Z4YKG8_MOUSE Loading...

Troponin T, fast skeletal muscle

Troponin T is the tropomyosin-binding subunit of troponin, the thin filament regulatory complex which confers calcium-sensitivity to striated muscle actomyosin ATPase activity.

AlphaFold DB , UniProt , Accession Z4YKG8, Species MOUSE (Mus musculus, Mouse), Gene Tnnt3, Length 263 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	44.8	Very low	50.3	Low	212 Å²	212	125.5 Å²	125.5	100%	1.044	64%	0.638	S	S	*	*				0	94.5	0	-45.3	-45.4	-154	0	0	103.9	E5	M1-E5 WeakPolarHBondContact CA-OE2 3.47Å
2	S	41.5	Very low	50.1	Low	80 Å²	80	126.3 Å²	126.3	56%	0.559	64%	0.638	S	S	*	*			trans	-86.9	154.9	-161.4	-61.7	0	0	0	0	110	E4 E5	S2-E4 PolarHBondContact O-N 3.46Å; S2-E5 VanDerWaalsContact O-CB 3.3Å; S2-E5 WeakPolarHBondContact O-CB 3.43Å; S2-E5 PolarHBondContact O-N 3.25Å
3	D	50.3	Low	50.7	Low	144 Å²	144	129 Å²	129	77%	0.77	64%	0.637	S	S	*	*	H	α-helix	trans	-51.6	-23.2	176.4	-70	-53.2	0	0	0	113.6	E5 T6 E7	D3-E5 VanDerWaalsContact C-N 3.33Å; D3-E5 PolarHBondContact O-N 3.48Å; D3-T6 WeakPolarHBondContact CA-OG1 3.46Å; D3-T6 PolarHBondContact O-N 3.45Å; D3-T6 PolarHBondContact O-OG1 3.03Å; D3-E7 PolarHBondContact O-N 3.38Å
4	E	48.5	Very low	51.2	Low	144 Å²	144	129.8 Å²	129.8	67%	0.673	64%	0.638	S	S	*	*	H	α-helix	trans	-70.6	-25.5	176.6	-152.7	168.9	-161.3	0	0	113.1	S2 Q8	S2-E4 PolarHBondContact O-N 3.46Å; E4-Q8 PolarHBondContact O-N 3.22Å
5	E	50.5	Low	51.6	Low	110 Å²	110	130.6 Å²	130.6	51%	0.514	64%	0.64	S	S	.	*	H	α-helix	trans	-82.2	-25.5	178.3	-152.9	176.2	-174.2	0	0	111.1	M1 S2 D3 V9	M1-E5 WeakPolarHBondContact CA-OE2 3.47Å; S2-E5 VanDerWaalsContact O-CB 3.3Å; S2-E5 WeakPolarHBondContact O-CB 3.43Å; S2-E5 PolarHBondContact O-N 3.25Å; D3-E5 VanDerWaalsContact C-N 3.33Å; D3-E5 PolarHBondContact O-N 3.48Å; E5-V9 WeakPolarHBondContact O-CG2 3.24Å
6	T	51.7	Low	51.9	Low	85 Å²	85	129.9 Å²	129.9	52%	0.521	64%	0.635	S	S	.	*	H	α-helix	trans	-79.9	-35	173.1	39.1	0	0	0	0	112.4	D3 V9 E10	D3-T6 WeakPolarHBondContact CA-OG1 3.46Å; D3-T6 PolarHBondContact O-N 3.45Å; D3-T6 PolarHBondContact O-OG1 3.03Å; T6-V9 PolarHBondContact O-N 3.14Å; T6-E10 PolarHBondContact O-N 2.97Å
7	E	54.7	Low	52.2	Low	131 Å²	131	130.2 Å²	130.2	61%	0.612	64%	0.635	S	S	*	*	H	α-helix	trans	-68.6	-38.6	178.5	-146.5	169.3	-163	0	0	111.2	D3 V9 E10 E11	D3-E7 PolarHBondContact O-N 3.38Å; E7-V9 VanDerWaalsContact C-N 3.32Å; E7-V9 PolarHBondContact O-N 2.93Å; E7-E10 PolarHBondContact O-N 3.44Å; E7-E11 PolarHBondContact O-N 2.99Å
8	Q	46.8	Very low	52.4	Low	124 Å²	124	130.4 Å²	130.4	58%	0.579	63%	0.634	S	S	*	*	H	α-helix	trans	-66.5	-29.7	173.1	-87.3	176.6	17.4	0	0	114	E4 Q12	E4-Q8 PolarHBondContact O-N 3.22Å; Q8-Q12 WeakPolarHBondContact O-CB 3.31Å; Q8-Q12 PolarHBondContact O-N 2.66Å; Q8-Q12 VanDerWaalsContact O-N 3.17Å
9	V	54.3	Low	52.6	Low	76 Å²	76	126.6 Å²	126.6	46%	0.461	63%	0.626	S	S	.	*	H	α-helix	trans	-78.5	-32.9	177.5	174.1	0	0	0	0	110.8	E5 T6 E7 Y13	E5-V9 WeakPolarHBondContact O-CG2 3.24Å; T6-V9 PolarHBondContact O-N 3.14Å; E7-V9 VanDerWaalsContact C-N 3.32Å; E7-V9 PolarHBondContact O-N 2.93Å; V9-Y13 HydrophobicContact CG1-CD2 4.26Å; V9-Y13 WeakPolarHBondContact O-CB 3.25Å; V9-Y13 PolarHBondContact O-N 3.09Å; V9-Y13 VanDerWaalsContact O-N 3.13Å
10	E	55.1	Low	52.5	Low	139 Å²	139	126.5 Å²	126.5	65%	0.65	62%	0.623	S	S	*	*	H	α-helix	trans	-68.3	-44.7	171.4	-94.3	179.6	156.5	0	0	112	T6 E7 Q12 Y13 E14	T6-E10 PolarHBondContact O-N 2.97Å; E7-E10 PolarHBondContact O-N 3.44Å; E10-Q12 VanDerWaalsContact C-N 3.33Å; E10-Q12 PolarHBondContact O-N 3.26Å; E10-Y13 PolarHBondContact O-N 2.89Å; E10-Y13 VanDerWaalsContact O-N 3.14Å; E10-E14 PolarHBondContact O-N 3.29Å
11	E	54.7	Low	52.4	Low	135 Å²	135	125.5 Å²	125.5	63%	0.631	62%	0.618	S	S	*	*	H	α-helix	trans	-60.7	-40.7	175.2	-94.9	-175.9	156.9	0	0	112	E7 Y13 E14 E15	E7-E11 PolarHBondContact O-N 2.99Å; E11-Y13 VanDerWaalsContact C-N 3.32Å; E11-Y13 PolarHBondContact O-N 3.02Å; E11-E14 PolarHBondContact O-N 3.18Å; E11-E15 PolarHBondContact O-N 2.92Å; E11-E15 VanDerWaalsContact O-N 3.09Å
12	Q	48	Very low	52.6	Low	136 Å²	136	122 Å²	122	64%	0.636	60%	0.599	S	S	*	*	H	α-helix	trans	-65.8	-33.1	175.2	-85.6	-174	-16.2	0	0	113.2	Q8 E10 E16	Q8-Q12 WeakPolarHBondContact O-CB 3.31Å; Q8-Q12 PolarHBondContact O-N 2.66Å; Q8-Q12 VanDerWaalsContact O-N 3.17Å; E10-Q12 VanDerWaalsContact C-N 3.33Å; E10-Q12 PolarHBondContact O-N 3.26Å; Q12-E16 WeakPolarHBondContact O-CB 3.42Å; Q12-E16 PolarHBondContact O-N 3.4Å
13	Y	58.4	Low	53	Low	161 Å²	161	124.7 Å²	124.7	63%	0.631	60%	0.602	S	S	*	*	H	α-helix	trans	-73.9	-36.4	177.5	-108.6	-85.7	0	0	0	112.3	V9 E10 E11 E17	V9-Y13 HydrophobicContact CG1-CD2 4.26Å; V9-Y13 WeakPolarHBondContact O-CB 3.25Å; V9-Y13 PolarHBondContact O-N 3.09Å; V9-Y13 VanDerWaalsContact O-N 3.13Å; E10-Y13 PolarHBondContact O-N 2.89Å; E10-Y13 VanDerWaalsContact O-N 3.14Å; E11-Y13 VanDerWaalsContact C-N 3.32Å; E11-Y13 PolarHBondContact O-N 3.02Å; Y13-E17 WeakPolarHBondContact O-CB 2.74Å; Y13-E17 PolarHBondContact O-N 3.34Å; Y13-E17 VanDerWaalsContact O-N 3.09Å
14	E	58.1	Low	52.9	Low	140 Å²	140	124.3 Å²	124.3	65%	0.654	60%	0.596	S	S	*	*	H	α-helix	trans	-68.7	-39.9	175.6	-74.6	-174.5	163.7	0	0	111.6	E10 E11 E16 E17 E18	E10-E14 PolarHBondContact O-N 3.29Å; E11-E14 PolarHBondContact O-N 3.18Å; E14-E16 PolarHBondContact O-N 3.41Å; E14-E17 PolarHBondContact O-N 3.49Å; E14-E18 PolarHBondContact O-N 3.39Å
15	E	56.2	Low	53.1	Low	142 Å²	142	122.1 Å²	122.1	66%	0.664	59%	0.592	S	S	*	*	H	α-helix	trans	-68	-33.7	177.4	-162.9	176.2	-166.1	0	0	112.2	E11 A19	E11-E15 PolarHBondContact O-N 2.92Å; E11-E15 VanDerWaalsContact O-N 3.09Å; E15-A19 WeakPolarHBondContact O-CB 3.3Å; E15-A19 PolarHBondContact O-N 3.27Å; E15-A19 VanDerWaalsContact O-N 3.16Å
16	E	56.2	Low	52.9	Low	120 Å²	120	123.6 Å²	123.6	56%	0.561	60%	0.599	S	S	*	*	H	α-helix	trans	-75.2	-30.6	176.2	-156.7	174.9	-154.2	0	0	112.5	Q12 E14 Q20	Q12-E16 WeakPolarHBondContact O-CB 3.42Å; Q12-E16 PolarHBondContact O-N 3.4Å; E14-E16 PolarHBondContact O-N 3.41Å; E16-Q20 PolarHBondContact O-N 2.96Å
17	E	57.9	Low	52.6	Low	135 Å²	135	126.4 Å²	126.4	63%	0.631	61%	0.606	S	S	*	*	H	α-helix	trans	-74.3	-37.8	174.5	-153.6	-177.8	-164.1	0	0	111.4	Y13 E14 Q20 E21	Y13-E17 WeakPolarHBondContact O-CB 2.74Å; Y13-E17 PolarHBondContact O-N 3.34Å; Y13-E17 VanDerWaalsContact O-N 3.09Å; E14-E17 PolarHBondContact O-N 3.49Å; E17-Q20 PolarHBondContact O-N 3.16Å; E17-E21 PolarHBondContact O-N 3.16Å
18	E	54.6	Low	52.2	Low	134 Å²	134	125.8 Å²	125.8	63%	0.626	61%	0.607	S	S	*	*	H	α-helix	trans	-67.7	-37.8	175.9	-162.5	173.3	-158.6	0	0	111.6	E14 E21 E22	E14-E18 PolarHBondContact O-N 3.39Å; E18-E21 PolarHBondContact O-N 3.48Å; E18-E22 PolarHBondContact O-N 2.87Å; E18-E22 VanDerWaalsContact O-N 3.12Å
19	A	56.2	Low	52.2	Low	57 Å²	57	122.9 Å²	122.9	47%	0.471	60%	0.604	S	S	.	*	H	α-helix	trans	-66.5	-35	174.7	0	0	0	0	0	113.2	E15 E23	E15-A19 WeakPolarHBondContact O-CB 3.3Å; E15-A19 PolarHBondContact O-N 3.27Å; E15-A19 VanDerWaalsContact O-N 3.16Å; A19-E23 PolarHBondContact O-N 3.11Å
20	Q	50.6	Low	51.7	Low	124 Å²	124	123.2 Å²	123.2	58%	0.579	61%	0.606	S	S	*	*	H	α-helix	trans	-71.1	-33.2	173.4	-80.9	178.7	4.8	0	0	112.4	E16 E17 E23 E24	E16-Q20 PolarHBondContact O-N 2.96Å; E17-Q20 PolarHBondContact O-N 3.16Å; Q20-E23 PolarHBondContact O-N 2.95Å; Q20-E24 PolarHBondContact O-N 2.98Å
21	E	50.3	Low	51.3	Low	107 Å²	107	119.6 Å²	119.6	50%	0.5	60%	0.6	S	S	.	*	H	α-helix	trans	-70.5	-32.5	176.9	-145.2	176.6	-167.1	0	0	111.4	E17 E18 V25 R108	E17-E21 PolarHBondContact O-N 3.16Å; E18-E21 PolarHBondContact O-N 3.48Å; E21-V25 WeakPolarHBondContact O-CB 3.42Å; E21-V25 WeakPolarHBondContact O-CG2 3.43Å; E21-V25 PolarHBondContact O-N 3.5Å; E21-R108 IonicContact OE1-NH1 3.88Å
22	E	51	Low	50.7	Low	139 Å²	139	121 Å²	121	65%	0.65	61%	0.606	S	S	*	*	H	α-helix	trans	-70.6	-33.9	172.5	-73	-161.6	158.5	0	0	113.5	E18 Q26	E18-E22 PolarHBondContact O-N 2.87Å; E18-E22 VanDerWaalsContact O-N 3.12Å; E22-Q26 PolarHBondContact O-N 3.4Å
23	E	48.8	Very low	50.4	Low	136 Å²	136	122.5 Å²	122.5	64%	0.636	61%	0.614	S	S	*	*	H	α-helix	trans	-72.6	-40.9	177	-165.3	174.2	-171.5	0	0	111.6	A19 Q20 V25 Q26 E27	A19-E23 PolarHBondContact O-N 3.11Å; Q20-E23 PolarHBondContact O-N 2.95Å; E23-V25 PolarHBondContact O-N 2.95Å; E23-Q26 PolarHBondContact O-N 3.4Å; E23-E27 PolarHBondContact O-N 3.33Å
24	E	48.5	Very low	49.3	Very low	135 Å²	135	122.9 Å²	122.9	63%	0.631	62%	0.621	S	S	*	*	H	α-helix	trans	-67.2	-35	177.6	-159	-177.7	-164.4	0	0	111.8	Q20 E27 D28	Q20-E24 PolarHBondContact O-N 2.98Å; E24-E27 PolarHBondContact O-N 3.44Å; E24-D28 PolarHBondContact O-N 3.05Å; E24-D28 VanDerWaalsContact O-N 3.13Å
25	V	53	Low	48.4	Very low	99 Å²	99	126.9 Å²	126.9	60%	0.6	63%	0.63	S	S	*	*	H	α-helix	trans	-71.5	-30.3	176.1	175.6	0	0	0	0	111.9	E21 E23 A29	E21-V25 WeakPolarHBondContact O-CB 3.42Å; E21-V25 WeakPolarHBondContact O-CG2 3.43Å; E21-V25 PolarHBondContact O-N 3.5Å; E23-V25 PolarHBondContact O-N 2.95Å; V25-A29 WeakPolarHBondContact O-CB 3.47Å; V25-A29 PolarHBondContact O-N 3.5Å
26	Q	45.9	Very low	47.7	Very low	141 Å²	141	129 Å²	129	66%	0.659	64%	0.64	S	S	*	*	H	α-helix	trans	-74.2	-39.1	172.7	-91.8	177.6	38.2	0	0	112.5	E22 E23 A29 V30	E22-Q26 PolarHBondContact O-N 3.4Å; E23-Q26 PolarHBondContact O-N 3.4Å; Q26-A29 PolarHBondContact O-N 2.9Å; Q26-V30 VanDerWaalsContact O-CG2 3.27Å; Q26-V30 WeakPolarHBondContact O-CG2 3.3Å; Q26-V30 PolarHBondContact O-N 3.03Å; Q26-V30 VanDerWaalsContact O-N 3.14Å
27	E	45.7	Very low	47.1	Very low	144 Å²	144	132.1 Å²	132.1	67%	0.673	65%	0.654	S	S	*	*	H	α-helix	trans	-65.2	-39.7	175.9	-94.7	-166.9	149.2	0	0	112.6	E23 E24 V30 A31	E23-E27 PolarHBondContact O-N 3.33Å; E24-E27 PolarHBondContact O-N 3.44Å; E27-V30 PolarHBondContact O-N 3.42Å; E27-A31 VanDerWaalsContact O-CB 3.3Å; E27-A31 WeakPolarHBondContact O-CB 3.27Å; E27-A31 PolarHBondContact O-N 3.43Å
28	D	45.7	Very low	46.1	Very low	118 Å²	118	133.1 Å²	133.1	63%	0.631	66%	0.664	S	S	*	*	H	α-helix	trans	-68.8	-35.3	178.9	-130.7	-89.3	0	0	0	111.6	E24 E32	E24-D28 PolarHBondContact O-N 3.05Å; E24-D28 VanDerWaalsContact O-N 3.13Å; D28-E32 PolarHBondContact O-N 2.9Å
29	A	47.1	Very low	45.2	Very low	62 Å²	62	134 Å²	134	51%	0.512	67%	0.669	S	S	.	*	H	α-helix	trans	-70	-34.1	176.3	0	0	0	0	0	113.2	V25 Q26	V25-A29 WeakPolarHBondContact O-CB 3.47Å; V25-A29 PolarHBondContact O-N 3.5Å; Q26-A29 PolarHBondContact O-N 2.9Å
30	V	43.9	Very low	44.6	Very low	84 Å²	84	141.2 Å²	141.2	51%	0.509	69%	0.692	S	S	.	*	H	α-helix	trans	-79.1	-33.5	177.3	178	0	0	0	0	111.3	Q26 E27 E32 E33 E34	Q26-V30 VanDerWaalsContact O-CG2 3.27Å; Q26-V30 WeakPolarHBondContact O-CG2 3.3Å; Q26-V30 PolarHBondContact O-N 3.03Å; Q26-V30 VanDerWaalsContact O-N 3.14Å; E27-V30 PolarHBondContact O-N 3.42Å; V30-E32 VanDerWaalsContact C-N 3.28Å; V30-E32 PolarHBondContact O-N 3.44Å; V30-E33 PolarHBondContact O-N 3.33Å; V30-E34 PolarHBondContact O-N 3.39Å
31	A	46	Very low	44.1	Very low	62 Å²	62	142.8 Å²	142.8	51%	0.512	70%	0.7	S	S	.	*	H	α-helix	trans	-69.5	-22.8	176.3	0	0	0	0	0	113.7	E27	E27-A31 VanDerWaalsContact O-CB 3.3Å; E27-A31 WeakPolarHBondContact O-CB 3.27Å; E27-A31 PolarHBondContact O-N 3.43Å
32	E	43.5	Very low	44	Very low	164 Å²	164	146.2 Å²	146.2	77%	0.766	72%	0.716	S	S	*	*	H	α-helix	trans	-82.2	-26.4	173.6	-137.1	-179.8	-167	0	0	112.5	D28 V30	D28-E32 PolarHBondContact O-N 2.9Å; V30-E32 VanDerWaalsContact C-N 3.28Å; V30-E32 PolarHBondContact O-N 3.44Å
33	E	40.9	Very low	43.7	Very low	169 Å²	169	148.1 Å²	148.1	79%	0.79	72%	0.722	S	S	*	*	H	α-helix	trans	-79.2	-26.3	178	-137.8	178.4	-172	0	0	112.9	V30 R35	V30-E33 PolarHBondContact O-N 3.33Å; E33-R35 VanDerWaalsContact C-N 3.34Å; E33-R35 PolarHBondContact O-N 2.92Å
34	E	36.2	Very low	43.7	Very low	168 Å²	168	147.6 Å²	147.6	79%	0.785	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	5.3	178.5	-77.3	-162.3	156.7	0	0	115.2	V30	V30-E34 PolarHBondContact O-N 3.39Å
35	R	38.3	Very low	43.6	Very low	225 Å²	225	151.9 Å²	151.9	85%	0.849	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	6.9	-179.1	-90.2	-170.4	-177.1	-175.4	5.6	116.9	E33	E33-R35 VanDerWaalsContact C-N 3.34Å; E33-R35 PolarHBondContact O-N 2.92Å
36	E	42.4	Very low	43.5	Very low	186 Å²	186	152.8 Å²	152.8	87%	0.869	75%	0.748	S	S	*	*	S	Bend	trans	-118.3	36.3	175.4	-74.9	-136.4	156.8	0	0	114.5
37	E	43.4	Very low	43.6	Very low	185 Å²	185	155.9 Å²	155.9	86%	0.864	76%	0.76	S	S	*	*			trans	-132.5	85.1	162.6	-73.9	-168.2	165	0	0	110.1
38	D	35.6	Very low	43.6	Very low	157 Å²	157	157.3 Å²	157.3	84%	0.84	77%	0.771	S	S	*	*			trans	-169.5	148.7	134.6	-130.8	-40.1	0	0	0	113.6
39	E	36.6	Very low	43.8	Very low	153 Å²	153	157.8 Å²	157.8	72%	0.715	78%	0.778	S	S	*	*			trans	82.7	72.3	164	-57.4	-168.6	166.5	0	0	119.8	E41	E39-E41 VanDerWaalsContact C-N 3.27Å; E39-E41 PolarHBondContact O-N 3.35Å
40	E	42.5	Very low	43.8	Very low	207 Å²	207	159.4 Å²	159.4	97%	0.967	79%	0.792	S	S	*	*			trans	-61	88.9	141.1	-86.4	-166.3	144.7	0	0	109.9	E42	E40-E42 PolarHBondContact O-N 2.95Å
41	E	41.7	Very low	44.5	Very low	158 Å²	158	161.1 Å²	161.1	74%	0.738	80%	0.804	S	S	*	*			trans	-75.5	101.3	163.8	-94.6	-158.7	150.1	0	0	110.7	E39 K43	E39-E41 VanDerWaalsContact C-N 3.27Å; E39-E41 PolarHBondContact O-N 3.35Å; E41-K43 PolarHBondContact O-N 3.3Å
42	E	46.5	Very low	44.5	Very low	179 Å²	179	167.7 Å²	167.7	84%	0.836	82%	0.822	S	S	*	*			trans	-64.7	97.2	172.6	-160.9	-173.5	-174.2	0	0	111.1	E40	E40-E42 PolarHBondContact O-N 2.95Å
43	K	46.5	Very low	44.8	Very low	179 Å²	179	167.1 Å²	167.1	78%	0.778	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-65.9	136.6	173.1	-76.1	179.2	-178.8	169.9	0	111.6	E41 R45	E41-K43 PolarHBondContact O-N 3.3Å; K43-R45 PolarHBondContact O-N 2.93Å
44	P	47.7	Very low	45.3	Very low	124 Å²	124	164.8 Å²	164.8	81%	0.805	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-69.7	127.6	-175.5	27.3	-32.9	0	0	0	111.5	P46	P44-P46 WeakPolarHBondContact O-CD 3.45Å
45	R	47.5	Very low	45.7	Very low	226 Å²	226	166.1 Å²	166.1	85%	0.853	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-59.3	122	175.2	-60.9	-178.7	-171.4	-155.5	1.1	110.6	K43 K47	K43-R45 PolarHBondContact O-N 2.93Å; R45-K47 PolarHBondContact O-N 2.92Å
46	P	50.3	Low	46.4	Very low	117 Å²	117	159.3 Å²	159.3	76%	0.76	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-73	129.3	173.1	12.3	-4.5	0	0	0	110.3	P44 L48	P44-P46 WeakPolarHBondContact O-CD 3.45Å; P46-L48 PolarHBondContact O-N 3.42Å; P46-L48 VanDerWaalsContact O-N 3.14Å
47	K	47.8	Very low	47.1	Very low	206 Å²	206	159 Å²	159	90%	0.896	83%	0.826	S	S	*	*			trans	-66.6	107.7	171.4	-71.5	174.9	-179.5	174.6	0	109.3	R45 T49	R45-K47 PolarHBondContact O-N 2.92Å; K47-T49 PolarHBondContact O-N 2.84Å
