A0A5K4F2M6_SCHMA Loading...

Polymorphic mucin variant C-r2/2; Polymorphic mucin variant IC-r2/2

AlphaFold DB , UniProt , Accession A0A5K4F2M6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 304 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.7	Very low	44.8	Very low	167 Å²	167	102.3 Å²	102.3	82%	0.823	53%	0.532	S	S	*	.				0	-58	0	-148.3	-176.8	-72.6	0	0	114.2	Q3 L4 I5	M1-Q3 PolarHBondContact O-N 3.01Å; M1-L4 PolarHBondContact O-N 3.2Å; M1-L4 VanDerWaalsContact O-N 3.08Å; M1-I5 HydrophobicContact CG-CD1 3.86Å; M1-I5 HydrophobicContact CG-CG1 4.37Å; M1-I5 WeakPolarHBondContact O-CG1 2.93Å; M1-I5 PolarHBondContact O-N 3.32Å; M1-I5 HydrophobicContact SD-CD1 4.35Å
2	Q	39.8	Very low	44.5	Very low	174 Å²	174	103.1 Å²	103.1	81%	0.813	53%	0.533	S	S	*	.	H	α-helix	trans	-57.9	-40.3	-176.7	-85.1	-179.8	-16.4	0	0	115	L4 S6	Q2-L4 VanDerWaalsContact C-N 3.33Å; Q2-L4 PolarHBondContact O-N 2.83Å; Q2-S6 VanDerWaalsContact O-CB 3.23Å; Q2-S6 WeakPolarHBondContact O-CB 3.49Å; Q2-S6 PolarHBondContact O-N 3.03Å
3	Q	45.2	Very low	44.8	Very low	137 Å²	137	105.5 Å²	105.5	64%	0.64	54%	0.537	S	S	*	.	H	α-helix	trans	-66.3	-34.6	176.1	-74.1	179.6	-16.6	0	0	112.4	M1 S6 L7 Q253	M1-Q3 PolarHBondContact O-N 3.01Å; Q3-S6 WeakPolarHBondContact O-CB 3.35Å; Q3-S6 PolarHBondContact O-N 2.66Å; Q3-L7 PolarHBondContact O-N 3.44Å; Q3-Q253 VanDerWaalsContact OE1-NE2 3.13Å
4	L	40.7	Very low	44.7	Very low	89 Å²	89	107.9 Å²	107.9	47%	0.466	55%	0.548	S	S	.	.	H	α-helix	trans	-75.6	-42.3	178.7	-123.6	121.9	0	0	0	111.6	M1 Q2 S6 L7 C8 A41	M1-L4 PolarHBondContact O-N 3.2Å; M1-L4 VanDerWaalsContact O-N 3.08Å; Q2-L4 VanDerWaalsContact C-N 3.33Å; Q2-L4 PolarHBondContact O-N 2.83Å; L4-S6 PolarHBondContact O-N 3.06Å; L4-L7 PolarHBondContact O-N 3.19Å; L4-L7 VanDerWaalsContact O-N 3.13Å; L4-C8 PolarHBondContact O-N 3.48Å; L4-C8 PolarHBondContact O-SG 3.37Å; L4-A41 HydrophobicContact CD2-CB 4.47Å
5	I	43.8	Very low	44.2	Very low	92 Å²	92	104.6 Å²	104.6	47%	0.472	53%	0.532	S	S	.	.	H	α-helix	trans	-57.8	-42.1	168.8	-66.7	170.3	0	0	0	109.4	M1 L7 C8 C9	M1-I5 HydrophobicContact CG-CD1 3.86Å; M1-I5 HydrophobicContact CG-CG1 4.37Å; M1-I5 WeakPolarHBondContact O-CG1 2.93Å; M1-I5 PolarHBondContact O-N 3.32Å; M1-I5 HydrophobicContact SD-CD1 4.35Å; I5-L7 PolarHBondContact O-N 3.02Å; I5-C8 PolarHBondContact O-N 3.19Å; I5-C9 WeakPolarHBondContact O-CB 3.47Å; I5-C9 PolarHBondContact O-N 3.2Å; I5-C9 PolarHBondContact O-SG 3.39Å
6	S	48.6	Very low	43.9	Very low	58 Å²	58	107.6 Å²	107.6	41%	0.406	55%	0.546	S	S	.	.	H	α-helix	trans	-62.2	-40.8	175.4	-176.9	0	0	0	0	112.4	Q2 Q3 L4 C9 K10	Q2-S6 VanDerWaalsContact O-CB 3.23Å; Q2-S6 WeakPolarHBondContact O-CB 3.49Å; Q2-S6 PolarHBondContact O-N 3.03Å; Q3-S6 WeakPolarHBondContact O-CB 3.35Å; Q3-S6 PolarHBondContact O-N 2.66Å; L4-S6 PolarHBondContact O-N 3.06Å; S6-C9 PolarHBondContact O-N 3.47Å; S6-K10 WeakPolarHBondContact O-CB 3.35Å; S6-K10 WeakPolarHBondContact O-CG 3.47Å; S6-K10 PolarHBondContact O-N 2.88Å
