E79-S81 VanDerWaalsContact C-N 3.29Å; E79-S81 PolarHBondContact O-N 2.97Å; S81-A84 PolarHBondContact O-N 3.22Å; S81-E85 WeakPolarHBondContact O-CG 3.39Å; S81-E85 PolarHBondContact O-N 3.37Å
82	K	97.9	Very high	97.8	Very high	123 Å²	123	96.3 Å²	96.3	54%	0.535	49%	0.49	S	S	.	.	H	α-helix	trans	-60.5	-46.1	174.5	-73.6	172.3	-176.5	170	0	111.8	E78 E79 A84 E85 E86	E78-K82 WeakPolarHBondContact O-CG 3.45Å; E78-K82 PolarHBondContact O-N 3.28Å; E79-K82 PolarHBondContact O-N 2.92Å; K82-A84 VanDerWaalsContact C-N 3.33Å; K82-A84 PolarHBondContact O-N 2.95Å; K82-E85 PolarHBondContact O-N 3.36Å; K82-E86 WeakPolarHBondContact O-CG 3.47Å; K82-E86 PolarHBondContact O-N 2.82Å
83	T	97.3	Very high	97.8	Very high	80 Å²	80	97 Å²	97	49%	0.491	49%	0.493	S	S	.	.	H	α-helix	trans	-63.3	-37.4	177.2	-58.7	0	0	0	0	112.4	E79 A80 E86 S87	E79-T83 PolarHBondContact O-N 3.43Å; E79-T83 PolarHBondContact O-OG1 3.42Å; A80-T83 PolarHBondContact O-N 3.21Å; T83-E86 PolarHBondContact O-N 3.4Å; T83-S87 WeakPolarHBondContact O-CB 3.4Å; T83-S87 PolarHBondContact O-N 3.37Å; T83-S87 PolarHBondContact O-OG 3.46Å
84	A	97.9	Very high	97.8	Very high	52 Å²	52	98.2 Å²	98.2	43%	0.43	50%	0.5	S	S	.	.	H	α-helix	trans	-64.7	-46.7	175.3	0	0	0	0	0	111.4	A80 S81 K82 E86 S87 E88	A80-A84 WeakPolarHBondContact O-CB 3.35Å; A80-A84 PolarHBondContact O-N 2.94Å; S81-A84 PolarHBondContact O-N 3.22Å; K82-A84 VanDerWaalsContact C-N 3.33Å; K82-A84 PolarHBondContact O-N 2.95Å; A84-E86 VanDerWaalsContact C-N 3.33Å; A84-E86 PolarHBondContact O-N 2.91Å; A84-S87 WeakPolarHBondContact O-CB 3.36Å; A84-S87 PolarHBondContact O-N 3.19Å; A84-E88 PolarHBondContact O-N 2.97Å
85	E	97.9	Very high	97.8	Very high	96 Å²	96	97.3 Å²	97.3	45%	0.449	49%	0.493	S	S	.	.	H	α-helix	trans	-59.6	-42	175.4	-73.4	-178.7	-163.5	0	0	112.5	S81 K82 E88 R89	S81-E85 WeakPolarHBondContact O-CG 3.39Å; S81-E85 PolarHBondContact O-N 3.37Å; K82-E85 PolarHBondContact O-N 3.36Å; E85-E88 PolarHBondContact O-N 2.75Å; E85-R89 VanDerWaalsContact O-CG 3.3Å; E85-R89 WeakPolarHBondContact O-CG 3.35Å; E85-R89 PolarHBondContact O-N 3.37Å; E85-R89 IonicContact OE2-CZ 2.84Å; E85-R89 IonicContact OE2-NH2 3.79Å; E85-R89 PolarHBondContact OE2-NH2 2.85Å
86	E	97.6	Very high	97.8	Very high	117 Å²	117	98.8 Å²	98.8	55%	0.547	50%	0.499	S	S	.	.	H	α-helix	trans	-63.4	-41.8	175.5	-74.1	174.5	177.6	0	0	111.9	K82 T83 A84 R89 A90	K82-E86 WeakPolarHBondContact O-CG 3.47Å; K82-E86 PolarHBondContact O-N 2.82Å; T83-E86 PolarHBondContact O-N 3.4Å; A84-E86 VanDerWaalsContact C-N 3.33Å; A84-E86 PolarHBondContact O-N 2.91Å; E86-R89 PolarHBondContact O-N 2.86Å; E86-A90 WeakPolarHBondContact O-CB 3.3Å; E86-A90 PolarHBondContact O-N 2.89Å
87	S	97.6	Very high	97.8	Very high	70 Å²	70	98.6 Å²	98.6	49%	0.49	50%	0.498	S	S	.	.	H	α-helix	trans	-63.1	-42	176.2	-60.6	0	0	0	0	111.6	T83 A84 A90 W91	T83-S87 WeakPolarHBondContact O-CB 3.4Å; T83-S87 PolarHBondContact O-N 3.37Å; T83-S87 PolarHBondContact O-OG 3.46Å; A84-S87 WeakPolarHBondContact O-CB 3.36Å; A84-S87 PolarHBondContact O-N 3.19Å; S87-A90 PolarHBondContact O-N 2.93Å; S87-W91 WeakPolarHBondContact O-CB 3.3Å; S87-W91 PolarHBondContact O-N 3.41Å
88	E	98.1	Very high	97.8	Very high	103 Å²	103	98.2 Å²	98.2	48%	0.481	49%	0.494	S	S	.	.	H	α-helix	trans	-65.4	-39.5	174.6	-71.3	-168.6	171.8	0	0	112.3	A84 E85 W91 R92	A84-E88 PolarHBondContact O-N 2.97Å; E85-E88 PolarHBondContact O-N 2.75Å; E88-W91 PolarHBondContact O-N 2.93Å; E88-R92 WeakPolarHBondContact O-CB 3.43Å; E88-R92 VanDerWaalsContact O-CG 3.3Å; E88-R92 WeakPolarHBondContact O-CG 3.46Å; E88-R92 PolarHBondContact O-N 3.42Å; E88-R92 IonicContact OE2-CZ 3.68Å; E88-R92 IonicContact OE2-NH1 2.75Å; E88-R92 PolarHBondContact OE2-NH1 2.89Å; E88-R92 IonicContact OE2-NH2 3.17Å; E88-R92 PolarHBondContact OE2-NH2 3.24Å
89	R	97.9	Very high	97.8	Very high	127 Å²	127	95.7 Å²	95.7	48%	0.479	49%	0.485	S	S	.	.	H	α-helix	trans	-62.5	-45.1	175.2	-72.7	174.8	-164.9	131.3	11.3	110.7	E85 E86 R92 Q93	E85-R89 VanDerWaalsContact O-CG 3.3Å; E85-R89 WeakPolarHBondContact O-CG 3.35Å; E85-R89 PolarHBondContact O-N 3.37Å; E85-R89 IonicContact OE2-CZ 2.84Å; E85-R89 IonicContact OE2-NH2 3.79Å; E85-R89 PolarHBondContact OE2-NH2 2.85Å; E86-R89 PolarHBondContact O-N 2.86Å; R89-R92 PolarHBondContact O-N 3.2Å; R89-Q93 WeakPolarHBondContact O-CG 3.47Å; R89-Q93 PolarHBondContact O-N 2.96Å
90	A	97.8	Very high	97.8	Very high	48 Å²	48	93.8 Å²	93.8	40%	0.397	48%	0.482	S	S	.	.	H	α-helix	trans	-62	-44.5	176.4	0	0	0	0	0	111.6	E86 S87 R92 Q93 V94	E86-A90 WeakPolarHBondContact O-CB 3.3Å; E86-A90 PolarHBondContact O-N 2.89Å; S87-A90 PolarHBondContact O-N 2.93Å; A90-R92 PolarHBondContact O-N 2.98Å; A90-Q93 WeakPolarHBondContact O-CB 3.5Å; A90-Q93 PolarHBondContact O-N 3.41Å; A90-V94 WeakPolarHBondContact O-CG2 3.37Å; A90-V94 PolarHBondContact O-N 3.49Å
91	W	97.8	Very high	97.8	Very high	169 Å²	169	98.1 Å²	98.1	64%	0.64	49%	0.486	S	S	*	.	H	α-helix	trans	-60.3	-46.3	176.8	-177.5	80.9	0	0	0	112	S87 E88 Q93 V94 Q95	S87-W91 WeakPolarHBondContact O-CB 3.3Å; S87-W91 PolarHBondContact O-N 3.41Å; E88-W91 PolarHBondContact O-N 2.93Å; W91-Q93 VanDerWaalsContact C-N 3.3Å; W91-Q93 PolarHBondContact O-N 2.87Å; W91-V94 PolarHBondContact O-N 3.15Å; W91-V94 VanDerWaalsContact O-N 3.15Å; W91-Q95 PolarHBondContact O-N 3.34Å
92	R	98	Very high	97.9	Very high	126 Å²	126	99.6 Å²	99.6	48%	0.475	49%	0.49	S	S	.	.	H	α-helix	trans	-59.5	-38.8	175.2	-71.8	179.4	-166.7	104.7	2.2	112.3	E88 R89 A90 Q95 N96	E88-R92 WeakPolarHBondContact O-CB 3.43Å; E88-R92 VanDerWaalsContact O-CG 3.3Å; E88-R92 WeakPolarHBondContact O-CG 3.46Å; E88-R92 PolarHBondContact O-N 3.42Å; E88-R92 IonicContact OE2-CZ 3.68Å; E88-R92 IonicContact OE2-NH1 2.75Å; E88-R92 PolarHBondContact OE2-NH1 2.89Å; E88-R92 IonicContact OE2-NH2 3.17Å; E88-R92 PolarHBondContact OE2-NH2 3.24Å; R89-R92 PolarHBondContact O-N 3.2Å; A90-R92 PolarHBondContact O-N 2.98Å; R92-Q95 PolarHBondContact O-N 2.9Å; R92-N96 VanDerWaalsContact O-CG 3.23Å; R92-N96 PolarHBondContact O-N 2.87Å; R92-N96 PolarHBondContact O-ND2 3.27Å
93	Q	98.2	Very high	97.9	Very high	121 Å²	121	100 Å²	100	57%	0.565	49%	0.492	S	S	*	.	H	α-helix	trans	-65.7	-41.7	175.7	-72	177.1	3	0	0	112.3	R89 A90 W91 K97	R89-Q93 WeakPolarHBondContact O-CG 3.47Å; R89-Q93 PolarHBondContact O-N 2.96Å; A90-Q93 WeakPolarHBondContact O-CB 3.5Å; A90-Q93 PolarHBondContact O-N 3.41Å; W91-Q93 VanDerWaalsContact C-N 3.3Å; W91-Q93 PolarHBondContact O-N 2.87Å; Q93-K97 WeakPolarHBondContact O-CG 3.43Å; Q93-K97 PolarHBondContact O-N 3.16Å; Q93-K97 VanDerWaalsContact O-N 3.08Å
94	V	97.9	Very high	97.9	Very high	94 Å²	94	102 Å²	102	57%	0.57	49%	0.493	S	S	*	.	H	α-helix	trans	-64.9	-43.3	176.3	172.7	0	0	0	0	110.6	A90 W91 N96 K97 M98	A90-V94 WeakPolarHBondContact O-CG2 3.37Å; A90-V94 PolarHBondContact O-N 3.49Å; W91-V94 PolarHBondContact O-N 3.15Å; W91-V94 VanDerWaalsContact O-N 3.15Å; V94-N96 PolarHBondContact O-N 3.06Å; V94-K97 WeakPolarHBondContact O-CB 3.44Å; V94-K97 PolarHBondContact O-N 3.08Å; V94-K97 VanDerWaalsContact O-N 3.16Å; V94-M98 PolarHBondContact O-N 3.36Å
95	Q	97.7	Very high	98	Very high	64 Å²	64	103 Å²	103	30%	0.299	49%	0.494	S	S	.	.	H	α-helix	trans	-60.4	-47.8	177	-172.8	60.5	38	0	0	111.6	W91 R92 K97 M98 D99	W91-Q95 PolarHBondContact O-N 3.34Å; R92-Q95 PolarHBondContact O-N 2.9Å; Q95-K97 PolarHBondContact O-N 3.48Å; Q95-M98 WeakPolarHBondContact O-CB 3.16Å; Q95-M98 PolarHBondContact O-N 3.01Å; Q95-M98 VanDerWaalsContact O-N 3.09Å; Q95-D99 PolarHBondContact NE2-OD1 3.09Å; Q95-D99 PolarHBondContact O-N 3.36Å
96	N	97.5	Very high	98	Very high	102 Å²	102	104.7 Å²	104.7	55%	0.545	50%	0.502	S	S	.	.	H	α-helix	trans	-59.1	-37.9	176.4	-71.1	-19.7	0	0	0	112	R92 V94 T100	R92-N96 VanDerWaalsContact O-CG 3.23Å; R92-N96 PolarHBondContact O-N 2.87Å; R92-N96 PolarHBondContact O-ND2 3.27Å; V94-N96 PolarHBondContact O-N 3.06Å; N96-T100 VanDerWaalsContact O-CG2 3.32Å; N96-T100 WeakPolarHBondContact O-CG2 3.49Å; N96-T100 PolarHBondContact O-N 2.84Å; N96-T100 VanDerWaalsContact O-N 3.14Å; N96-T100 PolarHBondContact O-OG1 3.05Å
97	K	98.3	Very high	98	Very high	121 Å²	121	105.7 Å²	105.7	53%	0.526	51%	0.507	S	S	.	.	H	α-helix	trans	-65.5	-45.6	174.7	-75.1	176.7	-178.8	178	0	111.3	Q93 V94 Q95 D99 T100 Y101	Q93-K97 WeakPolarHBondContact O-CG 3.43Å; Q93-K97 PolarHBondContact O-N 3.16Å; Q93-K97 VanDerWaalsContact O-N 3.08Å; V94-K97 WeakPolarHBondContact O-CB 3.44Å; V94-K97 PolarHBondContact O-N 3.08Å; V94-K97 VanDerWaalsContact O-N 3.16Å; Q95-K97 PolarHBondContact O-N 3.48Å; K97-D99 PolarHBondContact O-N 2.95Å; K97-T100 WeakPolarHBondContact CA-OG1 3.38Å; K97-T100 PolarHBondContact O-N 3.48Å; K97-T100 PolarHBondContact O-OG1 3.49Å; K97-Y101 HydrophobicContact CB-CD2 4.48Å; K97-Y101 HydrophobicContact CB-CE2 4.21Å; K97-Y101 WeakPolarHBondContact O-CD2 3.32Å; K97-Y101 PolarHBondContact O-N 2.92Å
98	M	98.2	Very high	98	Very high	96 Å²	96	107.1 Å²	107.1	47%	0.473	51%	0.508	S	S	.	.	H	α-helix	trans	-56.7	-49.7	176.4	-174.6	175	171.7	0	0	111.1	V94 Q95 T100 Y101 D102	V94-M98 PolarHBondContact O-N 3.36Å; Q95-M98 WeakPolarHBondContact O-CB 3.16Å; Q95-M98 PolarHBondContact O-N 3.01Å; Q95-M98 VanDerWaalsContact O-N 3.09Å; M98-T100 VanDerWaalsContact C-N 3.27Å; M98-T100 PolarHBondContact O-N 3.21Å; M98-Y101 PolarHBondContact O-N 3.24Å; M98-D102 PolarHBondContact O-N 3.23Å
99	D	98	Very high	98.1	Very high	63 Å²	63	108.1 Å²	108.1	34%	0.337	51%	0.513	S	S	.	.	H	α-helix	trans	-60	-36	178.8	-64.3	-9.4	0	0	0	112.6	Q95 K97 K103	Q95-D99 PolarHBondContact NE2-OD1 3.09Å; Q95-D99 PolarHBondContact O-N 3.36Å; K97-D99 PolarHBondContact O-N 2.95Å; D99-K103 VanDerWaalsContact O-CG 3.31Å; D99-K103 WeakPolarHBondContact O-CG 3.28Å; D99-K103 PolarHBondContact O-N 3.46Å
100	T	97.9	Very high	98.1	Very high	84 Å²	84	108.4 Å²	108.4	52%	0.515	52%	0.518	S	S	.	.	H	α-helix	trans	-73.1	-35.7	175.8	59	0	0	0	0	112.8	N96 K97 M98 K104	N96-T100 VanDerWaalsContact O-CG2 3.32Å; N96-T100 WeakPolarHBondContact O-CG2 3.49Å; N96-T100 PolarHBondContact O-N 2.84Å; N96-T100 VanDerWaalsContact O-N 3.14Å; N96-T100 PolarHBondContact O-OG1 3.05Å; K97-T100 WeakPolarHBondContact CA-OG1 3.38Å; K97-T100 PolarHBondContact O-N 3.48Å; K97-T100 PolarHBondContact O-OG1 3.49Å; M98-T100 VanDerWaalsContact C-N 3.27Å; M98-T100 PolarHBondContact O-N 3.21Å; T100-K104 WeakPolarHBondContact O-CB 3.45Å; T100-K104 PolarHBondContact O-N 3.24Å; T100-K104 VanDerWaalsContact O-N 3.12Å
101	Y	97.9	Very high	98.1	Very high	149 Å²	149	108.7 Å²	108.7	58%	0.584	52%	0.52	S	S	*	.	H	α-helix	trans	-68.4	-42	173.8	-71.2	-48.2	0	0	0	111.7	K97 M98 K103 K104 V105	K97-Y101 HydrophobicContact CB-CD2 4.48Å; K97-Y101 HydrophobicContact CB-CE2 4.21Å; K97-Y101 WeakPolarHBondContact O-CD2 3.32Å; K97-Y101 PolarHBondContact O-N 2.92Å; M98-Y101 PolarHBondContact O-N 3.24Å; Y101-K103 PolarHBondContact O-N 3.21Å; Y101-K104 CarbonylContact O-C 3.59Å; Y101-K104 WeakPolarHBondContact O-CB 3.31Å; Y101-K104 PolarHBondContact O-N 2.75Å; Y101-K104 VanDerWaalsContact O-N 3.08Å; Y101-V105 WeakPolarHBondContact O-CG2 3.42Å; Y101-V105 PolarHBondContact O-N 3.45Å