48	L	46.3	Very low	47.9	Very low	175 Å²	175	160.1 Å²	160.1	92%	0.916	83%	0.828	S	S	*	*			trans	-72.5	105.2	169.9	-71.3	165.2	0	0	0	109.4	P46	P46-L48 PolarHBondContact O-N 3.42Å; P46-L48 VanDerWaalsContact O-N 3.14Å
49	T	50	Low	49.1	Very low	127 Å²	127	157.3 Å²	157.3	78%	0.779	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-74.6	125.5	162.4	46.1	0	0	0	0	109.1	K47	K47-T49 PolarHBondContact O-N 2.84Å
50	A	46.3	Very low	50.9	Low	96 Å²	96	155.4 Å²	155.4	79%	0.793	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-56.4	124.7	-179.4	0	0	0	0	0	112.2	K52	A50-K52 PolarHBondContact O-N 3.37Å
51	P	59.2	Low	52.1	Low	120 Å²	120	153.5 Å²	153.5	78%	0.779	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-65.7	130.8	172.8	-18.5	31.1	0	0	0	111.1	I53	P51-I53 PolarHBondContact O-N 2.9Å
52	K	46.1	Very low	54	Low	201 Å²	201	150.2 Å²	150.2	87%	0.874	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-69.7	120.8	173.5	-162.1	104	177.1	165.8	0	108.9	A50 P54	A50-K52 PolarHBondContact O-N 3.37Å; K52-P54 WeakPolarHBondContact O-CD 3.44Å
53	I	48.2	Very low	55.8	Low	152 Å²	152	145 Å²	145	78%	0.779	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-77.2	123.5	176.6	-47.6	169.5	0	0	0	108.6	P51	P51-I53 PolarHBondContact O-N 2.9Å
54	P	51.9	Low	57.5	Low	119 Å²	119	140.8 Å²	140.8	77%	0.773	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-80.3	127.7	157.8	-2.4	21.8	0	0	0	108.7	K52	K52-P54 WeakPolarHBondContact O-CD 3.44Å
55	E	45.6	Very low	59.3	Low	196 Å²	196	140.4 Å²	140.4	92%	0.916	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-55.6	140.8	178.7	-79	172.5	128.2	0	0	113.5
56	G	53.2	Low	61.3	Low	82 Å²	82	134.9 Å²	134.9	85%	0.845	72%	0.72	S	S	*	*			trans	98.6	62.8	136.9	0	0	0	0	0	117.3
57	E	56	Low	63.2	Low	181 Å²	181	135.4 Å²	135.4	85%	0.846	71%	0.71	S	S	*	*			trans	-138.1	131.5	151.1	-160.4	165.8	-170.3	0	0	108.4	V59	E57-V59 PolarHBondContact O-N 3.4Å
58	K	61.3	Low	65.2	Low	208 Å²	208	133.7 Å²	133.7	90%	0.904	70%	0.698	S	S	*	*			trans	-53.7	108.8	-172.5	-81.5	173.4	175.3	173.7	0	109.8	D60	K58-D60 PolarHBondContact O-N 2.85Å; K58-D60 VanDerWaalsContact O-N 3.09Å
59	V	60.6	Low	67.2	Low	98 Å²	98	130.6 Å²	130.6	59%	0.594	68%	0.679	S	S	*	*			trans	-68.4	106.2	176.7	-172.8	0	0	0	0	108	E57 F61 I64	E57-V59 PolarHBondContact O-N 3.4Å; V59-F61 PolarHBondContact O-N 3.12Å; V59-I64 HydrophobicContact CG1-CD1 3.34Å; V59-I64 HydrophobicContact CG1-CG1 4.2Å
60	D	73.1	Confident	69.2	Low	112 Å²	112	129.1 Å²	129.1	60%	0.599	67%	0.666	S	S	*	*			trans	-77.7	106.9	178.7	-150.3	-13.7	0	0	0	108.7	K58 D62 D63 I64	K58-D60 PolarHBondContact O-N 2.85Å; K58-D60 VanDerWaalsContact O-N 3.09Å; D60-D62 PolarHBondContact O-N 2.95Å; D60-D63 HydrophobicContact CB-CB 4.06Å; D60-D63 WeakPolarHBondContact O-CB 3.4Å; D60-D63 PolarHBondContact O-N 3.48Å; D60-I64 PolarHBondContact O-N 3.13Å
61	F	69.1	Low	71.5	Confident	168 Å²	168	130.3 Å²	130.3	74%	0.737	65%	0.654	S	S	*	*	H	α-helix	trans	-60.2	-27.9	-175.6	-75.8	-84.5	0	0	0	112.5	V59 D63 I64 Q65	V59-F61 PolarHBondContact O-N 3.12Å; F61-D63 VanDerWaalsContact C-N 3.35Å; F61-I64 PolarHBondContact O-N 3.34Å; F61-Q65 PolarHBondContact O-N 3.46Å; F61-Q65 VanDerWaalsContact O-N 3.12Å
62	D	80.6	Confident	73.1	Confident	88 Å²	88	128.1 Å²	128.1	47%	0.471	64%	0.635	S	S	.	*	H	α-helix	trans	-70.5	-32.2	177.2	-146.2	44.1	0	0	0	111.7	D60 Q65 K66	D60-D62 PolarHBondContact O-N 2.95Å; D62-Q65 PolarHBondContact O-N 2.9Å; D62-K66 WeakPolarHBondContact O-CG 3.37Å; D62-K66 PolarHBondContact O-N 3.28Å; D62-K66 IonicContact OD2-NZ 3.79Å; D62-K66 PolarHBondContact OD2-NZ 3.41Å
63	D	85.1	Confident	75.4	Confident	69 Å²	69	123.7 Å²	123.7	37%	0.369	62%	0.621	S	S	.	*	H	α-helix	trans	-73.2	-36.7	175.2	-172.9	39	0	0	0	111.6	D60 F61 Q65 K67	D60-D63 HydrophobicContact CB-CB 4.06Å; D60-D63 WeakPolarHBondContact O-CB 3.4Å; D60-D63 PolarHBondContact O-N 3.48Å; F61-D63 VanDerWaalsContact C-N 3.35Å; D63-Q65 VanDerWaalsContact C-N 3.34Å; D63-K67 VanDerWaalsContact O-CB 3.3Å; D63-K67 WeakPolarHBondContact O-CB 3.33Å; D63-K67 VanDerWaalsContact O-CG 3.24Å; D63-K67 WeakPolarHBondContact O-CG 3.41Å; D63-K67 PolarHBondContact O-N 3.48Å; D63-K67 WeakPolarHBondContact OD1-CE 3.4Å; D63-K67 IonicContact OD1-NZ 3.31Å; D63-K67 VanDerWaalsContact OD2-CE 3.25Å; D63-K67 WeakPolarHBondContact OD2-CE 3.44Å; D63-K67 IonicContact OD2-NZ 2.66Å; D63-K67 PolarHBondContact OD2-NZ 2.93Å
64	I	82.4	Confident	77.5	Confident	91 Å²	91	123.3 Å²	123.3	47%	0.467	62%	0.617	S	S	.	*	H	α-helix	trans	-62.6	-43.8	172.4	-67.6	179.3	0	0	0	110.7	V59 D60 F61 K67 R68	V59-I64 HydrophobicContact CG1-CD1 3.34Å; V59-I64 HydrophobicContact CG1-CG1 4.2Å; D60-I64 PolarHBondContact O-N 3.13Å; F61-I64 PolarHBondContact O-N 3.34Å; I64-K67 PolarHBondContact O-N 3.14Å; I64-R68 WeakPolarHBondContact O-CB 3.32Å; I64-R68 PolarHBondContact O-N 3.46Å
65	Q	85.6	Confident	79.5	Confident	116 Å²	116	122.7 Å²	122.7	54%	0.542	60%	0.604	S	S	.	*	H	α-helix	trans	-68.1	-40.2	-178.2	-160.1	168.1	-1.3	0	0	111.6	F61 D62 D63 R68 Q69	F61-Q65 PolarHBondContact O-N 3.46Å; F61-Q65 VanDerWaalsContact O-N 3.12Å; D62-Q65 PolarHBondContact O-N 2.9Å; D63-Q65 VanDerWaalsContact C-N 3.34Å; Q65-R68 PolarHBondContact O-N 3.29Å; Q65-Q69 WeakPolarHBondContact O-CG 3.49Å; Q65-Q69 PolarHBondContact O-N 2.93Å
66	K	89.1	Confident	81.8	Confident	111 Å²	111	118 Å²	118	48%	0.483	59%	0.585	S	S	.	*	H	α-helix	trans	-64.7	-42.7	172.2	-76.4	173.5	-174.8	161.5	0	112.8	D62 R68 Q69 N70	D62-K66 WeakPolarHBondContact O-CG 3.37Å; D62-K66 PolarHBondContact O-N 3.28Å; D62-K66 IonicContact OD2-NZ 3.79Å; D62-K66 PolarHBondContact OD2-NZ 3.41Å; K66-R68 VanDerWaalsContact C-N 3.3Å; K66-R68 PolarHBondContact O-N 3.26Å; K66-Q69 PolarHBondContact O-N 3.02Å; K66-N70 WeakPolarHBondContact O-CB 3.47Å; K66-N70 PolarHBondContact O-N 3.28Å
67	K	90	Very high	83.8	Confident	127 Å²	127	118.9 Å²	118.9	55%	0.552	57%	0.567	S	S	*	*	H	α-helix	trans	-61.9	-39	175.4	-78.4	169.2	176.3	165.4	0	111.9	D63 I64 K71	D63-K67 VanDerWaalsContact O-CB 3.3Å; D63-K67 WeakPolarHBondContact O-CB 3.33Å; D63-K67 VanDerWaalsContact O-CG 3.24Å; D63-K67 WeakPolarHBondContact O-CG 3.41Å; D63-K67 PolarHBondContact O-N 3.48Å; D63-K67 WeakPolarHBondContact OD1-CE 3.4Å; D63-K67 IonicContact OD1-NZ 3.31Å; D63-K67 VanDerWaalsContact OD2-CE 3.25Å; D63-K67 WeakPolarHBondContact OD2-CE 3.44Å; D63-K67 IonicContact OD2-NZ 2.66Å; D63-K67 PolarHBondContact OD2-NZ 2.93Å; I64-K67 PolarHBondContact O-N 3.14Å; K67-K71 VanDerWaalsContact O-CB 3.31Å; K67-K71 WeakPolarHBondContact O-CB 3.22Å; K67-K71 PolarHBondContact O-N 2.96Å
68	R	89.9	Confident	85.6	Confident	171 Å²	171	113.1 Å²	113.1	65%	0.645	55%	0.55	S	S	*	.	H	α-helix	trans	-64.2	-50.4	173.6	-176.1	-179.8	177.4	179.7	2.7	111.5	I64 Q65 K66 N70 K71 D72	I64-R68 WeakPolarHBondContact O-CB 3.32Å; I64-R68 PolarHBondContact O-N 3.46Å; Q65-R68 PolarHBondContact O-N 3.29Å; K66-R68 VanDerWaalsContact C-N 3.3Å; K66-R68 PolarHBondContact O-N 3.26Å; R68-N70 VanDerWaalsContact C-N 3.33Å; R68-N70 PolarHBondContact O-N 3.45Å; R68-K71 WeakPolarHBondContact O-CB 3.24Å; R68-K71 PolarHBondContact O-N 2.87Å; R68-K71 VanDerWaalsContact O-N 3.16Å; R68-D72 IonicContact NE-OD2 3.72Å; R68-D72 WeakPolarHBondContact O-CB 3.5Å; R68-D72 PolarHBondContact O-N 3.03Å
69	Q	88.5	Confident	87.3	Confident	109 Å²	109	108.9 Å²	108.9	51%	0.509	54%	0.537	S	S	.	.	H	α-helix	trans	-59.4	-42.9	177.9	-74.4	176.6	-22.9	0	0	112.4	Q65 K66 K71 D72 L73	Q65-Q69 WeakPolarHBondContact O-CG 3.49Å; Q65-Q69 PolarHBondContact O-N 2.93Å; K66-Q69 PolarHBondContact O-N 3.02Å; Q69-K71 VanDerWaalsContact C-N 3.35Å; Q69-D72 PolarHBondContact O-N 3.17Å; Q69-L73 WeakPolarHBondContact O-CB 3.33Å; Q69-L73 VanDerWaalsContact O-CG 3.24Å; Q69-L73 WeakPolarHBondContact O-CG 3.18Å; Q69-L73 PolarHBondContact O-N 2.97Å
70	N	91.8	Very high	88.9	Confident	96 Å²	96	107.5 Å²	107.5	51%	0.513	53%	0.525	S	S	.	.	H	α-helix	trans	-64.6	-39.3	176.2	-76.4	-17.4	0	0	0	112.1	K66 R68 L73 M74	K66-N70 WeakPolarHBondContact O-CB 3.47Å; K66-N70 PolarHBondContact O-N 3.28Å; R68-N70 VanDerWaalsContact C-N 3.33Å; R68-N70 PolarHBondContact O-N 3.45Å; N70-L73 PolarHBondContact O-N 3.42Å; N70-M74 WeakPolarHBondContact O-CB 3.27Å; N70-M74 VanDerWaalsContact O-CG 3.27Å; N70-M74 WeakPolarHBondContact O-CG 3.11Å; N70-M74 PolarHBondContact O-N 3.46Å
71	K	94.1	Very high	90	Very high	121 Å²	121	106 Å²	106	53%	0.526	52%	0.518	S	S	.	.	H	α-helix	trans	-63	-49.6	174.3	-179.7	-177.6	169	-177	0	111.1	K67 R68 Q69 L73 M74 E75	K67-K71 VanDerWaalsContact O-CB 3.31Å; K67-K71 WeakPolarHBondContact O-CB 3.22Å; K67-K71 PolarHBondContact O-N 2.96Å; R68-K71 WeakPolarHBondContact O-CB 3.24Å; R68-K71 PolarHBondContact O-N 2.87Å; R68-K71 VanDerWaalsContact O-N 3.16Å; Q69-K71 VanDerWaalsContact C-N 3.35Å; K71-L73 VanDerWaalsContact C-N 3.28Å; K71-L73 PolarHBondContact O-N 2.91Å; K71-M74 PolarHBondContact O-N 3.12Å; K71-M74 VanDerWaalsContact O-N 3.16Å; K71-E75 WeakPolarHBondContact CE-OE1 3.38Å; K71-E75 HydrophobicContact CG-CG 4.41Å; K71-E75 IonicContact NZ-OE1 2.68Å; K71-E75 WeakPolarHBondContact O-CB 3.24Å; K71-E75 WeakPolarHBondContact O-CG 3.06Å; K71-E75 PolarHBondContact O-N 3.18Å
72	D	92.8	Very high	91.3	Very high	75 Å²	75	101.7 Å²	101.7	40%	0.401	51%	0.508	S	S	.	.	H	α-helix	trans	-61.4	-38	179.7	-63.6	-11.4	0	0	0	110.8	R68 Q69 L76	R68-D72 IonicContact NE-OD2 3.72Å; R68-D72 WeakPolarHBondContact O-CB 3.5Å; R68-D72 PolarHBondContact O-N 3.03Å; Q69-D72 PolarHBondContact O-N 3.17Å; D72-L76 VanDerWaalsContact O-CB 3.24Å; D72-L76 WeakPolarHBondContact O-CB 3.41Å; D72-L76 PolarHBondContact O-N 2.98Å
73	L	94.4	Very high	92	Very high	108 Å²	108	103 Å²	103	57%	0.565	51%	0.511	S	S	*	.	H	α-helix	trans	-66.9	-41.6	174.1	-75.1	171.6	0	0	0	112.7	Q69 N70 K71 Q77	Q69-L73 WeakPolarHBondContact O-CB 3.33Å; Q69-L73 VanDerWaalsContact O-CG 3.24Å; Q69-L73 WeakPolarHBondContact O-CG 3.18Å; Q69-L73 PolarHBondContact O-N 2.97Å; N70-L73 PolarHBondContact O-N 3.42Å; K71-L73 VanDerWaalsContact C-N 3.28Å; K71-L73 PolarHBondContact O-N 2.91Å; L73-Q77 WeakPolarHBondContact O-CB 3.46Å; L73-Q77 PolarHBondContact O-N 3.3Å
74	M	93.3	Very high	92.6	Very high	144 Å²	144	106.2 Å²	106.2	71%	0.709	52%	0.522	S	S	*	.	H	α-helix	trans	-67.7	-41	176.5	-74.3	-179.2	72.7	0	0	111.9	N70 K71 Q77 A78	N70-M74 WeakPolarHBondContact O-CB 3.27Å; N70-M74 VanDerWaalsContact O-CG 3.27Å; N70-M74 WeakPolarHBondContact O-CG 3.11Å; N70-M74 PolarHBondContact O-N 3.46Å; K71-M74 PolarHBondContact O-N 3.12Å; K71-M74 VanDerWaalsContact O-N 3.16Å; M74-Q77 PolarHBondContact O-N 3.47Å; M74-A78 WeakPolarHBondContact O-CB 3.28Å; M74-A78 PolarHBondContact O-N 3.14Å
75	E	92.6	Very high	93.2	Very high	105 Å²	105	106.4 Å²	106.4	49%	0.491	52%	0.521	S	S	.	.	H	α-helix	trans	-65.4	-40.8	175.6	-74.2	-179.5	174.9	0	0	111.3	K71 A78 L79	K71-E75 WeakPolarHBondContact CE-OE1 3.38Å; K71-E75 HydrophobicContact CG-CG 4.41Å; K71-E75 IonicContact NZ-OE1 2.68Å; K71-E75 WeakPolarHBondContact O-CB 3.24Å; K71-E75 WeakPolarHBondContact O-CG 3.06Å; K71-E75 PolarHBondContact O-N 3.18Å; E75-A78 PolarHBondContact O-N 3.36Å; E75-L79 WeakPolarHBondContact O-CB 3.37Å; E75-L79 PolarHBondContact O-N 2.9Å
76	L	94.6	Very high	93.7	Very high	97 Å²	97	103.6 Å²	103.6	51%	0.508	52%	0.517	S	S	.	.	H	α-helix	trans	-63	-44.4	175.1	-175.3	64.2	0	0	0	111.6	D72 L79 I80	D72-L76 VanDerWaalsContact O-CB 3.24Å; D72-L76 WeakPolarHBondContact O-CB 3.41Å; D72-L76 PolarHBondContact O-N 2.98Å; L76-L79 PolarHBondContact O-N 3.48Å; L76-I80 HydrophobicContact CD1-CD1 4.39Å; L76-I80 HydrophobicContact CG-CD1 4.01Å; L76-I80 WeakPolarHBondContact O-CB 3.4Å; L76-I80 VanDerWaalsContact O-CG1 3.23Å; L76-I80 WeakPolarHBondContact O-CG1 3.17Å; L76-I80 PolarHBondContact O-N 3Å
77	Q	94.2	Very high	94.1	Very high	102 Å²	102	104.8 Å²	104.8	48%	0.477	52%	0.519	S	S	.	.	H	α-helix	trans	-61.5	-44.5	175.9	-175	61.7	53.3	0	0	111.4	L73 M74 L79 I80 D81	L73-Q77 WeakPolarHBondContact O-CB 3.46Å; L73-Q77 PolarHBondContact O-N 3.3Å; M74-Q77 PolarHBondContact O-N 3.47Å; Q77-L79 VanDerWaalsContact C-N 3.34Å; Q77-L79 PolarHBondContact O-N 3.17Å; Q77-I80 PolarHBondContact O-N 3.19Å; Q77-D81 VanDerWaalsContact NE2-CG 3.35Å; Q77-D81 PolarHBondContact NE2-OD1 3.48Å; Q77-D81 PolarHBondContact NE2-OD2 2.92Å; Q77-D81 VanDerWaalsContact NE2-OD2 3.11Å; Q77-D81 VanDerWaalsContact O-CG 3.28Å; Q77-D81 PolarHBondContact O-N 3.17Å
78	A	94.4	Very high	94.4	Very high	59 Å²	59	103.7 Å²	103.7	49%	0.488	51%	0.514	S	S	.	.	H	α-helix	trans	-63.2	-38.5	177.6	0	0	0	0	0	112.6	M74 E75 S82	M74-A78 WeakPolarHBondContact O-CB 3.28Å; M74-A78 PolarHBondContact O-N 3.14Å; E75-A78 PolarHBondContact O-N 3.36Å; A78-S82 VanDerWaalsContact O-CB 3.22Å; A78-S82 WeakPolarHBondContact O-CB 3.24Å; A78-S82 PolarHBondContact O-N 3.43Å
79	L	96.3	Very high	94.7	Very high	120 Å²	120	101.3 Å²	101.3	63%	0.628	51%	0.508	S	S	*	.	H	α-helix	trans	-67.4	-41.3	176.5	-173.5	67.6	0	0	0	111.6	E75 L76 Q77 S82 H83	E75-L79 WeakPolarHBondContact O-CB 3.37Å; E75-L79 PolarHBondContact O-N 2.9Å; L76-L79 PolarHBondContact O-N 3.48Å; Q77-L79 VanDerWaalsContact C-N 3.34Å; Q77-L79 PolarHBondContact O-N 3.17Å; L79-S82 PolarHBondContact O-N 2.88Å; L79-H83 WeakPolarHBondContact O-CB 3.23Å; L79-H83 PolarHBondContact O-N 2.85Å
80	I	94.8	Very high	94.9	Very high	69 Å²	69	102.5 Å²	102.5	35%	0.354	51%	0.514	S	S	.	.	H	α-helix	trans	-59.6	-53.2	174.9	-72.2	167.4	0	0	0	109.8	L76 Q77 S82 H83 F84	L76-I80 HydrophobicContact CD1-CD1 4.39Å; L76-I80 HydrophobicContact CG-CD1 4.01Å; L76-I80 WeakPolarHBondContact O-CB 3.4Å; L76-I80 VanDerWaalsContact O-CG1 3.23Å; L76-I80 WeakPolarHBondContact O-CG1 3.17Å; L76-I80 PolarHBondContact O-N 3Å; Q77-I80 PolarHBondContact O-N 3.19Å; I80-S82 VanDerWaalsContact C-N 3.33Å; I80-S82 PolarHBondContact O-N 3.38Å; I80-H83 PolarHBondContact O-N 3.31Å; I80-H83 VanDerWaalsContact O-N 3.17Å; I80-F84 HydrophobicContact CG2-CD2 3.72Å; I80-F84 HydrophobicContact CG2-CE2 3.74Å; I80-F84 VanDerWaalsContact O-CD2 3.24Å; I80-F84 WeakPolarHBondContact O-CD2 3.48Å; I80-F84 PolarHBondContact O-N 3.41Å
81	D	95.7	Very high	95	Very high	81 Å²	81	102.4 Å²	102.4	43%	0.433	51%	0.51	S	S	.	.	H	α-helix	trans	-63	-41.1	-178.5	-65.6	-24.6	0	0	0	111.3	Q77 H83 F84 E85	Q77-D81 VanDerWaalsContact NE2-CG 3.35Å; Q77-D81 PolarHBondContact NE2-OD1 3.48Å; Q77-D81 PolarHBondContact NE2-OD2 2.92Å; Q77-D81 VanDerWaalsContact NE2-OD2 3.11Å; Q77-D81 VanDerWaalsContact O-CG 3.28Å; Q77-D81 PolarHBondContact O-N 3.17Å; D81-H83 VanDerWaalsContact C-N 3.34Å; D81-H83 PolarHBondContact O-N 2.89Å; D81-F84 PolarHBondContact O-N 3.3Å; D81-E85 WeakPolarHBondContact O-CB 3.34Å; D81-E85 WeakPolarHBondContact O-CG 3.27Å; D81-E85 PolarHBondContact O-N 2.89Å