7	L	47.7	Very low	44.1	Very low	113 Å²	113	112.1 Å²	112.1	59%	0.592	56%	0.561	S	S	*	*	H	α-helix	trans	-66.4	-48.4	175.7	-159	77.9	0	0	0	111.3	Q3 L4 I5 C9 K10 V11	Q3-L7 PolarHBondContact O-N 3.44Å; L4-L7 PolarHBondContact O-N 3.19Å; L4-L7 VanDerWaalsContact O-N 3.13Å; I5-L7 PolarHBondContact O-N 3.02Å; L7-C9 VanDerWaalsContact C-N 3.34Å; L7-C9 PolarHBondContact O-N 2.97Å; L7-K10 WeakPolarHBondContact O-CA 3.33Å; L7-K10 WeakPolarHBondContact O-CB 3.41Å; L7-K10 PolarHBondContact O-N 3.48Å; L7-V11 WeakPolarHBondContact O-CG2 3.33Å; L7-V11 PolarHBondContact O-N 3.12Å
8	C	43.1	Very low	43.7	Very low	47 Å²	47	113.4 Å²	113.4	32%	0.318	56%	0.558	S	S	.	*	H	α-helix	trans	-58.9	-44.1	174.5	-71.7	0	0	0	0	111.6	L4 I5 K10 V11 M12	L4-C8 PolarHBondContact O-N 3.48Å; L4-C8 PolarHBondContact O-SG 3.37Å; I5-C8 PolarHBondContact O-N 3.19Å; C8-K10 VanDerWaalsContact C-N 3.32Å; C8-K10 PolarHBondContact O-N 3.36Å; C8-V11 PolarHBondContact O-N 2.89Å; C8-M12 WeakPolarHBondContact O-CB 3.46Å; C8-M12 WeakPolarHBondContact O-CG 3.47Å; C8-M12 PolarHBondContact O-N 3.26Å
9	C	46.4	Very low	43.4	Very low	52 Å²	52	112.9 Å²	112.9	35%	0.351	56%	0.564	S	S	.	*	H	α-helix	trans	-64.1	-35.3	174.1	-74.9	0	0	0	0	112.1	I5 S6 L7 K13	I5-C9 WeakPolarHBondContact O-CB 3.47Å; I5-C9 PolarHBondContact O-N 3.2Å; I5-C9 PolarHBondContact O-SG 3.39Å; S6-C9 PolarHBondContact O-N 3.47Å; L7-C9 VanDerWaalsContact C-N 3.34Å; L7-C9 PolarHBondContact O-N 2.97Å; C9-K13 WeakPolarHBondContact O-CB 3.28Å; C9-K13 WeakPolarHBondContact O-CG 3.48Å; C9-K13 PolarHBondContact O-N 2.65Å
10	K	51.1	Low	43.4	Very low	129 Å²	129	119.1 Å²	119.1	56%	0.561	58%	0.58	S	S	*	*	H	α-helix	trans	-65.8	-46.3	173.5	-89.5	-180	177.9	177.3	0	111.1	S6 L7 C8 K13 M14	S6-K10 WeakPolarHBondContact O-CB 3.35Å; S6-K10 WeakPolarHBondContact O-CG 3.47Å; S6-K10 PolarHBondContact O-N 2.88Å; L7-K10 WeakPolarHBondContact O-CA 3.33Å; L7-K10 WeakPolarHBondContact O-CB 3.41Å; L7-K10 PolarHBondContact O-N 3.48Å; C8-K10 VanDerWaalsContact C-N 3.32Å; C8-K10 PolarHBondContact O-N 3.36Å; K10-K13 PolarHBondContact O-N 2.99Å; K10-M14 WeakPolarHBondContact O-CB 3.36Å; K10-M14 VanDerWaalsContact O-CG 3.29Å; K10-M14 WeakPolarHBondContact O-CG 3.48Å; K10-M14 PolarHBondContact O-N 3.29Å
11	V	45.7	Very low	43.3	Very low	67 Å²	67	125.2 Å²	125.2	41%	0.406	60%	0.598	S	S	.	*	H	α-helix	trans	-62.4	-45.9	177	178.7	0	0	0	0	110.7	L7 C8 K13 M14 N15	L7-V11 WeakPolarHBondContact O-CG2 3.33Å; L7-V11 PolarHBondContact O-N 3.12Å; C8-V11 PolarHBondContact O-N 2.89Å; V11-K13 PolarHBondContact O-N 3.44Å; V11-M14 PolarHBondContact O-N 2.85Å; V11-N15 PolarHBondContact O-N 3Å; V11-N15 VanDerWaalsContact O-N 3.07Å