102	D	98.3	Very high	98.1	Very high	86 Å²	86	105 Å²	105	46%	0.46	52%	0.516	S	S	.	.	H	α-helix	trans	-60	-46	177.8	-72.9	-16.9	0	0	0	111.2	M98 K104 V105 E106	M98-D102 PolarHBondContact O-N 3.23Å; D102-K104 VanDerWaalsContact C-N 3.3Å; D102-K104 PolarHBondContact O-N 3.14Å; D102-V105 PolarHBondContact O-N 3.32Å; D102-E106 PolarHBondContact O-N 2.84Å
103	K	98	Very high	98.2	Very high	131 Å²	131	105.3 Å²	105.3	57%	0.57	52%	0.523	S	S	*	.	H	α-helix	trans	-60.4	-38.7	173.6	-71.7	171.1	-174.7	172.7	0	112.7	D99 Y101 Q107	D99-K103 VanDerWaalsContact O-CG 3.31Å; D99-K103 WeakPolarHBondContact O-CG 3.28Å; D99-K103 PolarHBondContact O-N 3.46Å; Y101-K103 PolarHBondContact O-N 3.21Å; K103-Q107 VanDerWaalsContact O-CG 3.29Å; K103-Q107 WeakPolarHBondContact O-CG 3.45Å; K103-Q107 PolarHBondContact O-N 3.12Å
104	K	98.2	Very high	98.1	Very high	122 Å²	122	104.1 Å²	104.1	53%	0.53	52%	0.521	S	S	.	.	H	α-helix	trans	-68.8	-39.1	177.7	-174.2	174.7	-178.3	178.3	0	111.4	T100 Y101 D102 Q107 L108	T100-K104 WeakPolarHBondContact O-CB 3.45Å; T100-K104 PolarHBondContact O-N 3.24Å; T100-K104 VanDerWaalsContact O-N 3.12Å; Y101-K104 CarbonylContact O-C 3.59Å; Y101-K104 WeakPolarHBondContact O-CB 3.31Å; Y101-K104 PolarHBondContact O-N 2.75Å; Y101-K104 VanDerWaalsContact O-N 3.08Å; D102-K104 VanDerWaalsContact C-N 3.3Å; D102-K104 PolarHBondContact O-N 3.14Å; K104-Q107 PolarHBondContact O-N 2.82Å; K104-L108 HydrophobicContact CG-CD1 4.17Å; K104-L108 WeakPolarHBondContact O-CB 3.35Å; K104-L108 VanDerWaalsContact O-CG 3.29Å; K104-L108 WeakPolarHBondContact O-CG 3.29Å; K104-L108 PolarHBondContact O-N 2.95Å
105	V	98.5	Very high	98.2	Very high	73 Å²	73	102.5 Å²	102.5	44%	0.442	52%	0.517	S	S	.	.	H	α-helix	trans	-62.3	-46.4	175.2	169.3	0	0	0	0	110	Y101 D102 Q107 L108 Q109	Y101-V105 WeakPolarHBondContact O-CG2 3.42Å; Y101-V105 PolarHBondContact O-N 3.45Å; D102-V105 PolarHBondContact O-N 3.32Å; V105-Q107 PolarHBondContact O-N 3.08Å; V105-L108 PolarHBondContact O-N 3.45Å; V105-Q109 HydrophobicContact CG1-CG 4.33Å; V105-Q109 WeakPolarHBondContact O-CB 3.5Å; V105-Q109 VanDerWaalsContact O-CG 3.28Å; V105-Q109 WeakPolarHBondContact O-CG 3.4Å; V105-Q109 PolarHBondContact O-N 3.04Å
106	E	98.3	Very high	98.2	Very high	133 Å²	133	102.5 Å²	102.5	62%	0.621	52%	0.522	S	S	*	.	H	α-helix	trans	-60	-44.9	177	-172.7	-178.8	-175.1	0	0	112	D102 L108 Q109 K110	D102-E106 PolarHBondContact O-N 2.84Å; E106-L108 PolarHBondContact O-N 2.94Å; E106-Q109 PolarHBondContact O-N 3.49Å; E106-K110 PolarHBondContact O-N 3.32Å
107	Q	98.3	Very high	98.2	Very high	137 Å²	137	102.9 Å²	102.9	64%	0.64	52%	0.52	S	S	*	.	H	α-helix	trans	-61.3	-43.7	175.5	-74.6	174.9	-0.4	0	0	112.5	K103 K104 V105 K110 A111	K103-Q107 VanDerWaalsContact O-CG 3.29Å; K103-Q107 WeakPolarHBondContact O-CG 3.45Å; K103-Q107 PolarHBondContact O-N 3.12Å; K104-Q107 PolarHBondContact O-N 2.82Å; V105-Q107 PolarHBondContact O-N 3.08Å; Q107-K110 PolarHBondContact O-N 2.92Å; Q107-A111 WeakPolarHBondContact O-CB 3.45Å; Q107-A111 PolarHBondContact O-N 3.36Å
108	L	98.2	Very high	98.2	Very high	100 Å²	100	99.6 Å²	99.6	52%	0.524	52%	0.515	S	S	.	.	H	α-helix	trans	-67.1	-38.4	177.9	-73.9	172.8	0	0	0	111.6	K104 V105 E106 A111 V112	K104-L108 HydrophobicContact CG-CD1 4.17Å; K104-L108 WeakPolarHBondContact O-CB 3.35Å; K104-L108 VanDerWaalsContact O-CG 3.29Å; K104-L108 WeakPolarHBondContact O-CG 3.29Å; K104-L108 PolarHBondContact O-N 2.95Å; V105-L108 PolarHBondContact O-N 3.45Å; E106-L108 PolarHBondContact O-N 2.94Å; L108-A111 PolarHBondContact O-N 3.2Å; L108-V112 WeakPolarHBondContact O-CB 3.29Å; L108-V112 VanDerWaalsContact O-CG2 3.27Å; L108-V112 WeakPolarHBondContact O-CG2 3.27Å; L108-V112 PolarHBondContact O-N 3.26Å
109	Q	98.4	Very high	98.2	Very high	124 Å²	124	97.6 Å²	97.6	58%	0.579	51%	0.514	S	S	*	.	H	α-helix	trans	-60.9	-47.5	175.4	-77	172.6	-17.8	0	0	111.2	V105 E106 A111 V112 E113	V105-Q109 HydrophobicContact CG1-CG 4.33Å; V105-Q109 WeakPolarHBondContact O-CB 3.5Å; V105-Q109 VanDerWaalsContact O-CG 3.28Å; V105-Q109 WeakPolarHBondContact O-CG 3.4Å; V105-Q109 PolarHBondContact O-N 3.04Å; E106-Q109 PolarHBondContact O-N 3.49Å; Q109-A111 PolarHBondContact O-N 3.48Å; Q109-V112 PolarHBondContact O-N 3.01Å; Q109-E113 PolarHBondContact O-N 2.97Å
110	K	98.3	Very high	98.2	Very high	133 Å²	133	100.5 Å²	100.5	58%	0.578	52%	0.524	S	S	*	.	H	α-helix	trans	-61.9	-43.8	175.8	-173.6	177.6	179.1	179.7	0	112.2	E106 Q107 V112 E113 D114	E106-K110 PolarHBondContact O-N 3.32Å; Q107-K110 PolarHBondContact O-N 2.92Å; K110-V112 VanDerWaalsContact C-N 3.29Å; K110-V112 PolarHBondContact O-N 3.47Å; K110-E113 PolarHBondContact O-N 3.39Å; K110-D114 PolarHBondContact O-N 3.01Å
111	A	98.2	Very high	98.2	Very high	54 Å²	54	101.3 Å²	101.3	45%	0.446	52%	0.522	S	S	.	.	H	α-helix	trans	-62.4	-36.8	177.6	0	0	0	0	0	112.5	Q107 L108 Q109 A115	Q107-A111 WeakPolarHBondContact O-CB 3.45Å; Q107-A111 PolarHBondContact O-N 3.36Å; L108-A111 PolarHBondContact O-N 3.2Å; Q109-A111 PolarHBondContact O-N 3.48Å; A111-A115 VanDerWaalsContact O-CB 3.24Å; A111-A115 WeakPolarHBondContact O-CB 3.27Å; A111-A115 PolarHBondContact O-N 2.72Å
112	V	98.4	Very high	98.2	Very high	92 Å²	92	98.2 Å²	98.2	56%	0.558	52%	0.518	S	S	*	.	H	α-helix	trans	-65.8	-46.8	173.4	168.8	0	0	0	0	110.3	L108 Q109 K110 A115 T116	L108-V112 WeakPolarHBondContact O-CB 3.29Å; L108-V112 VanDerWaalsContact O-CG2 3.27Å; L108-V112 WeakPolarHBondContact O-CG2 3.27Å; L108-V112 PolarHBondContact O-N 3.26Å; Q109-V112 PolarHBondContact O-N 3.01Å; K110-V112 VanDerWaalsContact C-N 3.29Å; K110-V112 PolarHBondContact O-N 3.47Å; V112-A115 PolarHBondContact O-N 3.44Å; V112-T116 HydrophobicContact CG1-CG2 4.28Å; V112-T116 VanDerWaalsContact O-CG2 3.27Å; V112-T116 WeakPolarHBondContact O-CG2 3.48Å; V112-T116 PolarHBondContact O-N 2.86Å; V112-T116 PolarHBondContact O-OG1 3.29Å
113	E	98.5	Very high	98.2	Very high	133 Å²	133	97.7 Å²	97.7	62%	0.621	52%	0.515	S	S	*	.	H	α-helix	trans	-56.9	-52.1	177.5	-173.4	173.8	-167.5	0	0	111.6	Q109 K110 A115 T116 E117	Q109-E113 PolarHBondContact O-N 2.97Å; K110-E113 PolarHBondContact O-N 3.39Å; E113-A115 VanDerWaalsContact C-N 3.32Å; E113-A115 PolarHBondContact O-N 3.11Å; E113-T116 PolarHBondContact O-N 3.36Å; E113-T116 VanDerWaalsContact O-N 3.11Å; E113-T116 PolarHBondContact O-OG1 3.02Å; E113-E117 PolarHBondContact O-N 2.9Å
114	D	98	Very high	98.2	Very high	96 Å²	96	97.6 Å²	97.6	51%	0.513	52%	0.515	S	S	.	.	H	α-helix	trans	-58.1	-43.3	177.7	-69.9	-21.8	0	0	0	111.6	K110 E117 A118	K110-D114 PolarHBondContact O-N 3.01Å; D114-E117 PolarHBondContact O-N 3.39Å; D114-A118 WeakPolarHBondContact O-CB 3.24Å; D114-A118 PolarHBondContact O-N 2.9Å
115	A	98.1	Very high	98.2	Very high	60 Å²	60	96.6 Å²	96.6	50%	0.496	51%	0.511	S	S	.	.	H	α-helix	trans	-66.2	-37.8	177.3	0	0	0	0	0	112.4	A111 V112 E113 A119	A111-A115 VanDerWaalsContact O-CB 3.24Å; A111-A115 WeakPolarHBondContact O-CB 3.27Å; A111-A115 PolarHBondContact O-N 2.72Å; V112-A115 PolarHBondContact O-N 3.44Å; E113-A115 VanDerWaalsContact C-N 3.32Å; E113-A115 PolarHBondContact O-N 3.11Å; A115-A119 WeakPolarHBondContact O-CB 3.39Å; A115-A119 PolarHBondContact O-N 3.4Å
116	T	98.5	Very high	98.2	Very high	64 Å²	64	100.8 Å²	100.8	39%	0.393	52%	0.52	S	S	.	.	H	α-helix	trans	-67.4	-37.2	176.6	62.3	0	0	0	0	112.3	V112 E113 A119 K120	V112-T116 HydrophobicContact CG1-CG2 4.28Å; V112-T116 VanDerWaalsContact O-CG2 3.27Å; V112-T116 WeakPolarHBondContact O-CG2 3.48Å; V112-T116 PolarHBondContact O-N 2.86Å; V112-T116 PolarHBondContact O-OG1 3.29Å; E113-T116 PolarHBondContact O-N 3.36Å; E113-T116 VanDerWaalsContact O-N 3.11Å; E113-T116 PolarHBondContact O-OG1 3.02Å; T116-A119 PolarHBondContact O-N 3.15Å; T116-K120 WeakPolarHBondContact O-CG 3.35Å; T116-K120 PolarHBondContact O-N 3.36Å
117	E	98.1	Very high	98.2	Very high	110 Å²	110	100.4 Å²	100.4	51%	0.514	52%	0.516	S	S	.	.	H	α-helix	trans	-70.3	-42.8	177.7	-167.7	57	-152.9	0	0	111.4	E113 D114 A119 K120 E121	E113-E117 PolarHBondContact O-N 2.9Å; D114-E117 PolarHBondContact O-N 3.39Å; E117-A119 VanDerWaalsContact C-N 3.29Å; E117-A119 PolarHBondContact O-N 3.01Å; E117-K120 PolarHBondContact O-N 3.42Å; E117-K120 VanDerWaalsContact O-N 3.15Å; E117-K120 IonicContact OE2-NZ 2.93Å; E117-E121 PolarHBondContact O-N 3.03Å
118	A	98.1	Very high	98.2	Very high	51 Å²	51	98.7 Å²	98.7	42%	0.421	51%	0.508	S	S	.	.	H	α-helix	trans	-59.4	-40.2	172.7	0	0	0	0	0	112.2	D114 E121 T122	D114-A118 WeakPolarHBondContact O-CB 3.24Å; D114-A118 PolarHBondContact O-N 2.9Å; A118-E121 PolarHBondContact O-N 2.66Å; A118-T122 WeakPolarHBondContact O-CG2 3.38Å; A118-T122 PolarHBondContact O-N 2.98Å; A118-T122 PolarHBondContact O-OG1 2.98Å
119	A	98.3	Very high	98.2	Very high	55 Å²	55	99.2 Å²	99.2	46%	0.455	51%	0.51	S	S	.	.	H	α-helix	trans	-63.8	-40.8	175	0	0	0	0	0	112.3	A115 T116 E117 T122 D123	A115-A119 WeakPolarHBondContact O-CB 3.39Å; A115-A119 PolarHBondContact O-N 3.4Å; T116-A119 PolarHBondContact O-N 3.15Å; E117-A119 VanDerWaalsContact C-N 3.29Å; E117-A119 PolarHBondContact O-N 3.01Å; A119-T122 WeakPolarHBondContact CA-OG1 3.34Å; A119-T122 PolarHBondContact O-OG1 3.34Å; A119-D123 WeakPolarHBondContact O-CB 3.44Å; A119-D123 PolarHBondContact O-N 3.39Å
120	K	98.1	Very high	98.2	Very high	124 Å²	124	95.6 Å²	95.6	54%	0.539	50%	0.499	S	S	.	.	H	α-helix	trans	-65.5	-41.8	174.7	-70.9	171.5	-167.8	163.8	0	112.4	T116 E117 T122 D123 K124	T116-K120 WeakPolarHBondContact O-CG 3.35Å; T116-K120 PolarHBondContact O-N 3.36Å; E117-K120 PolarHBondContact O-N 3.42Å; E117-K120 VanDerWaalsContact O-N 3.15Å; E117-K120 IonicContact OE2-NZ 2.93Å; K120-T122 VanDerWaalsContact C-N 3.34Å; K120-D123 PolarHBondContact O-N 2.97Å; K120-K124 WeakPolarHBondContact O-CB 3.45Å; K120-K124 PolarHBondContact O-N 3.41Å
121	E	98.1	Very high	98.2	Very high	101 Å²	101	93.5 Å²	93.5	47%	0.472	50%	0.5	S	S	.	.	H	α-helix	trans	-63.9	-42	179	-166.5	-169.5	162.7	0	0	111.1	E117 A118 K124 K125	E117-E121 PolarHBondContact O-N 3.03Å; A118-E121 PolarHBondContact O-N 2.66Å; E121-K124 PolarHBondContact O-N 2.99Å; E121-K125 WeakPolarHBondContact O-CG 3.22Å; E121-K125 PolarHBondContact O-N 2.96Å; E121-K125 WeakPolarHBondContact OE1-CE 3.36Å; E121-K125 IonicContact OE1-NZ 3.44Å; E121-K125 PolarHBondContact OE1-NZ 2.65Å
122	T	97.4	Very high	98.2	Very high	83 Å²	83	94.8 Å²	94.8	51%	0.509	50%	0.502	S	S	.	.	H	α-helix	trans	-67.4	-40.2	176.6	51.3	0	0	0	0	112.7	A118 A119 K120 K124 K125 Y126	A118-T122 WeakPolarHBondContact O-CG2 3.38Å; A118-T122 PolarHBondContact O-N 2.98Å; A118-T122 PolarHBondContact O-OG1 2.98Å; A119-T122 WeakPolarHBondContact CA-OG1 3.34Å; A119-T122 PolarHBondContact O-OG1 3.34Å; K120-T122 VanDerWaalsContact C-N 3.34Å; T122-K124 VanDerWaalsContact C-N 3.34Å; T122-K124 PolarHBondContact O-N 2.89Å; T122-K125 PolarHBondContact O-N 2.87Å; T122-Y126 WeakPolarHBondContact O-CB 3.15Å; T122-Y126 PolarHBondContact O-N 3.35Å
123	D	98.4	Very high	98.2	Very high	75 Å²	75	94.6 Å²	94.6	40%	0.401	50%	0.497	S	S	.	.	H	α-helix	trans	-62.5	-40.4	173.2	179.6	64.7	0	0	0	111.8	A119 K120 Y126 K127	A119-D123 WeakPolarHBondContact O-CB 3.44Å; A119-D123 PolarHBondContact O-N 3.39Å; K120-D123 PolarHBondContact O-N 2.97Å; D123-Y126 PolarHBondContact O-N 2.95Å; D123-K127 WeakPolarHBondContact O-CG 3.21Å; D123-K127 PolarHBondContact O-N 3.49Å; D123-K127 IonicContact OD1-NZ 3.59Å; D123-K127 VanDerWaalsContact OD2-CE 3.22Å; D123-K127 WeakPolarHBondContact OD2-CE 3.4Å; D123-K127 IonicContact OD2-NZ 3.56Å; D123-K127 PolarHBondContact OD2-NZ 2.99Å