82	S	96.1	Very high	95.1	Very high	77 Å²	77	101.8 Å²	101.8	54%	0.538	51%	0.509	S	S	.	.	H	α-helix	trans	-60.6	-41	174.8	-175.4	0	0	0	0	112.5	A78 L79 I80 A86	A78-S82 VanDerWaalsContact O-CB 3.22Å; A78-S82 WeakPolarHBondContact O-CB 3.24Å; A78-S82 PolarHBondContact O-N 3.43Å; L79-S82 PolarHBondContact O-N 2.88Å; I80-S82 VanDerWaalsContact C-N 3.33Å; I80-S82 PolarHBondContact O-N 3.38Å; S82-A86 WeakPolarHBondContact O-CB 3.48Å; S82-A86 PolarHBondContact O-N 3.02Å
83	H	96.9	Very high	95.2	Very high	115 Å²	115	104.9 Å²	104.9	53%	0.532	52%	0.522	S	S	.	.	H	α-helix	trans	-68.8	-42.4	179.6	-178.5	-81.7	0	0	0	111.6	L79 I80 D81 R87	L79-H83 WeakPolarHBondContact O-CB 3.23Å; L79-H83 PolarHBondContact O-N 2.85Å; I80-H83 PolarHBondContact O-N 3.31Å; I80-H83 VanDerWaalsContact O-N 3.17Å; D81-H83 VanDerWaalsContact C-N 3.34Å; D81-H83 PolarHBondContact O-N 2.89Å; H83-R87 VanDerWaalsContact O-CB 3.32Å; H83-R87 WeakPolarHBondContact O-CB 3.43Å; H83-R87 PolarHBondContact O-N 2.97Å
84	F	96.9	Very high	95.2	Very high	136 Å²	136	103.9 Å²	103.9	60%	0.596	52%	0.516	S	S	*	.	H	α-helix	trans	-67.6	-42.9	177.3	-81.2	-71.4	0	0	0	112.4	I80 D81 K88	I80-F84 HydrophobicContact CG2-CD2 3.72Å; I80-F84 HydrophobicContact CG2-CE2 3.74Å; I80-F84 VanDerWaalsContact O-CD2 3.24Å; I80-F84 WeakPolarHBondContact O-CD2 3.48Å; I80-F84 PolarHBondContact O-N 3.41Å; D81-F84 PolarHBondContact O-N 3.3Å; F84-K88 WeakPolarHBondContact O-CB 3.42Å; F84-K88 PolarHBondContact O-N 3.04Å
85	E	96	Very high	95.2	Very high	96 Å²	96	101.4 Å²	101.4	45%	0.449	51%	0.505	S	S	.	.	H	α-helix	trans	-67.7	-39.1	177.5	-74.7	-65	145.7	0	0	112.2	D81 K89	D81-E85 WeakPolarHBondContact O-CB 3.34Å; D81-E85 WeakPolarHBondContact O-CG 3.27Å; D81-E85 PolarHBondContact O-N 2.89Å; E85-K89 WeakPolarHBondContact O-CB 3.31Å; E85-K89 WeakPolarHBondContact O-CG 3.47Å; E85-K89 PolarHBondContact O-N 2.96Å
86	A	95.8	Very high	95.4	Very high	56 Å²	56	98.6 Å²	98.6	46%	0.463	50%	0.499	S	S	.	.	H	α-helix	trans	-62	-50.5	174.5	0	0	0	0	0	111.2	S82 K88 K89 E90	S82-A86 WeakPolarHBondContact O-CB 3.48Å; S82-A86 PolarHBondContact O-N 3.02Å; A86-K88 VanDerWaalsContact C-N 3.34Å; A86-K88 PolarHBondContact O-N 3.22Å; A86-K89 PolarHBondContact O-N 3.26Å; A86-E90 WeakPolarHBondContact O-CB 3.31Å; A86-E90 PolarHBondContact O-N 3.04Å
87	R	96	Very high	95.5	Very high	136 Å²	136	98 Å²	98	51%	0.513	50%	0.496	S	S	.	.	H	α-helix	trans	-62.9	-40.1	179	-171.3	177	-175.4	106.7	3.7	112.5	H83 E90 E91	H83-R87 VanDerWaalsContact O-CB 3.32Å; H83-R87 WeakPolarHBondContact O-CB 3.43Å; H83-R87 PolarHBondContact O-N 2.97Å; R87-E90 PolarHBondContact O-N 3.41Å; R87-E91 HydrophobicContact CG-CG 4.35Å; R87-E91 IonicContact CZ-OE1 3.85Å; R87-E91 IonicContact NE-OE1 4Å; R87-E91 PolarHBondContact NE-OE1 3.3Å; R87-E91 IonicContact NH2-OE1 2.71Å; R87-E91 WeakPolarHBondContact O-CB 3.46Å; R87-E91 VanDerWaalsContact O-CG 3.31Å; R87-E91 WeakPolarHBondContact O-CG 3.31Å; R87-E91 PolarHBondContact O-N 3.38Å
88	K	96.5	Very high	95.6	Very high	105 Å²	105	99.1 Å²	99.1	46%	0.457	50%	0.499	S	S	.	.	H	α-helix	trans	-63.1	-43.8	177.7	-178.2	-178.6	172.2	-167.5	0	111.4	F84 A86 E91 E92	F84-K88 WeakPolarHBondContact O-CB 3.42Å; F84-K88 PolarHBondContact O-N 3.04Å; A86-K88 VanDerWaalsContact C-N 3.34Å; A86-K88 PolarHBondContact O-N 3.22Å; K88-E91 PolarHBondContact O-N 3.47Å; K88-E92 WeakPolarHBondContact CE-OE1 3.41Å; K88-E92 WeakPolarHBondContact O-CB 3.35Å; K88-E92 VanDerWaalsContact O-CG 3.28Å; K88-E92 WeakPolarHBondContact O-CG 3.32Å; K88-E92 PolarHBondContact O-N 3.26Å
89	K	96.5	Very high	95.7	Very high	121 Å²	121	102.2 Å²	102.2	53%	0.526	50%	0.504	S	S	.	.	H	α-helix	trans	-63.6	-45.3	175.7	-74.2	176.2	-177.4	179.2	0	111.8	E85 A86 E91 E92 E93	E85-K89 WeakPolarHBondContact O-CB 3.31Å; E85-K89 WeakPolarHBondContact O-CG 3.47Å; E85-K89 PolarHBondContact O-N 2.96Å; A86-K89 PolarHBondContact O-N 3.26Å; K89-E91 PolarHBondContact O-N 3.28Å; K89-E92 PolarHBondContact O-N 3.12Å; K89-E93 WeakPolarHBondContact O-CB 3.06Å; K89-E93 WeakPolarHBondContact O-CG 3.47Å; K89-E93 PolarHBondContact O-N 3.07Å
90	E	94	Very high	95.7	Very high	133 Å²	133	103.9 Å²	103.9	62%	0.621	50%	0.502	S	S	*	.	H	α-helix	trans	-61	-43.8	176.7	-171	-170.3	163.9	0	0	111.8	A86 R87 E93 L94	A86-E90 WeakPolarHBondContact O-CB 3.31Å; A86-E90 PolarHBondContact O-N 3.04Å; R87-E90 PolarHBondContact O-N 3.41Å; E90-E93 PolarHBondContact O-N 3.43Å; E90-L94 VanDerWaalsContact O-CB 3.31Å; E90-L94 WeakPolarHBondContact O-CB 3.41Å; E90-L94 PolarHBondContact O-N 3.34Å
91	E	94.1	Very high	95.7	Very high	94 Å²	94	103.8 Å²	103.8	44%	0.439	50%	0.501	S	S	.	.	H	α-helix	trans	-64.4	-42	176.2	-75.8	178.5	-171.8	0	0	111.7	R87 K88 K89 L94 I95	R87-E91 HydrophobicContact CG-CG 4.35Å; R87-E91 IonicContact CZ-OE1 3.85Å; R87-E91 IonicContact NE-OE1 4Å; R87-E91 PolarHBondContact NE-OE1 3.3Å; R87-E91 IonicContact NH2-OE1 2.71Å; R87-E91 WeakPolarHBondContact O-CB 3.46Å; R87-E91 VanDerWaalsContact O-CG 3.31Å; R87-E91 WeakPolarHBondContact O-CG 3.31Å; R87-E91 PolarHBondContact O-N 3.38Å; K88-E91 PolarHBondContact O-N 3.47Å; K89-E91 PolarHBondContact O-N 3.28Å; E91-L94 PolarHBondContact O-N 2.9Å; E91-I95 WeakPolarHBondContact O-CB 3.4Å; E91-I95 WeakPolarHBondContact O-CD1 3.3Å; E91-I95 WeakPolarHBondContact O-CG1 3.16Å; E91-I95 PolarHBondContact O-N 2.92Å
92	E	94.9	Very high	95.7	Very high	109 Å²	109	106.5 Å²	106.5	51%	0.509	51%	0.512	S	S	.	.	H	α-helix	trans	-62.9	-41.8	175.4	-76	174.7	-172.3	0	0	112	K88 K89 I95 A96	K88-E92 WeakPolarHBondContact CE-OE1 3.41Å; K88-E92 WeakPolarHBondContact O-CB 3.35Å; K88-E92 VanDerWaalsContact O-CG 3.28Å; K88-E92 WeakPolarHBondContact O-CG 3.32Å; K88-E92 PolarHBondContact O-N 3.26Å; K89-E92 PolarHBondContact O-N 3.12Å; E92-I95 PolarHBondContact O-N 2.78Å; E92-A96 WeakPolarHBondContact O-CB 3.38Å; E92-A96 PolarHBondContact O-N 2.97Å
93	E	94.3	Very high	95.8	Very high	140 Å²	140	109.2 Å²	109.2	65%	0.654	51%	0.513	S	S	*	.	H	α-helix	trans	-66.6	-42.6	176.4	-74	174.9	-170.5	0	0	111.9	K89 E90 I95 A96 L97	K89-E93 WeakPolarHBondContact O-CB 3.06Å; K89-E93 WeakPolarHBondContact O-CG 3.47Å; K89-E93 PolarHBondContact O-N 3.07Å; E90-E93 PolarHBondContact O-N 3.43Å; E93-I95 VanDerWaalsContact C-N 3.34Å; E93-I95 PolarHBondContact O-N 3.22Å; E93-A96 PolarHBondContact O-N 3.25Å; E93-L97 WeakPolarHBondContact O-CB 3.47Å; E93-L97 PolarHBondContact O-N 3.4Å
94	L	94.8	Very high	95.7	Very high	86 Å²	86	109.8 Å²	109.8	45%	0.45	51%	0.511	S	S	.	.	H	α-helix	trans	-64.6	-39.6	176.9	-171.4	69.2	0	0	0	111.7	E90 E91 K98	E90-L94 VanDerWaalsContact O-CB 3.31Å; E90-L94 WeakPolarHBondContact O-CB 3.41Å; E90-L94 PolarHBondContact O-N 3.34Å; E91-L94 PolarHBondContact O-N 2.9Å; L94-K98 WeakPolarHBondContact O-CB 3.44Å; L94-K98 VanDerWaalsContact O-CG 3.31Å; L94-K98 WeakPolarHBondContact O-CG 3.4Å; L94-K98 PolarHBondContact O-N 3.35Å
95	I	94.7	Very high	95.7	Very high	93 Å²	93	111.2 Å²	111.2	48%	0.477	51%	0.513	S	S	.	.	H	α-helix	trans	-64.5	-48.3	174.5	-70.3	165	0	0	0	109.9	E91 E92 E93 L97 K98 E99	E91-I95 WeakPolarHBondContact O-CB 3.4Å; E91-I95 WeakPolarHBondContact O-CD1 3.3Å; E91-I95 WeakPolarHBondContact O-CG1 3.16Å; E91-I95 PolarHBondContact O-N 2.92Å; E92-I95 PolarHBondContact O-N 2.78Å; E93-I95 VanDerWaalsContact C-N 3.34Å; E93-I95 PolarHBondContact O-N 3.22Å; I95-L97 VanDerWaalsContact C-N 3.27Å; I95-L97 PolarHBondContact O-N 3.4Å; I95-K98 PolarHBondContact O-N 2.85Å; I95-K98 VanDerWaalsContact O-N 3.17Å; I95-E99 HydrophobicContact CG2-CG 4.4Å; I95-E99 WeakPolarHBondContact O-CG 3.37Å; I95-E99 PolarHBondContact O-N 3.47Å
96	A	96.5	Very high	95.5	Very high	45 Å²	45	109.3 Å²	109.3	37%	0.372	51%	0.513	S	S	.	.	H	α-helix	trans	-60.7	-36.7	179	0	0	0	0	0	112.5	E92 E93 R100	E92-A96 WeakPolarHBondContact O-CB 3.38Å; E92-A96 PolarHBondContact O-N 2.97Å; E93-A96 PolarHBondContact O-N 3.25Å; A96-R100 PolarHBondContact O-N 3.27Å; A96-R100 VanDerWaalsContact O-N 3.14Å
97	L	96.3	Very high	95.5	Very high	84 Å²	84	110.8 Å²	110.8	44%	0.44	51%	0.51	S	S	.	.	H	α-helix	trans	-66.7	-46.7	174.9	-177.8	60.8	0	0	0	111.5	E93 I95 E99 R100 I101	E93-L97 WeakPolarHBondContact O-CB 3.47Å; E93-L97 PolarHBondContact O-N 3.4Å; I95-L97 VanDerWaalsContact C-N 3.27Å; I95-L97 PolarHBondContact O-N 3.4Å; L97-E99 PolarHBondContact O-N 2.86Å; L97-R100 PolarHBondContact O-N 2.83Å; L97-I101 HydrophobicContact CD1-CD1 4.4Å; L97-I101 HydrophobicContact CG-CD1 4.17Å; L97-I101 WeakPolarHBondContact O-CG1 3.31Å; L97-I101 PolarHBondContact O-N 3.02Å
98	K	95.6	Very high	95.5	Very high	126 Å²	126	110.3 Å²	110.3	55%	0.548	51%	0.509	S	S	.	.	H	α-helix	trans	-59.3	-45.4	176.3	-77.2	174.2	-179.4	174.6	0	112	L94 I95 R100 I101 E102	L94-K98 WeakPolarHBondContact O-CB 3.44Å; L94-K98 VanDerWaalsContact O-CG 3.31Å; L94-K98 WeakPolarHBondContact O-CG 3.4Å; L94-K98 PolarHBondContact O-N 3.35Å; I95-K98 PolarHBondContact O-N 2.85Å; I95-K98 VanDerWaalsContact O-N 3.17Å; K98-R100 VanDerWaalsContact C-N 3.29Å; K98-R100 PolarHBondContact O-N 2.96Å; K98-I101 PolarHBondContact O-N 3.42Å; K98-E102 WeakPolarHBondContact O-CB 3.4Å; K98-E102 PolarHBondContact O-N 2.94Å
99	E	96.1	Very high	95.3	Very high	124 Å²	124	107.6 Å²	107.6	58%	0.579	51%	0.506	S	S	*	.	H	α-helix	trans	-59.7	-39.1	176	-73.5	-177.1	173	0	0	111.9	I95 L97 K103	I95-E99 HydrophobicContact CG2-CG 4.4Å; I95-E99 WeakPolarHBondContact O-CG 3.37Å; I95-E99 PolarHBondContact O-N 3.47Å; L97-E99 PolarHBondContact O-N 2.86Å; E99-K103 VanDerWaalsContact O-CB 3.27Å; E99-K103 WeakPolarHBondContact O-CB 3.38Å; E99-K103 PolarHBondContact O-N 3.44Å
100	R	97.1	Very high	95.2	Very high	155 Å²	155	107.7 Å²	107.7	59%	0.585	51%	0.508	S	S	*	.	H	α-helix	trans	-68.4	-37.8	176.8	-167.4	-176.2	-62	167.4	3.1	112.6	A96 L97 K98 R104	A96-R100 PolarHBondContact O-N 3.27Å; A96-R100 VanDerWaalsContact O-N 3.14Å; L97-R100 PolarHBondContact O-N 2.83Å; K98-R100 VanDerWaalsContact C-N 3.29Å; K98-R100 PolarHBondContact O-N 2.96Å; R100-R104 WeakPolarHBondContact O-CG 3.31Å; R100-R104 PolarHBondContact O-N 2.92Å; R100-R104 VanDerWaalsContact O-N 3.12Å
101	I	95.6	Very high	95.2	Very high	67 Å²	67	106.1 Å²	106.1	34%	0.344	50%	0.501	S	S	.	.	H	α-helix	trans	-67.8	-46.8	175.4	-68.4	169.8	0	0	0	109.9	L97 K98 K103 R104 R105	L97-I101 HydrophobicContact CD1-CD1 4.4Å; L97-I101 HydrophobicContact CG-CD1 4.17Å; L97-I101 WeakPolarHBondContact O-CG1 3.31Å; L97-I101 PolarHBondContact O-N 3.02Å; K98-I101 PolarHBondContact O-N 3.42Å; I101-K103 VanDerWaalsContact C-N 3.33Å; I101-K103 PolarHBondContact O-N 2.95Å; I101-R104 PolarHBondContact O-N 3.33Å; I101-R105 PolarHBondContact O-N 3.43Å
102	E	95.7	Very high	95.1	Very high	139 Å²	139	107.7 Å²	107.7	65%	0.65	51%	0.508	S	S	*	.	H	α-helix	trans	-60.9	-43.1	178.9	-173.1	171.6	-167.4	0	0	111.3	K98 R104 R105 A106	K98-E102 WeakPolarHBondContact O-CB 3.4Å; K98-E102 PolarHBondContact O-N 2.94Å; E102-R104 PolarHBondContact O-N 2.9Å; E102-R105 PolarHBondContact O-N 3.44Å; E102-A106 WeakPolarHBondContact O-CB 3.42Å; E102-A106 PolarHBondContact O-N 2.98Å
103	K	96.9	Very high	94.9	Very high	133 Å²	133	111.8 Å²	111.8	58%	0.578	52%	0.519	S	S	*	.	H	α-helix	trans	-59.2	-46.2	173.5	-176.2	177.2	174.7	-177.1	0	112.3	E99 I101 R105 A106 E107	E99-K103 VanDerWaalsContact O-CB 3.27Å; E99-K103 WeakPolarHBondContact O-CB 3.38Å; E99-K103 PolarHBondContact O-N 3.44Å; I101-K103 VanDerWaalsContact C-N 3.33Å; I101-K103 PolarHBondContact O-N 2.95Å; K103-R105 VanDerWaalsContact C-N 3.35Å; K103-R105 PolarHBondContact O-N 3.23Å; K103-A106 PolarHBondContact O-N 2.95Å; K103-E107 WeakPolarHBondContact CE-OE1 3.38Å; K103-E107 WeakPolarHBondContact O-CG 3.49Å; K103-E107 PolarHBondContact O-N 3.46Å
104	R	96	Very high	94.9	Very high	128 Å²	128	108.4 Å²	108.4	48%	0.483	50%	0.504	S	S	.	.	H	α-helix	trans	-63.4	-38.6	177.2	-80	-172.2	-86.1	179.2	-4.4	112.4	R100 I101 E102 R108	R100-R104 WeakPolarHBondContact O-CG 3.31Å; R100-R104 PolarHBondContact O-N 2.92Å; R100-R104 VanDerWaalsContact O-N 3.12Å; I101-R104 PolarHBondContact O-N 3.33Å; E102-R104 PolarHBondContact O-N 2.9Å; R104-R108 PolarHBondContact O-N 3.13Å
105	R	95.9	Very high	94.8	Very high	166 Å²	166	112.5 Å²	112.5	63%	0.626	51%	0.514	S	S	*	.	H	α-helix	trans	-65.8	-43.6	174.6	-75.6	-178.1	175.6	-179.4	-1.7	111.6	I101 E102 K103 R108 A109	I101-R105 PolarHBondContact O-N 3.43Å; E102-R105 PolarHBondContact O-N 3.44Å; K103-R105 VanDerWaalsContact C-N 3.35Å; K103-R105 PolarHBondContact O-N 3.23Å; R105-R108 PolarHBondContact O-N 3.14Å; R105-A109 WeakPolarHBondContact O-CB 3.38Å; R105-A109 PolarHBondContact O-N 3.37Å
106	A	92.5	Very high	94.6	Very high	56 Å²	56	111.1 Å²	111.1	46%	0.463	52%	0.517	S	S	.	.	H	α-helix	trans	-62.1	-43.2	176.3	0	0	0	0	0	111.7	E102 K103 A109 E110	E102-A106 WeakPolarHBondContact O-CB 3.42Å; E102-A106 PolarHBondContact O-N 2.98Å; K103-A106 PolarHBondContact O-N 2.95Å; A106-A109 PolarHBondContact O-N 3.46Å; A106-E110 WeakPolarHBondContact O-CB 3.45Å; A106-E110 PolarHBondContact O-N 3.09Å
107	E	95.2	Very high	94.4	Very high	86 Å²	86	115.6 Å²	115.6	40%	0.402	53%	0.53	S	S	.	.	H	α-helix	trans	-62.1	-42.4	175.8	-74.7	172.4	-176.5	0	0	112	K103 E110 Q111	K103-E107 WeakPolarHBondContact CE-OE1 3.38Å; K103-E107 WeakPolarHBondContact O-CG 3.49Å; K103-E107 PolarHBondContact O-N 3.46Å; E107-E110 PolarHBondContact O-N 3.5Å; E107-Q111 VanDerWaalsContact O-CG 3.31Å; E107-Q111 WeakPolarHBondContact O-CG 3.48Å; E107-Q111 PolarHBondContact O-N 3.01Å
108	R	95.6	Very high	94.3	Very high	127 Å²	127	117.6 Å²	117.6	48%	0.479	54%	0.535	S	S	.	.	H	α-helix	trans	-63.4	-46.2	174.4	-79.1	-171.6	-89.8	150.6	-18.3	112.2	E21 R104 R105 E110 Q111 Q112	E21-R108 IonicContact OE1-NH1 3.88Å; R104-R108 PolarHBondContact O-N 3.13Å; R105-R108 PolarHBondContact O-N 3.14Å; R108-E110 VanDerWaalsContact C-N 3.3Å; R108-E110 PolarHBondContact O-N 3.19Å; R108-Q111 PolarHBondContact O-N 3.43Å; R108-Q112 PolarHBondContact O-N 2.9Å
109	A	93.9	Very high	94	Very high	48 Å²	48	115.6 Å²	115.6	40%	0.397	53%	0.528	S	S	.	.	H	α-helix	trans	-61.2	-39.5	176.6	0	0	0	0	0	111.8	R105 A106 Q112 R113	R105-A109 WeakPolarHBondContact O-CB 3.38Å; R105-A109 PolarHBondContact O-N 3.37Å; A106-A109 PolarHBondContact O-N 3.46Å; A109-Q112 PolarHBondContact O-N 3.29Å; A109-R113 WeakPolarHBondContact O-CG 3.21Å; A109-R113 PolarHBondContact O-N 3.48Å
110	E	93.4	Very high	93.7	Very high	122 Å²	122	118.2 Å²	118.2	57%	0.57	53%	0.532	S	S	*	.	H	α-helix	trans	-66.5	-42	175.4	-171.4	173.3	-170.1	0	0	111.7	A106 E107 R108 Q112 R113 I114	A106-E110 WeakPolarHBondContact O-CB 3.45Å; A106-E110 PolarHBondContact O-N 3.09Å; E107-E110 PolarHBondContact O-N 3.5Å; R108-E110 VanDerWaalsContact C-N 3.3Å; R108-E110 PolarHBondContact O-N 3.19Å; E110-Q112 PolarHBondContact O-N 3.16Å; E110-R113 PolarHBondContact O-N 3.09Å; E110-I114 HydrophobicContact CG-CD1 4.04Å; E110-I114 VanDerWaalsContact O-CG1 3.31Å; E110-I114 WeakPolarHBondContact O-CG1 3.34Å; E110-I114 PolarHBondContact O-N 2.85Å