12	M	41.6	Very low	43.1	Very low	112 Å²	112	122.1 Å²	122.1	55%	0.552	58%	0.581	S	S	*	*	H	α-helix	trans	-62	-42.8	174.8	-72.2	-168	-72.9	0	0	112.1	C8 N15 M16	C8-M12 WeakPolarHBondContact O-CB 3.46Å; C8-M12 WeakPolarHBondContact O-CG 3.47Å; C8-M12 PolarHBondContact O-N 3.26Å; M12-N15 PolarHBondContact O-N 3.15Å; M12-M16 WeakPolarHBondContact O-CG 3.16Å; M12-M16 PolarHBondContact O-N 3.19Å
13	K	47.5	Very low	42.9	Very low	135 Å²	135	120.6 Å²	120.6	59%	0.587	58%	0.577	S	S	*	*	H	α-helix	trans	-65.3	-37	175.3	-86.1	-178.8	173.8	176.9	0	112.7	C9 K10 V11 N15 M16 K17	C9-K13 WeakPolarHBondContact O-CB 3.28Å; C9-K13 WeakPolarHBondContact O-CG 3.48Å; C9-K13 PolarHBondContact O-N 2.65Å; K10-K13 PolarHBondContact O-N 2.99Å; V11-K13 PolarHBondContact O-N 3.44Å; K13-N15 VanDerWaalsContact C-N 3.28Å; K13-N15 PolarHBondContact O-N 2.83Å; K13-M16 HydrophobicContact CG-CE 4.47Å; K13-M16 PolarHBondContact O-N 3.29Å; K13-K17 PolarHBondContact O-N 3.02Å
14	M	43.3	Very low	42.7	Very low	138 Å²	138	120.8 Å²	120.8	68%	0.68	58%	0.576	S	S	*	*	H	α-helix	trans	-62.7	-38.2	175.3	-78.9	179.2	67.5	0	0	110.8	K10 V11	K10-M14 WeakPolarHBondContact O-CB 3.36Å; K10-M14 VanDerWaalsContact O-CG 3.29Å; K10-M14 WeakPolarHBondContact O-CG 3.48Å; K10-M14 PolarHBondContact O-N 3.29Å; V11-M14 PolarHBondContact O-N 2.85Å
15	N	38.4	Very low	42.8	Very low	59 Å²	59	124.7 Å²	124.7	32%	0.316	59%	0.594	S	S	.	*	H	α-helix	trans	-72.4	-35.9	174.2	-80.2	-19.1	0	0	0	113	V11 M12 K13 K17 R18	V11-N15 PolarHBondContact O-N 3Å; V11-N15 VanDerWaalsContact O-N 3.07Å; M12-N15 PolarHBondContact O-N 3.15Å; K13-N15 VanDerWaalsContact C-N 3.28Å; K13-N15 PolarHBondContact O-N 2.83Å; N15-K17 PolarHBondContact O-N 2.92Å; N15-R18 PolarHBondContact O-N 3.12Å
16	M	39.1	Very low	42.7	Very low	152 Å²	152	123.7 Å²	123.7	75%	0.749	59%	0.589	S	S	*	*	H	α-helix	trans	-73.7	-21.4	176.4	-69.3	-159.1	-60.4	0	0	114.6	M12 K13 R18	M12-M16 WeakPolarHBondContact O-CG 3.16Å; M12-M16 PolarHBondContact O-N 3.19Å; K13-M16 HydrophobicContact CG-CE 4.47Å; K13-M16 PolarHBondContact O-N 3.29Å; M16-R18 PolarHBondContact O-N 3.11Å
17	K	46.6	Very low	42.7	Very low	185 Å²	185	124.7 Å²	124.7	80%	0.804	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-4.8	175.6	-83	-170.3	176.2	-172.6	0	113.5	K13 N15	K13-K17 PolarHBondContact O-N 3.02Å; N15-K17 PolarHBondContact O-N 2.92Å
18	R	37.4	Very low	42.8	Very low	135 Å²	135	123.1 Å²	123.1	51%	0.509	60%	0.596	S	S	.	*	S	Bend	trans	-72.7	135.7	170	-71.8	-170.2	-178.5	176.7	4.5	109.6	N15 M16 R20	N15-R18 PolarHBondContact O-N 3.12Å; M16-R18 PolarHBondContact O-N 3.11Å; R18-R20 PolarHBondContact O-N 3.25Å