124	K	98.4	Very high	98.2	Very high	130 Å²	130	90.9 Å²	90.9	57%	0.565	49%	0.489	S	S	*	.	H	α-helix	trans	-61.6	-48.7	174.4	-172.9	-175.3	176.8	-168.4	0	111.5	K120 E121 T122 Y126 K127 E128	K120-K124 WeakPolarHBondContact O-CB 3.45Å; K120-K124 PolarHBondContact O-N 3.41Å; E121-K124 PolarHBondContact O-N 2.99Å; T122-K124 VanDerWaalsContact C-N 3.34Å; T122-K124 PolarHBondContact O-N 2.89Å; K124-Y126 VanDerWaalsContact C-N 3.31Å; K124-Y126 PolarHBondContact O-N 2.98Å; K124-K127 PolarHBondContact O-N 3.27Å; K124-E128 WeakPolarHBondContact CE-OE1 3.29Å; K124-E128 WeakPolarHBondContact O-CG 3.44Å; K124-E128 PolarHBondContact O-N 3.43Å
125	K	98.3	Very high	98.2	Very high	100 Å²	100	91 Å²	91	44%	0.435	49%	0.49	S	S	.	.	H	α-helix	trans	-59.7	-41.7	176.4	-73.3	172.5	-176.2	167.9	0	111.7	E121 T122 E128 I129	E121-K125 WeakPolarHBondContact O-CG 3.22Å; E121-K125 PolarHBondContact O-N 2.96Å; E121-K125 WeakPolarHBondContact OE1-CE 3.36Å; E121-K125 IonicContact OE1-NZ 3.44Å; E121-K125 PolarHBondContact OE1-NZ 2.65Å; T122-K125 PolarHBondContact O-N 2.87Å; K125-E128 PolarHBondContact O-N 2.94Å; K125-I129 VanDerWaalsContact O-CG1 3.29Å; K125-I129 WeakPolarHBondContact O-CG1 3.37Å; K125-I129 PolarHBondContact O-N 3Å
126	Y	97.8	Very high	98.2	Very high	162 Å²	162	92 Å²	92	64%	0.635	49%	0.49	S	S	*	.	H	α-helix	trans	-60.5	-47.6	177	-176.2	-95.2	0	0	0	111.2	T122 D123 K124 E128 I129 S130	T122-Y126 WeakPolarHBondContact O-CB 3.15Å; T122-Y126 PolarHBondContact O-N 3.35Å; D123-Y126 PolarHBondContact O-N 2.95Å; K124-Y126 VanDerWaalsContact C-N 3.31Å; K124-Y126 PolarHBondContact O-N 2.98Å; Y126-E128 PolarHBondContact O-N 3.43Å; Y126-I129 PolarHBondContact O-N 3.26Å; Y126-S130 PolarHBondContact O-N 3.07Å; Y126-S130 PolarHBondContact O-OG 2.85Å; Y126-S130 VanDerWaalsContact O-OG 3.07Å
127	K	98.2	Very high	98.2	Very high	125 Å²	125	94.5 Å²	94.5	54%	0.543	50%	0.497	S	S	.	.	H	α-helix	trans	-60.4	-42	176.5	-74	168.6	177	164.3	0	112.8	D123 K124 S130 C131	D123-K127 WeakPolarHBondContact O-CG 3.21Å; D123-K127 PolarHBondContact O-N 3.49Å; D123-K127 IonicContact OD1-NZ 3.59Å; D123-K127 VanDerWaalsContact OD2-CE 3.22Å; D123-K127 WeakPolarHBondContact OD2-CE 3.4Å; D123-K127 IonicContact OD2-NZ 3.56Å; D123-K127 PolarHBondContact OD2-NZ 2.99Å; K124-K127 PolarHBondContact O-N 3.27Å; K127-S130 PolarHBondContact O-N 3.43Å; K127-C131 WeakPolarHBondContact O-CB 3.41Å; K127-C131 PolarHBondContact O-N 3.35Å
128	E	98.2	Very high	98.2	Very high	101 Å²	101	95.1 Å²	95.1	47%	0.472	50%	0.498	S	S	.	.	H	α-helix	trans	-62.5	-46.9	176.2	-73.8	173.6	-175.2	0	0	111.2	K124 K125 Y126 S130 C131 T132	K124-E128 WeakPolarHBondContact CE-OE1 3.29Å; K124-E128 WeakPolarHBondContact O-CG 3.44Å; K124-E128 PolarHBondContact O-N 3.43Å; K125-E128 PolarHBondContact O-N 2.94Å; Y126-E128 PolarHBondContact O-N 3.43Å; E128-S130 PolarHBondContact O-N 3.5Å; E128-C131 PolarHBondContact O-N 3.25Å; E128-T132 WeakPolarHBondContact O-CG2 3.39Å; E128-T132 PolarHBondContact O-N 3.26Å; E128-T132 PolarHBondContact O-OG1 2.94Å
129	I	98.2	Very high	98.2	Very high	110 Å²	110	96.6 Å²	96.6	56%	0.564	50%	0.499	S	S	*	.	H	α-helix	trans	-63.3	-41.2	177.1	-68.1	167.4	0	0	0	111.4	K125 Y126 C131 T132 L133	K125-I129 VanDerWaalsContact O-CG1 3.29Å; K125-I129 WeakPolarHBondContact O-CG1 3.37Å; K125-I129 PolarHBondContact O-N 3Å; Y126-I129 PolarHBondContact O-N 3.26Å; I129-C131 VanDerWaalsContact C-N 3.32Å; I129-C131 PolarHBondContact O-N 3.06Å; I129-T132 WeakPolarHBondContact CA-OG1 3.24Å; I129-T132 PolarHBondContact O-N 3.42Å; I129-T132 PolarHBondContact O-OG1 2.86Å; I129-L133 VanDerWaalsContact O-CB 3.24Å; I129-L133 WeakPolarHBondContact O-CB 3.46Å; I129-L133 PolarHBondContact O-N 3.1Å
130	S	98.2	Very high	98.3	Very high	49 Å²	49	98.7 Å²	98.7	34%	0.343	50%	0.502	S	S	.	.	H	α-helix	trans	-63.7	-39	176.2	-61.8	0	0	0	0	112.1	Y126 K127 E128 A134	Y126-S130 PolarHBondContact O-N 3.07Å; Y126-S130 PolarHBondContact O-OG 2.85Å; Y126-S130 VanDerWaalsContact O-OG 3.07Å; K127-S130 PolarHBondContact O-N 3.43Å; E128-S130 PolarHBondContact O-N 3.5Å; S130-A134 WeakPolarHBondContact O-CB 3.41Å; S130-A134 PolarHBondContact O-N 3.46Å
131	C	98	Very high	98.3	Very high	89 Å²	89	95 Å²	95	60%	0.601	50%	0.495	S	S	*	.	H	α-helix	trans	-67.8	-43.6	177.1	-176.3	0	0	0	0	111.9	K127 E128 I129 A134 L135	K127-C131 WeakPolarHBondContact O-CB 3.41Å; K127-C131 PolarHBondContact O-N 3.35Å; E128-C131 PolarHBondContact O-N 3.25Å; I129-C131 VanDerWaalsContact C-N 3.32Å; I129-C131 PolarHBondContact O-N 3.06Å; C131-A134 PolarHBondContact O-N 3.49Å; C131-L135 PolarHBondContact O-N 2.96Å; C131-L135 VanDerWaalsContact O-N 3.1Å
132	T	98.4	Very high	98.3	Very high	81 Å²	81	95.1 Å²	95.1	50%	0.497	50%	0.495	S	S	.	.	H	α-helix	trans	-66.3	-40.9	176.8	56.9	0	0	0	0	111.5	E128 I129 L135 T136	E128-T132 WeakPolarHBondContact O-CG2 3.39Å; E128-T132 PolarHBondContact O-N 3.26Å; E128-T132 PolarHBondContact O-OG1 2.94Å; I129-T132 WeakPolarHBondContact CA-OG1 3.24Å; I129-T132 PolarHBondContact O-N 3.42Å; I129-T132 PolarHBondContact O-OG1 2.86Å; T132-L135 PolarHBondContact O-N 2.73Å; T132-T136 WeakPolarHBondContact O-CG2 3.38Å; T132-T136 PolarHBondContact O-N 3.48Å; T132-T136 PolarHBondContact O-OG1 2.9Å
133	L	98.3	Very high	98.3	Very high	87 Å²	87	93.1 Å²	93.1	46%	0.455	49%	0.487	S	S	.	.	H	α-helix	trans	-57.6	-52.4	175.4	179.9	62	0	0	0	111	I129 L135 T136 E137	I129-L133 VanDerWaalsContact O-CB 3.24Å; I129-L133 WeakPolarHBondContact O-CB 3.46Å; I129-L133 PolarHBondContact O-N 3.1Å; L133-L135 VanDerWaalsContact C-N 3.26Å; L133-L135 PolarHBondContact O-N 3.04Å; L133-T136 WeakPolarHBondContact CA-OG1 3.4Å; L133-T136 PolarHBondContact O-N 3.25Å; L133-T136 PolarHBondContact O-OG1 3.26Å; L133-E137 HydrophobicContact CD1-CG 4.19Å; L133-E137 HydrophobicContact CG-CG 4.39Å; L133-E137 WeakPolarHBondContact O-CG 3Å; L133-E137 PolarHBondContact O-N 3.09Å
134	A	98.6	Very high	98.3	Very high	55 Å²	55	94.6 Å²	94.6	46%	0.455	49%	0.491	S	S	.	.	H	α-helix	trans	-58.6	-38	179	0	0	0	0	0	112.6	S130 C131 K138	S130-A134 WeakPolarHBondContact O-CB 3.41Å; S130-A134 PolarHBondContact O-N 3.46Å; C131-A134 PolarHBondContact O-N 3.49Å; A134-K138 WeakPolarHBondContact O-CB 3.49Å; A134-K138 PolarHBondContact O-N 2.86Å; A134-K138 VanDerWaalsContact O-N 3.09Å
135	L	98.4	Very high	98.3	Very high	100 Å²	100	92.9 Å²	92.9	52%	0.524	49%	0.492	S	S	.	.	H	α-helix	trans	-66.5	-43	174.8	-179.1	62.6	0	0	0	111.8	C131 T132 L133 K138 N139	C131-L135 PolarHBondContact O-N 2.96Å; C131-L135 VanDerWaalsContact O-N 3.1Å; T132-L135 PolarHBondContact O-N 2.73Å; L133-L135 VanDerWaalsContact C-N 3.26Å; L133-L135 PolarHBondContact O-N 3.04Å; L135-K138 PolarHBondContact O-N 3Å; L135-N139 VanDerWaalsContact O-CG 3.25Å; L135-N139 PolarHBondContact O-N 3.41Å; L135-N139 PolarHBondContact O-ND2 2.95Å
136	T	98.3	Very high	98.3	Very high	80 Å²	80	97 Å²	97	49%	0.491	51%	0.505	S	S	.	.	H	α-helix	trans	-67.1	-38	178.2	55.4	0	0	0	0	112.6	T132 L133 N139 L140	T132-T136 WeakPolarHBondContact O-CG2 3.38Å; T132-T136 PolarHBondContact O-N 3.48Å; T132-T136 PolarHBondContact O-OG1 2.9Å; L133-T136 WeakPolarHBondContact CA-OG1 3.4Å; L133-T136 PolarHBondContact O-N 3.25Å; L133-T136 PolarHBondContact O-OG1 3.26Å; T136-N139 PolarHBondContact O-N 2.99Å; T136-L140 WeakPolarHBondContact O-CB 3.39Å; T136-L140 PolarHBondContact O-N 2.87Å
137	E	98.5	Very high	98.3	Very high	117 Å²	117	94.4 Å²	94.4	55%	0.547	50%	0.5	S	S	.	.	H	α-helix	trans	-63.5	-42.4	174.9	-72.6	175.2	159.9	0	0	111.2	L133 L140 A141	L133-E137 HydrophobicContact CD1-CG 4.19Å; L133-E137 HydrophobicContact CG-CG 4.39Å; L133-E137 WeakPolarHBondContact O-CG 3Å; L133-E137 PolarHBondContact O-N 3.09Å; E137-L140 PolarHBondContact O-N 3.24Å; E137-A141 PolarHBondContact O-N 3.32Å
138	K	98.5	Very high	98.3	Very high	123 Å²	123	90.9 Å²	90.9	54%	0.535	49%	0.494	S	S	.	.	H	α-helix	trans	-60.6	-48.4	173.5	-178.9	-177.3	170.2	-176.3	0	111.7	A134 L135 L140 A141 E142	A134-K138 WeakPolarHBondContact O-CB 3.49Å; A134-K138 PolarHBondContact O-N 2.86Å; A134-K138 VanDerWaalsContact O-N 3.09Å; L135-K138 PolarHBondContact O-N 3Å; K138-L140 VanDerWaalsContact C-N 3.29Å; K138-L140 PolarHBondContact O-N 3.27Å; K138-A141 PolarHBondContact O-N 3.41Å; K138-E142 WeakPolarHBondContact CE-OE1 3.46Å; K138-E142 IonicContact NZ-OE1 2.83Å; K138-E142 WeakPolarHBondContact O-CG 3.46Å; K138-E142 PolarHBondContact O-N 3.01Å
139	N	98.5	Very high	98.3	Very high	81 Å²	81	93.5 Å²	93.5	43%	0.433	50%	0.504	S	S	.	.	H	α-helix	trans	-63.4	-36.4	179.6	-69.7	-14.8	0	0	0	112	L135 T136 E142 A143	L135-N139 VanDerWaalsContact O-CG 3.25Å; L135-N139 PolarHBondContact O-N 3.41Å; L135-N139 PolarHBondContact O-ND2 2.95Å; T136-N139 PolarHBondContact O-N 2.99Å; N139-E142 PolarHBondContact O-N 3.36Å; N139-A143 WeakPolarHBondContact O-CB 3.42Å; N139-A143 PolarHBondContact O-N 3.36Å
140	L	98.4	Very high	98.3	Very high	99 Å²	99	91.5 Å²	91.5	52%	0.518	50%	0.5	S	S	.	.	H	α-helix	trans	-63	-48.6	174.7	178.5	62.3	0	0	0	110.8	T136 E137 K138 E142 A143 E144	T136-L140 WeakPolarHBondContact O-CB 3.39Å; T136-L140 PolarHBondContact O-N 2.87Å; E137-L140 PolarHBondContact O-N 3.24Å; K138-L140 VanDerWaalsContact C-N 3.29Å; K138-L140 PolarHBondContact O-N 3.27Å; L140-E142 VanDerWaalsContact C-N 3.31Å; L140-E142 PolarHBondContact O-N 3.45Å; L140-A143 WeakPolarHBondContact O-CB 3.37Å; L140-A143 PolarHBondContact O-N 2.89Å; L140-E144 HydrophobicContact CD1-CG 4.27Å; L140-E144 HydrophobicContact CG-CG 4.46Å; L140-E144 WeakPolarHBondContact O-CG 3.39Å; L140-E144 PolarHBondContact O-N 3.15Å
141	A	98.5	Very high	98.3	Very high	48 Å²	48	94.7 Å²	94.7	40%	0.397	51%	0.509	S	S	.	.	H	α-helix	trans	-59.9	-40.5	177.4	0	0	0	0	0	112.3	E137 K138 E144 T145	E137-A141 PolarHBondContact O-N 3.32Å; K138-A141 PolarHBondContact O-N 3.41Å; A141-E144 PolarHBondContact O-N 3.18Å; A141-T145 WeakPolarHBondContact O-CG2 3.32Å; A141-T145 PolarHBondContact O-N 3.48Å; A141-T145 PolarHBondContact O-OG1 3.35Å
142	E	98.5	Very high	98.3	Very high	103 Å²	103	96.2 Å²	96.2	48%	0.481	51%	0.508	S	S	.	.	H	α-helix	trans	-64.6	-38.3	173.9	-71.4	178.4	-175.1	0	0	112.2	K138 N139 L140 T145 R146	K138-E142 WeakPolarHBondContact CE-OE1 3.46Å; K138-E142 IonicContact NZ-OE1 2.83Å; K138-E142 WeakPolarHBondContact O-CG 3.46Å; K138-E142 PolarHBondContact O-N 3.01Å; N139-E142 PolarHBondContact O-N 3.36Å; L140-E142 VanDerWaalsContact C-N 3.31Å; L140-E142 PolarHBondContact O-N 3.45Å; E142-T145 PolarHBondContact O-OG1 3.17Å; E142-R146 PolarHBondContact O-N 3.02Å
143	A	98.4	Very high	98.3	Very high	40 Å²	40	96.8 Å²	96.8	33%	0.331	51%	0.507	S	S	.	.	H	α-helix	trans	-68.1	-41.3	176.1	0	0	0	0	0	112.3	N139 L140 R146 M147	N139-A143 WeakPolarHBondContact O-CB 3.42Å; N139-A143 PolarHBondContact O-N 3.36Å; L140-A143 WeakPolarHBondContact O-CB 3.37Å; L140-A143 PolarHBondContact O-N 2.89Å; A143-R146 PolarHBondContact O-N 2.9Å; A143-M147 WeakPolarHBondContact O-CB 3.46Å; A143-M147 PolarHBondContact O-N 3.05Å