111	Q	94.3	Very high	93.4	Very high	101 Å²	101	115.7 Å²	115.7	47%	0.472	53%	0.527	S	S	.	.	H	α-helix	trans	-60.3	-44.1	174.3	-74.5	179.5	21	0	0	112.3	E107 R108 I114 R115	E107-Q111 VanDerWaalsContact O-CG 3.31Å; E107-Q111 WeakPolarHBondContact O-CG 3.48Å; E107-Q111 PolarHBondContact O-N 3.01Å; R108-Q111 PolarHBondContact O-N 3.43Å; Q111-I114 PolarHBondContact O-N 3.42Å; Q111-R115 WeakPolarHBondContact O-CG 3.41Å; Q111-R115 PolarHBondContact O-N 2.99Å
112	Q	91.3	Very high	93.1	Very high	126 Å²	126	119.9 Å²	119.9	59%	0.589	54%	0.538	S	S	*	.	H	α-helix	trans	-61.6	-44	175	-76.1	-179.7	-16.9	0	0	111.4	R108 A109 E110 I114 R115 A116	R108-Q112 PolarHBondContact O-N 2.9Å; A109-Q112 PolarHBondContact O-N 3.29Å; E110-Q112 PolarHBondContact O-N 3.16Å; Q112-I114 PolarHBondContact O-N 2.87Å; Q112-R115 PolarHBondContact O-N 3.38Å; Q112-A116 WeakPolarHBondContact O-CB 3.29Å; Q112-A116 PolarHBondContact O-N 3.47Å
113	R	91.6	Very high	92.6	Very high	195 Å²	195	118.2 Å²	118.2	74%	0.736	53%	0.53	S	S	*	.	H	α-helix	trans	-60.2	-43.4	175.6	-74.9	-174.5	69.6	171.2	1.6	112.6	A109 E110 R115 A116 E117	A109-R113 WeakPolarHBondContact O-CG 3.21Å; A109-R113 PolarHBondContact O-N 3.48Å; E110-R113 PolarHBondContact O-N 3.09Å; R113-R115 VanDerWaalsContact C-N 3.35Å; R113-A116 PolarHBondContact O-N 2.84Å; R113-E117 VanDerWaalsContact O-CB 3.29Å; R113-E117 WeakPolarHBondContact O-CB 3.37Å; R113-E117 PolarHBondContact O-N 3.36Å
114	I	92.9	Very high	92	Very high	69 Å²	69	116 Å²	116	35%	0.354	53%	0.525	S	S	.	.	H	α-helix	trans	-65.1	-39.5	177.5	-68.9	167	0	0	0	111	E110 Q111 Q112 K118	E110-I114 HydrophobicContact CG-CD1 4.04Å; E110-I114 VanDerWaalsContact O-CG1 3.31Å; E110-I114 WeakPolarHBondContact O-CG1 3.34Å; E110-I114 PolarHBondContact O-N 2.85Å; Q111-I114 PolarHBondContact O-N 3.42Å; Q112-I114 PolarHBondContact O-N 2.87Å; I114-K118 HydrophobicContact CG2-CD 4.1Å; I114-K118 WeakPolarHBondContact O-CB 3.5Å; I114-K118 VanDerWaalsContact O-CG 3.3Å; I114-K118 WeakPolarHBondContact O-CG 3.42Å; I114-K118 PolarHBondContact O-N 3.43Å
115	R	92.9	Very high	91.6	Very high	173 Å²	173	116.6 Å²	116.6	65%	0.653	53%	0.527	S	S	*	.	H	α-helix	trans	-63.9	-49	175.3	-73.7	178.8	-171.1	162.7	4.4	111.1	Q111 Q112 R113 E117 K118 E119	Q111-R115 WeakPolarHBondContact O-CG 3.41Å; Q111-R115 PolarHBondContact O-N 2.99Å; Q112-R115 PolarHBondContact O-N 3.38Å; R113-R115 VanDerWaalsContact C-N 3.35Å; R115-E117 VanDerWaalsContact C-N 3.34Å; R115-E117 PolarHBondContact O-N 3.22Å; R115-K118 PolarHBondContact O-N 3.31Å; R115-E119 PolarHBondContact O-N 3.46Å
116	A	92.3	Very high	91.1	Very high	64 Å²	64	113.6 Å²	113.6	53%	0.529	52%	0.523	S	S	.	.	H	α-helix	trans	-61.3	-40.6	177.6	0	0	0	0	0	112.4	Q112 R113 E119 R120	Q112-A116 WeakPolarHBondContact O-CB 3.29Å; Q112-A116 PolarHBondContact O-N 3.47Å; R113-A116 PolarHBondContact O-N 2.84Å; A116-E119 PolarHBondContact O-N 3.47Å; A116-R120 VanDerWaalsContact O-CB 3.29Å; A116-R120 WeakPolarHBondContact O-CB 3.33Å; A116-R120 PolarHBondContact O-N 2.88Å
117	E	91.2	Very high	90.6	Very high	138 Å²	138	113.7 Å²	113.7	65%	0.645	52%	0.524	S	S	*	.	H	α-helix	trans	-66.1	-43.9	176.5	-175.2	172.1	-161.3	0	0	111.9	R113 R115 E119 R120 E121	R113-E117 VanDerWaalsContact O-CB 3.29Å; R113-E117 WeakPolarHBondContact O-CB 3.37Å; R113-E117 PolarHBondContact O-N 3.36Å; R115-E117 VanDerWaalsContact C-N 3.34Å; R115-E117 PolarHBondContact O-N 3.22Å; E117-E119 VanDerWaalsContact C-N 3.35Å; E117-E119 PolarHBondContact O-N 2.92Å; E117-R120 PolarHBondContact O-N 3.46Å; E117-E121 WeakPolarHBondContact O-CB 3.37Å; E117-E121 PolarHBondContact O-N 3.12Å
118	K	93.8	Very high	90	Very high	126 Å²	126	116.4 Å²	116.4	55%	0.548	54%	0.537	S	S	.	.	H	α-helix	trans	-63	-39.6	175.8	-78	176.5	-179.3	173.9	0	112.4	I114 R115 E121 R122	I114-K118 HydrophobicContact CG2-CD 4.1Å; I114-K118 WeakPolarHBondContact O-CB 3.5Å; I114-K118 VanDerWaalsContact O-CG 3.3Å; I114-K118 WeakPolarHBondContact O-CG 3.42Å; I114-K118 PolarHBondContact O-N 3.43Å; R115-K118 PolarHBondContact O-N 3.31Å; K118-E121 PolarHBondContact O-N 2.89Å; K118-R122 WeakPolarHBondContact O-CG 3.41Å; K118-R122 PolarHBondContact O-N 2.92Å
119	E	89.9	Confident	89.2	Confident	85 Å²	85	116 Å²	116	40%	0.397	54%	0.54	S	S	.	.	H	α-helix	trans	-68.3	-44.6	176.8	-173.1	51.4	-141.3	0	0	110.9	R115 A116 E117 E121 R122 Q123	R115-E119 PolarHBondContact O-N 3.46Å; A116-E119 PolarHBondContact O-N 3.47Å; E117-E119 VanDerWaalsContact C-N 3.35Å; E117-E119 PolarHBondContact O-N 2.92Å; E119-E121 VanDerWaalsContact C-N 3.28Å; E119-E121 PolarHBondContact O-N 2.89Å; E119-R122 WeakPolarHBondContact O-CB 3.29Å; E119-R122 PolarHBondContact O-N 2.97Å; E119-R122 VanDerWaalsContact O-N 3.12Å; E119-Q123 WeakPolarHBondContact O-CG 3.45Å; E119-Q123 PolarHBondContact O-N 3.35Å; E119-Q123 PolarHBondContact OE1-NE2 3.43Å
120	R	89.9	Confident	88.7	Confident	179 Å²	179	120 Å²	120	68%	0.675	55%	0.548	S	S	*	.	H	α-helix	trans	-58.5	-39.5	173.2	-173.7	179.1	174.1	-166.3	-3.1	112.3	A116 E117 Q123 N124	A116-R120 VanDerWaalsContact O-CB 3.29Å; A116-R120 WeakPolarHBondContact O-CB 3.33Å; A116-R120 PolarHBondContact O-N 2.88Å; E117-R120 PolarHBondContact O-N 3.46Å; R120-Q123 PolarHBondContact O-N 3.06Å; R120-N124 WeakPolarHBondContact O-CB 3.44Å; R120-N124 PolarHBondContact O-N 2.98Å; R120-N124 PolarHBondContact O-ND2 2.99Å
121	E	90.4	Very high	88	Confident	102 Å²	102	116.5 Å²	116.5	48%	0.477	54%	0.541	S	S	.	.	H	α-helix	trans	-66	-39.7	176.4	-161.4	-152.4	132.3	0	0	111.9	E117 K118 E119 N124 R125	E117-E121 WeakPolarHBondContact O-CB 3.37Å; E117-E121 PolarHBondContact O-N 3.12Å; K118-E121 PolarHBondContact O-N 2.89Å; E119-E121 VanDerWaalsContact C-N 3.28Å; E119-E121 PolarHBondContact O-N 2.89Å; E121-N124 PolarHBondContact O-N 2.73Å; E121-R125 WeakPolarHBondContact O-CB 3.3Å; E121-R125 PolarHBondContact O-N 3.42Å; E121-R125 IonicContact OE1-CZ 3.56Å; E121-R125 IonicContact OE1-NH2 3.49Å; E121-R125 PolarHBondContact OE1-NH2 3.4Å
122	R	90.1	Very high	87.2	Confident	154 Å²	154	118.7 Å²	118.7	58%	0.581	55%	0.545	S	S	*	.	H	α-helix	trans	-62.9	-47.5	174	-75.1	175.5	175.9	-166.1	-0.7	111.6	K118 E119 N124 R125 L126	K118-R122 WeakPolarHBondContact O-CG 3.41Å; K118-R122 PolarHBondContact O-N 2.92Å; E119-R122 WeakPolarHBondContact O-CB 3.29Å; E119-R122 PolarHBondContact O-N 2.97Å; E119-R122 VanDerWaalsContact O-N 3.12Å; R122-N124 VanDerWaalsContact C-N 3.33Å; R122-N124 PolarHBondContact O-N 2.87Å; R122-R125 PolarHBondContact O-N 3.23Å; R122-L126 WeakPolarHBondContact O-CG 3.37Å; R122-L126 PolarHBondContact O-N 3.02Å
123	Q	85.4	Confident	86.6	Confident	104 Å²	104	121.2 Å²	121.2	49%	0.486	55%	0.549	S	S	.	.	H	α-helix	trans	-60.2	-43.9	176.5	-66.9	-60.4	-25.6	0	0	111.4	E119 R120 R125 L126 A127	E119-Q123 WeakPolarHBondContact O-CG 3.45Å; E119-Q123 PolarHBondContact O-N 3.35Å; E119-Q123 PolarHBondContact OE1-NE2 3.43Å; R120-Q123 PolarHBondContact O-N 3.06Å; Q123-R125 PolarHBondContact O-N 3.3Å; Q123-L126 PolarHBondContact O-N 2.86Å; Q123-A127 WeakPolarHBondContact O-CB 3.31Å; Q123-A127 PolarHBondContact O-N 3.34Å
124	N	84.5	Confident	85.9	Confident	87 Å²	87	117.4 Å²	117.4	47%	0.465	54%	0.539	S	S	.	.	H	α-helix	trans	-62.9	-40.2	176.1	-73.3	-18	0	0	0	112.3	R120 E121 R122 A127 E128	R120-N124 WeakPolarHBondContact O-CB 3.44Å; R120-N124 PolarHBondContact O-N 2.98Å; R120-N124 PolarHBondContact O-ND2 2.99Å; E121-N124 PolarHBondContact O-N 2.73Å; R122-N124 VanDerWaalsContact C-N 3.33Å; R122-N124 PolarHBondContact O-N 2.87Å; N124-A127 PolarHBondContact O-N 3.41Å; N124-E128 VanDerWaalsContact O-CB 3.29Å; N124-E128 WeakPolarHBondContact O-CB 3.39Å; N124-E128 PolarHBondContact O-N 2.79Å
125	R	86.8	Confident	84.9	Confident	140 Å²	140	120.8 Å²	120.8	53%	0.528	55%	0.554	S	S	.	*	H	α-helix	trans	-65.9	-40.9	178	-168.6	-171.7	-45.4	-176.8	2.8	112.2	E121 R122 Q123 E128 E129	E121-R125 WeakPolarHBondContact O-CB 3.3Å; E121-R125 PolarHBondContact O-N 3.42Å; E121-R125 IonicContact OE1-CZ 3.56Å; E121-R125 IonicContact OE1-NH2 3.49Å; E121-R125 PolarHBondContact OE1-NH2 3.4Å; R122-R125 PolarHBondContact O-N 3.23Å; Q123-R125 PolarHBondContact O-N 3.3Å; R125-E128 PolarHBondContact O-N 3.42Å; R125-E129 WeakPolarHBondContact O-CB 3.29Å; R125-E129 PolarHBondContact O-N 3.17Å
126	L	84.4	Confident	84.1	Confident	104 Å²	104	117.5 Å²	117.5	55%	0.545	55%	0.546	S	S	.	.	H	α-helix	trans	-66.1	-41	174.2	-70	172.6	0	0	0	111.3	R122 Q123 K130	R122-L126 WeakPolarHBondContact O-CG 3.37Å; R122-L126 PolarHBondContact O-N 3.02Å; Q123-L126 PolarHBondContact O-N 2.86Å; L126-K130 WeakPolarHBondContact O-CB 3.32Å; L126-K130 PolarHBondContact O-N 3.31Å
127	A	83.3	Confident	83.3	Confident	58 Å²	58	116.4 Å²	116.4	48%	0.479	53%	0.531	S	S	.	.	H	α-helix	trans	-64.8	-40.3	175.1	0	0	0	0	0	111.9	Q123 N124 A131	Q123-A127 WeakPolarHBondContact O-CB 3.31Å; Q123-A127 PolarHBondContact O-N 3.34Å; N124-A127 PolarHBondContact O-N 3.41Å; A127-A131 WeakPolarHBondContact O-CB 3.41Å; A127-A131 PolarHBondContact O-N 2.68Å
128	E	81.3	Confident	82.6	Confident	143 Å²	143	112.4 Å²	112.4	67%	0.668	52%	0.521	S	S	*	.	H	α-helix	trans	-70.2	-41.3	177.5	-171.5	177.9	-177.5	0	0	111.9	N124 R125 K130 A131 R132	N124-E128 VanDerWaalsContact O-CB 3.29Å; N124-E128 WeakPolarHBondContact O-CB 3.39Å; N124-E128 PolarHBondContact O-N 2.79Å; R125-E128 PolarHBondContact O-N 3.42Å; E128-K130 VanDerWaalsContact C-N 3.34Å; E128-A131 PolarHBondContact O-N 3.29Å; E128-R132 WeakPolarHBondContact O-CB 3.31Å; E128-R132 PolarHBondContact O-N 2.92Å
129	E	80.3	Confident	81.8	Confident	118 Å²	118	112.7 Å²	112.7	55%	0.551	52%	0.523	S	S	*	.	H	α-helix	trans	-64	-41.7	174.2	-171.7	-177.4	169.3	0	0	111.3	R125 R132 R133	R125-E129 WeakPolarHBondContact O-CB 3.29Å; R125-E129 PolarHBondContact O-N 3.17Å; E129-R132 PolarHBondContact O-N 2.86Å; E129-R133 WeakPolarHBondContact O-CB 3.21Å; E129-R133 PolarHBondContact O-N 2.93Å
130	K	82.6	Confident	81.3	Confident	131 Å²	131	115.6 Å²	115.6	57%	0.57	53%	0.53	S	S	*	.	H	α-helix	trans	-63.8	-43.2	173.6	-173.5	177.6	178.7	-177.2	0	111.3	L126 E128 R133 E134	L126-K130 WeakPolarHBondContact O-CB 3.32Å; L126-K130 PolarHBondContact O-N 3.31Å; E128-K130 VanDerWaalsContact C-N 3.34Å; K130-R133 PolarHBondContact O-N 2.8Å; K130-E134 WeakPolarHBondContact CE-OE1 3.4Å; K130-E134 WeakPolarHBondContact O-CB 3.33Å; K130-E134 VanDerWaalsContact O-CG 3.31Å; K130-E134 WeakPolarHBondContact O-CG 3.38Å; K130-E134 PolarHBondContact O-N 2.79Å
131	A	80.1	Confident	80.8	Confident	50 Å²	50	114.5 Å²	114.5	41%	0.413	53%	0.526	S	S	.	.	H	α-helix	trans	-64.3	-40.8	176.5	0	0	0	0	0	111.9	A127 E128 E134 E135	A127-A131 WeakPolarHBondContact O-CB 3.41Å; A127-A131 PolarHBondContact O-N 2.68Å; E128-A131 PolarHBondContact O-N 3.29Å; A131-E134 PolarHBondContact O-N 3.33Å; A131-E135 WeakPolarHBondContact O-CB 3.33Å; A131-E135 PolarHBondContact O-N 2.9Å
132	R	76.8	Confident	80.3	Confident	146 Å²	146	112 Å²	112	55%	0.551	52%	0.523	S	S	*	.	H	α-helix	trans	-65.4	-40.5	175.8	-160.2	-171.9	85.2	-144.6	-3.7	111.4	E128 E129 E135 E136	E128-R132 WeakPolarHBondContact O-CB 3.31Å; E128-R132 PolarHBondContact O-N 2.92Å; E129-R132 PolarHBondContact O-N 2.86Å; R132-E135 PolarHBondContact O-N 3.31Å; R132-E136 IonicContact CZ-OE1 3.8Å; R132-E136 IonicContact NE-OE1 3.39Å; R132-E136 PolarHBondContact NE-OE1 2.84Å; R132-E136 IonicContact NH2-OE1 2.78Å; R132-E136 WeakPolarHBondContact O-CB 3.26Å; R132-E136 VanDerWaalsContact O-CG 3.31Å; R132-E136 WeakPolarHBondContact O-CG 3.34Å; R132-E136 PolarHBondContact O-N 3.34Å
133	R	79.3	Confident	79.7	Confident	179 Å²	179	110 Å²	110	68%	0.675	52%	0.52	S	S	*	.	H	α-helix	trans	-65.2	-40.7	174.4	-171.3	174.3	-176.7	171.7	1.8	111.8	E129 K130 D137	E129-R133 WeakPolarHBondContact O-CB 3.21Å; E129-R133 PolarHBondContact O-N 2.93Å; K130-R133 PolarHBondContact O-N 2.8Å; R133-D137 WeakPolarHBondContact O-CB 3.2Å; R133-D137 PolarHBondContact O-N 2.94Å
134	E	76.5	Confident	79.3	Confident	115 Å²	115	109.4 Å²	109.4	54%	0.537	52%	0.521	S	S	.	.	H	α-helix	trans	-67	-36.2	174.6	-75	178.4	-167.2	0	0	112	K130 A131 A138	K130-E134 WeakPolarHBondContact CE-OE1 3.4Å; K130-E134 WeakPolarHBondContact O-CB 3.33Å; K130-E134 VanDerWaalsContact O-CG 3.31Å; K130-E134 WeakPolarHBondContact O-CG 3.38Å; K130-E134 PolarHBondContact O-N 2.79Å; A131-E134 PolarHBondContact O-N 3.33Å; E134-A138 WeakPolarHBondContact O-CB 3.34Å; E134-A138 PolarHBondContact O-N 3.22Å
135	E	70.6	Confident	78.8	Confident	140 Å²	140	109.5 Å²	109.5	65%	0.654	52%	0.521	S	S	*	.	H	α-helix	trans	-69.5	-43.2	175.2	-170.4	179.6	-175.3	0	0	111.8	A131 R132 A138 K139	A131-E135 WeakPolarHBondContact O-CB 3.33Å; A131-E135 PolarHBondContact O-N 2.9Å; R132-E135 PolarHBondContact O-N 3.31Å; E135-A138 PolarHBondContact O-N 3.5Å; E135-K139 VanDerWaalsContact O-CB 3.26Å; E135-K139 WeakPolarHBondContact O-CB 3.38Å; E135-K139 PolarHBondContact O-N 2.81Å
136	E	76.4	Confident	78.1	Confident	105 Å²	105	109.2 Å²	109.2	49%	0.491	53%	0.527	S	S	.	.	H	α-helix	trans	-64.2	-42.3	174.2	-74.1	173.8	-154.8	0	0	111.5	R132 K139 R140	R132-E136 IonicContact CZ-OE1 3.8Å; R132-E136 IonicContact NE-OE1 3.39Å; R132-E136 PolarHBondContact NE-OE1 2.84Å; R132-E136 IonicContact NH2-OE1 2.78Å; R132-E136 WeakPolarHBondContact O-CB 3.26Å; R132-E136 VanDerWaalsContact O-CG 3.31Å; R132-E136 WeakPolarHBondContact O-CG 3.34Å; R132-E136 PolarHBondContact O-N 3.34Å; E136-K139 PolarHBondContact O-N 3.4Å; E136-R140 WeakPolarHBondContact O-CB 3.41Å; E136-R140 PolarHBondContact O-N 2.84Å
137	D	75.4	Confident	77.7	Confident	41 Å²	41	111.7 Å²	111.7	22%	0.219	53%	0.534	C	S	.	.	H	α-helix	trans	-68.8	-35.6	174.7	-88.6	-29.3	0	0	0	112.4	R133 R140 R141	R133-D137 WeakPolarHBondContact O-CB 3.2Å; R133-D137 PolarHBondContact O-N 2.94Å; D137-R140 IonicContact OD1-CZ 3.78Å; D137-R140 VanDerWaalsContact OD1-CZ 3.31Å; D137-R140 IonicContact OD1-NE 2.96Å; D137-R140 IonicContact OD1-NH2 3.75Å; D137-R140 PolarHBondContact OD1-NH2 3.44Å; D137-R141 WeakPolarHBondContact O-CB 3.26Å; D137-R141 VanDerWaalsContact O-CG 3.24Å; D137-R141 WeakPolarHBondContact O-CG 3.24Å; D137-R141 PolarHBondContact O-N 2.81Å
138	A	77.1	Confident	77.1	Confident	53 Å²	53	115 Å²	115	44%	0.438	54%	0.537	S	S	.	.	H	α-helix	trans	-67.5	-40.6	173.7	0	0	0	0	0	111.3	E134 E135 R141 A142	E134-A138 WeakPolarHBondContact O-CB 3.34Å; E134-A138 PolarHBondContact O-N 3.22Å; E135-A138 PolarHBondContact O-N 3.5Å; A138-R141 PolarHBondContact O-N 2.8Å; A138-A142 VanDerWaalsContact O-CB 3.26Å; A138-A142 WeakPolarHBondContact O-CB 3.33Å; A138-A142 PolarHBondContact O-N 3.38Å