19	P	38.7	Very low	42.7	Very low	104 Å²	104	122.8 Å²	122.8	68%	0.675	60%	0.6	S	S	*	*			trans	-53.3	136.7	-175.4	18.7	-30.1	0	0	0	110.9	R21 E22	P19-R21 PolarHBondContact O-N 2.92Å; P19-E22 PolarHBondContact O-N 3.37Å
20	R	42.4	Very low	42.6	Very low	236 Å²	236	123.5 Å²	123.5	89%	0.891	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-49	-10.1	-170.6	-80	-176.7	177.6	-179.6	-0.9	116.9	R18	R18-R20 PolarHBondContact O-N 3.25Å
21	R	40.7	Very low	42.4	Very low	249 Å²	249	120.1 Å²	120.1	94%	0.94	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-83.6	-11	174.9	-69.2	-172.3	178.1	-176.5	-0.2	114.1	P19	P19-R21 PolarHBondContact O-N 2.92Å
22	E	36.4	Very low	42.4	Very low	102 Å²	102	120.7 Å²	120.7	48%	0.477	59%	0.592	S	S	.	*	G	3₁₀ helix	trans	-128.3	53.3	173.9	-66.2	-164.1	172.3	0	0	111.6	P19 K24	P19-E22 PolarHBondContact O-N 3.37Å; E22-K24 PolarHBondContact O-N 3.13Å; E22-K24 IonicContact OE1-NZ 4Å; E22-K24 IonicContact OE2-NZ 3.65Å
23	I	36.4	Very low	42.6	Very low	142 Å²	142	120.1 Å²	120.1	73%	0.728	59%	0.59	S	S	*	*			trans	-70.6	69.5	153.3	-52.3	176.3	0	0	0	105.8	M25	I23-M25 PolarHBondContact O-N 2.96Å
24	K	41.1	Very low	42.4	Very low	141 Å²	141	116.4 Å²	116.4	61%	0.613	58%	0.576	S	S	*	*			trans	-59.5	115	162.8	-75.1	178.7	-179.6	164.4	0	103.6	E22 L26	E22-K24 PolarHBondContact O-N 3.13Å; E22-K24 IonicContact OE1-NZ 4Å; E22-K24 IonicContact OE2-NZ 3.65Å; K24-L26 PolarHBondContact O-N 2.77Å; K24-L26 VanDerWaalsContact O-N 3.12Å
25	M	42	Very low	42.5	Very low	171 Å²	171	113.8 Å²	113.8	84%	0.842	56%	0.564	S	S	*	*			trans	-40.1	126.2	160.3	-74	-175.4	-73.4	0	0	106.1	I23 T27	I23-M25 PolarHBondContact O-N 2.96Å; M25-T27 PolarHBondContact O-N 3.47Å
26	L	42.3	Very low	42.7	Very low	71 Å²	71	115.4 Å²	115.4	37%	0.372	57%	0.572	S	S	.	*			trans	-37.8	120.6	173.2	-85.7	152.1	0	0	0	106.5	K24 A28 E30 T31 I34	K24-L26 PolarHBondContact O-N 2.77Å; K24-L26 VanDerWaalsContact O-N 3.12Å; L26-A28 PolarHBondContact O-N 3.04Å; L26-E30 WeakPolarHBondContact CA-OE2 3.38Å; L26-E30 HydrophobicContact CB-CB 4.33Å; L26-E30 HydrophobicContact CD2-CB 3.46Å; L26-E30 VanDerWaalsContact CD2-CB 3.46Å; L26-E30 HydrophobicContact CD2-CG 4.31Å; L26-T31 WeakPolarHBondContact CB-OG1 3.41Å; L26-I34 HydrophobicContact CD1-CD1 4.49Å; L26-I34 HydrophobicContact CD2-CD1 4.27Å
27	T	49.1	Very low	42.8	Very low	79 Å²	79	112.5 Å²	112.5	49%	0.485	56%	0.558	S	S	.	*			trans	-54.1	149	179.6	55.5	0	0	0	0	107.4	M25 G29 E30 T31	M25-T27 PolarHBondContact O-N 3.47Å; T27-G29 CarbonylContact O-C 3.58Å; T27-G29 PolarHBondContact O-N 3.47Å; T27-E30 PolarHBondContact N-OE2 2.92Å; T27-E30 PolarHBondContact O-N 3.34Å; T27-E30 WeakPolarHBondContact OG1-CG 3.1Å; T27-E30 PolarHBondContact OG1-N 3.49Å; T27-E30 PolarHBondContact OG1-OE2 3.18Å; T27-E30 VanDerWaalsContact OG1-OE2 3.09Å; T27-T31 PolarHBondContact O-N 3.39Å; T27-T31 VanDerWaalsContact O-N 3.13Å; T27-T31 PolarHBondContact O-OG1 3.29Å