144	E	98.5	Very high	98.3	Very high	106 Å²	106	95.9 Å²	95.9	50%	0.495	51%	0.505	S	S	.	.	H	α-helix	trans	-64.4	-44.1	177.7	-73.6	176.4	162.9	0	0	111.7	L140 A141 R146 M147 A148	L140-E144 HydrophobicContact CD1-CG 4.27Å; L140-E144 HydrophobicContact CG-CG 4.46Å; L140-E144 WeakPolarHBondContact O-CG 3.39Å; L140-E144 PolarHBondContact O-N 3.15Å; A141-E144 PolarHBondContact O-N 3.18Å; E144-R146 VanDerWaalsContact C-N 3.32Å; E144-R146 PolarHBondContact O-N 3.2Å; E144-M147 PolarHBondContact O-N 2.86Å; E144-A148 PolarHBondContact O-N 3.06Å
145	T	98.2	Very high	98.3	Very high	95 Å²	95	95.3 Å²	95.3	58%	0.583	50%	0.501	S	S	*	.	H	α-helix	trans	-62.5	-38.7	175.6	54	0	0	0	0	112.3	A141 E142 K149	A141-T145 WeakPolarHBondContact O-CG2 3.32Å; A141-T145 PolarHBondContact O-N 3.48Å; A141-T145 PolarHBondContact O-OG1 3.35Å; E142-T145 PolarHBondContact O-OG1 3.17Å; T145-K149 PolarHBondContact O-N 3.41Å; T145-K149 VanDerWaalsContact O-N 3.17Å
146	R	98.2	Very high	98.3	Very high	187 Å²	187	95.9 Å²	95.9	71%	0.706	50%	0.5	S	S	*	.	H	α-helix	trans	-66.2	-40.6	174.1	-176.2	178.4	64.3	-177.7	-1.7	112.1	E142 A143 E144 K149 S150	E142-R146 PolarHBondContact O-N 3.02Å; A143-R146 PolarHBondContact O-N 2.9Å; E144-R146 VanDerWaalsContact C-N 3.32Å; E144-R146 PolarHBondContact O-N 3.2Å; R146-K149 PolarHBondContact O-N 2.97Å; R146-S150 PolarHBondContact O-N 2.91Å
147	M	98	Very high	98.3	Very high	106 Å²	106	97 Å²	97	52%	0.522	50%	0.503	S	S	.	.	H	α-helix	trans	-62.8	-49.1	177.2	-173.2	179.5	77.1	0	0	110.7	A143 E144 K149 S150 E151	A143-M147 WeakPolarHBondContact O-CB 3.46Å; A143-M147 PolarHBondContact O-N 3.05Å; E144-M147 PolarHBondContact O-N 2.86Å; M147-K149 VanDerWaalsContact C-N 3.29Å; M147-K149 PolarHBondContact O-N 3.32Å; M147-S150 CarbonylContact O-C 3.6Å; M147-S150 WeakPolarHBondContact O-CA 3.38Å; M147-S150 WeakPolarHBondContact O-CB 3.45Å; M147-S150 PolarHBondContact O-N 2.97Å; M147-E151 WeakPolarHBondContact O-CG 3.46Å; M147-E151 PolarHBondContact O-N 2.88Å
148	A	98.2	Very high	98.3	Very high	52 Å²	52	97.4 Å²	97.4	43%	0.43	51%	0.505	S	S	.	.	H	α-helix	trans	-56	-43.1	177.7	0	0	0	0	0	112.2	E144 S150 E151 E152	E144-A148 PolarHBondContact O-N 3.06Å; A148-S150 VanDerWaalsContact C-N 3.34Å; A148-S150 PolarHBondContact O-N 3.08Å; A148-E151 PolarHBondContact O-N 3.29Å; A148-E152 PolarHBondContact O-N 3.47Å
149	K	98.2	Very high	98.2	Very high	155 Å²	155	97 Å²	97	67%	0.674	51%	0.508	S	S	*	.	H	α-helix	trans	-64.1	-37.7	174.9	-175.9	175.6	-178.9	176.8	0	112.9	T145 R146 M147 L153	T145-K149 PolarHBondContact O-N 3.41Å; T145-K149 VanDerWaalsContact O-N 3.17Å; R146-K149 PolarHBondContact O-N 2.97Å; M147-K149 VanDerWaalsContact C-N 3.29Å; M147-K149 PolarHBondContact O-N 3.32Å; K149-L153 PolarHBondContact O-N 3.47Å; K149-L153 VanDerWaalsContact O-N 3.08Å
150	S	97.4	Very high	98.2	Very high	69 Å²	69	97 Å²	97	48%	0.483	51%	0.511	S	S	.	.	H	α-helix	trans	-68.2	-39.1	176.5	-171.5	0	0	0	0	111.5	R146 M147 A148 L153 V154	R146-S150 PolarHBondContact O-N 2.91Å; M147-S150 CarbonylContact O-C 3.6Å; M147-S150 WeakPolarHBondContact O-CA 3.38Å; M147-S150 WeakPolarHBondContact O-CB 3.45Å; M147-S150 PolarHBondContact O-N 2.97Å; A148-S150 VanDerWaalsContact C-N 3.34Å; A148-S150 PolarHBondContact O-N 3.08Å; S150-L153 PolarHBondContact O-N 2.95Å; S150-V154 VanDerWaalsContact O-CG2 3.27Å; S150-V154 WeakPolarHBondContact O-CG2 3.48Å; S150-V154 PolarHBondContact O-N 2.99Å
151	E	98.4	Very high	98.1	Very high	115 Å²	115	98 Å²	98	54%	0.537	52%	0.517	S	S	.	.	H	α-helix	trans	-65.5	-41.3	176.6	-70.8	177.5	155	0	0	111.4	M147 A148 V154 A155	M147-E151 WeakPolarHBondContact O-CG 3.46Å; M147-E151 PolarHBondContact O-N 2.88Å; A148-E151 PolarHBondContact O-N 3.29Å; E151-V154 PolarHBondContact O-N 2.93Å; E151-A155 WeakPolarHBondContact O-CB 3.39Å; E151-A155 PolarHBondContact O-N 3.41Å
152	E	98.4	Very high	98.1	Very high	121 Å²	121	103.5 Å²	103.5	57%	0.565	53%	0.532	S	S	*	.	H	α-helix	trans	-58.9	-48.7	172.7	-176.2	177	-155.5	0	0	111.4	A148 V154 A155 E156	A148-E152 PolarHBondContact O-N 3.47Å; E152-V154 VanDerWaalsContact C-N 3.33Å; E152-V154 PolarHBondContact O-N 2.92Å; E152-A155 PolarHBondContact O-N 3.2Å; E152-E156 WeakPolarHBondContact O-CG 3.45Å; E152-E156 PolarHBondContact O-N 3.4Å
153	L	98.4	Very high	98.1	Very high	93 Å²	93	100.5 Å²	100.5	49%	0.487	53%	0.528	S	S	.	.	H	α-helix	trans	-62	-39.9	178	-179.4	62.2	0	0	0	112.4	K149 S150 E156 L157	K149-L153 PolarHBondContact O-N 3.47Å; K149-L153 VanDerWaalsContact O-N 3.08Å; S150-L153 PolarHBondContact O-N 2.95Å; L153-E156 PolarHBondContact O-N 2.95Å; L153-L157 HydrophobicContact CD1-CD1 4.49Å; L153-L157 HydrophobicContact CD1-CG 4.45Å; L153-L157 HydrophobicContact CG-CD1 4.27Å; L153-L157 WeakPolarHBondContact O-CB 3.27Å; L153-L157 VanDerWaalsContact O-CG 3.3Å; L153-L157 WeakPolarHBondContact O-CG 3.3Å; L153-L157 PolarHBondContact O-N 3.34Å
154	V	98.4	Very high	98	Very high	69 Å²	69	103.5 Å²	103.5	42%	0.418	54%	0.538	S	S	.	.	H	α-helix	trans	-63	-46	175.5	168.7	0	0	0	0	110.2	S150 E151 E152 E156 L157 E158	S150-V154 VanDerWaalsContact O-CG2 3.27Å; S150-V154 WeakPolarHBondContact O-CG2 3.48Å; S150-V154 PolarHBondContact O-N 2.99Å; E151-V154 PolarHBondContact O-N 2.93Å; E152-V154 VanDerWaalsContact C-N 3.33Å; E152-V154 PolarHBondContact O-N 2.92Å; V154-E156 VanDerWaalsContact C-N 3.34Å; V154-E156 PolarHBondContact O-N 3.42Å; V154-L157 PolarHBondContact O-N 2.8Å; V154-E158 HydrophobicContact CG1-CG 4.32Å; V154-E158 WeakPolarHBondContact O-CB 3.34Å; V154-E158 WeakPolarHBondContact O-CG 3.38Å; V154-E158 PolarHBondContact O-N 2.86Å
155	A	98.3	Very high	98	Very high	43 Å²	43	101.3 Å²	101.3	36%	0.355	54%	0.538	S	S	.	.	H	α-helix	trans	-62.2	-39.2	178	0	0	0	0	0	112.5	E151 E152 N159	E151-A155 WeakPolarHBondContact O-CB 3.39Å; E151-A155 PolarHBondContact O-N 3.41Å; E152-A155 PolarHBondContact O-N 3.2Å; A155-N159 WeakPolarHBondContact O-CB 3.45Å; A155-N159 PolarHBondContact O-N 3.24Å; A155-N159 PolarHBondContact O-ND2 3.47Å
156	E	98.1	Very high	98	Very high	111 Å²	111	98.9 Å²	98.9	52%	0.519	53%	0.532	S	S	.	.	H	α-helix	trans	-61.5	-48.3	172.8	-73.1	-176.9	168.1	0	0	111.6	E152 L153 V154 E158 N159 T160	E152-E156 WeakPolarHBondContact O-CG 3.45Å; E152-E156 PolarHBondContact O-N 3.4Å; L153-E156 PolarHBondContact O-N 2.95Å; V154-E156 VanDerWaalsContact C-N 3.34Å; V154-E156 PolarHBondContact O-N 3.42Å; E156-E158 PolarHBondContact O-N 3.44Å; E156-N159 PolarHBondContact O-N 2.95Å; E156-T160 WeakPolarHBondContact O-CG2 3.46Å; E156-T160 PolarHBondContact O-N 3.05Å
157	L	98.2	Very high	97.9	Very high	103 Å²	103	97 Å²	97	54%	0.539	53%	0.529	S	S	.	.	H	α-helix	trans	-62.1	-42.8	178.8	-72.5	174	0	0	0	111.8	L153 V154 N159 T160 L161	L153-L157 HydrophobicContact CD1-CD1 4.49Å; L153-L157 HydrophobicContact CD1-CG 4.45Å; L153-L157 HydrophobicContact CG-CD1 4.27Å; L153-L157 WeakPolarHBondContact O-CB 3.27Å; L153-L157 VanDerWaalsContact O-CG 3.3Å; L153-L157 WeakPolarHBondContact O-CG 3.3Å; L153-L157 PolarHBondContact O-N 3.34Å; V154-L157 PolarHBondContact O-N 2.8Å; L157-N159 VanDerWaalsContact C-N 3.34Å; L157-N159 PolarHBondContact O-N 2.88Å; L157-T160 PolarHBondContact O-N 3.44Å; L157-T160 PolarHBondContact O-OG1 3.2Å; L157-L161 WeakPolarHBondContact O-CB 3.39Å; L157-L161 PolarHBondContact O-N 3.44Å
158	E	98.2	Very high	97.8	Very high	127 Å²	127	100 Å²	100	59%	0.593	54%	0.535	S	S	*	.	H	α-helix	trans	-60.2	-42.7	175.2	-74.2	179.9	164.8	0	0	112.1	V154 E156 L161 K162	V154-E158 HydrophobicContact CG1-CG 4.32Å; V154-E158 WeakPolarHBondContact O-CB 3.34Å; V154-E158 WeakPolarHBondContact O-CG 3.38Å; V154-E158 PolarHBondContact O-N 2.86Å; E156-E158 PolarHBondContact O-N 3.44Å; E158-L161 PolarHBondContact O-N 3.47Å; E158-K162 WeakPolarHBondContact O-CB 3.5Å; E158-K162 PolarHBondContact O-N 2.95Å
159	N	97.5	Very high	97.8	Very high	113 Å²	113	103.5 Å²	103.5	60%	0.604	54%	0.54	S	S	*	.	H	α-helix	trans	-63.5	-42.9	175.9	-78.9	-45.3	0	0	0	112	A155 E156 L157 K162 G163	A155-N159 WeakPolarHBondContact O-CB 3.45Å; A155-N159 PolarHBondContact O-N 3.24Å; A155-N159 PolarHBondContact O-ND2 3.47Å; E156-N159 PolarHBondContact O-N 2.95Å; L157-N159 VanDerWaalsContact C-N 3.34Å; L157-N159 PolarHBondContact O-N 2.88Å; N159-K162 PolarHBondContact O-N 3.21Å; N159-G163 PolarHBondContact O-N 3.26Å
160	T	97	Very high	97.8	Very high	81 Å²	81	98.8 Å²	98.8	50%	0.497	53%	0.527	S	S	.	.	H	α-helix	trans	-65.7	-41.2	176.4	64.6	0	0	0	0	112	E156 L157 K162 G163 L164	E156-T160 WeakPolarHBondContact O-CG2 3.46Å; E156-T160 PolarHBondContact O-N 3.05Å; L157-T160 PolarHBondContact O-N 3.44Å; L157-T160 PolarHBondContact O-OG1 3.2Å; T160-K162 VanDerWaalsContact C-N 3.35Å; T160-K162 PolarHBondContact O-N 3.04Å; T160-G163 PolarHBondContact O-N 3.38Å; T160-L164 WeakPolarHBondContact O-CG 3.38Å; T160-L164 PolarHBondContact O-N 2.87Å
161	L	97.7	Very high	97.7	Very high	121 Å²	121	101.3 Å²	101.3	63%	0.634	53%	0.532	S	S	*	.	H	α-helix	trans	-60.7	-44.7	176.8	-170.7	78.2	0	0	0	110.9	L157 E158 G163 L164 A165	L157-L161 WeakPolarHBondContact O-CB 3.39Å; L157-L161 PolarHBondContact O-N 3.44Å; E158-L161 PolarHBondContact O-N 3.47Å; L161-G163 VanDerWaalsContact C-N 3.34Å; L161-G163 PolarHBondContact O-N 2.85Å; L161-L164 PolarHBondContact O-N 2.83Å; L161-A165 WeakPolarHBondContact O-CB 3.43Å; L161-A165 PolarHBondContact O-N 3.46Å
162	K	97.9	Very high	97.7	Very high	164 Å²	164	99 Å²	99	71%	0.713	52%	0.521	S	S	*	.	H	α-helix	trans	-60.4	-43.2	175.5	-173.4	178.6	-178.8	179.2	0	111.7	E158 N159 T160 A165 G166	E158-K162 WeakPolarHBondContact O-CB 3.5Å; E158-K162 PolarHBondContact O-N 2.95Å; N159-K162 PolarHBondContact O-N 3.21Å; T160-K162 VanDerWaalsContact C-N 3.35Å; T160-K162 PolarHBondContact O-N 3.04Å; K162-A165 PolarHBondContact O-N 3.09Å; K162-G166 PolarHBondContact O-N 3.49Å; K162-G166 VanDerWaalsContact O-N 3.09Å
163	G	97.5	Very high	97.6	Very high	39 Å²	39	97.1 Å²	97.1	40%	0.402	52%	0.515	S	S	.	.	H	α-helix	trans	-62.9	-43	175.4	0	0	0	0	0	113	N159 T160 L161 G166 K167	N159-G163 PolarHBondContact O-N 3.26Å; T160-G163 PolarHBondContact O-N 3.38Å; L161-G163 VanDerWaalsContact C-N 3.34Å; L161-G163 PolarHBondContact O-N 2.85Å; G163-G166 PolarHBondContact O-N 3.2Å; G163-K167 WeakPolarHBondContact O-CG 3.44Å; G163-K167 PolarHBondContact O-N 3.4Å
164	L	97.9	Very high	97.6	Very high	104 Å²	104	98.7 Å²	98.7	55%	0.545	52%	0.517	S	S	.	.	H	α-helix	trans	-66.6	-42.4	177	-72.5	174.5	0	0	0	112.1	T160 L161 G166 K167 W168	T160-L164 WeakPolarHBondContact O-CG 3.38Å; T160-L164 PolarHBondContact O-N 2.87Å; L161-L164 PolarHBondContact O-N 2.83Å; L164-G166 VanDerWaalsContact C-N 3.3Å; L164-G166 PolarHBondContact O-N 3.27Å; L164-K167 PolarHBondContact O-N 3.03Å; L164-W168 WeakPolarHBondContact O-CB 3.42Å; L164-W168 PolarHBondContact O-N 3.41Å
165	A	97.8	Very high	97.5	Very high	59 Å²	59	101.8 Å²	101.8	49%	0.488	53%	0.525	S	S	.	.	H	α-helix	trans	-58.9	-42.4	175.1	0	0	0	0	0	111.5	L161 K162 W168 K169	L161-A165 WeakPolarHBondContact O-CB 3.43Å; L161-A165 PolarHBondContact O-N 3.46Å; K162-A165 PolarHBondContact O-N 3.09Å; A165-W168 PolarHBondContact O-N 3.06Å; A165-K169 PolarHBondContact O-N 3.02Å