139	K	77.6	Confident	76.5	Confident	132 Å²	132	112 Å²	112	57%	0.574	52%	0.522	S	S	*	.	H	α-helix	trans	-66	-44.3	175.3	-171	179	178	-175.6	0	111.2	E135 E136 A142 E143	E135-K139 VanDerWaalsContact O-CB 3.26Å; E135-K139 WeakPolarHBondContact O-CB 3.38Å; E135-K139 PolarHBondContact O-N 2.81Å; E136-K139 PolarHBondContact O-N 3.4Å; K139-A142 PolarHBondContact O-N 2.8Å; K139-E143 VanDerWaalsContact CE-OE1 3.26Å; K139-E143 WeakPolarHBondContact CE-OE1 3.12Å; K139-E143 WeakPolarHBondContact O-CB 3.24Å; K139-E143 WeakPolarHBondContact O-CG 3.34Å; K139-E143 PolarHBondContact O-N 3.35Å
140	R	78.8	Confident	76	Confident	146 Å²	146	114.4 Å²	114.4	55%	0.551	53%	0.531	S	S	*	.	H	α-helix	trans	-61.8	-44.4	174.1	-173.3	177.9	65.4	-173.3	-3	111.7	E136 D137 A142 E143 D144	E136-R140 WeakPolarHBondContact O-CB 3.41Å; E136-R140 PolarHBondContact O-N 2.84Å; D137-R140 IonicContact OD1-CZ 3.78Å; D137-R140 VanDerWaalsContact OD1-CZ 3.31Å; D137-R140 IonicContact OD1-NE 2.96Å; D137-R140 IonicContact OD1-NH2 3.75Å; D137-R140 PolarHBondContact OD1-NH2 3.44Å; R140-A142 VanDerWaalsContact C-N 3.33Å; R140-A142 PolarHBondContact O-N 3.46Å; R140-E143 PolarHBondContact O-N 2.89Å; R140-D144 WeakPolarHBondContact O-CB 3.2Å; R140-D144 PolarHBondContact O-N 2.89Å
141	R	79.8	Confident	75.2	Confident	156 Å²	156	111.3 Å²	111.3	59%	0.589	53%	0.529	S	S	*	.	H	α-helix	trans	-62.3	-39.5	174.2	-75.7	-176.8	-169.4	114.8	0.7	112.1	D137 A138 D145	D137-R141 WeakPolarHBondContact O-CB 3.26Å; D137-R141 VanDerWaalsContact O-CG 3.24Å; D137-R141 WeakPolarHBondContact O-CG 3.24Å; D137-R141 PolarHBondContact O-N 2.81Å; A138-R141 PolarHBondContact O-N 2.8Å; R141-D145 VanDerWaalsContact O-CB 3.24Å; R141-D145 WeakPolarHBondContact O-CB 3.36Å; R141-D145 PolarHBondContact O-N 3.39Å
142	A	78.8	Confident	74.3	Confident	51 Å²	51	110.9 Å²	110.9	42%	0.421	52%	0.52	S	S	.	.	H	α-helix	trans	-68.3	-38.5	176.7	0	0	0	0	0	112.3	A138 K139 R140 M146	A138-A142 VanDerWaalsContact O-CB 3.26Å; A138-A142 WeakPolarHBondContact O-CB 3.33Å; A138-A142 PolarHBondContact O-N 3.38Å; K139-A142 PolarHBondContact O-N 2.8Å; R140-A142 VanDerWaalsContact C-N 3.33Å; R140-A142 PolarHBondContact O-N 3.46Å; A142-M146 WeakPolarHBondContact O-CB 3.13Å; A142-M146 WeakPolarHBondContact O-CG 3.39Å; A142-M146 PolarHBondContact O-N 2.78Å
143	E	77.6	Confident	73.5	Confident	111 Å²	111	107.2 Å²	107.2	52%	0.519	52%	0.516	S	S	.	.	H	α-helix	trans	-68.7	-42.2	175.1	-75.4	177.4	-167.2	0	0	111.7	K139 R140 M146 K147	K139-E143 VanDerWaalsContact CE-OE1 3.26Å; K139-E143 WeakPolarHBondContact CE-OE1 3.12Å; K139-E143 WeakPolarHBondContact O-CB 3.24Å; K139-E143 WeakPolarHBondContact O-CG 3.34Å; K139-E143 PolarHBondContact O-N 3.35Å; R140-E143 PolarHBondContact O-N 2.89Å; E143-M146 PolarHBondContact O-N 3.33Å; E143-K147 VanDerWaalsContact O-CB 3.24Å; E143-K147 WeakPolarHBondContact O-CB 3.26Å; E143-K147 PolarHBondContact O-N 3.32Å
144	D	77.9	Confident	72.5	Confident	92 Å²	92	103.9 Å²	103.9	49%	0.492	52%	0.521	S	S	.	.	H	α-helix	trans	-65.5	-41.2	173.9	-76.8	-25.7	0	0	0	111.4	R140 K147 K148	R140-D144 WeakPolarHBondContact O-CB 3.2Å; R140-D144 PolarHBondContact O-N 2.89Å; D144-K147 PolarHBondContact O-N 2.78Å; D144-K148 WeakPolarHBondContact O-CB 3.24Å; D144-K148 PolarHBondContact O-N 3.4Å
145	D	72.8	Confident	71.7	Confident	88 Å²	88	106.3 Å²	106.3	47%	0.471	53%	0.534	S	S	.	.	H	α-helix	trans	-67.7	-35.8	174	-87.5	-14.6	0	0	0	112.1	R141 K149	R141-D145 VanDerWaalsContact O-CB 3.24Å; R141-D145 WeakPolarHBondContact O-CB 3.36Å; R141-D145 PolarHBondContact O-N 3.39Å; D145-K149 WeakPolarHBondContact O-CB 3.24Å; D145-K149 WeakPolarHBondContact O-CG 3.18Å; D145-K149 PolarHBondContact O-N 3.37Å
146	M	72.9	Confident	71	Confident	135 Å²	135	101.3 Å²	101.3	67%	0.665	52%	0.52	S	S	*	.	H	α-helix	trans	-67.8	-42.3	173.3	-81.1	-93.9	-85	0	0	111.3	A142 E143 K149 K150	A142-M146 WeakPolarHBondContact O-CB 3.13Å; A142-M146 WeakPolarHBondContact O-CG 3.39Å; A142-M146 PolarHBondContact O-N 2.78Å; E143-M146 PolarHBondContact O-N 3.33Å; M146-K149 PolarHBondContact O-N 2.81Å; M146-K150 VanDerWaalsContact O-CB 3.24Å; M146-K150 WeakPolarHBondContact O-CB 3.25Å; M146-K150 PolarHBondContact O-N 3.44Å
147	K	75.7	Confident	70.2	Confident	156 Å²	156	100.6 Å²	100.6	68%	0.678	53%	0.532	S	S	*	.	H	α-helix	trans	-67	-39.6	176.5	-167.2	174	-177.3	179.3	0	111	E143 D144 K150 A151	E143-K147 VanDerWaalsContact O-CB 3.24Å; E143-K147 WeakPolarHBondContact O-CB 3.26Å; E143-K147 PolarHBondContact O-N 3.32Å; D144-K147 PolarHBondContact O-N 2.78Å; K147-K150 PolarHBondContact O-N 2.85Å; K147-A151 WeakPolarHBondContact O-CB 3.09Å; K147-A151 PolarHBondContact O-N 2.83Å
148	K	71.8	Confident	69.5	Low	126 Å²	126	105.6 Å²	105.6	55%	0.548	56%	0.559	S	S	.	*	H	α-helix	trans	-67.2	-42.5	172.8	-173.8	172.7	-177.7	178.5	0	111.9	D144 K150 A151 L152	D144-K148 WeakPolarHBondContact O-CB 3.24Å; D144-K148 PolarHBondContact O-N 3.4Å; K148-K150 VanDerWaalsContact C-N 3.35Å; K148-A151 PolarHBondContact O-N 2.84Å; K148-L152 HydrophobicContact CD-CD1 4.5Å; K148-L152 HydrophobicContact CG-CD1 3.61Å; K148-L152 VanDerWaalsContact O-CB 3.25Å; K148-L152 WeakPolarHBondContact O-CB 3.18Å; K148-L152 WeakPolarHBondContact O-CD1 3.34Å; K148-L152 WeakPolarHBondContact O-CG 3.17Å; K148-L152 PolarHBondContact O-N 2.75Å
149	K	68.3	Low	68.6	Low	81 Å²	81	108.5 Å²	108.5	35%	0.352	56%	0.56	S	S	.	*	H	α-helix	trans	-63.4	-37.9	172	-80.2	172.5	-178.6	173.3	0	111.8	D145 M146 L152 S153 L163 D167	D145-K149 WeakPolarHBondContact O-CB 3.24Å; D145-K149 WeakPolarHBondContact O-CG 3.18Å; D145-K149 PolarHBondContact O-N 3.37Å; M146-K149 PolarHBondContact O-N 2.81Å; K149-L152 PolarHBondContact O-N 2.79Å; K149-S153 VanDerWaalsContact O-CB 3.27Å; K149-S153 WeakPolarHBondContact O-CB 3.27Å; K149-S153 PolarHBondContact O-N 3.45Å; K149-S153 PolarHBondContact O-OG 2.75Å; K149-L163 HydrophobicContact CG-CD1 4.18Å; K149-D167 IonicContact NZ-OD2 3.75Å
150	K	69.4	Low	67.7	Low	169 Å²	169	104.6 Å²	104.6	74%	0.735	55%	0.549	S	S	*	.	H	α-helix	trans	-68.3	-42.1	176.3	-167.8	173.2	-176.3	178.2	0	111.5	M146 K147 K148 S154	M146-K150 VanDerWaalsContact O-CB 3.24Å; M146-K150 WeakPolarHBondContact O-CB 3.25Å; M146-K150 PolarHBondContact O-N 3.44Å; K147-K150 PolarHBondContact O-N 2.85Å; K148-K150 VanDerWaalsContact C-N 3.35Å; K150-S154 PolarHBondContact O-N 3.39Å
151	A	66.4	Low	66.9	Low	66 Å²	66	100.1 Å²	100.1	55%	0.545	54%	0.54	S	S	.	.	H	α-helix	trans	-65.2	-39.3	172.9	0	0	0	0	0	112.2	K147 K148 S154	K147-A151 WeakPolarHBondContact O-CB 3.09Å; K147-A151 PolarHBondContact O-N 2.83Å; K148-A151 PolarHBondContact O-N 2.84Å; A151-S154 WeakPolarHBondContact O-CB 3.4Å; A151-S154 PolarHBondContact O-N 3.33Å
152	L	60.1	Low	66.3	Low	41 Å²	41	100.6 Å²	100.6	22%	0.215	54%	0.543	C	S	.	.	H	α-helix	trans	-81.3	-24	-179.7	-68	164.2	0	0	0	113.4	K148 K149 S154 M155 Y159	K148-L152 HydrophobicContact CD-CD1 4.5Å; K148-L152 HydrophobicContact CG-CD1 3.61Å; K148-L152 VanDerWaalsContact O-CB 3.25Å; K148-L152 WeakPolarHBondContact O-CB 3.18Å; K148-L152 WeakPolarHBondContact O-CD1 3.34Å; K148-L152 WeakPolarHBondContact O-CG 3.17Å; K148-L152 PolarHBondContact O-N 2.75Å; K149-L152 PolarHBondContact O-N 2.79Å; L152-S154 PolarHBondContact O-N 3.44Å; L152-M155 PolarHBondContact O-N 3.12Å; L152-M155 VanDerWaalsContact O-N 3.12Å; L152-Y159 HydrophobicContact CB-CD1 3.82Å; L152-Y159 HydrophobicContact CB-CE1 4.01Å; L152-Y159 HydrophobicContact CD1-CD1 4.2Å; L152-Y159 HydrophobicContact CD1-CE1 3.48Å; L152-Y159 VanDerWaalsContact CD1-CE1 3.48Å; L152-Y159 HydrophobicContact CD2-CD1 4.32Å; L152-Y159 HydrophobicContact CD2-CE1 4.14Å; L152-Y159 HydrophobicContact CG-CD1 4.32Å; L152-Y159 HydrophobicContact CG-CE1 4.07Å
153	S	61	Low	65.6	Low	68 Å²	68	100.8 Å²	100.8	48%	0.476	54%	0.536	S	S	.	.	H	α-helix	trans	-64.2	-29	166.1	-96.2	0	0	0	0	111.9	K149 M155	K149-S153 VanDerWaalsContact O-CB 3.27Å; K149-S153 WeakPolarHBondContact O-CB 3.27Å; K149-S153 PolarHBondContact O-N 3.45Å; K149-S153 PolarHBondContact O-OG 2.75Å; S153-M155 VanDerWaalsContact C-N 3.25Å; S153-M155 PolarHBondContact O-N 3.45Å
154	S	58.3	Low	65.1	Low	110 Å²	110	98 Å²	98	77%	0.769	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-15.5	172.8	-167.9	0	0	0	0	113.3	K150 A151 L152	K150-S154 PolarHBondContact O-N 3.39Å; A151-S154 WeakPolarHBondContact O-CB 3.4Å; A151-S154 PolarHBondContact O-N 3.33Å; L152-S154 PolarHBondContact O-N 3.44Å
155	M	58.2	Low	64.6	Low	165 Å²	165	100.3 Å²	100.3	81%	0.813	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	10	-173.8	-157.6	160.8	164.2	0	0	114.1	L152 S153	L152-M155 PolarHBondContact O-N 3.12Å; L152-M155 VanDerWaalsContact O-N 3.12Å; S153-M155 VanDerWaalsContact C-N 3.25Å; S153-M155 PolarHBondContact O-N 3.45Å
156	G	56.7	Low	64.2	Low	35 Å²	35	98.2 Å²	98.2	36%	0.361	53%	0.533	S	S	.	.			trans	131.3	137	165.5	0	0	0	0	0	114.3	N158 Y159	G156-N158 PolarHBondContact O-N 3.44Å; G156-Y159 PolarHBondContact O-N 3.29Å
157	A	59.7	Low	63.6	Low	90 Å²	90	96.6 Å²	96.6	74%	0.744	53%	0.527	S	S	*	.	H	α-helix	trans	-56.6	-12.9	-173.8	0	0	0	0	0	115.8
158	N	60.8	Low	63.1	Low	147 Å²	147	95 Å²	95	79%	0.786	52%	0.522	S	S	*	.	H	α-helix	trans	-86.6	-28.9	-177.6	-68.1	-30.6	0	0	0	113.5	G156	G156-N158 PolarHBondContact O-N 3.44Å
159	Y	57.8	Low	62.6	Low	114 Å²	114	95.4 Å²	95.4	45%	0.447	52%	0.524	S	S	.	.	H	α-helix	trans	-79.2	-35.7	-177.8	-170	-94.1	0	0	0	112.1	L152 G156 S161 Y162 L163	L152-Y159 HydrophobicContact CB-CD1 3.82Å; L152-Y159 HydrophobicContact CB-CE1 4.01Å; L152-Y159 HydrophobicContact CD1-CD1 4.2Å; L152-Y159 HydrophobicContact CD1-CE1 3.48Å; L152-Y159 VanDerWaalsContact CD1-CE1 3.48Å; L152-Y159 HydrophobicContact CD2-CD1 4.32Å; L152-Y159 HydrophobicContact CD2-CE1 4.14Å; L152-Y159 HydrophobicContact CG-CD1 4.32Å; L152-Y159 HydrophobicContact CG-CE1 4.07Å; G156-Y159 PolarHBondContact O-N 3.29Å; Y159-S161 VanDerWaalsContact C-N 3.28Å; Y159-S161 PolarHBondContact O-N 3.22Å; Y159-Y162 PolarHBondContact O-N 2.89Å; Y159-Y162 VanDerWaalsContact O-N 3.15Å; Y159-L163 HydrophobicContact CD1-CD1 4.22Å; Y159-L163 HydrophobicContact CE1-CD1 3.64Å; Y159-L163 HydrophobicContact CE1-CG 4.25Å; Y159-L163 PolarHBondContact O-N 3.11Å
160	S	59.3	Low	62.2	Low	50 Å²	50	100.9 Å²	100.9	35%	0.35	54%	0.543	S	S	.	.	H	α-helix	trans	-61.9	-32.2	177.6	-167.1	0	0	0	0	113	A164	S160-A164 PolarHBondContact O-N 3.23Å
161	S	62.6	Low	61.7	Low	51 Å²	51	94.8 Å²	94.8	36%	0.357	53%	0.528	S	S	.	.	H	α-helix	trans	-73.2	-27.8	177.6	101.8	0	0	0	0	113	Y159 K165	Y159-S161 VanDerWaalsContact C-N 3.28Å; Y159-S161 PolarHBondContact O-N 3.22Å; S161-K165 WeakPolarHBondContact O-CB 3.13Å; S161-K165 WeakPolarHBondContact O-CG 3.48Å; S161-K165 PolarHBondContact O-N 3.1Å
162	Y	66.6	Low	61.4	Low	166 Å²	166	98.5 Å²	98.5	65%	0.651	53%	0.531	S	S	*	.	H	α-helix	trans	-71.1	-44	-179.2	-174.1	-98	0	0	0	111.4	Y159 K165 A166	Y159-Y162 PolarHBondContact O-N 2.89Å; Y159-Y162 VanDerWaalsContact O-N 3.15Å; Y162-K165 PolarHBondContact O-N 3.31Å; Y162-A166 WeakPolarHBondContact O-CB 3.34Å; Y162-A166 PolarHBondContact O-N 3.17Å
163	L	63.9	Low	61.4	Low	55 Å²	55	102.7 Å²	102.7	29%	0.288	55%	0.548	S	S	.	.	H	α-helix	trans	-64.5	-42.8	175.5	-77.3	171.3	0	0	0	112	K149 Y159 K165 A166 D167	K149-L163 HydrophobicContact CG-CD1 4.18Å; Y159-L163 HydrophobicContact CD1-CD1 4.22Å; Y159-L163 HydrophobicContact CE1-CD1 3.64Å; Y159-L163 HydrophobicContact CE1-CG 4.25Å; Y159-L163 PolarHBondContact O-N 3.11Å; L163-K165 VanDerWaalsContact C-N 3.35Å; L163-K165 PolarHBondContact O-N 3.3Å; L163-A166 PolarHBondContact O-N 3.36Å; L163-D167 PolarHBondContact O-N 3.02Å; L163-D167 VanDerWaalsContact O-N 3.11Å
164	A	67.6	Low	61.4	Low	54 Å²	54	105 Å²	105	45%	0.446	55%	0.551	S	S	.	*	H	α-helix	trans	-63.9	-37.7	176.4	0	0	0	0	0	112.8	S160 Q168	S160-A164 PolarHBondContact O-N 3.23Å; A164-Q168 WeakPolarHBondContact O-CB 3.47Å; A164-Q168 WeakPolarHBondContact O-CG 3.22Å; A164-Q168 PolarHBondContact O-N 3.36Å; A164-Q168 VanDerWaalsContact O-N 3.1Å
165	K	67.8	Low	62.2	Low	139 Å²	139	103.9 Å²	103.9	60%	0.604	54%	0.54	S	S	*	.	H	α-helix	trans	-70.1	-35.3	175.6	-76.5	173	-179.1	171.3	0	112.6	S161 Y162 L163 K169	S161-K165 WeakPolarHBondContact O-CB 3.13Å; S161-K165 WeakPolarHBondContact O-CG 3.48Å; S161-K165 PolarHBondContact O-N 3.1Å; Y162-K165 PolarHBondContact O-N 3.31Å; L163-K165 VanDerWaalsContact C-N 3.35Å; L163-K165 PolarHBondContact O-N 3.3Å; K165-K169 WeakPolarHBondContact O-CB 3.46Å; K165-K169 PolarHBondContact O-N 3.27Å; K165-K169 VanDerWaalsContact O-N 3.13Å
166	A	63.2	Low	63.5	Low	45 Å²	45	98.8 Å²	98.8	37%	0.372	52%	0.524	S	S	.	.	H	α-helix	trans	-65.9	-43.6	176.9	0	0	0	0	0	111.5	Y162 L163 K169 R170	Y162-A166 WeakPolarHBondContact O-CB 3.34Å; Y162-A166 PolarHBondContact O-N 3.17Å; L163-A166 PolarHBondContact O-N 3.36Å; A166-K169 PolarHBondContact O-N 3.5Å; A166-R170 PolarHBondContact O-N 3.2Å; A166-R170 VanDerWaalsContact O-N 3.12Å
167	D	61.2	Low	64.9	Low	100 Å²	100	106.9 Å²	106.9	54%	0.535	54%	0.543	S	S	.	.	H	α-helix	trans	-67.7	-49	179.8	-126.2	-9	0	0	0	112	K149 L163 K169 R170 G171	K149-D167 IonicContact NZ-OD2 3.75Å; L163-D167 PolarHBondContact O-N 3.02Å; L163-D167 VanDerWaalsContact O-N 3.11Å; D167-K169 VanDerWaalsContact C-N 3.27Å; D167-K169 PolarHBondContact O-N 3.13Å; D167-R170 PolarHBondContact O-N 3.15Å; D167-G171 PolarHBondContact O-N 3.49Å
168	Q	64.6	Low	66.2	Low	124 Å²	124	107.6 Å²	107.6	58%	0.579	53%	0.531	S	S	*	.	H	α-helix	trans	-62.6	-32.6	177.9	-77.9	-168.8	-25.6	0	0	113.2	A164 K172	A164-Q168 WeakPolarHBondContact O-CB 3.47Å; A164-Q168 WeakPolarHBondContact O-CG 3.22Å; A164-Q168 PolarHBondContact O-N 3.36Å; A164-Q168 VanDerWaalsContact O-N 3.1Å; Q168-K172 WeakPolarHBondContact O-CB 3.47Å; Q168-K172 WeakPolarHBondContact O-CG 3.47Å; Q168-K172 PolarHBondContact O-N 2.96Å
169	K	61	Low	67.6	Low	134 Å²	134	106.7 Å²	106.7	58%	0.583	52%	0.524	S	S	*	.	H	α-helix	trans	-76.9	-30.1	179	-166.7	-178.4	-177	-172.9	0	112.3	K165 A166 D167 K173	K165-K169 WeakPolarHBondContact O-CB 3.46Å; K165-K169 PolarHBondContact O-N 3.27Å; K165-K169 VanDerWaalsContact O-N 3.13Å; A166-K169 PolarHBondContact O-N 3.5Å; D167-K169 VanDerWaalsContact C-N 3.27Å; D167-K169 PolarHBondContact O-N 3.13Å; K169-K173 HydrophobicContact CG-CD 4.22Å; K169-K173 WeakPolarHBondContact O-CB 3.22Å; K169-K173 WeakPolarHBondContact O-CD 3.35Å; K169-K173 WeakPolarHBondContact O-CG 3.16Å
170	R	59.7	Low	69.3	Low	196 Å²	196	107.9 Å²	107.9	74%	0.74	53%	0.532	S	S	*	.	H	α-helix	trans	-73.4	-50.5	173.3	-81.4	177.4	78.2	141.7	-2.8	111.2	A166 D167 K173 Q174	A166-R170 PolarHBondContact O-N 3.2Å; A166-R170 VanDerWaalsContact O-N 3.12Å; D167-R170 PolarHBondContact O-N 3.15Å; R170-K173 PolarHBondContact O-N 3.21Å; R170-Q174 WeakPolarHBondContact O-CB 3.42Å; R170-Q174 PolarHBondContact O-N 3.03Å; R170-Q174 VanDerWaalsContact O-N 3.07Å