28	A	48.8	Very low	42.4	Very low	80 Å²	80	108 Å²	108	66%	0.661	54%	0.543	S	S	*	.	H	α-helix	trans	-48.6	-34.2	178.2	0	0	0	0	0	111.1	L26 V32	L26-A28 PolarHBondContact O-N 3.04Å; A28-V32 WeakPolarHBondContact O-CB 3.42Å; A28-V32 WeakPolarHBondContact O-CG2 2.96Å; A28-V32 PolarHBondContact O-N 3.41Å
29	G	42.1	Very low	42.5	Very low	39 Å²	39	105.6 Å²	105.6	40%	0.402	54%	0.539	S	S	.	.	H	α-helix	trans	-61	-48.1	172.1	0	0	0	0	0	115.2	T27 T31 V32 I33	T27-G29 CarbonylContact O-C 3.58Å; T27-G29 PolarHBondContact O-N 3.47Å; G29-T31 PolarHBondContact O-N 3.5Å; G29-V32 PolarHBondContact O-N 3.11Å; G29-I33 VanDerWaalsContact O-CG1 3.29Å; G29-I33 WeakPolarHBondContact O-CG1 3.41Å; G29-I33 PolarHBondContact O-N 2.81Å
30	E	43.1	Very low	42.4	Very low	68 Å²	68	104.3 Å²	104.3	32%	0.318	53%	0.529	S	S	.	.	H	α-helix	trans	-66.4	-37.6	179.5	-68.9	164.9	137.6	0	0	112.2	L26 T27 I33 I34	L26-E30 WeakPolarHBondContact CA-OE2 3.38Å; L26-E30 HydrophobicContact CB-CB 4.33Å; L26-E30 HydrophobicContact CD2-CB 3.46Å; L26-E30 VanDerWaalsContact CD2-CB 3.46Å; L26-E30 HydrophobicContact CD2-CG 4.31Å; T27-E30 PolarHBondContact N-OE2 2.92Å; T27-E30 PolarHBondContact O-N 3.34Å; T27-E30 WeakPolarHBondContact OG1-CG 3.1Å; T27-E30 PolarHBondContact OG1-N 3.49Å; T27-E30 PolarHBondContact OG1-OE2 3.18Å; T27-E30 VanDerWaalsContact OG1-OE2 3.09Å; E30-I33 PolarHBondContact O-N 3.15Å; E30-I34 WeakPolarHBondContact O-CG1 3.46Å; E30-I34 PolarHBondContact O-N 3.08Å
31	T	47.1	Very low	42.1	Very low	57 Å²	57	94.6 Å²	94.6	35%	0.35	50%	0.499	S	S	.	.	H	α-helix	trans	-64.9	-42.7	175.1	-49.7	0	0	0	0	110.8	L26 T27 G29 I33 I34 I35	L26-T31 WeakPolarHBondContact CB-OG1 3.41Å; T27-T31 PolarHBondContact O-N 3.39Å; T27-T31 VanDerWaalsContact O-N 3.13Å; T27-T31 PolarHBondContact O-OG1 3.29Å; G29-T31 PolarHBondContact O-N 3.5Å; T31-I33 VanDerWaalsContact C-N 3.35Å; T31-I33 PolarHBondContact O-N 3.26Å; T31-I34 PolarHBondContact O-N 2.76Å; T31-I35 HydrophobicContact CG2-CD1 4.08Å; T31-I35 VanDerWaalsContact O-CG1 3.31Å; T31-I35 WeakPolarHBondContact O-CG1 3.1Å; T31-I35 PolarHBondContact O-N 3.38Å
32	V	47.1	Very low	41.9	Very low	79 Å²	79	87.3 Å²	87.3	48%	0.479	48%	0.479	S	S	.	.	H	α-helix	trans	-61.6	-41.8	174.8	167.4	0	0	0	0	111.2	A28 G29 I35 I36	A28-V32 WeakPolarHBondContact O-CB 3.42Å; A28-V32 WeakPolarHBondContact O-CG2 2.96Å; A28-V32 PolarHBondContact O-N 3.41Å; G29-V32 PolarHBondContact O-N 3.11Å; V32-I35 PolarHBondContact O-N 2.9Å; V32-I36 HydrophobicContact CG1-CD1 3.62Å; V32-I36 HydrophobicContact CG1-CG1 4.29Å; V32-I36 WeakPolarHBondContact O-CB 3.3Å; V32-I36 WeakPolarHBondContact O-CG1 3.28Å; V32-I36 PolarHBondContact O-N 3.28Å