166	G	97.2	Very high	97.4	Very high	45 Å²	45	105.8 Å²	105.8	46%	0.464	54%	0.536	S	S	.	.	H	α-helix	trans	-62.2	-45.4	173.8	0	0	0	0	0	113.1	K162 G163 L164 K169 S170	K162-G166 PolarHBondContact O-N 3.49Å; K162-G166 VanDerWaalsContact O-N 3.09Å; G163-G166 PolarHBondContact O-N 3.2Å; L164-G166 VanDerWaalsContact C-N 3.3Å; L164-G166 PolarHBondContact O-N 3.27Å; G166-K169 PolarHBondContact O-N 3.42Å; G166-S170 PolarHBondContact O-N 2.9Å
167	K	97.6	Very high	97.3	Very high	147 Å²	147	106 Å²	106	64%	0.639	54%	0.538	S	S	*	.	H	α-helix	trans	-61.9	-43	175.7	-73.6	177.4	-177.1	178.1	0	112	G163 L164 S170 M171	G163-K167 WeakPolarHBondContact O-CG 3.44Å; G163-K167 PolarHBondContact O-N 3.4Å; L164-K167 PolarHBondContact O-N 3.03Å; K167-S170 PolarHBondContact O-N 3.25Å; K167-M171 WeakPolarHBondContact O-CG 3.45Å; K167-M171 PolarHBondContact O-N 3.38Å
168	W	96.4	Very high	97.2	Very high	170 Å²	170	104.6 Å²	104.6	64%	0.644	54%	0.536	S	S	*	.	H	α-helix	trans	-61.3	-45.5	178.3	-174.6	78.4	0	0	0	111.1	L164 A165 S170 M171 E172	L164-W168 WeakPolarHBondContact O-CB 3.42Å; L164-W168 PolarHBondContact O-N 3.41Å; A165-W168 PolarHBondContact O-N 3.06Å; W168-S170 VanDerWaalsContact C-N 3.31Å; W168-S170 PolarHBondContact O-N 3.18Å; W168-M171 PolarHBondContact O-N 3.37Å; W168-E172 PolarHBondContact O-N 2.9Å
169	K	97.4	Very high	97.2	Very high	125 Å²	125	100.7 Å²	100.7	54%	0.543	53%	0.525	S	S	.	.	H	α-helix	trans	-61.8	-38.8	176.2	-172.7	58.1	178.2	175	0	112.7	A165 G166 E172 I173	A165-K169 PolarHBondContact O-N 3.02Å; G166-K169 PolarHBondContact O-N 3.42Å; K169-E172 PolarHBondContact O-N 3.16Å; K169-I173 HydrophobicContact CG-CD1 4.49Å; K169-I173 WeakPolarHBondContact O-CG1 3.38Å; K169-I173 PolarHBondContact O-N 3.46Å; K169-I173 VanDerWaalsContact O-N 3.16Å
170	S	97.3	Very high	97.1	Very high	56 Å²	56	99.7 Å²	99.7	39%	0.392	52%	0.517	S	S	.	.	H	α-helix	trans	-65.6	-40.7	174.9	-178.7	0	0	0	0	112.5	G166 K167 W168 I173 K174	G166-S170 PolarHBondContact O-N 2.9Å; K167-S170 PolarHBondContact O-N 3.25Å; W168-S170 VanDerWaalsContact C-N 3.31Å; W168-S170 PolarHBondContact O-N 3.18Å; S170-I173 PolarHBondContact O-N 3.05Å; S170-K174 WeakPolarHBondContact O-CG 3.36Å; S170-K174 PolarHBondContact O-N 3.4Å
171	M	97	Very high	97.1	Very high	121 Å²	121	100.7 Å²	100.7	60%	0.596	52%	0.518	S	S	*	.	H	α-helix	trans	-65	-39.1	175.8	-74.3	-66.1	-67.4	0	0	112	K167 W168 I173 K174 K175	K167-M171 WeakPolarHBondContact O-CG 3.45Å; K167-M171 PolarHBondContact O-N 3.38Å; W168-M171 PolarHBondContact O-N 3.37Å; M171-I173 VanDerWaalsContact C-N 3.34Å; M171-I173 PolarHBondContact O-N 2.88Å; M171-K174 PolarHBondContact O-N 2.94Å; M171-K175 WeakPolarHBondContact O-CB 3.41Å; M171-K175 PolarHBondContact O-N 3.49Å
172	E	97.3	Very high	97.1	Very high	66 Å²	66	100.3 Å²	100.3	31%	0.308	51%	0.514	S	S	.	.	H	α-helix	trans	-63.1	-42.1	176.7	-163.2	62.4	-161.6	0	0	111.4	W168 K169 K174 K175 E176	W168-E172 PolarHBondContact O-N 2.9Å; K169-E172 PolarHBondContact O-N 3.16Å; E172-K174 PolarHBondContact O-N 3.48Å; E172-K175 PolarHBondContact O-N 2.99Å; E172-E176 PolarHBondContact O-N 3.29Å
173	I	97.4	Very high	97	Very high	83 Å²	83	97.2 Å²	97.2	43%	0.426	50%	0.5	S	S	.	.	H	α-helix	trans	-62	-44.1	174.5	-66.9	165.2	0	0	0	111	K169 S170 M171 K175 E176 Q177	K169-I173 HydrophobicContact CG-CD1 4.49Å; K169-I173 WeakPolarHBondContact O-CG1 3.38Å; K169-I173 PolarHBondContact O-N 3.46Å; K169-I173 VanDerWaalsContact O-N 3.16Å; S170-I173 PolarHBondContact O-N 3.05Å; M171-I173 VanDerWaalsContact C-N 3.34Å; M171-I173 PolarHBondContact O-N 2.88Å; I173-K175 VanDerWaalsContact C-N 3.3Å; I173-K175 PolarHBondContact O-N 2.93Å; I173-E176 PolarHBondContact O-N 3.22Å; I173-Q177 WeakPolarHBondContact O-CG 3.49Å; I173-Q177 PolarHBondContact O-N 3.22Å
174	K	96.6	Very high	97	Very high	125 Å²	125	99 Å²	99	54%	0.543	50%	0.501	S	S	.	.	H	α-helix	trans	-63.9	-37.2	177.8	-74.4	-178.7	179.2	-175.9	0	112.4	S170 M171 E172 S178	S170-K174 WeakPolarHBondContact O-CG 3.36Å; S170-K174 PolarHBondContact O-N 3.4Å; M171-K174 PolarHBondContact O-N 2.94Å; E172-K174 PolarHBondContact O-N 3.48Å; K174-S178 WeakPolarHBondContact O-CB 3.4Å; K174-S178 PolarHBondContact O-N 3.25Å
175	K	96.4	Very high	96.9	Very high	135 Å²	135	98.3 Å²	98.3	59%	0.587	50%	0.497	S	S	*	.	H	α-helix	trans	-64.7	-46.2	176.4	-177.7	-172.7	169.6	-161.1	0	110.9	M171 E172 I173 Q177 S178 A179	M171-K175 WeakPolarHBondContact O-CB 3.41Å; M171-K175 PolarHBondContact O-N 3.49Å; E172-K175 PolarHBondContact O-N 2.99Å; I173-K175 VanDerWaalsContact C-N 3.3Å; I173-K175 PolarHBondContact O-N 2.93Å; K175-Q177 PolarHBondContact O-N 3.41Å; K175-S178 PolarHBondContact O-N 3.49Å; K175-A179 PolarHBondContact O-N 3.45Å
176	E	96.8	Very high	96.8	Very high	126 Å²	126	101 Å²	101	59%	0.589	50%	0.499	S	S	*	.	H	α-helix	trans	-60.3	-45.4	176.1	-169.2	65	-163.1	0	0	111.5	E172 I173 S178 A179 E180	E172-E176 PolarHBondContact O-N 3.29Å; I173-E176 PolarHBondContact O-N 3.22Å; E176-S178 VanDerWaalsContact C-N 3.33Å; E176-S178 PolarHBondContact O-N 2.98Å; E176-A179 PolarHBondContact O-N 2.95Å; E176-E180 PolarHBondContact O-N 3.33Å
177	Q	96.9	Very high	96.8	Very high	117 Å²	117	103.9 Å²	103.9	55%	0.547	50%	0.501	S	S	.	.	H	α-helix	trans	-60.3	-41.3	175.3	-73.4	175.4	-18.6	0	0	112.5	I173 K175 I181	I173-Q177 WeakPolarHBondContact O-CG 3.49Å; I173-Q177 PolarHBondContact O-N 3.22Å; K175-Q177 PolarHBondContact O-N 3.41Å; Q177-I181 WeakPolarHBondContact O-CD1 3.4Å; Q177-I181 VanDerWaalsContact O-CG1 3.28Å; Q177-I181 WeakPolarHBondContact O-CG1 3.33Å; Q177-I181 PolarHBondContact O-N 3.45Å; Q177-I181 VanDerWaalsContact O-N 3.13Å
178	S	96.5	Very high	96.7	Very high	72 Å²	72	104.7 Å²	104.7	50%	0.503	50%	0.5	S	S	.	.	H	α-helix	trans	-65.7	-39	177	-168.3	0	0	0	0	111.9	K174 K175 E176 I181 E182	K174-S178 WeakPolarHBondContact O-CB 3.4Å; K174-S178 PolarHBondContact O-N 3.25Å; K175-S178 PolarHBondContact O-N 3.49Å; E176-S178 VanDerWaalsContact C-N 3.33Å; E176-S178 PolarHBondContact O-N 2.98Å; S178-I181 PolarHBondContact O-N 3.36Å; S178-E182 WeakPolarHBondContact O-CB 3.5Å; S178-E182 PolarHBondContact O-N 3.13Å
179	A	96.5	Very high	96.7	Very high	45 Å²	45	101.6 Å²	101.6	37%	0.372	50%	0.495	S	S	.	.	H	α-helix	trans	-67.4	-39.3	178.3	0	0	0	0	0	112	K175 E176 E182 K183	K175-A179 PolarHBondContact O-N 3.45Å; E176-A179 PolarHBondContact O-N 2.95Å; A179-E182 PolarHBondContact O-N 2.99Å; A179-K183 WeakPolarHBondContact O-CB 3.28Å; A179-K183 PolarHBondContact O-N 3.19Å
180	E	96.9	Very high	96.7	Very high	92 Å²	92	99.6 Å²	99.6	43%	0.43	50%	0.497	S	S	.	.	H	α-helix	trans	-64.2	-43.8	175.1	-168.8	65.8	-166.5	0	0	111.3	E176 E182 K183 D184	E176-E180 PolarHBondContact O-N 3.33Å; E180-E182 VanDerWaalsContact C-N 3.32Å; E180-E182 PolarHBondContact O-N 2.98Å; E180-K183 PolarHBondContact O-N 3.44Å; E180-D184 PolarHBondContact O-N 2.89Å
181	I	96.7	Very high	96.7	Very high	102 Å²	102	100.7 Å²	100.7	52%	0.523	50%	0.501	S	S	.	.	H	α-helix	trans	-62.1	-41.2	175.5	-67.3	165.9	0	0	0	111.1	Q177 S178 D184 L185	Q177-I181 WeakPolarHBondContact O-CD1 3.4Å; Q177-I181 VanDerWaalsContact O-CG1 3.28Å; Q177-I181 WeakPolarHBondContact O-CG1 3.33Å; Q177-I181 PolarHBondContact O-N 3.45Å; Q177-I181 VanDerWaalsContact O-N 3.13Å; S178-I181 PolarHBondContact O-N 3.36Å; I181-D184 PolarHBondContact O-N 2.84Å; I181-L185 HydrophobicContact CG2-CD1 4.02Å; I181-L185 HydrophobicContact CG2-CG 4.41Å; I181-L185 WeakPolarHBondContact O-CB 3.48Å; I181-L185 VanDerWaalsContact O-CG 3.27Å; I181-L185 WeakPolarHBondContact O-CG 3.27Å; I181-L185 PolarHBondContact O-N 3.19Å
182	E	96.3	Very high	96.7	Very high	114 Å²	114	99.6 Å²	99.6	53%	0.533	50%	0.497	S	S	.	.	H	α-helix	trans	-61.6	-46.6	178.1	-173.2	170.3	-167.8	0	0	111	S178 A179 E180 D184 L185 E186	S178-E182 WeakPolarHBondContact O-CB 3.5Å; S178-E182 PolarHBondContact O-N 3.13Å; A179-E182 PolarHBondContact O-N 2.99Å; E180-E182 VanDerWaalsContact C-N 3.32Å; E180-E182 PolarHBondContact O-N 2.98Å; E182-D184 PolarHBondContact O-N 3.44Å; E182-L185 PolarHBondContact O-N 2.99Å; E182-E186 WeakPolarHBondContact O-CG 3.26Å; E182-E186 PolarHBondContact O-N 2.96Å
183	K	96.8	Very high	96.7	Very high	99 Å²	99	99.7 Å²	99.7	43%	0.43	50%	0.502	S	S	.	.	H	α-helix	trans	-59.9	-45.8	175.2	-176.6	-172.2	167.6	-154.3	0	112.5	A179 E180 L185 E186 E187	A179-K183 WeakPolarHBondContact O-CB 3.28Å; A179-K183 PolarHBondContact O-N 3.19Å; E180-K183 PolarHBondContact O-N 3.44Å; K183-L185 VanDerWaalsContact C-N 3.27Å; K183-L185 PolarHBondContact O-N 3.36Å; K183-E186 PolarHBondContact O-N 3.34Å; K183-E187 VanDerWaalsContact CE-OE1 3.26Å; K183-E187 WeakPolarHBondContact CE-OE1 3.26Å; K183-E187 WeakPolarHBondContact O-CG 3.3Å; K183-E187 PolarHBondContact O-N 2.89Å
184	D	96.5	Very high	96.6	Very high	77 Å²	77	101.3 Å²	101.3	41%	0.412	51%	0.508	S	S	.	.	H	α-helix	trans	-59.5	-39.7	176.2	-80.8	-11.5	0	0	0	111.8	E180 I181 E182 R188	E180-D184 PolarHBondContact O-N 2.89Å; I181-D184 PolarHBondContact O-N 2.84Å; E182-D184 PolarHBondContact O-N 3.44Å; D184-R188 WeakPolarHBondContact O-CB 3.48Å; D184-R188 VanDerWaalsContact O-CG 3.23Å; D184-R188 WeakPolarHBondContact O-CG 3.41Å; D184-R188 PolarHBondContact O-N 3.48Å
185	L	96.2	Very high	96.7	Very high	88 Å²	88	100.3 Å²	100.3	46%	0.461	51%	0.505	S	S	.	.	H	α-helix	trans	-68.9	-39.7	176.6	-71.7	174.4	0	0	0	111.7	I181 E182 K183 R188 L189	I181-L185 HydrophobicContact CG2-CD1 4.02Å; I181-L185 HydrophobicContact CG2-CG 4.41Å; I181-L185 WeakPolarHBondContact O-CB 3.48Å; I181-L185 VanDerWaalsContact O-CG 3.27Å; I181-L185 WeakPolarHBondContact O-CG 3.27Å; I181-L185 PolarHBondContact O-N 3.19Å; E182-L185 PolarHBondContact O-N 2.99Å; K183-L185 VanDerWaalsContact C-N 3.27Å; K183-L185 PolarHBondContact O-N 3.36Å; L185-R188 PolarHBondContact O-N 3.48Å; L185-L189 VanDerWaalsContact O-CB 3.3Å; L185-L189 WeakPolarHBondContact O-CB 3.23Å; L185-L189 VanDerWaalsContact O-CG 3.26Å; L185-L189 WeakPolarHBondContact O-CG 3.21Å; L185-L189 PolarHBondContact O-N 3.41Å
186	E	96.8	Very high	96.7	Very high	117 Å²	117	97.7 Å²	97.7	55%	0.547	50%	0.5	S	S	.	.	H	α-helix	trans	-62.6	-45.3	175.1	-74.2	-179.4	166.7	0	0	112.1	E182 K183 L189 S190	E182-E186 WeakPolarHBondContact O-CG 3.26Å; E182-E186 PolarHBondContact O-N 2.96Å; K183-E186 PolarHBondContact O-N 3.34Å; E186-L189 PolarHBondContact O-N 2.9Å; E186-S190 WeakPolarHBondContact O-CB 3.38Å; E186-S190 PolarHBondContact O-N 2.93Å
187	E	96.1	Very high	96.7	Very high	104 Å²	104	97.9 Å²	97.9	49%	0.486	50%	0.499	S	S	.	.	H	α-helix	trans	-61.7	-45.7	176.3	-72.4	-177.8	-171.3	0	0	111.2	K183 L189 S190 V191	K183-E187 VanDerWaalsContact CE-OE1 3.26Å; K183-E187 WeakPolarHBondContact CE-OE1 3.26Å; K183-E187 WeakPolarHBondContact O-CG 3.3Å; K183-E187 PolarHBondContact O-N 2.89Å; E187-L189 PolarHBondContact O-N 3.06Å; E187-S190 WeakPolarHBondContact O-CB 3.42Å; E187-S190 PolarHBondContact O-N 3.32Å; E187-V191 WeakPolarHBondContact O-CG2 3.46Å; E187-V191 PolarHBondContact O-N 3Å