171	G	58.4	Low	70.9	Confident	41 Å²	41	113.2 Å²	113.2	42%	0.423	55%	0.548	S	S	.	.	H	α-helix	trans	-63	-45.7	-176.6	0	0	0	0	0	114.5	D167 K173 T175	D167-G171 PolarHBondContact O-N 3.49Å; G171-K173 PolarHBondContact O-N 3.12Å; G171-T175 PolarHBondContact O-N 3.24Å; G171-T175 PolarHBondContact O-OG1 2.92Å
172	K	60.9	Low	72.3	Confident	143 Å²	143	118.1 Å²	118.1	62%	0.622	56%	0.564	S	S	*	*	H	α-helix	trans	-70.8	-29.2	-179.6	-69.4	179.8	179	179.2	0	113.9	Q168 T175 A176	Q168-K172 WeakPolarHBondContact O-CB 3.47Å; Q168-K172 WeakPolarHBondContact O-CG 3.47Å; Q168-K172 PolarHBondContact O-N 2.96Å; K172-T175 PolarHBondContact O-OG1 2.99Å; K172-A176 WeakPolarHBondContact O-CB 3.41Å; K172-A176 PolarHBondContact O-N 2.86Å
173	K	60.2	Low	73.6	Confident	130 Å²	130	113.4 Å²	113.4	57%	0.565	55%	0.549	S	S	*	.	H	α-helix	trans	-80.1	-33.3	178.8	-74.8	-173.5	175.7	-160.2	0	112.1	K169 R170 G171 R177	K169-K173 HydrophobicContact CG-CD 4.22Å; K169-K173 WeakPolarHBondContact O-CB 3.22Å; K169-K173 WeakPolarHBondContact O-CD 3.35Å; K169-K173 WeakPolarHBondContact O-CG 3.16Å; R170-K173 PolarHBondContact O-N 3.21Å; G171-K173 PolarHBondContact O-N 3.12Å; K173-R177 VanDerWaalsContact O-CB 3.26Å; K173-R177 WeakPolarHBondContact O-CB 3.45Å; K173-R177 PolarHBondContact O-N 3.41Å
174	Q	60.5	Low	75.1	Confident	116 Å²	116	115.3 Å²	115.3	54%	0.542	56%	0.559	S	S	.	*	H	α-helix	trans	-64.5	-48.9	176	-174.9	163.4	-0.2	0	0	110.5	R170 A176 R177 E178	R170-Q174 WeakPolarHBondContact O-CB 3.42Å; R170-Q174 PolarHBondContact O-N 3.03Å; R170-Q174 VanDerWaalsContact O-N 3.07Å; Q174-A176 PolarHBondContact O-N 3.46Å; Q174-R177 PolarHBondContact O-N 3.07Å; Q174-E178 WeakPolarHBondContact CG-OE1 3.26Å; Q174-E178 PolarHBondContact NE2-OE1 3.45Å; Q174-E178 WeakPolarHBondContact O-CB 3.31Å; Q174-E178 VanDerWaalsContact O-CG 3.31Å; Q174-E178 WeakPolarHBondContact O-CG 3.43Å; Q174-E178 PolarHBondContact O-N 3.3Å
175	T	75.5	Confident	76.3	Confident	86 Å²	86	115.8 Å²	115.8	53%	0.528	56%	0.563	S	S	.	*	H	α-helix	trans	-63.8	-40.5	176.9	51.7	0	0	0	0	113.4	G171 K172 M179	G171-T175 PolarHBondContact O-N 3.24Å; G171-T175 PolarHBondContact O-OG1 2.92Å; K172-T175 PolarHBondContact O-OG1 2.99Å; T175-M179 WeakPolarHBondContact O-CB 3.21Å; T175-M179 PolarHBondContact O-N 3.46Å
176	A	86.5	Confident	77.5	Confident	58 Å²	58	116.6 Å²	116.6	48%	0.479	57%	0.569	S	S	.	*	H	α-helix	trans	-66.9	-36.8	176.1	0	0	0	0	0	112.8	K172 Q174 K180	K172-A176 WeakPolarHBondContact O-CB 3.41Å; K172-A176 PolarHBondContact O-N 2.86Å; Q174-A176 PolarHBondContact O-N 3.46Å; A176-K180 WeakPolarHBondContact O-CB 3.42Å; A176-K180 PolarHBondContact O-N 3.2Å
177	R	84.6	Confident	79	Confident	205 Å²	205	123.3 Å²	123.3	77%	0.774	58%	0.584	S	S	*	*	H	α-helix	trans	-68.9	-44.1	176.9	-174	-178.9	-175	-161.9	1.4	111.1	K173 Q174 K180 K181	K173-R177 VanDerWaalsContact O-CB 3.26Å; K173-R177 WeakPolarHBondContact O-CB 3.45Å; K173-R177 PolarHBondContact O-N 3.41Å; Q174-R177 PolarHBondContact O-N 3.07Å; R177-K180 PolarHBondContact O-N 3.38Å; R177-K181 WeakPolarHBondContact O-CB 3.36Å; R177-K181 PolarHBondContact O-N 2.81Å
178	E	87.3	Confident	80.5	Confident	105 Å²	105	128.2 Å²	128.2	49%	0.491	60%	0.595	S	S	.	*	H	α-helix	trans	-64.5	-44.9	176.8	-73.1	166.7	-172.6	0	0	111.1	Q174 K180 K181 K182	Q174-E178 WeakPolarHBondContact CG-OE1 3.26Å; Q174-E178 PolarHBondContact NE2-OE1 3.45Å; Q174-E178 WeakPolarHBondContact O-CB 3.31Å; Q174-E178 VanDerWaalsContact O-CG 3.31Å; Q174-E178 WeakPolarHBondContact O-CG 3.43Å; Q174-E178 PolarHBondContact O-N 3.3Å; E178-K180 PolarHBondContact O-N 3.36Å; E178-K181 PolarHBondContact O-N 3.16Å; E178-K181 VanDerWaalsContact O-N 3.16Å; E178-K182 WeakPolarHBondContact O-CB 3.35Å; E178-K182 PolarHBondContact O-N 3.15Å
179	M	90	Very high	81.7	Confident	128 Å²	128	131.2 Å²	131.2	63%	0.631	61%	0.607	S	S	*	*	H	α-helix	trans	-61.6	-43.3	175.2	-176	176.2	-96.2	0	0	111.7	T175 K181 K182 I183	T175-M179 WeakPolarHBondContact O-CB 3.21Å; T175-M179 PolarHBondContact O-N 3.46Å; M179-K181 PolarHBondContact O-N 2.94Å; M179-K182 PolarHBondContact O-N 3.43Å; M179-I183 HydrophobicContact CG-CD1 3.91Å; M179-I183 VanDerWaalsContact O-CG1 3.29Å; M179-I183 WeakPolarHBondContact O-CG1 3.28Å; M179-I183 PolarHBondContact O-N 3.18Å
180	K	93.5	Very high	83.1	Confident	139 Å²	139	130.5 Å²	130.5	60%	0.604	62%	0.616	S	S	*	*	H	α-helix	trans	-60.4	-44.7	173.2	-178.6	-179.9	177	-178.7	0	111.4	A176 R177 E178 K182 I183 L184	A176-K180 WeakPolarHBondContact O-CB 3.42Å; A176-K180 PolarHBondContact O-N 3.2Å; R177-K180 PolarHBondContact O-N 3.38Å; E178-K180 PolarHBondContact O-N 3.36Å; K180-K182 VanDerWaalsContact C-N 3.35Å; K180-I183 PolarHBondContact O-N 3.16Å; K180-L184 HydrophobicContact CG-CD1 3.97Å; K180-L184 HydrophobicContact CG-CG 4.4Å; K180-L184 WeakPolarHBondContact O-CB 3.41Å; K180-L184 VanDerWaalsContact O-CG 3.28Å; K180-L184 WeakPolarHBondContact O-CG 3.31Å; K180-L184 PolarHBondContact O-N 2.89Å
181	K	93.4	Very high	84.6	Confident	162 Å²	162	125.7 Å²	125.7	70%	0.704	60%	0.604	S	S	*	*	H	α-helix	trans	-63.1	-42.4	179	-168.3	179.6	179.7	-172.4	0	111	R177 E178 M179 L184 A185	R177-K181 WeakPolarHBondContact O-CB 3.36Å; R177-K181 PolarHBondContact O-N 2.81Å; E178-K181 PolarHBondContact O-N 3.16Å; E178-K181 VanDerWaalsContact O-N 3.16Å; M179-K181 PolarHBondContact O-N 2.94Å; K181-L184 PolarHBondContact O-N 2.9Å; K181-A185 WeakPolarHBondContact O-CB 3.39Å; K181-A185 PolarHBondContact O-N 3.41Å
182	K	92.6	Very high	86.1	Confident	155 Å²	155	128.8 Å²	128.8	67%	0.674	61%	0.611	S	S	*	*	H	α-helix	trans	-60.2	-51.7	176.1	-174.6	179.9	179.2	179.9	0	111.6	E178 M179 K180 L184 A185 E186	E178-K182 WeakPolarHBondContact O-CB 3.35Å; E178-K182 PolarHBondContact O-N 3.15Å; M179-K182 PolarHBondContact O-N 3.43Å; K180-K182 VanDerWaalsContact C-N 3.35Å; K182-L184 VanDerWaalsContact C-N 3.31Å; K182-L184 PolarHBondContact O-N 3.5Å; K182-A185 PolarHBondContact O-N 3.16Å; K182-E186 PolarHBondContact O-N 3.06Å
183	I	93.3	Very high	87.7	Confident	66 Å²	66	124.8 Å²	124.8	34%	0.338	60%	0.596	S	S	.	*	H	α-helix	trans	-62	-39.9	179.5	-66.5	166.5	0	0	0	111.2	M179 K180 E186 R187	M179-I183 HydrophobicContact CG-CD1 3.91Å; M179-I183 VanDerWaalsContact O-CG1 3.29Å; M179-I183 WeakPolarHBondContact O-CG1 3.28Å; M179-I183 PolarHBondContact O-N 3.18Å; K180-I183 PolarHBondContact O-N 3.16Å; I183-E186 PolarHBondContact O-N 3.42Å; I183-R187 VanDerWaalsContact O-CG 3.31Å; I183-R187 WeakPolarHBondContact O-CG 3.29Å; I183-R187 PolarHBondContact O-N 2.95Å; I183-R187 VanDerWaalsContact O-N 3.08Å
184	L	94.9	Very high	89.2	Confident	95 Å²	95	125.9 Å²	125.9	50%	0.497	61%	0.608	S	S	.	*	H	α-helix	trans	-68.4	-37.5	177.2	-72.4	175.6	0	0	0	112.5	K180 K181 K182 R187 R188	K180-L184 HydrophobicContact CG-CD1 3.97Å; K180-L184 HydrophobicContact CG-CG 4.4Å; K180-L184 WeakPolarHBondContact O-CB 3.41Å; K180-L184 VanDerWaalsContact O-CG 3.28Å; K180-L184 WeakPolarHBondContact O-CG 3.31Å; K180-L184 PolarHBondContact O-N 2.89Å; K181-L184 PolarHBondContact O-N 2.9Å; K182-L184 VanDerWaalsContact C-N 3.31Å; K182-L184 PolarHBondContact O-N 3.5Å; L184-R187 PolarHBondContact O-N 3.47Å; L184-R188 WeakPolarHBondContact O-CB 3.43Å; L184-R188 PolarHBondContact O-N 3.07Å; L184-R188 VanDerWaalsContact O-N 3.1Å
185	A	93.4	Very high	90.8	Very high	65 Å²	65	126.6 Å²	126.6	54%	0.537	61%	0.611	S	S	.	*	H	α-helix	trans	-64.9	-42.8	174.8	0	0	0	0	0	111.4	K181 K182 R187 R188	K181-A185 WeakPolarHBondContact O-CB 3.39Å; K181-A185 PolarHBondContact O-N 3.41Å; K182-A185 PolarHBondContact O-N 3.16Å; A185-R187 VanDerWaalsContact C-N 3.33Å; A185-R187 PolarHBondContact O-N 3.27Å; A185-R188 PolarHBondContact O-N 2.96Å; A185-R188 VanDerWaalsContact O-N 3.15Å
186	E	93.4	Very high	91.7	Very high	156 Å²	156	124.8 Å²	124.8	73%	0.729	60%	0.598	S	S	*	*	H	α-helix	trans	-62.1	-38.2	176.5	-175.1	-179.9	176.9	0	0	112.6	K182 I183 R188	K182-E186 PolarHBondContact O-N 3.06Å; I183-E186 PolarHBondContact O-N 3.42Å; E186-R188 VanDerWaalsContact C-N 3.32Å
187	R	93.5	Very high	92.1	Very high	185 Å²	185	125.1 Å²	125.1	70%	0.698	60%	0.596	S	S	*	*	H	α-helix	trans	-73.7	-22.9	175.9	-69.5	175.5	-172.6	-164.4	0.4	113.3	I183 L184 A185 K189	I183-R187 VanDerWaalsContact O-CG 3.31Å; I183-R187 WeakPolarHBondContact O-CG 3.29Å; I183-R187 PolarHBondContact O-N 2.95Å; I183-R187 VanDerWaalsContact O-N 3.08Å; L184-R187 PolarHBondContact O-N 3.47Å; A185-R187 VanDerWaalsContact C-N 3.33Å; A185-R187 PolarHBondContact O-N 3.27Å; R187-K189 PolarHBondContact O-N 3.48Å
188	R	92.9	Very high	92.6	Very high	203 Å²	203	120.2 Å²	120.2	77%	0.766	59%	0.586	S	S	*	*			trans	-81.4	100.6	-178.2	-176.6	177.2	177.6	-113.6	1.7	109.3	L184 A185 E186	L184-R188 WeakPolarHBondContact O-CB 3.43Å; L184-R188 PolarHBondContact O-N 3.07Å; L184-R188 VanDerWaalsContact O-N 3.1Å; A185-R188 PolarHBondContact O-N 2.96Å; A185-R188 VanDerWaalsContact O-N 3.15Å; E186-R188 VanDerWaalsContact C-N 3.32Å
189	K	89.6	Confident	93	Very high	187 Å²	187	120.8 Å²	120.8	81%	0.813	59%	0.592	S	S	*	*			trans	-72.5	128.1	170.2	-62.5	-179.4	-176.5	177.8	0	109.2	R187 L191	R187-K189 PolarHBondContact O-N 3.48Å; K189-L191 PolarHBondContact O-N 2.97Å
190	P	90.8	Very high	93.2	Very high	119 Å²	119	120.9 Å²	120.9	77%	0.773	59%	0.589	S	S	*	*			trans	-61.6	138.2	172.9	26.3	-32.3	0	0	0	109.2
191	L	91.6	Very high	93.3	Very high	96 Å²	96	117.1 Å²	117.1	50%	0.503	58%	0.575	S	S	.	*			trans	-94.9	114.7	-179.6	-172.1	65.4	0	0	0	107.9	K189 I193 K204 L208	K189-L191 PolarHBondContact O-N 2.97Å; L191-I193 HydrophobicContact CD1-CG2 3.65Å; L191-I193 HydrophobicContact CD2-CD1 4.07Å; L191-I193 HydrophobicContact CD2-CG1 4.46Å; L191-I193 HydrophobicContact CD2-CG2 4.25Å; L191-I193 HydrophobicContact CG-CD1 4.44Å; L191-I193 HydrophobicContact CG-CG1 4.31Å; L191-I193 HydrophobicContact CG-CG2 3.67Å; L191-K204 HydrophobicContact CD1-CG 4.37Å; L191-L208 HydrophobicContact CD1-CD1 4.06Å; L191-L208 HydrophobicContact CD2-CD1 4.28Å
192	N	90.4	Very high	93.5	Very high	106 Å²	106	116.7 Å²	116.7	57%	0.567	57%	0.569	S	S	*	*			trans	-114.7	104.1	174.8	-173.4	7.6	0	0	0	108.3	H195	N192-H195 PolarHBondContact ND2-CE1 3.46Å; N192-H195 PolarHBondContact OD1-CE1 3.1Å; N192-H195 PolarHBondContact OD1-ND1 3.08Å
193	I	93.6	Very high	93.7	Very high	58 Å²	58	113.6 Å²	113.6	30%	0.297	56%	0.56	S	S	.	*			trans	-128.6	-8.6	-170.3	54.6	166.1	0	0	0	113.6	L191 H195 L196 L201 K204	L191-I193 HydrophobicContact CD1-CG2 3.65Å; L191-I193 HydrophobicContact CD2-CD1 4.07Å; L191-I193 HydrophobicContact CD2-CG1 4.46Å; L191-I193 HydrophobicContact CD2-CG2 4.25Å; L191-I193 HydrophobicContact CG-CD1 4.44Å; L191-I193 HydrophobicContact CG-CG1 4.31Å; L191-I193 HydrophobicContact CG-CG2 3.67Å; I193-H195 PolarHBondContact O-N 3.48Å; I193-H195 VanDerWaalsContact O-N 3.07Å; I193-L196 PolarHBondContact O-N 3.22Å; I193-L196 VanDerWaalsContact O-N 3.16Å; I193-L201 HydrophobicContact CB-CD2 3.94Å; I193-L201 HydrophobicContact CG2-CD2 4.33Å; I193-K204 HydrophobicContact CG2-CG 4.32Å
194	D	93.1	Very high	93.8	Very high	153 Å²	153	113.8 Å²	113.8	82%	0.818	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	-16.2	-168.3	-58	-25.9	0	0	0	114.1
195	H	92.4	Very high	93.9	Very high	132 Å²	132	112 Å²	112	61%	0.611	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.3	14.4	-176.4	59.9	-65.4	0	0	0	112.1	N192 I193	N192-H195 PolarHBondContact ND2-CE1 3.46Å; N192-H195 PolarHBondContact OD1-CE1 3.1Å; N192-H195 PolarHBondContact OD1-ND1 3.08Å; I193-H195 PolarHBondContact O-N 3.48Å; I193-H195 VanDerWaalsContact O-N 3.07Å
196	L	94.3	Very high	94	Very high	47 Å²	47	115.2 Å²	115.2	25%	0.246	56%	0.559	C	S	.	*			trans	-91.9	146.1	178.1	-91.3	63.1	0	0	0	111.9	I193 K200 L201	I193-L196 PolarHBondContact O-N 3.22Å; I193-L196 VanDerWaalsContact O-N 3.16Å; L196-K200 HydrophobicContact CB-CB 4.25Å; L196-K200 HydrophobicContact CD2-CB 4.05Å; L196-K200 HydrophobicContact CG-CB 4.08Å; L196-L201 HydrophobicContact CB-CD2 3.76Å; L196-L201 HydrophobicContact CB-CG 3.95Å; L196-L201 HydrophobicContact CD2-CD2 4.34Å
197	S	95.6	Very high	94.1	Very high	65 Å²	65	112.6 Å²	112.6	46%	0.455	55%	0.547	S	S	.	.			trans	-77	161.1	171.8	60.9	0	0	0	0	112.2	D199 K200 L201	S197-D199 VanDerWaalsContact C-N 3.31Å; S197-D199 PolarHBondContact O-N 2.91Å; S197-K200 PolarHBondContact O-N 2.71Å; S197-L201 WeakPolarHBondContact O-CG 3.46Å; S197-L201 PolarHBondContact O-N 3.23Å
198	D	94.9	Very high	94.3	Very high	103 Å²	103	107.7 Å²	107.7	55%	0.551	53%	0.534	S	S	*	.	H	α-helix	trans	-53.2	-43.6	-175.6	-134.6	67.5	0	0	0	113.3	L201 R202	D198-L201 PolarHBondContact O-N 3.33Å; D198-R202 WeakPolarHBondContact O-CG 3.4Å; D198-R202 PolarHBondContact O-N 3.05Å; D198-R202 VanDerWaalsContact O-N 3.08Å; D198-R202 IonicContact OD2-CZ 3.93Å; D198-R202 IonicContact OD2-NE 3.02Å; D198-R202 IonicContact OD2-NH2 3.97Å; D198-R202 PolarHBondContact OD2-NH2 3.42Å
199	D	95.6	Very high	94.5	Very high	117 Å²	117	105.6 Å²	105.6	63%	0.626	53%	0.526	S	S	*	.	H	α-helix	trans	-64.4	-42.4	177.4	-66.7	-31.5	0	0	0	112.1	S197 L201 R202 D203	S197-D199 VanDerWaalsContact C-N 3.31Å; S197-D199 PolarHBondContact O-N 2.91Å; D199-L201 VanDerWaalsContact C-N 3.32Å; D199-L201 PolarHBondContact O-N 3.44Å; D199-R202 WeakPolarHBondContact O-CB 3.32Å; D199-R202 PolarHBondContact O-N 3.36Å; D199-D203 PolarHBondContact O-N 2.87Å
200	K	95.3	Very high	94.9	Very high	130 Å²	130	101 Å²	101	57%	0.565	51%	0.511	S	S	*	.	H	α-helix	trans	-68.1	-33	177.2	-69.6	-177.5	179.9	179	0	112	L196 S197 R202 D203 K204	L196-K200 HydrophobicContact CB-CB 4.25Å; L196-K200 HydrophobicContact CD2-CB 4.05Å; L196-K200 HydrophobicContact CG-CB 4.08Å; S197-K200 PolarHBondContact O-N 2.71Å; K200-R202 VanDerWaalsContact C-N 3.35Å; K200-D203 PolarHBondContact O-N 3.43Å; K200-K204 WeakPolarHBondContact O-CB 3.35Å; K200-K204 PolarHBondContact O-N 3.01Å
201	L	95.8	Very high	95.1	Very high	60 Å²	60	99.2 Å²	99.2	31%	0.314	50%	0.498	S	S	.	.	H	α-helix	trans	-65.8	-38.1	174	-70.3	173.7	0	0	0	111.5	I193 L196 S197 D198 D199 K204 A205	I193-L201 HydrophobicContact CB-CD2 3.94Å; I193-L201 HydrophobicContact CG2-CD2 4.33Å; L196-L201 HydrophobicContact CB-CD2 3.76Å; L196-L201 HydrophobicContact CB-CG 3.95Å; L196-L201 HydrophobicContact CD2-CD2 4.34Å; S197-L201 WeakPolarHBondContact O-CG 3.46Å; S197-L201 PolarHBondContact O-N 3.23Å; D198-L201 PolarHBondContact O-N 3.33Å; D199-L201 VanDerWaalsContact C-N 3.32Å; D199-L201 PolarHBondContact O-N 3.44Å; L201-K204 PolarHBondContact O-N 3.17Å; L201-A205 WeakPolarHBondContact O-CB 3.39Å; L201-A205 PolarHBondContact O-N 3.17Å