33	I	45.2	Very low	41.8	Very low	100 Å²	100	88.5 Å²	88.5	51%	0.513	48%	0.483	S	S	.	.	H	α-helix	trans	-62.1	-45.5	176.9	-69.4	165.1	0	0	0	111.2	G29 E30 T31 I35 I36 I37	G29-I33 VanDerWaalsContact O-CG1 3.29Å; G29-I33 WeakPolarHBondContact O-CG1 3.41Å; G29-I33 PolarHBondContact O-N 2.81Å; E30-I33 PolarHBondContact O-N 3.15Å; T31-I33 VanDerWaalsContact C-N 3.35Å; T31-I33 PolarHBondContact O-N 3.26Å; I33-I35 PolarHBondContact O-N 3.39Å; I33-I36 PolarHBondContact O-N 2.91Å; I33-I37 HydrophobicContact CG2-CD1 3.78Å; I33-I37 HydrophobicContact CG2-CG1 4.44Å; I33-I37 VanDerWaalsContact O-CG1 3.28Å; I33-I37 WeakPolarHBondContact O-CG1 3.15Å; I33-I37 PolarHBondContact O-N 2.98Å
34	I	43.3	Very low	41.7	Very low	57 Å²	57	86.1 Å²	86.1	29%	0.292	47%	0.467	S	S	.	.	H	α-helix	trans	-63	-43	178	-68	170.1	0	0	0	110.9	L26 E30 T31 I37 L38	L26-I34 HydrophobicContact CD1-CD1 4.49Å; L26-I34 HydrophobicContact CD2-CD1 4.27Å; E30-I34 WeakPolarHBondContact O-CG1 3.46Å; E30-I34 PolarHBondContact O-N 3.08Å; T31-I34 PolarHBondContact O-N 2.76Å; I34-I37 PolarHBondContact O-N 3.35Å; I34-L38 HydrophobicContact CG2-CD1 4.04Å; I34-L38 HydrophobicContact CG2-CG 4.5Å; I34-L38 WeakPolarHBondContact O-CB 3.46Å; I34-L38 WeakPolarHBondContact O-CG 3.45Å; I34-L38 PolarHBondContact O-N 3.42Å
35	I	45.4	Very low	41.4	Very low	84 Å²	84	85.5 Å²	85.5	43%	0.431	47%	0.467	S	S	.	.	H	α-helix	trans	-62.3	-43.7	175.9	-69.9	168.9	0	0	0	110.6	T31 V32 I33 I37 L38 I39	T31-I35 HydrophobicContact CG2-CD1 4.08Å; T31-I35 VanDerWaalsContact O-CG1 3.31Å; T31-I35 WeakPolarHBondContact O-CG1 3.1Å; T31-I35 PolarHBondContact O-N 3.38Å; V32-I35 PolarHBondContact O-N 2.9Å; I33-I35 PolarHBondContact O-N 3.39Å; I35-I37 PolarHBondContact O-N 2.84Å; I35-L38 PolarHBondContact O-N 3.08Å; I35-I39 HydrophobicContact CG2-CD1 3.58Å; I35-I39 HydrophobicContact CG2-CG1 4.23Å; I35-I39 WeakPolarHBondContact O-CB 3.35Å; I35-I39 VanDerWaalsContact O-CG1 3.24Å; I35-I39 WeakPolarHBondContact O-CG1 3.33Å; I35-I39 PolarHBondContact O-N 3.3Å
36	I	43.1	Very low	41.2	Very low	93 Å²	93	81.7 Å²	81.7	48%	0.477	45%	0.453	S	S	.	.	H	α-helix	trans	-60.9	-46	176.9	-71.1	166.9	0	0	0	110.3	V32 I33 L38 I39 T40	V32-I36 HydrophobicContact CG1-CD1 3.62Å; V32-I36 HydrophobicContact CG1-CG1 4.29Å; V32-I36 WeakPolarHBondContact O-CB 3.3Å; V32-I36 WeakPolarHBondContact O-CG1 3.28Å; V32-I36 PolarHBondContact O-N 3.28Å; I33-I36 PolarHBondContact O-N 2.91Å; I36-L38 PolarHBondContact O-N 3.06Å; I36-I39 PolarHBondContact O-N 2.97Å; I36-T40 PolarHBondContact O-N 2.78Å; I36-T40 PolarHBondContact O-OG1 2.83Å