188	R	96.5	Very high	96.6	Very high	164 Å²	164	96.9 Å²	96.9	62%	0.619	49%	0.494	S	S	*	.	H	α-helix	trans	-63	-41.3	175.9	-74.4	173.9	65.6	-177.7	0.2	112.4	D184 L185 S190 V191 L192	D184-R188 WeakPolarHBondContact O-CB 3.48Å; D184-R188 VanDerWaalsContact O-CG 3.23Å; D184-R188 WeakPolarHBondContact O-CG 3.41Å; D184-R188 PolarHBondContact O-N 3.48Å; L185-R188 PolarHBondContact O-N 3.48Å; R188-S190 VanDerWaalsContact C-N 3.32Å; R188-V191 PolarHBondContact O-N 3.32Å; R188-L192 WeakPolarHBondContact O-CB 3.3Å; R188-L192 VanDerWaalsContact O-CG 3.3Å; R188-L192 WeakPolarHBondContact O-CG 3.35Å; R188-L192 PolarHBondContact O-N 3.43Å
189	L	96.8	Very high	96.6	Very high	106 Å²	106	96.1 Å²	96.1	56%	0.555	49%	0.492	S	S	*	.	H	α-helix	trans	-62.6	-40.7	175.4	-81.1	170	0	0	0	111.1	L185 E186 E187 L192 T193	L185-L189 VanDerWaalsContact O-CB 3.3Å; L185-L189 WeakPolarHBondContact O-CB 3.23Å; L185-L189 VanDerWaalsContact O-CG 3.26Å; L185-L189 WeakPolarHBondContact O-CG 3.21Å; L185-L189 PolarHBondContact O-N 3.41Å; E186-L189 PolarHBondContact O-N 2.9Å; E187-L189 PolarHBondContact O-N 3.06Å; L189-L192 PolarHBondContact O-N 2.67Å; L189-T193 WeakPolarHBondContact O-CB 3.43Å; L189-T193 PolarHBondContact O-N 2.92Å; L189-T193 PolarHBondContact O-OG1 3.08Å
190	S	96.6	Very high	96.6	Very high	82 Å²	82	99.2 Å²	99.2	57%	0.573	50%	0.499	S	S	*	.	H	α-helix	trans	-61.6	-48.5	176.1	-175	0	0	0	0	111.8	E186 E187 R188 T193 H194	E186-S190 WeakPolarHBondContact O-CB 3.38Å; E186-S190 PolarHBondContact O-N 2.93Å; E187-S190 WeakPolarHBondContact O-CB 3.42Å; E187-S190 PolarHBondContact O-N 3.32Å; R188-S190 VanDerWaalsContact C-N 3.32Å; S190-T193 PolarHBondContact O-N 2.82Å; S190-H194 PolarHBondContact O-N 3.47Å
191	V	97.2	Very high	96.5	Very high	79 Å²	79	101.5 Å²	101.5	48%	0.479	51%	0.508	S	S	.	.	H	α-helix	trans	-60.9	-47.9	176.5	173.1	0	0	0	0	111.3	E187 R188 T193 H194 H195	E187-V191 WeakPolarHBondContact O-CG2 3.46Å; E187-V191 PolarHBondContact O-N 3Å; R188-V191 PolarHBondContact O-N 3.32Å; V191-T193 VanDerWaalsContact C-N 3.33Å; V191-T193 PolarHBondContact O-N 2.89Å; V191-H194 PolarHBondContact O-N 3.21Å; V191-H195 PolarHBondContact O-N 2.92Å
192	L	96.6	Very high	96.5	Very high	98 Å²	98	104.6 Å²	104.6	51%	0.513	51%	0.513	S	S	.	.	H	α-helix	trans	-63	-40.8	178.4	-75.1	170.8	0	0	0	111.7	R188 L189 H194 H195 V196	R188-L192 WeakPolarHBondContact O-CB 3.3Å; R188-L192 VanDerWaalsContact O-CG 3.3Å; R188-L192 WeakPolarHBondContact O-CG 3.35Å; R188-L192 PolarHBondContact O-N 3.43Å; L189-L192 PolarHBondContact O-N 2.67Å; L192-H194 VanDerWaalsContact C-N 3.31Å; L192-H194 PolarHBondContact O-N 3.23Å; L192-H195 PolarHBondContact O-N 3.31Å; L192-V196 VanDerWaalsContact O-CG2 3.31Å; L192-V196 WeakPolarHBondContact O-CG2 3.31Å; L192-V196 PolarHBondContact O-N 3.46Å
193	T	97.2	Very high	96.4	Very high	69 Å²	69	101.4 Å²	101.4	42%	0.423	51%	0.506	S	S	.	.	H	α-helix	trans	-62.8	-40	176.1	-60	0	0	0	0	111.1	L189 S190 V191 K197	L189-T193 WeakPolarHBondContact O-CB 3.43Å; L189-T193 PolarHBondContact O-N 2.92Å; L189-T193 PolarHBondContact O-OG1 3.08Å; S190-T193 PolarHBondContact O-N 2.82Å; V191-T193 VanDerWaalsContact C-N 3.33Å; V191-T193 PolarHBondContact O-N 2.89Å; T193-K197 HydrophobicContact CG2-CD 4.47Å; T193-K197 WeakPolarHBondContact O-CG 3.27Å; T193-K197 PolarHBondContact O-N 3.22Å; T193-K197 VanDerWaalsContact O-N 3.08Å
194	H	96.7	Very high	96.4	Very high	116 Å²	116	101.4 Å²	101.4	54%	0.537	51%	0.511	S	S	.	.	H	α-helix	trans	-64.7	-46.6	174.7	-177.1	64	0	0	0	112	S190 V191 L192 V196 K197 E198	S190-H194 PolarHBondContact O-N 3.47Å; V191-H194 PolarHBondContact O-N 3.21Å; L192-H194 VanDerWaalsContact C-N 3.31Å; L192-H194 PolarHBondContact O-N 3.23Å; H194-V196 VanDerWaalsContact C-N 3.33Å; H194-V196 PolarHBondContact O-N 2.89Å; H194-K197 PolarHBondContact O-N 3.45Å; H194-E198 PolarHBondContact O-N 3.41Å
195	H	96.8	Very high	96.3	Very high	105 Å²	105	100.9 Å²	100.9	49%	0.486	51%	0.51	S	S	.	.	H	α-helix	trans	-60.7	-39.7	176.3	-75.3	173.8	0	0	0	112.9	V191 L192 E198 A199	V191-H195 PolarHBondContact O-N 2.92Å; L192-H195 PolarHBondContact O-N 3.31Å; H195-E198 PolarHBondContact O-N 3.47Å; H195-A199 VanDerWaalsContact O-CB 3.27Å; H195-A199 WeakPolarHBondContact O-CB 3.32Å; H195-A199 PolarHBondContact O-N 3.07Å
196	V	96.7	Very high	96.2	Very high	79 Å²	79	99.1 Å²	99.1	48%	0.479	51%	0.509	S	S	.	.	H	α-helix	trans	-62.1	-47.8	175.1	169.2	0	0	0	0	110	L192 H194 E198 A199 E200	L192-V196 VanDerWaalsContact O-CG2 3.31Å; L192-V196 WeakPolarHBondContact O-CG2 3.31Å; L192-V196 PolarHBondContact O-N 3.46Å; H194-V196 VanDerWaalsContact C-N 3.33Å; H194-V196 PolarHBondContact O-N 2.89Å; V196-E198 VanDerWaalsContact C-N 3.34Å; V196-E198 PolarHBondContact O-N 2.93Å; V196-A199 PolarHBondContact O-N 3.34Å; V196-E200 HydrophobicContact CG1-CG 4.3Å; V196-E200 WeakPolarHBondContact O-CB 3.4Å; V196-E200 VanDerWaalsContact O-CG 3.3Å; V196-E200 WeakPolarHBondContact O-CG 3.41Å; V196-E200 PolarHBondContact O-N 3.49Å
197	K	96.5	Very high	96.1	Very high	131 Å²	131	99.4 Å²	99.4	57%	0.57	51%	0.51	S	S	*	.	H	α-helix	trans	-61.3	-40.1	177.2	-73.5	175	179.6	178.3	0	113.1	T193 H194 E200 F201	T193-K197 HydrophobicContact CG2-CD 4.47Å; T193-K197 WeakPolarHBondContact O-CG 3.27Å; T193-K197 PolarHBondContact O-N 3.22Å; T193-K197 VanDerWaalsContact O-N 3.08Å; H194-K197 PolarHBondContact O-N 3.45Å; K197-E200 PolarHBondContact O-N 2.82Å; K197-F201 WeakPolarHBondContact O-CB 3.37Å; K197-F201 PolarHBondContact O-N 3.4Å
198	E	95.9	Very high	96	Very high	95 Å²	95	97.3 Å²	97.3	44%	0.444	51%	0.51	S	S	.	.	H	α-helix	trans	-67.1	-40.6	176.8	-168.8	-175.2	167.7	0	0	111.3	H194 H195 V196 F201 R202	H194-E198 PolarHBondContact O-N 3.41Å; H195-E198 PolarHBondContact O-N 3.47Å; V196-E198 VanDerWaalsContact C-N 3.34Å; V196-E198 PolarHBondContact O-N 2.93Å; E198-F201 PolarHBondContact O-N 3.43Å; E198-R202 WeakPolarHBondContact O-CB 3.3Å; E198-R202 WeakPolarHBondContact O-CG 3.44Å; E198-R202 PolarHBondContact O-N 2.84Å
199	A	96	Very high	96	Very high	57 Å²	57	94.4 Å²	94.4	47%	0.471	50%	0.504	S	S	.	.	H	α-helix	trans	-65.1	-41.6	175.1	0	0	0	0	0	112	H195 V196 R202 A203	H195-A199 VanDerWaalsContact O-CB 3.27Å; H195-A199 WeakPolarHBondContact O-CB 3.32Å; H195-A199 PolarHBondContact O-N 3.07Å; V196-A199 PolarHBondContact O-N 3.34Å; A199-R202 PolarHBondContact O-N 2.87Å; A199-A203 WeakPolarHBondContact O-CB 3.46Å; A199-A203 PolarHBondContact O-N 3.39Å
200	E	96.1	Very high	95.9	Very high	109 Å²	109	93.3 Å²	93.3	51%	0.509	50%	0.501	S	S	.	.	H	α-helix	trans	-60.9	-49.4	173.6	-74.7	173.1	162.3	0	0	110.9	V196 K197 R202 A203 D204	V196-E200 HydrophobicContact CG1-CG 4.3Å; V196-E200 WeakPolarHBondContact O-CB 3.4Å; V196-E200 VanDerWaalsContact O-CG 3.3Å; V196-E200 WeakPolarHBondContact O-CG 3.41Å; V196-E200 PolarHBondContact O-N 3.49Å; K197-E200 PolarHBondContact O-N 2.82Å; E200-R202 VanDerWaalsContact C-N 3.31Å; E200-R202 PolarHBondContact O-N 3.21Å; E200-A203 WeakPolarHBondContact O-CB 3.34Å; E200-A203 PolarHBondContact O-N 2.9Å; E200-A203 VanDerWaalsContact O-N 3.07Å; E200-D204 PolarHBondContact O-N 2.95Å
201	F	95.5	Very high	95.8	Very high	140 Å²	140	94.2 Å²	94.2	61%	0.614	50%	0.5	S	S	*	.	H	α-helix	trans	-60.3	-39.8	176.9	-179.5	-99.3	0	0	0	112.7	K197 E198 D204 T205	K197-F201 WeakPolarHBondContact O-CB 3.37Å; K197-F201 PolarHBondContact O-N 3.4Å; E198-F201 PolarHBondContact O-N 3.43Å; F201-D204 PolarHBondContact O-N 3.01Å; F201-T205 HydrophobicContact CD1-CG2 4.37Å; F201-T205 HydrophobicContact CE1-CG2 3.94Å; F201-T205 HydrophobicContact CE2-CG2 4.31Å; F201-T205 HydrophobicContact CZ-CG2 3.91Å; F201-T205 WeakPolarHBondContact O-CG2 3.42Å; F201-T205 PolarHBondContact O-N 2.98Å; F201-T205 PolarHBondContact O-OG1 3.15Å
202	R	95.8	Very high	95.7	Very high	168 Å²	168	95.2 Å²	95.2	63%	0.634	50%	0.495	S	S	*	.	H	α-helix	trans	-66.1	-37.5	173.9	-77.6	177.6	58.7	-174.1	-4.7	112.5	E198 A199 E200 T205 A206	E198-R202 WeakPolarHBondContact O-CB 3.3Å; E198-R202 WeakPolarHBondContact O-CG 3.44Å; E198-R202 PolarHBondContact O-N 2.84Å; A199-R202 PolarHBondContact O-N 2.87Å; E200-R202 VanDerWaalsContact C-N 3.31Å; E200-R202 PolarHBondContact O-N 3.21Å; R202-T205 WeakPolarHBondContact CA-OG1 3.44Å; R202-T205 PolarHBondContact O-OG1 2.89Å; R202-A206 WeakPolarHBondContact O-CB 3.41Å; R202-A206 PolarHBondContact O-N 3.44Å; R202-A206 VanDerWaalsContact O-N 3.08Å
203	A	96	Very high	95.5	Very high	46 Å²	46	96.4 Å²	96.4	38%	0.38	49%	0.493	S	S	.	.	H	α-helix	trans	-65.9	-47.5	174.8	0	0	0	0	0	110.6	A199 E200 T205 A206 E207	A199-A203 WeakPolarHBondContact O-CB 3.46Å; A199-A203 PolarHBondContact O-N 3.39Å; E200-A203 WeakPolarHBondContact O-CB 3.34Å; E200-A203 PolarHBondContact O-N 2.9Å; E200-A203 VanDerWaalsContact O-N 3.07Å; A203-T205 VanDerWaalsContact C-N 3.35Å; A203-T205 PolarHBondContact O-N 2.81Å; A203-A206 PolarHBondContact O-N 3.19Å; A203-E207 WeakPolarHBondContact O-CB 3.36Å; A203-E207 WeakPolarHBondContact O-CG 3.34Å; A203-E207 PolarHBondContact O-N 3.38Å
204	D	95.8	Very high	95.3	Very high	100 Å²	100	97.9 Å²	97.9	54%	0.535	50%	0.497	S	S	.	.	H	α-helix	trans	-59.3	-43.4	178.6	-73.7	-16.1	0	0	0	112.2	E200 F201 E207 A208	E200-D204 PolarHBondContact O-N 2.95Å; F201-D204 PolarHBondContact O-N 3.01Å; D204-E207 PolarHBondContact O-N 3.5Å; D204-A208 WeakPolarHBondContact O-CB 3.33Å; D204-A208 PolarHBondContact O-N 3.08Å
205	T	95.3	Very high	95.2	Very high	66 Å²	66	97.7 Å²	97.7	41%	0.405	50%	0.498	S	S	.	.	H	α-helix	trans	-66.5	-41.4	177.1	48.8	0	0	0	0	112.1	F201 R202 A203 A208 E209	F201-T205 HydrophobicContact CD1-CG2 4.37Å; F201-T205 HydrophobicContact CE1-CG2 3.94Å; F201-T205 HydrophobicContact CE2-CG2 4.31Å; F201-T205 HydrophobicContact CZ-CG2 3.91Å; F201-T205 WeakPolarHBondContact O-CG2 3.42Å; F201-T205 PolarHBondContact O-N 2.98Å; F201-T205 PolarHBondContact O-OG1 3.15Å; R202-T205 WeakPolarHBondContact CA-OG1 3.44Å; R202-T205 PolarHBondContact O-OG1 2.89Å; A203-T205 VanDerWaalsContact C-N 3.35Å; A203-T205 PolarHBondContact O-N 2.81Å; T205-A208 PolarHBondContact O-N 2.96Å; T205-E209 PolarHBondContact O-N 3.28Å
206	A	94.6	Very high	95	Very high	51 Å²	51	96.6 Å²	96.6	42%	0.421	49%	0.493	S	S	.	.	H	α-helix	trans	-64.7	-42.3	174.7	0	0	0	0	0	111.8	R202 A203 E209 V210	R202-A206 WeakPolarHBondContact O-CB 3.41Å; R202-A206 PolarHBondContact O-N 3.44Å; R202-A206 VanDerWaalsContact O-N 3.08Å; A203-A206 PolarHBondContact O-N 3.19Å; A206-E209 PolarHBondContact O-N 3.39Å; A206-V210 WeakPolarHBondContact O-CB 3.28Å; A206-V210 VanDerWaalsContact O-CG2 3.28Å; A206-V210 WeakPolarHBondContact O-CG2 3.49Å; A206-V210 PolarHBondContact O-N 3.04Å
207	E	94.3	Very high	94.8	Very high	123 Å²	123	97.2 Å²	97.2	58%	0.575	49%	0.493	S	S	*	.	H	α-helix	trans	-63.2	-43	175.6	-76.9	-169.7	179	0	0	111.9	A203 D204 E209 V210 N211	A203-E207 WeakPolarHBondContact O-CB 3.36Å; A203-E207 WeakPolarHBondContact O-CG 3.34Å; A203-E207 PolarHBondContact O-N 3.38Å; D204-E207 PolarHBondContact O-N 3.5Å; E207-E209 VanDerWaalsContact C-N 3.33Å; E207-E209 PolarHBondContact O-N 2.93Å; E207-V210 PolarHBondContact O-N 3.44Å; E207-N211 WeakPolarHBondContact O-CB 3.4Å; E207-N211 VanDerWaalsContact O-CG 3.31Å; E207-N211 PolarHBondContact O-N 2.87Å; E207-N211 PolarHBondContact O-ND2 2.86Å; E207-N211 VanDerWaalsContact O-ND2 3.15Å