202	R	96.7	Very high	95.4	Very high	152 Å²	152	99.1 Å²	99.1	57%	0.574	50%	0.497	S	S	*	.	H	α-helix	trans	-63.4	-42.8	175.1	-69.6	168.2	-173.1	-86.3	-6.7	112	D198 D199 K200 A205 K206	D198-R202 WeakPolarHBondContact O-CG 3.4Å; D198-R202 PolarHBondContact O-N 3.05Å; D198-R202 VanDerWaalsContact O-N 3.08Å; D198-R202 IonicContact OD2-CZ 3.93Å; D198-R202 IonicContact OD2-NE 3.02Å; D198-R202 IonicContact OD2-NH2 3.97Å; D198-R202 PolarHBondContact OD2-NH2 3.42Å; D199-R202 WeakPolarHBondContact O-CB 3.32Å; D199-R202 PolarHBondContact O-N 3.36Å; K200-R202 VanDerWaalsContact C-N 3.35Å; R202-A205 PolarHBondContact O-N 3Å; R202-K206 WeakPolarHBondContact O-CG 3.45Å; R202-K206 PolarHBondContact O-N 3.08Å; R202-K206 VanDerWaalsContact O-N 3.13Å
203	D	96.3	Very high	95.7	Very high	90 Å²	90	100.3 Å²	100.3	48%	0.481	50%	0.495	S	S	.	.	H	α-helix	trans	-66.8	-42.9	176.3	-69.2	-22.4	0	0	0	111.2	D199 K200 A205 K206 E207	D199-D203 PolarHBondContact O-N 2.87Å; K200-D203 PolarHBondContact O-N 3.43Å; D203-A205 VanDerWaalsContact C-N 3.31Å; D203-A205 PolarHBondContact O-N 3.23Å; D203-K206 WeakPolarHBondContact O-CB 3.49Å; D203-K206 PolarHBondContact O-N 3.38Å; D203-E207 PolarHBondContact O-N 2.93Å
204	K	95.5	Very high	95.9	Very high	71 Å²	71	102.5 Å²	102.5	31%	0.309	50%	0.504	S	S	.	.	H	α-helix	trans	-61.2	-38.8	175.3	-163.4	73.1	-155	158.9	0	112.6	L191 I193 K200 L201 E207 L208	L191-K204 HydrophobicContact CD1-CG 4.37Å; I193-K204 HydrophobicContact CG2-CG 4.32Å; K200-K204 WeakPolarHBondContact O-CB 3.35Å; K200-K204 PolarHBondContact O-N 3.01Å; L201-K204 PolarHBondContact O-N 3.17Å; K204-E207 IonicContact NZ-OE2 3.66Å; K204-E207 PolarHBondContact NZ-OE2 3.45Å; K204-E207 PolarHBondContact O-N 3.45Å; K204-L208 VanDerWaalsContact O-CG 3.32Å; K204-L208 WeakPolarHBondContact O-CG 3.33Å; K204-L208 PolarHBondContact O-N 3.31Å
205	A	96.5	Very high	96.1	Very high	58 Å²	58	100 Å²	100	48%	0.479	49%	0.49	S	S	.	.	H	α-helix	trans	-63.8	-41.3	176.1	0	0	0	0	0	111.9	L201 R202 D203 L208 W209	L201-A205 WeakPolarHBondContact O-CB 3.39Å; L201-A205 PolarHBondContact O-N 3.17Å; R202-A205 PolarHBondContact O-N 3Å; D203-A205 VanDerWaalsContact C-N 3.31Å; D203-A205 PolarHBondContact O-N 3.23Å; A205-L208 PolarHBondContact O-N 3.39Å; A205-W209 WeakPolarHBondContact O-CB 3.32Å; A205-W209 PolarHBondContact O-N 3.36Å
206	K	97.2	Very high	96.3	Very high	131 Å²	131	99.1 Å²	99.1	57%	0.57	49%	0.486	S	S	*	.	H	α-helix	trans	-62.2	-47.6	174.3	-71.3	173.3	-175.7	165.8	0	111.7	R202 D203 L208 W209 D210	R202-K206 WeakPolarHBondContact O-CG 3.45Å; R202-K206 PolarHBondContact O-N 3.08Å; R202-K206 VanDerWaalsContact O-N 3.13Å; D203-K206 WeakPolarHBondContact O-CB 3.49Å; D203-K206 PolarHBondContact O-N 3.38Å; K206-L208 VanDerWaalsContact C-N 3.31Å; K206-L208 PolarHBondContact O-N 3.41Å; K206-W209 WeakPolarHBondContact O-CB 3.44Å; K206-W209 PolarHBondContact O-N 2.94Å; K206-W209 VanDerWaalsContact O-N 3.11Å; K206-D210 PolarHBondContact O-N 3.05Å
207	E	95.5	Very high	96.5	Very high	101 Å²	101	98.8 Å²	98.8	47%	0.472	49%	0.486	S	S	.	.	H	α-helix	trans	-57.8	-42.6	177.5	-70.4	179.1	178.5	0	0	112.8	D203 K204 W209 T211	D203-E207 PolarHBondContact O-N 2.93Å; K204-E207 IonicContact NZ-OE2 3.66Å; K204-E207 PolarHBondContact NZ-OE2 3.45Å; K204-E207 PolarHBondContact O-N 3.45Å; E207-W209 VanDerWaalsContact C-N 3.35Å; E207-T211 WeakPolarHBondContact O-CB 3.47Å; E207-T211 PolarHBondContact O-N 2.95Å; E207-T211 PolarHBondContact O-OG1 3.01Å
208	L	95.9	Very high	96.6	Very high	82 Å²	82	98.1 Å²	98.1	43%	0.429	48%	0.477	S	S	.	.	H	α-helix	trans	-66.8	-38.7	177.4	-71	174.6	0	0	0	111.5	L191 K204 A205 K206 T211 L212	L191-L208 HydrophobicContact CD1-CD1 4.06Å; L191-L208 HydrophobicContact CD2-CD1 4.28Å; K204-L208 VanDerWaalsContact O-CG 3.32Å; K204-L208 WeakPolarHBondContact O-CG 3.33Å; K204-L208 PolarHBondContact O-N 3.31Å; A205-L208 PolarHBondContact O-N 3.39Å; K206-L208 VanDerWaalsContact C-N 3.31Å; K206-L208 PolarHBondContact O-N 3.41Å; L208-T211 PolarHBondContact O-N 3.36Å; L208-L212 WeakPolarHBondContact O-CB 3.44Å; L208-L212 PolarHBondContact O-N 3.45Å
209	W	97.5	Very high	96.7	Very high	159 Å²	159	101 Å²	101	60%	0.602	49%	0.485	S	S	*	.	H	α-helix	trans	-64.7	-46.3	176	-176	88.5	0	0	0	111.8	A205 K206 E207 T211 L212 Y213	A205-W209 WeakPolarHBondContact O-CB 3.32Å; A205-W209 PolarHBondContact O-N 3.36Å; K206-W209 WeakPolarHBondContact O-CB 3.44Å; K206-W209 PolarHBondContact O-N 2.94Å; K206-W209 VanDerWaalsContact O-N 3.11Å; E207-W209 VanDerWaalsContact C-N 3.35Å; W209-T211 VanDerWaalsContact C-N 3.31Å; W209-T211 PolarHBondContact O-N 3.48Å; W209-L212 WeakPolarHBondContact O-CB 3.45Å; W209-L212 PolarHBondContact O-N 3.4Å; W209-Y213 WeakPolarHBondContact O-CB 3.49Å; W209-Y213 PolarHBondContact O-N 2.87Å
210	D	97.6	Very high	96.8	Very high	90 Å²	90	102.1 Å²	102.1	48%	0.481	48%	0.484	S	S	.	.	H	α-helix	trans	-60.4	-42.3	176	-70.3	-32.1	0	0	0	111.2	K206 L212 Y213 Q214	K206-D210 PolarHBondContact O-N 3.05Å; D210-L212 PolarHBondContact O-N 3.1Å; D210-Y213 PolarHBondContact O-N 3.15Å; D210-Q214 PolarHBondContact O-N 3.47Å
211	T	96.3	Very high	97	Very high	82 Å²	82	101.7 Å²	101.7	50%	0.503	48%	0.484	S	S	.	.	H	α-helix	trans	-62.4	-42.9	176.1	-56.2	0	0	0	0	111.5	E207 L208 W209 Q214 L215	E207-T211 WeakPolarHBondContact O-CB 3.47Å; E207-T211 PolarHBondContact O-N 2.95Å; E207-T211 PolarHBondContact O-OG1 3.01Å; L208-T211 PolarHBondContact O-N 3.36Å; W209-T211 VanDerWaalsContact C-N 3.31Å; W209-T211 PolarHBondContact O-N 3.48Å; T211-Q214 PolarHBondContact O-N 2.79Å; T211-L215 HydrophobicContact CG2-CD1 4.41Å; T211-L215 WeakPolarHBondContact O-CG 3.39Å; T211-L215 PolarHBondContact O-N 2.94Å; T211-L215 VanDerWaalsContact O-N 3.1Å
212	L	96.6	Very high	97.1	Very high	94 Å²	94	105.3 Å²	105.3	49%	0.492	50%	0.498	S	S	.	.	H	α-helix	trans	-63.1	-46.7	176.8	179.1	65.3	0	0	0	111	L208 W209 D210 Q214 L215 E216	L208-L212 WeakPolarHBondContact O-CB 3.44Å; L208-L212 PolarHBondContact O-N 3.45Å; W209-L212 WeakPolarHBondContact O-CB 3.45Å; W209-L212 PolarHBondContact O-N 3.4Å; D210-L212 PolarHBondContact O-N 3.1Å; L212-Q214 VanDerWaalsContact C-N 3.31Å; L212-Q214 PolarHBondContact O-N 3.17Å; L212-L215 PolarHBondContact O-N 2.86Å; L212-L215 VanDerWaalsContact O-N 3.15Å; L212-E216 WeakPolarHBondContact O-CG 3.48Å; L212-E216 PolarHBondContact O-N 2.98Å
213	Y	97.8	Very high	97.1	Very high	132 Å²	132	99.4 Å²	99.4	52%	0.518	49%	0.485	S	S	.	.	H	α-helix	trans	-59.6	-41.8	178.8	-177.6	-103.2	0	0	0	112	W209 D210 E216 T217	W209-Y213 WeakPolarHBondContact O-CB 3.49Å; W209-Y213 PolarHBondContact O-N 2.87Å; D210-Y213 PolarHBondContact O-N 3.15Å; Y213-E216 PolarHBondContact O-N 3.13Å; Y213-T217 WeakPolarHBondContact O-CB 3.28Å; Y213-T217 PolarHBondContact O-N 3.41Å; Y213-T217 PolarHBondContact O-OG1 3Å
214	Q	97.3	Very high	97.2	Very high	103 Å²	103	99 Å²	99	48%	0.481	48%	0.48	S	S	.	.	H	α-helix	trans	-61.8	-45.4	174.3	-173.4	61.6	39.5	0	0	111.7	D210 T211 L212 E216 T217 D218	D210-Q214 PolarHBondContact O-N 3.47Å; T211-Q214 PolarHBondContact O-N 2.79Å; L212-Q214 VanDerWaalsContact C-N 3.31Å; L212-Q214 PolarHBondContact O-N 3.17Å; Q214-E216 VanDerWaalsContact C-N 3.32Å; Q214-E216 PolarHBondContact O-N 2.93Å; Q214-T217 WeakPolarHBondContact O-CB 3.03Å; Q214-T217 PolarHBondContact O-N 2.9Å; Q214-D218 PolarHBondContact NE2-OD1 3.04Å; Q214-D218 PolarHBondContact O-N 3.02Å
215	L	96.9	Very high	97.3	Very high	100 Å²	100	101.5 Å²	101.5	52%	0.524	49%	0.491	S	S	.	.	H	α-helix	trans	-63.8	-36	178.5	-70.4	172.7	0	0	0	112.7	T211 L212 K219	T211-L215 HydrophobicContact CG2-CD1 4.41Å; T211-L215 WeakPolarHBondContact O-CG 3.39Å; T211-L215 PolarHBondContact O-N 2.94Å; T211-L215 VanDerWaalsContact O-N 3.1Å; L212-L215 PolarHBondContact O-N 2.86Å; L212-L215 VanDerWaalsContact O-N 3.15Å; L215-K219 WeakPolarHBondContact O-CB 3.45Å; L215-K219 PolarHBondContact O-N 3.11Å
216	E	97.6	Very high	97.4	Very high	114 Å²	114	102.9 Å²	102.9	53%	0.533	49%	0.49	S	S	.	.	H	α-helix	trans	-67.1	-41.6	174.1	-73.1	-172.3	161.5	0	0	112	L212 Y213 Q214 K219 F220	L212-E216 WeakPolarHBondContact O-CG 3.48Å; L212-E216 PolarHBondContact O-N 2.98Å; Y213-E216 PolarHBondContact O-N 3.13Å; Q214-E216 VanDerWaalsContact C-N 3.32Å; Q214-E216 PolarHBondContact O-N 2.93Å; E216-K219 WeakPolarHBondContact O-CB 3.45Å; E216-K219 PolarHBondContact O-N 2.98Å; E216-F220 PolarHBondContact O-N 3.34Å
217	T	97.9	Very high	97.4	Very high	40 Å²	40	102.9 Å²	102.9	25%	0.245	49%	0.49	C	S	.	.	H	α-helix	trans	-60.8	-51.8	175.4	-58.9	0	0	0	0	110.8	Y213 Q214 K219 F220 E221	Y213-T217 WeakPolarHBondContact O-CB 3.28Å; Y213-T217 PolarHBondContact O-N 3.41Å; Y213-T217 PolarHBondContact O-OG1 3Å; Q214-T217 WeakPolarHBondContact O-CB 3.03Å; Q214-T217 PolarHBondContact O-N 2.9Å; T217-K219 VanDerWaalsContact C-N 3.28Å; T217-K219 PolarHBondContact O-N 3.28Å; T217-F220 WeakPolarHBondContact O-CB 3.32Å; T217-F220 PolarHBondContact O-N 3.37Å; T217-E221 PolarHBondContact O-N 2.88Å
218	D	97.7	Very high	97.5	Very high	52 Å²	52	105.4 Å²	105.4	28%	0.278	50%	0.495	S	S	.	.	H	α-helix	trans	-57.1	-42.5	177.2	-69.4	-2.7	0	0	0	111.4	Q214 F220 E221 F222	Q214-D218 PolarHBondContact NE2-OD1 3.04Å; Q214-D218 PolarHBondContact O-N 3.02Å; D218-F220 VanDerWaalsContact C-N 3.32Å; D218-F220 PolarHBondContact O-N 2.9Å; D218-E221 PolarHBondContact O-N 3.44Å; D218-F222 HydrophobicContact CB-CD2 4.42Å; D218-F222 HydrophobicContact CB-CE2 4.11Å; D218-F222 WeakPolarHBondContact O-CB 3.36Å; D218-F222 WeakPolarHBondContact O-CD2 3.4Å; D218-F222 VanDerWaalsContact O-CG 3.32Å; D218-F222 WeakPolarHBondContact O-CG 3.5Å; D218-F222 PolarHBondContact O-N 3.22Å
219	K	97.9	Very high	97.6	Very high	163 Å²	163	106 Å²	106	71%	0.709	50%	0.495	S	S	*	.	H	α-helix	trans	-61.5	-41.1	177.3	177.9	-172.6	170.5	-166.4	0	111.5	L215 E216 T217 G223	L215-K219 WeakPolarHBondContact O-CB 3.45Å; L215-K219 PolarHBondContact O-N 3.11Å; E216-K219 WeakPolarHBondContact O-CB 3.45Å; E216-K219 PolarHBondContact O-N 2.98Å; T217-K219 VanDerWaalsContact C-N 3.28Å; T217-K219 PolarHBondContact O-N 3.28Å; K219-G223 PolarHBondContact O-N 2.94Å
220	F	97.9	Very high	97.6	Very high	140 Å²	140	104.4 Å²	104.4	61%	0.614	49%	0.493	S	S	*	.	H	α-helix	trans	-64.1	-49.7	176.3	178.2	-94.8	0	0	0	111.1	E216 T217 D218 F222 G223 E224	E216-F220 PolarHBondContact O-N 3.34Å; T217-F220 WeakPolarHBondContact O-CB 3.32Å; T217-F220 PolarHBondContact O-N 3.37Å; D218-F220 VanDerWaalsContact C-N 3.32Å; D218-F220 PolarHBondContact O-N 2.9Å; F220-F222 PolarHBondContact O-N 2.95Å; F220-G223 WeakPolarHBondContact O-CA 3.47Å; F220-G223 PolarHBondContact O-N 3.43Å; F220-E224 HydrophobicContact CD1-CG 4.26Å; F220-E224 HydrophobicContact CE1-CG 3.73Å; F220-E224 HydrophobicContact CE2-CG 4.32Å; F220-E224 HydrophobicContact CZ-CG 3.76Å; F220-E224 PolarHBondContact O-N 3.38Å
221	E	98.1	Very high	97.7	Very high	121 Å²	121	106.8 Å²	106.8	57%	0.565	50%	0.496	S	S	*	.	H	α-helix	trans	-59	-44.6	178.2	-69.2	-172.3	170.8	0	0	112.4	T217 D218 G223 E224 K225	T217-E221 PolarHBondContact O-N 2.88Å; D218-E221 PolarHBondContact O-N 3.44Å; E221-G223 VanDerWaalsContact C-N 3.26Å; E221-G223 PolarHBondContact O-N 2.88Å; E221-E224 PolarHBondContact O-N 2.95Å; E221-K225 VanDerWaalsContact O-CB 3.31Å; E221-K225 WeakPolarHBondContact O-CB 3.48Å; E221-K225 PolarHBondContact O-N 3.05Å
222	F	98.2	Very high	97.7	Very high	136 Å²	136	105.6 Å²	105.6	60%	0.596	49%	0.486	S	S	*	.	H	α-helix	trans	-62.6	-34.9	174.2	-69.4	-44	0	0	0	112.2	D218 F220 L226	D218-F222 HydrophobicContact CB-CD2 4.42Å; D218-F222 HydrophobicContact CB-CE2 4.11Å; D218-F222 WeakPolarHBondContact O-CB 3.36Å; D218-F222 WeakPolarHBondContact O-CD2 3.4Å; D218-F222 VanDerWaalsContact O-CG 3.32Å; D218-F222 WeakPolarHBondContact O-CG 3.5Å; D218-F222 PolarHBondContact O-N 3.22Å; F220-F222 PolarHBondContact O-N 2.95Å; F222-L226 VanDerWaalsContact O-CB 3.28Å; F222-L226 WeakPolarHBondContact O-CB 3.48Å; F222-L226 PolarHBondContact O-N 3.4Å
223	G	97.6	Very high	97.8	Very high	29 Å²	29	105 Å²	105	30%	0.299	48%	0.483	S	S	.	.	H	α-helix	trans	-62	-49.6	173.6	0	0	0	0	0	112.5	K219 F220 E221 L226 K227	K219-G223 PolarHBondContact O-N 2.94Å; F220-G223 WeakPolarHBondContact O-CA 3.47Å; F220-G223 PolarHBondContact O-N 3.43Å; E221-G223 VanDerWaalsContact C-N 3.26Å; E221-G223 PolarHBondContact O-N 2.88Å; G223-L226 PolarHBondContact O-N 2.87Å; G223-K227 WeakPolarHBondContact O-CG 3.21Å; G223-K227 PolarHBondContact O-N 3.34Å
224	E	98	Very high	97.8	Very high	80 Å²	80	102.7 Å²	102.7	37%	0.374	48%	0.483	S	S	.	.	H	α-helix	trans	-64.9	-43.2	177.8	-69.2	-55.4	104.6	0	0	111.7	F220 E221 L226 K227 R228	F220-E224 HydrophobicContact CD1-CG 4.26Å; F220-E224 HydrophobicContact CE1-CG 3.73Å; F220-E224 HydrophobicContact CE2-CG 4.32Å; F220-E224 HydrophobicContact CZ-CG 3.76Å; F220-E224 PolarHBondContact O-N 3.38Å; E221-E224 PolarHBondContact O-N 2.95Å; E224-L226 VanDerWaalsContact C-N 3.31Å; E224-L226 PolarHBondContact O-N 3.47Å; E224-K227 WeakPolarHBondContact O-CB 3.47Å; E224-K227 PolarHBondContact O-N 3.48Å; E224-K227 WeakPolarHBondContact OE1-CD 3.41Å; E224-K227 WeakPolarHBondContact OE1-CE 3.28Å; E224-K227 IonicContact OE1-NZ 2.67Å; E224-K227 PolarHBondContact OE1-NZ 3.17Å; E224-R228 PolarHBondContact O-N 2.79Å
225	K	98	Very high	97.8	Very high	125 Å²	125	99.5 Å²	99.5	54%	0.543	47%	0.47	S	S	.	.	H	α-helix	trans	-58.2	-43.6	174.1	-173.4	174.7	-175.9	172.7	0	111.6	E221 R228 Q229	E221-K225 VanDerWaalsContact O-CB 3.31Å; E221-K225 WeakPolarHBondContact O-CB 3.48Å; E221-K225 PolarHBondContact O-N 3.05Å; K225-R228 PolarHBondContact O-N 3.09Å; K225-Q229 WeakPolarHBondContact O-CB 3.3Å; K225-Q229 VanDerWaalsContact O-CG 3.3Å; K225-Q229 WeakPolarHBondContact O-CG 3.46Å; K225-Q229 PolarHBondContact O-N 3.14Å
226	L	97.7	Very high	97.8	Very high	87 Å²	87	99.1 Å²	99.1	46%	0.455	47%	0.468	S	S	.	.	H	α-helix	trans	-64.5	-40.4	177.5	-177.9	66.2	0	0	0	111.8	F222 G223 E224 Q229 K230	F222-L226 VanDerWaalsContact O-CB 3.28Å; F222-L226 WeakPolarHBondContact O-CB 3.48Å; F222-L226 PolarHBondContact O-N 3.4Å; G223-L226 PolarHBondContact O-N 2.87Å; E224-L226 VanDerWaalsContact C-N 3.31Å; E224-L226 PolarHBondContact O-N 3.47Å; L226-Q229 PolarHBondContact O-N 3.31Å; L226-K230 WeakPolarHBondContact O-CG 3.33Å; L226-K230 PolarHBondContact O-N 3.45Å
227	K	97.5	Very high	97.7	Very high	131 Å²	131	101.6 Å²	101.6	57%	0.57	47%	0.473	S	S	*	.	H	α-helix	trans	-60.3	-46	174.3	-70.9	174.7	-170.8	167.9	0	110.8	G223 E224 K230 Y231	G223-K227 WeakPolarHBondContact O-CG 3.21Å; G223-K227 PolarHBondContact O-N 3.34Å; E224-K227 WeakPolarHBondContact O-CB 3.47Å; E224-K227 PolarHBondContact O-N 3.48Å; E224-K227 WeakPolarHBondContact OE1-CD 3.41Å; E224-K227 WeakPolarHBondContact OE1-CE 3.28Å; E224-K227 IonicContact OE1-NZ 2.67Å; E224-K227 PolarHBondContact OE1-NZ 3.17Å; K227-K230 PolarHBondContact O-N 2.89Å; K227-Y231 PolarHBondContact O-N 2.94Å; K227-Y231 VanDerWaalsContact O-N 3.14Å