37	I	41.3	Very low	40.9	Very low	90 Å²	90	80 Å²	80	46%	0.462	45%	0.45	S	S	.	.	H	α-helix	trans	-61	-43.3	177.3	-68.3	166.1	0	0	0	111	I33 I34 I35 T40 A41	I33-I37 HydrophobicContact CG2-CD1 3.78Å; I33-I37 HydrophobicContact CG2-CG1 4.44Å; I33-I37 VanDerWaalsContact O-CG1 3.28Å; I33-I37 WeakPolarHBondContact O-CG1 3.15Å; I33-I37 PolarHBondContact O-N 2.98Å; I34-I37 PolarHBondContact O-N 3.35Å; I35-I37 PolarHBondContact O-N 2.84Å; I37-T40 WeakPolarHBondContact CA-OG1 3.49Å; I37-T40 PolarHBondContact O-N 3.23Å; I37-T40 PolarHBondContact O-OG1 3.18Å; I37-A41 WeakPolarHBondContact O-CB 3.27Å; I37-A41 PolarHBondContact O-N 3.33Å
38	L	37.5	Very low	40.5	Very low	92 Å²	92	78.1 Å²	78.1	48%	0.482	44%	0.439	S	S	.	.	H	α-helix	trans	-65.7	-40.6	176.6	-76	171	0	0	0	111.6	I34 I35 I36 N42	I34-L38 HydrophobicContact CG2-CD1 4.04Å; I34-L38 HydrophobicContact CG2-CG 4.5Å; I34-L38 WeakPolarHBondContact O-CB 3.46Å; I34-L38 WeakPolarHBondContact O-CG 3.45Å; I34-L38 PolarHBondContact O-N 3.42Å; I35-L38 PolarHBondContact O-N 3.08Å; I36-L38 PolarHBondContact O-N 3.06Å; L38-N42 WeakPolarHBondContact O-CB 3.41Å; L38-N42 PolarHBondContact O-N 2.77Å
39	I	39.9	Very low	40.6	Very low	83 Å²	83	81.7 Å²	81.7	43%	0.426	44%	0.436	S	S	.	.	H	α-helix	trans	-66.9	-43.5	176.8	-70	169.5	0	0	0	110.7	I35 I36 K43	I35-I39 HydrophobicContact CG2-CD1 3.58Å; I35-I39 HydrophobicContact CG2-CG1 4.23Å; I35-I39 WeakPolarHBondContact O-CB 3.35Å; I35-I39 VanDerWaalsContact O-CG1 3.24Å; I35-I39 WeakPolarHBondContact O-CG1 3.33Å; I35-I39 PolarHBondContact O-N 3.3Å; I36-I39 PolarHBondContact O-N 2.97Å; I39-K43 HydrophobicContact CG2-CD 4.11Å; I39-K43 HydrophobicContact CG2-CG 4.41Å; I39-K43 VanDerWaalsContact O-CB 3.23Å; I39-K43 WeakPolarHBondContact O-CB 3.3Å; I39-K43 VanDerWaalsContact O-CG 3.25Å; I39-K43 WeakPolarHBondContact O-CG 3.46Å; I39-K43 PolarHBondContact O-N 2.74Å
40	T	36	Very low	41.1	Very low	77 Å²	77	80.2 Å²	80.2	47%	0.472	42%	0.419	S	S	.	.	H	α-helix	trans	-68.9	-38.8	176.9	40.2	0	0	0	0	111.8	I36 I37 K43 F44	I36-T40 PolarHBondContact O-N 2.78Å; I36-T40 PolarHBondContact O-OG1 2.83Å; I37-T40 WeakPolarHBondContact CA-OG1 3.49Å; I37-T40 PolarHBondContact O-N 3.23Å; I37-T40 PolarHBondContact O-OG1 3.18Å; T40-K43 PolarHBondContact O-N 2.83Å; T40-F44 VanDerWaalsContact O-CB 3.32Å; T40-F44 WeakPolarHBondContact O-CB 3.39Å; T40-F44 PolarHBondContact O-N 3.37Å
41	A	35.8	Very low	41.5	Very low	32 Å²	32	77.3 Å²	77.3	26%	0.264	41%	0.406	S	S	.	.	H	α-helix	trans	-64.8	-45	174.2	0	0	0	0	0	111.7	L4 I37 F44 E45	L4-A41 HydrophobicContact CD2-CB 4.47Å; I37-A41 WeakPolarHBondContact O-CB 3.27Å; I37-A41 PolarHBondContact O-N 3.33Å; A41-F44 WeakPolarHBondContact O-CB 3.43Å; A41-F44 PolarHBondContact O-N 3.46Å; A41-F44 VanDerWaalsContact O-N 3.15Å; A41-E45 WeakPolarHBondContact O-CB 3.43Å; A41-E45 PolarHBondContact O-N 2.93Å