208	A	94.3	Very high	94.6	Very high	60 Å²	60	97.3 Å²	97.3	50%	0.496	49%	0.493	S	S	.	.	H	α-helix	trans	-61.1	-41.9	174.9	0	0	0	0	0	111.7	D204 T205 N211 R212	D204-A208 WeakPolarHBondContact O-CB 3.33Å; D204-A208 PolarHBondContact O-N 3.08Å; T205-A208 PolarHBondContact O-N 2.96Å; A208-N211 PolarHBondContact O-N 3.41Å; A208-R212 PolarHBondContact O-N 3.3Å
209	E	94.8	Very high	94.4	Very high	102 Å²	102	97.6 Å²	97.6	48%	0.477	49%	0.493	S	S	.	.	H	α-helix	trans	-67.1	-42.1	176.2	-178	153.3	-148.5	0	0	112.2	T205 A206 E207 N211 R212 R213	T205-E209 PolarHBondContact O-N 3.28Å; A206-E209 PolarHBondContact O-N 3.39Å; E207-E209 VanDerWaalsContact C-N 3.33Å; E207-E209 PolarHBondContact O-N 2.93Å; E209-N211 VanDerWaalsContact C-N 3.34Å; E209-N211 PolarHBondContact O-N 3.46Å; E209-R212 PolarHBondContact O-N 2.99Å; E209-R212 IonicContact OE1-NH2 2.75Å; E209-R212 PolarHBondContact OE1-NH2 3.41Å; E209-R213 HydrophobicContact CG-CG 4.49Å; E209-R213 WeakPolarHBondContact O-CG 3.27Å; E209-R213 PolarHBondContact O-N 3Å
210	V	95.4	Very high	94.2	Very high	84 Å²	84	97.1 Å²	97.1	51%	0.509	49%	0.489	S	S	.	.	H	α-helix	trans	-57.9	-47.1	173.1	167.9	0	0	0	0	110.4	A206 E207 R212 R213 L214	A206-V210 WeakPolarHBondContact O-CB 3.28Å; A206-V210 VanDerWaalsContact O-CG2 3.28Å; A206-V210 WeakPolarHBondContact O-CG2 3.49Å; A206-V210 PolarHBondContact O-N 3.04Å; E207-V210 PolarHBondContact O-N 3.44Å; V210-R212 PolarHBondContact O-N 3.45Å; V210-R213 PolarHBondContact O-N 3.22Å; V210-L214 HydrophobicContact CG1-CD1 4.01Å; V210-L214 HydrophobicContact CG1-CG 4.37Å; V210-L214 WeakPolarHBondContact O-CG 3.43Å; V210-L214 PolarHBondContact O-N 2.9Å
211	N	94.3	Very high	93.9	Very high	101 Å²	101	98.6 Å²	98.6	54%	0.54	49%	0.494	S	S	.	.	H	α-helix	trans	-61.9	-41.2	178.1	-75.9	-35.8	0	0	0	112.5	E207 A208 E209 L214 M215	E207-N211 WeakPolarHBondContact O-CB 3.4Å; E207-N211 VanDerWaalsContact O-CG 3.31Å; E207-N211 PolarHBondContact O-N 2.87Å; E207-N211 PolarHBondContact O-ND2 2.86Å; E207-N211 VanDerWaalsContact O-ND2 3.15Å; A208-N211 PolarHBondContact O-N 3.41Å; E209-N211 VanDerWaalsContact C-N 3.34Å; E209-N211 PolarHBondContact O-N 3.46Å; N211-L214 PolarHBondContact O-N 3.32Å; N211-M215 PolarHBondContact O-N 3.45Å
212	R	94.5	Very high	93.7	Very high	100 Å²	100	96.6 Å²	96.6	38%	0.377	49%	0.486	S	S	.	.	H	α-helix	trans	-60.6	-47.1	173.4	-178.2	-173.8	64.6	87.9	-7.2	111.5	A208 E209 V210 L214 M215 E216	A208-R212 PolarHBondContact O-N 3.3Å; E209-R212 PolarHBondContact O-N 2.99Å; E209-R212 IonicContact OE1-NH2 2.75Å; E209-R212 PolarHBondContact OE1-NH2 3.41Å; V210-R212 PolarHBondContact O-N 3.45Å; R212-L214 PolarHBondContact O-N 3.43Å; R212-M215 PolarHBondContact O-N 2.86Å; R212-E216 IonicContact CZ-OE1 3.48Å; R212-E216 VanDerWaalsContact NH1-CD 3.33Å; R212-E216 IonicContact NH1-OE1 2.85Å; R212-E216 PolarHBondContact NH1-OE1 2.96Å; R212-E216 IonicContact NH1-OE2 3.81Å; R212-E216 PolarHBondContact NH1-OE2 3.27Å; R212-E216 PolarHBondContact O-N 2.67Å
213	R	93.1	Very high	93.3	Very high	123 Å²	123	96.6 Å²	96.6	46%	0.464	49%	0.486	S	S	.	.	H	α-helix	trans	-63.3	-40	178	-69.1	-59.4	-173	-175.7	5.2	112	E209 V210 M215 E216 I217	E209-R213 HydrophobicContact CG-CG 4.49Å; E209-R213 WeakPolarHBondContact O-CG 3.27Å; E209-R213 PolarHBondContact O-N 3Å; V210-R213 PolarHBondContact O-N 3.22Å; R213-M215 VanDerWaalsContact C-N 3.31Å; R213-M215 PolarHBondContact O-N 3.22Å; R213-E216 WeakPolarHBondContact CD-OE2 3.44Å; R213-E216 IonicContact CZ-OE2 3.79Å; R213-E216 IonicContact NE-OE2 3.37Å; R213-E216 IonicContact NH1-OE2 2.93Å; R213-E216 PolarHBondContact NH1-OE2 3.49Å; R213-E216 PolarHBondContact O-N 2.93Å; R213-I217 WeakPolarHBondContact O-CB 3.32Å; R213-I217 VanDerWaalsContact O-CG1 3.24Å; R213-I217 WeakPolarHBondContact O-CG1 3.46Å; R213-I217 PolarHBondContact O-N 3.43Å
214	L	93.9	Very high	92.9	Very high	99 Å²	99	99.4 Å²	99.4	52%	0.518	49%	0.494	S	S	.	.	H	α-helix	trans	-60.4	-41	174.2	-73.7	173	0	0	0	111.7	V210 N211 R212 I217 K218	V210-L214 HydrophobicContact CG1-CD1 4.01Å; V210-L214 HydrophobicContact CG1-CG 4.37Å; V210-L214 WeakPolarHBondContact O-CG 3.43Å; V210-L214 PolarHBondContact O-N 2.9Å; N211-L214 PolarHBondContact O-N 3.32Å; R212-L214 PolarHBondContact O-N 3.43Å; L214-I217 PolarHBondContact O-N 2.86Å; L214-K218 WeakPolarHBondContact O-CB 3.24Å; L214-K218 PolarHBondContact O-N 3.5Å
215	M	93.2	Very high	92.6	Very high	113 Å²	113	99.7 Å²	99.7	56%	0.557	49%	0.494	S	S	*	.	H	α-helix	trans	-67.8	-38.8	176.2	-173.9	168.4	151.6	0	0	112.6	N211 R212 R213 K218 K219	N211-M215 PolarHBondContact O-N 3.45Å; R212-M215 PolarHBondContact O-N 2.86Å; R213-M215 VanDerWaalsContact C-N 3.31Å; R213-M215 PolarHBondContact O-N 3.22Å; M215-K218 PolarHBondContact O-N 2.93Å; M215-K219 WeakPolarHBondContact O-CG 3.45Å; M215-K219 PolarHBondContact O-N 3.34Å
216	E	93.4	Very high	92.2	Very high	81 Å²	81	100.1 Å²	100.1	38%	0.379	50%	0.497	S	S	.	.	H	α-helix	trans	-62.5	-45.2	172	-74.2	172.8	-176.9	0	0	111.9	R212 R213 K218 K219 A220	R212-E216 IonicContact CZ-OE1 3.48Å; R212-E216 VanDerWaalsContact NH1-CD 3.33Å; R212-E216 IonicContact NH1-OE1 2.85Å; R212-E216 PolarHBondContact NH1-OE1 2.96Å; R212-E216 IonicContact NH1-OE2 3.81Å; R212-E216 PolarHBondContact NH1-OE2 3.27Å; R212-E216 PolarHBondContact O-N 2.67Å; R213-E216 WeakPolarHBondContact CD-OE2 3.44Å; R213-E216 IonicContact CZ-OE2 3.79Å; R213-E216 IonicContact NE-OE2 3.37Å; R213-E216 IonicContact NH1-OE2 2.93Å; R213-E216 PolarHBondContact NH1-OE2 3.49Å; R213-E216 PolarHBondContact O-N 2.93Å; E216-K218 VanDerWaalsContact C-N 3.33Å; E216-K218 PolarHBondContact O-N 3.42Å; E216-K219 PolarHBondContact O-N 2.85Å; E216-A220 WeakPolarHBondContact O-CB 3.34Å; E216-A220 PolarHBondContact O-N 3.32Å
217	I	92.7	Very high	91.7	Very high	93 Å²	93	104.2 Å²	104.2	48%	0.477	51%	0.507	S	S	.	.	H	α-helix	trans	-61.3	-42.6	176	-70.8	165.6	0	0	0	110.5	R213 L214 A220 K221	R213-I217 WeakPolarHBondContact O-CB 3.32Å; R213-I217 VanDerWaalsContact O-CG1 3.24Å; R213-I217 WeakPolarHBondContact O-CG1 3.46Å; R213-I217 PolarHBondContact O-N 3.43Å; L214-I217 PolarHBondContact O-N 2.86Å; I217-A220 PolarHBondContact O-N 3.24Å; I217-K221 WeakPolarHBondContact O-CB 3.46Å; I217-K221 PolarHBondContact O-N 2.9Å
218	K	92.8	Very high	91.3	Very high	132 Å²	132	106.1 Å²	106.1	57%	0.574	51%	0.509	S	S	*	.	H	α-helix	trans	-61.5	-48.3	176.8	-171.7	-178.9	177	-175.1	0	111.2	L214 M215 E216 A220 K221 E222	L214-K218 WeakPolarHBondContact O-CB 3.24Å; L214-K218 PolarHBondContact O-N 3.5Å; M215-K218 PolarHBondContact O-N 2.93Å; E216-K218 VanDerWaalsContact C-N 3.33Å; E216-K218 PolarHBondContact O-N 3.42Å; K218-A220 VanDerWaalsContact C-N 3.32Å; K218-A220 PolarHBondContact O-N 3.47Å; K218-K221 PolarHBondContact O-N 3.33Å; K218-E222 VanDerWaalsContact CE-OE1 3.27Å; K218-E222 WeakPolarHBondContact CE-OE1 3.39Å; K218-E222 WeakPolarHBondContact O-CG 3.36Å; K218-E222 PolarHBondContact O-N 2.84Å
219	K	92	Very high	90.7	Very high	102 Å²	102	106.5 Å²	106.5	44%	0.443	51%	0.506	S	S	.	.	H	α-helix	trans	-60.7	-39.4	175.4	-74.2	179.5	179.2	-178.6	0	112.4	M215 E216 E222 R223	M215-K219 WeakPolarHBondContact O-CG 3.45Å; M215-K219 PolarHBondContact O-N 3.34Å; E216-K219 PolarHBondContact O-N 2.85Å; K219-E222 PolarHBondContact O-N 2.84Å; K219-R223 WeakPolarHBondContact O-CG 3.46Å; K219-R223 PolarHBondContact O-N 3.02Å
220	A	89.8	Confident	90.2	Very high	46 Å²	46	108.4 Å²	108.4	38%	0.38	52%	0.516	S	S	.	.	H	α-helix	trans	-66.6	-42.3	176.4	0	0	0	0	0	111.6	E216 I217 K218 R223 I224	E216-A220 WeakPolarHBondContact O-CB 3.34Å; E216-A220 PolarHBondContact O-N 3.32Å; I217-A220 PolarHBondContact O-N 3.24Å; K218-A220 VanDerWaalsContact C-N 3.32Å; K218-A220 PolarHBondContact O-N 3.47Å; A220-R223 PolarHBondContact O-N 2.92Å; A220-I224 VanDerWaalsContact O-CG1 3.29Å; A220-I224 WeakPolarHBondContact O-CG1 3.47Å; A220-I224 PolarHBondContact O-N 3.39Å
221	K	91	Very high	89.5	Confident	140 Å²	140	112.2 Å²	112.2	61%	0.609	52%	0.523	S	S	*	.	H	α-helix	trans	-60.6	-45.1	172.9	-86.2	-174.8	173.7	-178.9	0	112.2	I217 K218 R223 I224 I225	I217-K221 WeakPolarHBondContact O-CB 3.46Å; I217-K221 PolarHBondContact O-N 2.9Å; K218-K221 PolarHBondContact O-N 3.33Å; K221-R223 VanDerWaalsContact C-N 3.35Å; K221-R223 PolarHBondContact O-N 3.27Å; K221-I224 PolarHBondContact O-N 3.26Å; K221-I225 VanDerWaalsContact O-CG1 3.29Å; K221-I225 WeakPolarHBondContact O-CG1 3.35Å; K221-I225 PolarHBondContact O-N 2.92Å
222	E	90.8	Very high	88.9	Confident	98 Å²	98	111.7 Å²	111.7	46%	0.458	52%	0.517	S	S	.	.	H	α-helix	trans	-60	-44.1	176.4	-75.1	168.4	-176.1	0	0	111.1	K218 K219 I225 T226	K218-E222 VanDerWaalsContact CE-OE1 3.27Å; K218-E222 WeakPolarHBondContact CE-OE1 3.39Å; K218-E222 WeakPolarHBondContact O-CG 3.36Å; K218-E222 PolarHBondContact O-N 2.84Å; K219-E222 PolarHBondContact O-N 2.84Å; E222-I225 PolarHBondContact O-N 2.82Å; E222-T226 WeakPolarHBondContact O-CG2 3.32Å; E222-T226 PolarHBondContact O-N 3.49Å; E222-T226 PolarHBondContact O-OG1 3.17Å
223	R	88.4	Confident	88.2	Confident	168 Å²	168	110.6 Å²	110.6	63%	0.634	52%	0.521	S	S	*	.	H	α-helix	trans	-59.4	-47	173.7	-75.1	-175.6	-141.5	-177.2	4.2	112.7	K219 A220 K221 I225 T226 E227	K219-R223 WeakPolarHBondContact O-CG 3.46Å; K219-R223 PolarHBondContact O-N 3.02Å; A220-R223 PolarHBondContact O-N 2.92Å; K221-R223 VanDerWaalsContact C-N 3.35Å; K221-R223 PolarHBondContact O-N 3.27Å; R223-I225 VanDerWaalsContact C-N 3.29Å; R223-I225 PolarHBondContact O-N 2.73Å; R223-T226 VanDerWaalsContact CA-OG1 3.32Å; R223-T226 WeakPolarHBondContact CA-OG1 3.45Å; R223-T226 PolarHBondContact O-N 3.33Å; R223-T226 PolarHBondContact O-OG1 3.19Å; R223-E227 WeakPolarHBondContact O-CB 3.29Å; R223-E227 PolarHBondContact O-N 2.86Å
224	I	86.9	Confident	87.4	Confident	106 Å²	106	109.7 Å²	109.7	54%	0.544	53%	0.525	S	S	.	.	H	α-helix	trans	-60.2	-41.2	177.8	-69.5	165.6	0	0	0	110.7	A220 K221 R228	A220-I224 VanDerWaalsContact O-CG1 3.29Å; A220-I224 WeakPolarHBondContact O-CG1 3.47Å; A220-I224 PolarHBondContact O-N 3.39Å; K221-I224 PolarHBondContact O-N 3.26Å; I224-R228 WeakPolarHBondContact O-CB 3.4Å; I224-R228 PolarHBondContact O-N 2.81Å
225	I	89.8	Confident	86.7	Confident	105 Å²	105	112.4 Å²	112.4	54%	0.538	53%	0.529	S	S	.	.	H	α-helix	trans	-63.6	-46.8	176	-68.4	164.8	0	0	0	110.1	K221 E222 R223 R228 T229	K221-I225 VanDerWaalsContact O-CG1 3.29Å; K221-I225 WeakPolarHBondContact O-CG1 3.35Å; K221-I225 PolarHBondContact O-N 2.92Å; E222-I225 PolarHBondContact O-N 2.82Å; R223-I225 VanDerWaalsContact C-N 3.29Å; R223-I225 PolarHBondContact O-N 2.73Å; I225-R228 PolarHBondContact O-N 3.23Å; I225-T229 WeakPolarHBondContact O-CG2 3.34Å; I225-T229 PolarHBondContact O-N 3.29Å; I225-T229 PolarHBondContact O-OG1 2.96Å
226	T	87	Confident	86	Confident	76 Å²	76	114.3 Å²	114.3	47%	0.466	53%	0.534	S	S	.	.	H	α-helix	trans	-63	-44.6	178.8	52.5	0	0	0	0	112.5	E222 R223 R228 T229 M230	E222-T226 WeakPolarHBondContact O-CG2 3.32Å; E222-T226 PolarHBondContact O-N 3.49Å; E222-T226 PolarHBondContact O-OG1 3.17Å; R223-T226 VanDerWaalsContact CA-OG1 3.32Å; R223-T226 WeakPolarHBondContact CA-OG1 3.45Å; R223-T226 PolarHBondContact O-N 3.33Å; R223-T226 PolarHBondContact O-OG1 3.19Å; T226-R228 VanDerWaalsContact C-N 3.33Å; T226-R228 PolarHBondContact O-N 3.29Å; T226-T229 WeakPolarHBondContact CA-OG1 3.48Å; T226-T229 PolarHBondContact O-N 2.73Å; T226-T229 PolarHBondContact O-OG1 3.28Å; T226-M230 WeakPolarHBondContact O-CG 3.29Å; T226-M230 PolarHBondContact O-N 3.46Å