228	R	97.8	Very high	97.6	Very high	154 Å²	154	102.5 Å²	102.5	58%	0.581	48%	0.481	S	S	*	.	H	α-helix	trans	-61.5	-47.6	177.2	-179.2	58.8	-174.4	-150.4	-2.4	112.1	E224 K225 K230 Y231 D232	E224-R228 PolarHBondContact O-N 2.79Å; K225-R228 PolarHBondContact O-N 3.09Å; R228-K230 VanDerWaalsContact C-N 3.3Å; R228-K230 PolarHBondContact O-N 3.3Å; R228-Y231 WeakPolarHBondContact O-CB 3.31Å; R228-Y231 PolarHBondContact O-N 3.02Å; R228-Y231 VanDerWaalsContact O-N 3.09Å; R228-D232 IonicContact CZ-OD1 3.71Å; R228-D232 IonicContact NE-OD1 3.19Å; R228-D232 PolarHBondContact NE-OD1 3.38Å; R228-D232 IonicContact NE-OD2 3.48Å; R228-D232 PolarHBondContact NE-OD2 3.31Å; R228-D232 IonicContact NH2-OD1 3.72Å; R228-D232 PolarHBondContact O-N 3.18Å
229	Q	98	Very high	97.4	Very high	93 Å²	93	107.5 Å²	107.5	44%	0.435	50%	0.496	S	S	.	.	H	α-helix	trans	-59.6	-39.1	177.3	-74.2	177.1	-26.1	0	0	112.3	K225 L226 Y231 D232 I233	K225-Q229 WeakPolarHBondContact O-CB 3.3Å; K225-Q229 VanDerWaalsContact O-CG 3.3Å; K225-Q229 WeakPolarHBondContact O-CG 3.46Å; K225-Q229 PolarHBondContact O-N 3.14Å; L226-Q229 PolarHBondContact O-N 3.31Å; Q229-Y231 VanDerWaalsContact C-N 3.34Å; Q229-Y231 PolarHBondContact O-N 2.97Å; Q229-D232 PolarHBondContact O-N 3.34Å; Q229-I233 WeakPolarHBondContact O-CB 3.47Å; Q229-I233 WeakPolarHBondContact O-CD1 3.44Å; Q229-I233 WeakPolarHBondContact O-CG1 3.43Å; Q229-I233 PolarHBondContact O-N 2.87Å
230	K	98	Very high	97.3	Very high	126 Å²	126	104.4 Å²	104.4	55%	0.548	49%	0.486	S	S	.	.	H	α-helix	trans	-61.4	-41.9	174.6	-76.5	174.6	177.9	179.8	0	112.1	L226 K227 R228 T234	L226-K230 WeakPolarHBondContact O-CG 3.33Å; L226-K230 PolarHBondContact O-N 3.45Å; K227-K230 PolarHBondContact O-N 2.89Å; R228-K230 VanDerWaalsContact C-N 3.3Å; R228-K230 PolarHBondContact O-N 3.3Å; K230-T234 PolarHBondContact O-N 2.93Å; K230-T234 PolarHBondContact O-OG1 3.09Å
231	Y	98.1	Very high	97.1	Very high	140 Å²	140	102.6 Å²	102.6	55%	0.549	48%	0.482	S	S	.	.	H	α-helix	trans	-63.5	-46.5	175	174.8	-94.6	0	0	0	111.6	K227 R228 Q229 I233 T234 T235	K227-Y231 PolarHBondContact O-N 2.94Å; K227-Y231 VanDerWaalsContact O-N 3.14Å; R228-Y231 WeakPolarHBondContact O-CB 3.31Å; R228-Y231 PolarHBondContact O-N 3.02Å; R228-Y231 VanDerWaalsContact O-N 3.09Å; Q229-Y231 VanDerWaalsContact C-N 3.34Å; Q229-Y231 PolarHBondContact O-N 2.97Å; Y231-I233 PolarHBondContact O-N 3.31Å; Y231-T234 WeakPolarHBondContact O-CB 3.39Å; Y231-T234 PolarHBondContact O-N 3.12Å; Y231-T235 PolarHBondContact O-N 3.2Å; Y231-T235 PolarHBondContact O-OG1 3.49Å; Y231-T235 VanDerWaalsContact O-OG1 3.05Å
232	D	97.6	Very high	96.7	Very high	57 Å²	57	103 Å²	103	31%	0.305	48%	0.484	S	S	.	.	H	α-helix	trans	-62.2	-44.5	179.5	-65.9	-25.6	0	0	0	111	R228 Q229 T234 T235 L236	R228-D232 IonicContact CZ-OD1 3.71Å; R228-D232 IonicContact NE-OD1 3.19Å; R228-D232 PolarHBondContact NE-OD1 3.38Å; R228-D232 IonicContact NE-OD2 3.48Å; R228-D232 PolarHBondContact NE-OD2 3.31Å; R228-D232 IonicContact NH2-OD1 3.72Å; R228-D232 PolarHBondContact O-N 3.18Å; Q229-D232 PolarHBondContact O-N 3.34Å; D232-T234 VanDerWaalsContact C-N 3.31Å; D232-T234 PolarHBondContact O-N 3.07Å; D232-T235 PolarHBondContact O-N 2.74Å; D232-L236 WeakPolarHBondContact O-CB 3.17Å; D232-L236 WeakPolarHBondContact O-CG 3.31Å; D232-L236 PolarHBondContact O-N 2.75Å
233	I	97.9	Very high	96.3	Very high	82 Å²	82	100.5 Å²	100.5	42%	0.421	49%	0.489	S	S	.	.	H	α-helix	trans	-57.7	-44.1	174.3	-71.8	165	0	0	0	111.2	Q229 Y231 L236 R237	Q229-I233 WeakPolarHBondContact O-CB 3.47Å; Q229-I233 WeakPolarHBondContact O-CD1 3.44Å; Q229-I233 WeakPolarHBondContact O-CG1 3.43Å; Q229-I233 PolarHBondContact O-N 2.87Å; Y231-I233 PolarHBondContact O-N 3.31Å; I233-L236 PolarHBondContact O-N 3.38Å; I233-R237 WeakPolarHBondContact O-CB 3.48Å; I233-R237 VanDerWaalsContact O-CG 3.28Å; I233-R237 WeakPolarHBondContact O-CG 3.28Å; I233-R237 PolarHBondContact O-N 2.67Å
234	T	97.5	Very high	95.8	Very high	83 Å²	83	104.7 Å²	104.7	51%	0.509	50%	0.5	S	S	.	.	H	α-helix	trans	-63.7	-45.2	179.7	-56	0	0	0	0	110.8	K230 Y231 D232 R237 S238	K230-T234 PolarHBondContact O-N 2.93Å; K230-T234 PolarHBondContact O-OG1 3.09Å; Y231-T234 WeakPolarHBondContact O-CB 3.39Å; Y231-T234 PolarHBondContact O-N 3.12Å; D232-T234 VanDerWaalsContact C-N 3.31Å; D232-T234 PolarHBondContact O-N 3.07Å; T234-R237 PolarHBondContact O-N 3.24Å; T234-S238 PolarHBondContact O-N 3.35Å; T234-S238 VanDerWaalsContact O-N 3.14Å; T234-S238 PolarHBondContact O-OG 3.45Å
235	T	97.3	Very high	94.7	Very high	36 Å²	36	108.9 Å²	108.9	22%	0.221	52%	0.518	C	S	.	.	H	α-helix	trans	-64.3	-43.4	177.5	-58.1	0	0	0	0	111.8	Y231 D232 S238 R239	Y231-T235 PolarHBondContact O-N 3.2Å; Y231-T235 PolarHBondContact O-OG1 3.49Å; Y231-T235 VanDerWaalsContact O-OG1 3.05Å; D232-T235 PolarHBondContact O-N 2.74Å; T235-S238 PolarHBondContact O-N 3.02Å; T235-R239 WeakPolarHBondContact O-CG 3.33Å; T235-R239 PolarHBondContact O-N 2.91Å
236	L	97.2	Very high	93	Very high	92 Å²	92	109.4 Å²	109.4	48%	0.482	52%	0.522	S	S	.	.	H	α-helix	trans	-64.2	-40.2	178.3	-73.3	170.9	0	0	0	111.7	D232 I233 R239 I240	D232-L236 WeakPolarHBondContact O-CB 3.17Å; D232-L236 WeakPolarHBondContact O-CG 3.31Å; D232-L236 PolarHBondContact O-N 2.75Å; I233-L236 PolarHBondContact O-N 3.38Å; L236-R239 PolarHBondContact O-N 3.21Å; L236-I240 VanDerWaalsContact O-CG1 3.28Å; L236-I240 WeakPolarHBondContact O-CG1 3.49Å; L236-I240 PolarHBondContact O-N 3.13Å
237	R	96	Very high	91.2	Very high	167 Å²	167	109.5 Å²	109.5	63%	0.63	53%	0.53	S	S	*	.	H	α-helix	trans	-58.6	-48.3	173	-75.7	172	177.5	-178.4	-0.8	111.3	I233 T234 R239 I240 D241	I233-R237 WeakPolarHBondContact O-CB 3.48Å; I233-R237 VanDerWaalsContact O-CG 3.28Å; I233-R237 WeakPolarHBondContact O-CG 3.28Å; I233-R237 PolarHBondContact O-N 2.67Å; T234-R237 PolarHBondContact O-N 3.24Å; R237-R239 VanDerWaalsContact C-N 3.3Å; R237-R239 PolarHBondContact O-N 3.34Å; R237-I240 WeakPolarHBondContact O-CB 3.26Å; R237-I240 PolarHBondContact O-N 3.16Å; R237-I240 VanDerWaalsContact O-N 3.16Å; R237-D241 PolarHBondContact O-N 3.23Å
238	S	94.8	Very high	89.1	Confident	59 Å²	59	113.6 Å²	113.6	41%	0.413	55%	0.547	S	S	.	.	H	α-helix	trans	-60	-38.6	175.9	-59.7	0	0	0	0	112.9	T234 T235 D241 Q242	T234-S238 PolarHBondContact O-N 3.35Å; T234-S238 VanDerWaalsContact O-N 3.14Å; T234-S238 PolarHBondContact O-OG 3.45Å; T235-S238 PolarHBondContact O-N 3.02Å; S238-D241 PolarHBondContact O-N 3.25Å; S238-Q242 VanDerWaalsContact O-CG 3.26Å; S238-Q242 WeakPolarHBondContact O-CG 3.2Å; S238-Q242 PolarHBondContact O-N 3.34Å
239	R	95.3	Very high	87	Confident	157 Å²	157	115.7 Å²	115.7	59%	0.592	56%	0.561	S	S	*	*	H	α-helix	trans	-67.5	-40.1	175.5	-72.7	177.5	-177.7	-180	1.6	112.2	T235 L236 R237 Q242 A243	T235-R239 WeakPolarHBondContact O-CG 3.33Å; T235-R239 PolarHBondContact O-N 2.91Å; L236-R239 PolarHBondContact O-N 3.21Å; R237-R239 VanDerWaalsContact C-N 3.3Å; R237-R239 PolarHBondContact O-N 3.34Å; R239-Q242 PolarHBondContact O-N 2.95Å; R239-A243 WeakPolarHBondContact O-CB 3.4Å; R239-A243 PolarHBondContact O-N 3.14Å
240	I	94.9	Very high	84.8	Confident	97 Å²	97	115.6 Å²	115.6	50%	0.497	58%	0.576	S	S	.	*	H	α-helix	trans	-60.5	-48.3	173.9	-71.1	165.5	0	0	0	109.3	L236 R237 Q242 A243 Q244	L236-I240 VanDerWaalsContact O-CG1 3.28Å; L236-I240 WeakPolarHBondContact O-CG1 3.49Å; L236-I240 PolarHBondContact O-N 3.13Å; R237-I240 WeakPolarHBondContact O-CB 3.26Å; R237-I240 PolarHBondContact O-N 3.16Å; R237-I240 VanDerWaalsContact O-N 3.16Å; I240-Q242 VanDerWaalsContact C-N 3.29Å; I240-Q242 PolarHBondContact O-N 3.29Å; I240-A243 CarbonylContact O-C 3.57Å; I240-A243 PolarHBondContact O-N 2.85Å; I240-A243 VanDerWaalsContact O-N 3.13Å; I240-Q244 HydrophobicContact CG2-CG 3.96Å; I240-Q244 VanDerWaalsContact O-CB 3.31Å; I240-Q244 WeakPolarHBondContact O-CB 3.38Å; I240-Q244 WeakPolarHBondContact O-CG 3.4Å; I240-Q244 PolarHBondContact O-N 2.81Å
241	D	92.8	Very high	82.5	Confident	102 Å²	102	113 Å²	113	55%	0.545	58%	0.584	S	S	.	*	H	α-helix	trans	-60.7	-38.6	178.9	-67.4	-19.8	0	0	0	112	R237 S238 Q244 K245	R237-D241 PolarHBondContact O-N 3.23Å; S238-D241 PolarHBondContact O-N 3.25Å; D241-Q244 PolarHBondContact O-N 2.92Å; D241-K245 PolarHBondContact O-N 3.48Å
242	Q	91.4	Very high	80.1	Confident	130 Å²	130	111.1 Å²	111.1	61%	0.607	60%	0.598	S	S	*	*	H	α-helix	trans	-66	-43	174.1	-73	171.6	-1.6	0	0	112.3	S238 R239 I240 Q244 K245	S238-Q242 VanDerWaalsContact O-CG 3.26Å; S238-Q242 WeakPolarHBondContact O-CG 3.2Å; S238-Q242 PolarHBondContact O-N 3.34Å; R239-Q242 PolarHBondContact O-N 2.95Å; I240-Q242 VanDerWaalsContact C-N 3.29Å; I240-Q242 PolarHBondContact O-N 3.29Å; Q242-Q244 VanDerWaalsContact C-N 3.33Å; Q242-K245 WeakPolarHBondContact O-CB 3.41Å; Q242-K245 PolarHBondContact O-N 3.19Å
243	A	89.4	Confident	77.9	Confident	83 Å²	83	114.7 Å²	114.7	69%	0.686	62%	0.622	S	S	*	*	H	α-helix	trans	-70.8	-29.5	177.3	0	0	0	0	0	112.6	R239 I240 K245	R239-A243 WeakPolarHBondContact O-CB 3.4Å; R239-A243 PolarHBondContact O-N 3.14Å; I240-A243 CarbonylContact O-C 3.57Å; I240-A243 PolarHBondContact O-N 2.85Å; I240-A243 VanDerWaalsContact O-N 3.13Å; A243-K245 VanDerWaalsContact C-N 3.25Å; A243-K245 PolarHBondContact O-N 3.41Å
244	Q	87.5	Confident	75.6	Confident	117 Å²	117	115.2 Å²	115.2	55%	0.547	64%	0.639	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.7	-1.7	173.5	-67.4	-121.3	-51.7	0	0	112.8	I240 D241 Q242 H246	I240-Q244 HydrophobicContact CG2-CG 3.96Å; I240-Q244 VanDerWaalsContact O-CB 3.31Å; I240-Q244 WeakPolarHBondContact O-CB 3.38Å; I240-Q244 WeakPolarHBondContact O-CG 3.4Å; I240-Q244 PolarHBondContact O-N 2.81Å; D241-Q244 PolarHBondContact O-N 2.92Å; Q242-Q244 VanDerWaalsContact C-N 3.33Å; Q244-H246 PolarHBondContact O-CD2 3.05Å; Q244-H246 PolarHBondContact O-CE1 3.19Å; Q244-H246 VanDerWaalsContact O-CG 3.23Å; Q244-H246 PolarHBondContact O-N 3.26Å; Q244-H246 PolarHBondContact O-ND1 2.92Å; Q244-H246 PolarHBondContact O-NE2 3.05Å
245	K	74.1	Confident	73.7	Confident	169 Å²	169	121.2 Å²	121.2	74%	0.735	66%	0.658	S	S	*	*	S	Bend	trans	-70.6	77.5	162.9	-71.3	178	-176.9	-178.4	0	108.6	D241 Q242 A243 S247	D241-K245 PolarHBondContact O-N 3.48Å; Q242-K245 WeakPolarHBondContact O-CB 3.41Å; Q242-K245 PolarHBondContact O-N 3.19Å; A243-K245 VanDerWaalsContact C-N 3.25Å; A243-K245 PolarHBondContact O-N 3.41Å; K245-S247 PolarHBondContact O-N 3.07Å
246	H	61.9	Low	71.4	Confident	135 Å²	135	122.9 Å²	122.9	63%	0.625	68%	0.682	S	S	*	*			trans	-54.7	132.7	175.1	-38.5	-59.5	0	0	0	109.1	Q244 K248	Q244-H246 PolarHBondContact O-CD2 3.05Å; Q244-H246 PolarHBondContact O-CE1 3.19Å; Q244-H246 VanDerWaalsContact O-CG 3.23Å; Q244-H246 PolarHBondContact O-N 3.26Å; Q244-H246 PolarHBondContact O-ND1 2.92Å; Q244-H246 PolarHBondContact O-NE2 3.05Å; H246-K248 PolarHBondContact O-N 3.22Å
247	S	59.3	Low	69	Low	90 Å²	90	128.2 Å²	128.2	63%	0.629	70%	0.701	S	S	*	*			trans	-42.9	96.8	162.8	171.4	0	0	0	0	110.8	K245 K249	K245-S247 PolarHBondContact O-N 3.07Å; S247-K249 PolarHBondContact O-N 3.34Å; S247-K249 PolarHBondContact OG-N 3.33Å
248	K	54.8	Low	66.8	Low	216 Å²	216	127.5 Å²	127.5	94%	0.939	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	30.8	158.8	-74.9	-171.3	177.4	179.7	0	110.9	H246	H246-K248 PolarHBondContact O-N 3.22Å
249	K	52.8	Low	64.4	Low	199 Å²	199	127.7 Å²	127.7	87%	0.865	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.6	39	177.9	-149.3	176.5	-175.8	176.9	0	113.8	S247	S247-K249 PolarHBondContact O-N 3.34Å; S247-K249 PolarHBondContact OG-N 3.33Å
250	A	52.9	Low	62.1	Low	90 Å²	90	123.7 Å²	123.7	74%	0.744	73%	0.734	S	S	*	*	S	Bend	trans	-153.4	83.6	159.5	0	0	0	0	0	108.5
251	G	49.3	Very low	60.1	Low	71 Å²	71	130.4 Å²	130.4	73%	0.732	75%	0.753	S	S	*	*	S	Bend	trans	165	-8.9	179	0	0	0	0	0	116.8	T253	G251-T253 VanDerWaalsContact C-N 3.3Å; G251-T253 PolarHBondContact O-N 2.84Å
252	A	48.7	Very low	57.8	Low	101 Å²	101	137.5 Å²	137.5	84%	0.835	77%	0.772	S	S	*	*			trans	-94.3	55.9	170.4	0	0	0	0	0	111.2	A254	A252-A254 PolarHBondContact O-N 3.37Å; A252-A254 VanDerWaalsContact O-N 3.07Å
253	T	50.7	Low	55.8	Low	133 Å²	133	144.6 Å²	144.6	82%	0.816	80%	0.801	S	S	*	*			trans	-77.9	67.9	154.3	-4.6	0	0	0	0	107.2	G251 K255	G251-T253 VanDerWaalsContact C-N 3.3Å; G251-T253 PolarHBondContact O-N 2.84Å; T253-K255 VanDerWaalsContact C-N 3.32Å; T253-K255 PolarHBondContact O-N 3.48Å
254	A	50.1	Low	54.1	Low	92 Å²	92	147.7 Å²	147.7	76%	0.76	81%	0.807	S	S	*	*			trans	-75.2	91.9	166.6	0	0	0	0	0	107.6	A252 G256	A252-A254 PolarHBondContact O-N 3.37Å; A252-A254 VanDerWaalsContact O-N 3.07Å; A254-G256 PolarHBondContact O-N 2.89Å
255	K	56.1	Low	52.3	Low	210 Å²	210	149.3 Å²	149.3	91%	0.913	82%	0.821	S	S	*	*			trans	-51.7	117.2	157.5	-73.6	-173.2	175.9	-179	0	107.6	T253	T253-K255 VanDerWaalsContact C-N 3.32Å; T253-K255 PolarHBondContact O-N 3.48Å
256	G	50.5	Low	51.1	Low	71 Å²	71	148.2 Å²	148.2	73%	0.732	83%	0.825	S	S	*	*			trans	173.8	83.9	177.2	0	0	0	0	0	115.6	A254	A254-G256 PolarHBondContact O-N 2.89Å
257	K	45.7	Very low	50.5	Low	204 Å²	204	149 Å²	149	89%	0.887	84%	0.837	S	S	*	*			trans	78.6	79.5	146.9	-141	157.5	-172.7	170	0	117.6	G259	K257-G259 VanDerWaalsContact C-N 3.3Å; K257-G259 PolarHBondContact O-N 3.14Å; K257-G259 VanDerWaalsContact O-N 3.14Å
258	V	50.1	Low	49.9	Very low	152 Å²	152	152.7 Å²	152.7	92%	0.921	85%	0.85	S	S	*	*			trans	-72.3	91.2	147.1	176.1	0	0	0	0	107.1
259	G	44.8	Very low	49.6	Very low	63 Å²	63	148.5 Å²	148.5	65%	0.649	84%	0.844	S	S	*	*			trans	-86.8	104.4	165.4	0	0	0	0	0	108.6	K257 R261	K257-G259 VanDerWaalsContact C-N 3.3Å; K257-G259 PolarHBondContact O-N 3.14Å; K257-G259 VanDerWaalsContact O-N 3.14Å; G259-R261 PolarHBondContact O-N 3.4Å
260	G	46.2	Very low	49.4	Very low	72 Å²	72	144.9 Å²	144.9	74%	0.742	84%	0.843	S	S	*	*			trans	-56.8	127.7	-179.9	0	0	0	0	0	112.3
261	R	53	Low	49.1	Very low	238 Å²	238	149.1 Å²	149.1	90%	0.898	85%	0.85	S	S	*	*			trans	-110	100.9	161.2	-179.8	177.3	178.9	-148.4	2.2	106.7	G259	G259-R261 PolarHBondContact O-N 3.4Å
262	W	45.1	Very low	49.1	Very low	251 Å²	251	155.6 Å²	155.6	95%	0.951	86%	0.86	S	S	*	*			trans	-125.2	134.3	164.4	-77.4	65.2	0	0	0	107.8
263	K	48.8	Very low	49.2	Very low	280 Å²	280	160.5 Å²	160.5	100%	1.217	86%	0.862	S	S	*	*			trans	-67.8	0	174.3	-92.8	176.9	167.4	179.9	0	110.8

Retrieved 263 of 263 residues in 41.2 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).