227	E	84.4	Confident	85.2	Confident	136 Å²	136	115.5 Å²	115.5	64%	0.636	54%	0.539	S	S	*	.	H	α-helix	trans	-61.9	-41.9	174.9	-82.8	178.6	155	0	0	111.1	R223 M230 Y231	R223-E227 WeakPolarHBondContact O-CB 3.29Å; R223-E227 PolarHBondContact O-N 2.86Å; E227-M230 PolarHBondContact O-N 2.87Å; E227-Y231 WeakPolarHBondContact O-CB 3.47Å; E227-Y231 PolarHBondContact O-N 2.93Å
228	R	84.7	Confident	84.2	Confident	164 Å²	164	116.4 Å²	116.4	62%	0.619	54%	0.543	S	S	*	.	H	α-helix	trans	-62.8	-43.1	175.8	-176.1	178.3	-179.3	161.1	7.1	112	I224 I225 T226 Y231 E232	I224-R228 WeakPolarHBondContact O-CB 3.4Å; I224-R228 PolarHBondContact O-N 2.81Å; I225-R228 PolarHBondContact O-N 3.23Å; T226-R228 VanDerWaalsContact C-N 3.33Å; T226-R228 PolarHBondContact O-N 3.29Å; R228-Y231 PolarHBondContact O-N 2.7Å; R228-E232 HydrophobicContact CG-CG 4.48Å; R228-E232 WeakPolarHBondContact CG-OE1 3.19Å; R228-E232 IonicContact CZ-OE1 3.52Å; R228-E232 IonicContact NE-OE1 3.83Å; R228-E232 PolarHBondContact NE-OE1 2.93Å; R228-E232 IonicContact NH2-OE1 2.66Å; R228-E232 WeakPolarHBondContact O-CB 3.4Å; R228-E232 WeakPolarHBondContact O-CG 3.17Å; R228-E232 PolarHBondContact O-N 3.32Å
229	T	83.1	Confident	83.3	Confident	68 Å²	68	113.4 Å²	113.4	42%	0.417	53%	0.533	S	S	.	.	H	α-helix	trans	-65.5	-38.5	176.2	51.2	0	0	0	0	112.2	I225 T226 E232 T233	I225-T229 WeakPolarHBondContact O-CG2 3.34Å; I225-T229 PolarHBondContact O-N 3.29Å; I225-T229 PolarHBondContact O-OG1 2.96Å; T226-T229 WeakPolarHBondContact CA-OG1 3.48Å; T226-T229 PolarHBondContact O-N 2.73Å; T226-T229 PolarHBondContact O-OG1 3.28Å; T229-E232 PolarHBondContact O-N 3.46Å; T229-T233 WeakPolarHBondContact O-CB 3.42Å; T229-T233 PolarHBondContact O-N 2.93Å; T229-T233 PolarHBondContact O-OG1 2.87Å
230	M	83	Confident	82.3	Confident	142 Å²	142	112.2 Å²	112.2	70%	0.7	53%	0.534	S	S	*	.	H	α-helix	trans	-64.8	-42.6	173.4	-73.9	-161.9	173.1	0	0	111.1	T226 E227 T233 L234	T226-M230 WeakPolarHBondContact O-CG 3.29Å; T226-M230 PolarHBondContact O-N 3.46Å; E227-M230 PolarHBondContact O-N 2.87Å; M230-T233 PolarHBondContact O-N 3.48Å; M230-L234 WeakPolarHBondContact O-CB 3.47Å; M230-L234 PolarHBondContact O-N 3.31Å
231	Y	82	Confident	81.3	Confident	164 Å²	164	115 Å²	115	64%	0.643	54%	0.541	S	S	*	.	H	α-helix	trans	-64.5	-41	176.6	-161.9	-90	0	0	0	112.3	E227 R228 L234 R235	E227-Y231 WeakPolarHBondContact O-CB 3.47Å; E227-Y231 PolarHBondContact O-N 2.93Å; R228-Y231 PolarHBondContact O-N 2.7Å; Y231-L234 PolarHBondContact O-N 2.83Å; Y231-R235 WeakPolarHBondContact O-CB 3.49Å; Y231-R235 PolarHBondContact O-N 2.99Å
232	E	79.7	Confident	80.1	Confident	89 Å²	89	111.9 Å²	111.9	42%	0.416	53%	0.53	S	S	.	.	H	α-helix	trans	-67.2	-35.2	175.5	-78.5	167.5	-174.7	0	0	112.2	R228 T229 K236	R228-E232 HydrophobicContact CG-CG 4.48Å; R228-E232 WeakPolarHBondContact CG-OE1 3.19Å; R228-E232 IonicContact CZ-OE1 3.52Å; R228-E232 IonicContact NE-OE1 3.83Å; R228-E232 PolarHBondContact NE-OE1 2.93Å; R228-E232 IonicContact NH2-OE1 2.66Å; R228-E232 WeakPolarHBondContact O-CB 3.4Å; R228-E232 WeakPolarHBondContact O-CG 3.17Å; R228-E232 PolarHBondContact O-N 3.32Å; T229-E232 PolarHBondContact O-N 3.46Å; E232-K236 WeakPolarHBondContact O-CG 3.33Å; E232-K236 PolarHBondContact O-N 2.82Å
233	T	79.8	Confident	78.6	Confident	78 Å²	78	112.6 Å²	112.6	48%	0.479	54%	0.537	S	S	.	.	H	α-helix	trans	-67.5	-48.9	173.9	-51.8	0	0	0	0	110.5	T229 M230 R235 K236 E237	T229-T233 WeakPolarHBondContact O-CB 3.42Å; T229-T233 PolarHBondContact O-N 2.93Å; T229-T233 PolarHBondContact O-OG1 2.87Å; M230-T233 PolarHBondContact O-N 3.48Å; T233-R235 VanDerWaalsContact C-N 3.3Å; T233-R235 PolarHBondContact O-N 2.9Å; T233-K236 PolarHBondContact O-N 3.46Å; T233-K236 VanDerWaalsContact O-N 3.17Å; T233-E237 WeakPolarHBondContact O-CG 3.47Å; T233-E237 PolarHBondContact O-N 3.37Å
234	L	77.9	Confident	77.3	Confident	103 Å²	103	111 Å²	111	54%	0.539	54%	0.537	S	S	.	.	H	α-helix	trans	-62	-37.6	177.3	-162.8	75.5	0	0	0	112	M230 Y231 E237 M238	M230-L234 WeakPolarHBondContact O-CB 3.47Å; M230-L234 PolarHBondContact O-N 3.31Å; Y231-L234 PolarHBondContact O-N 2.83Å; L234-E237 PolarHBondContact O-N 3.21Å; L234-M238 PolarHBondContact O-N 2.85Å
235	R	79	Confident	75.8	Confident	157 Å²	157	113.4 Å²	113.4	59%	0.592	54%	0.544	S	S	*	.	H	α-helix	trans	-66.6	-42.1	175.1	-173.3	174.6	-176.3	-111.5	-4.4	111.7	Y231 T233 E237 M238 D239	Y231-R235 WeakPolarHBondContact O-CB 3.49Å; Y231-R235 PolarHBondContact O-N 2.99Å; T233-R235 VanDerWaalsContact C-N 3.3Å; T233-R235 PolarHBondContact O-N 2.9Å; R235-E237 VanDerWaalsContact C-N 3.35Å; R235-M238 PolarHBondContact O-N 3.44Å; R235-D239 WeakPolarHBondContact O-CB 3.5Å; R235-D239 PolarHBondContact O-N 2.87Å
236	K	77	Confident	74.1	Confident	153 Å²	153	115.6 Å²	115.6	67%	0.665	55%	0.551	S	S	*	*	H	α-helix	trans	-62.7	-41.7	173	-83.3	-179.8	177.8	177.4	0	111.8	E232 T233 M238 D239 T240	E232-K236 WeakPolarHBondContact O-CG 3.33Å; E232-K236 PolarHBondContact O-N 2.82Å; T233-K236 PolarHBondContact O-N 3.46Å; T233-K236 VanDerWaalsContact O-N 3.17Å; K236-M238 VanDerWaalsContact C-N 3.34Å; K236-D239 PolarHBondContact O-N 3.17Å; K236-T240 PolarHBondContact O-N 3.36Å; K236-T240 PolarHBondContact O-OG1 2.82Å
237	E	78.3	Confident	72.2	Confident	106 Å²	106	117.1 Å²	117.1	50%	0.495	57%	0.565	S	S	.	*	H	α-helix	trans	-60.6	-42.8	175.7	-75.3	176.6	177	0	0	111.6	T233 L234 R235 T240 M241	T233-E237 WeakPolarHBondContact O-CG 3.47Å; T233-E237 PolarHBondContact O-N 3.37Å; L234-E237 PolarHBondContact O-N 3.21Å; R235-E237 VanDerWaalsContact C-N 3.35Å; E237-T240 VanDerWaalsContact C-OG1 3.3Å; E237-T240 VanDerWaalsContact CA-OG1 3.23Å; E237-T240 WeakPolarHBondContact CA-OG1 3.23Å; E237-T240 PolarHBondContact O-N 2.8Å; E237-T240 PolarHBondContact O-OG1 3.39Å; E237-M241 PolarHBondContact O-N 3.41Å
238	M	70.4	Confident	70.4	Confident	111 Å²	111	120 Å²	120	55%	0.547	58%	0.583	S	S	.	*	H	α-helix	trans	-63.6	-44.5	171.3	-83.6	-171.3	74.1	0	0	112.5	L234 R235 K236 T240 M241 I242	L234-M238 PolarHBondContact O-N 2.85Å; R235-M238 PolarHBondContact O-N 3.44Å; K236-M238 VanDerWaalsContact C-N 3.34Å; M238-T240 VanDerWaalsContact C-N 3.31Å; M238-T240 PolarHBondContact O-N 2.95Å; M238-M241 PolarHBondContact O-N 3.45Å; M238-I242 WeakPolarHBondContact O-CB 3.39Å; M238-I242 VanDerWaalsContact O-CG1 3.26Å; M238-I242 WeakPolarHBondContact O-CG1 3.47Å; M238-I242 PolarHBondContact O-N 3.25Å
239	D	74.3	Confident	69.7	Low	70 Å²	70	117.9 Å²	117.9	37%	0.374	58%	0.581	S	S	.	*	H	α-helix	trans	-64	-36.5	178.1	-75.3	-22.7	0	0	0	111.4	R235 K236 I242 N243	R235-D239 WeakPolarHBondContact O-CB 3.5Å; R235-D239 PolarHBondContact O-N 2.87Å; K236-D239 PolarHBondContact O-N 3.17Å; D239-I242 PolarHBondContact O-N 2.9Å; D239-N243 WeakPolarHBondContact O-CB 3.42Å; D239-N243 PolarHBondContact O-N 3.45Å; D239-N243 PolarHBondContact O-ND2 3.18Å
240	T	71.5	Confident	69	Low	76 Å²	76	120.5 Å²	120.5	47%	0.466	59%	0.589	S	S	.	*	H	α-helix	trans	-65.8	-43.7	170.5	35.4	0	0	0	0	112	K236 E237 M238 I242 N243 E244	K236-T240 PolarHBondContact O-N 3.36Å; K236-T240 PolarHBondContact O-OG1 2.82Å; E237-T240 VanDerWaalsContact C-OG1 3.3Å; E237-T240 VanDerWaalsContact CA-OG1 3.23Å; E237-T240 WeakPolarHBondContact CA-OG1 3.23Å; E237-T240 PolarHBondContact O-N 2.8Å; E237-T240 PolarHBondContact O-OG1 3.39Å; M238-T240 VanDerWaalsContact C-N 3.31Å; M238-T240 PolarHBondContact O-N 2.95Å; T240-I242 VanDerWaalsContact C-N 3.3Å; T240-I242 PolarHBondContact O-N 3.41Å; T240-N243 PolarHBondContact O-N 2.8Å; T240-E244 WeakPolarHBondContact O-CB 3.26Å; T240-E244 WeakPolarHBondContact O-CG 3.45Å; T240-E244 PolarHBondContact O-N 2.85Å
241	M	69	Low	68.2	Low	105 Å²	105	119.3 Å²	119.3	52%	0.517	58%	0.583	S	S	.	*	H	α-helix	trans	-60.8	-40.2	174.3	-107.1	-170.2	-75	0	0	111.7	E237 M238 E244 F245	E237-M241 PolarHBondContact O-N 3.41Å; M238-M241 PolarHBondContact O-N 3.45Å; M241-E244 PolarHBondContact O-N 3.48Å; M241-F245 WeakPolarHBondContact O-CB 3.37Å; M241-F245 WeakPolarHBondContact O-CD2 3.45Å; M241-F245 PolarHBondContact O-N 2.83Å
242	I	64.6	Low	67.4	Low	75 Å²	75	116.6 Å²	116.6	39%	0.385	58%	0.58	S	S	.	*	H	α-helix	trans	-67.7	-40	177.7	-70.2	168.7	0	0	0	110.8	M238 D239 T240 F245 H246	M238-I242 WeakPolarHBondContact O-CB 3.39Å; M238-I242 VanDerWaalsContact O-CG1 3.26Å; M238-I242 WeakPolarHBondContact O-CG1 3.47Å; M238-I242 PolarHBondContact O-N 3.25Å; D239-I242 PolarHBondContact O-N 2.9Å; T240-I242 VanDerWaalsContact C-N 3.3Å; T240-I242 PolarHBondContact O-N 3.41Å; I242-F245 PolarHBondContact O-N 3.06Å; I242-H246 PolarHBondContact O-N 3.31Å; I242-H246 PolarHBondContact O-ND1 3.49Å
243	N	60.8	Low	66.6	Low	113 Å²	113	118.4 Å²	118.4	60%	0.604	59%	0.59	S	S	*	*	H	α-helix	trans	-68.8	-37.9	175.5	-78.5	-24.4	0	0	0	112.2	D239 T240 F245 H246 S247	D239-N243 WeakPolarHBondContact O-CB 3.42Å; D239-N243 PolarHBondContact O-N 3.45Å; D239-N243 PolarHBondContact O-ND2 3.18Å; T240-N243 PolarHBondContact O-N 2.8Å; N243-F245 VanDerWaalsContact C-N 3.29Å; N243-F245 PolarHBondContact O-N 2.94Å; N243-H246 PolarHBondContact O-N 2.92Å; N243-S247 WeakPolarHBondContact O-CB 3.42Å; N243-S247 PolarHBondContact O-N 2.96Å
244	E	60.7	Low	65.7	Low	134 Å²	134	121.1 Å²	121.1	63%	0.626	60%	0.598	S	S	*	*	H	α-helix	trans	-62.4	-38.1	171.6	-75.3	-179.6	178	0	0	111.2	T240 M241 S247	T240-E244 WeakPolarHBondContact O-CB 3.26Å; T240-E244 WeakPolarHBondContact O-CG 3.45Å; T240-E244 PolarHBondContact O-N 2.85Å; M241-E244 PolarHBondContact O-N 3.48Å; E244-S247 PolarHBondContact O-N 3.32Å
245	F	54.7	Low	64.8	Low	157 Å²	157	122.4 Å²	122.4	69%	0.689	60%	0.602	S	S	*	*	H	α-helix	trans	-69.2	-33.9	174.1	-100.7	-79.4	0	0	0	114.2	M241 I242 N243 S247	M241-F245 WeakPolarHBondContact O-CB 3.37Å; M241-F245 WeakPolarHBondContact O-CD2 3.45Å; M241-F245 PolarHBondContact O-N 2.83Å; I242-F245 PolarHBondContact O-N 3.06Å; N243-F245 VanDerWaalsContact C-N 3.29Å; N243-F245 PolarHBondContact O-N 2.94Å; F245-S247 VanDerWaalsContact C-N 3.35Å
246	H	54.2	Low	63.8	Low	151 Å²	151	119.7 Å²	119.7	70%	0.699	60%	0.602	S	S	*	*	H	α-helix	trans	-82.1	-12.4	177.2	-76.2	87.9	0	0	0	113.7	I242 N243 I248	I242-H246 PolarHBondContact O-N 3.31Å; I242-H246 PolarHBondContact O-ND1 3.49Å; N243-H246 PolarHBondContact O-N 2.92Å; H246-I248 VanDerWaalsContact C-N 3.3Å
247	S	48	Very low	62.7	Low	107 Å²	107	116.9 Å²	116.9	75%	0.748	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	5.5	176.4	-159.9	0	0	0	0	113.2	N243 E244 F245	N243-S247 WeakPolarHBondContact O-CB 3.42Å; N243-S247 PolarHBondContact O-N 2.96Å; E244-S247 PolarHBondContact O-N 3.32Å; F245-S247 VanDerWaalsContact C-N 3.35Å
248	I	45.4	Very low	61.2	Low	198 Å²	198	117.9 Å²	117.9	100%	1.015	61%	0.606	S	S	*	*			trans	-109.8	0	171.5	-60.6	172.6	0	0	0	108.3	H246	H246-I248 VanDerWaalsContact C-N 3.3Å

Retrieved 248 of 248 residues in 355.8 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).