42	N	36.7	Very low	41.6	Very low	96 Å²	96	74.9 Å²	74.9	51%	0.513	39%	0.391	S	S	.	.	H	α-helix	trans	-68.5	-36.9	178	-160.9	13.4	0	0	0	111.1	L38 F44 E45 T46	L38-N42 WeakPolarHBondContact O-CB 3.41Å; L38-N42 PolarHBondContact O-N 2.77Å; N42-F44 VanDerWaalsContact C-N 3.33Å; N42-E45 PolarHBondContact O-N 3.21Å; N42-T46 WeakPolarHBondContact O-CB 3.1Å; N42-T46 PolarHBondContact O-N 3.38Å; N42-T46 PolarHBondContact O-OG1 3.42Å
43	K	35	Very low	42	Very low	128 Å²	128	73.9 Å²	73.9	56%	0.557	38%	0.383	S	S	*	.	H	α-helix	trans	-62.7	-39.6	169.3	-80.1	-179.5	178.5	-175.7	0	111.4	I39 T40 A47	I39-K43 HydrophobicContact CG2-CD 4.11Å; I39-K43 HydrophobicContact CG2-CG 4.41Å; I39-K43 VanDerWaalsContact O-CB 3.23Å; I39-K43 WeakPolarHBondContact O-CB 3.3Å; I39-K43 VanDerWaalsContact O-CG 3.25Å; I39-K43 WeakPolarHBondContact O-CG 3.46Å; I39-K43 PolarHBondContact O-N 2.74Å; T40-K43 PolarHBondContact O-N 2.83Å; K43-A47 WeakPolarHBondContact O-CA 3.41Å; K43-A47 WeakPolarHBondContact O-CB 3.23Å; K43-A47 PolarHBondContact O-N 3.06Å
44	F	33.3	Very low	42.4	Very low	92 Å²	92	69.6 Å²	69.6	40%	0.404	36%	0.361	S	S	.	.	H	α-helix	trans	-65.3	-40.3	176.2	-165.1	-93.5	0	0	0	111.4	T40 A41 N42 S48	T40-F44 VanDerWaalsContact O-CB 3.32Å; T40-F44 WeakPolarHBondContact O-CB 3.39Å; T40-F44 PolarHBondContact O-N 3.37Å; A41-F44 WeakPolarHBondContact O-CB 3.43Å; A41-F44 PolarHBondContact O-N 3.46Å; A41-F44 VanDerWaalsContact O-N 3.15Å; N42-F44 VanDerWaalsContact C-N 3.33Å; F44-S48 WeakPolarHBondContact O-CB 3.45Å; F44-S48 PolarHBondContact O-N 3.43Å; F44-S48 PolarHBondContact O-OG 3.31Å
45	E	35.7	Very low	43	Very low	128 Å²	128	67 Å²	67	60%	0.598	35%	0.347	S	S	*	.	H	α-helix	trans	-72.8	-44.8	178.7	-162.3	168.4	-159.2	0	0	112.4	A41 N42	A41-E45 WeakPolarHBondContact O-CB 3.43Å; A41-E45 PolarHBondContact O-N 2.93Å; N42-E45 PolarHBondContact O-N 3.21Å
46	T	36.9	Very low	43.5	Very low	91 Å²	91	64.1 Å²	64.1	56%	0.558	34%	0.339	S	S	*	.	H	α-helix	trans	-74.8	-34.8	178.1	42.2	0	0	0	0	114	N42 S48	N42-T46 WeakPolarHBondContact O-CB 3.1Å; N42-T46 PolarHBondContact O-N 3.38Å; N42-T46 PolarHBondContact O-OG1 3.42Å; T46-S48 VanDerWaalsContact C-N 3.32Å
47	A	37	Very low	44.2	Very low	36 Å²	36	64.2 Å²	64.2	30%	0.298	34%	0.337	S	S	.	.	S	Bend	trans	-92.3	3.6	178	0	0	0	0	0	113.2	K43 R49 H130	K43-A47 WeakPolarHBondContact O-CA 3.41Å; K43-A47 WeakPolarHBondContact O-CB 3.23Å; K43-A47 PolarHBondContact O-N 3.06Å; A47-R49 VanDerWaalsContact C-N 3.35Å; A47-H130 WeakPolarHBondContact CB-CE1 3.47Å; A47-H130 VanDerWaalsContact CB-ND1 3.26Å; A47-H130 WeakPolarHBondContact CB-ND1 3.14Å; A47-H130 PolarHBondContact O-ND1 2.98Å
48	S	40.1	Very low	45	Very low	39 Å²	39	60.4 Å²	60.4	27%	0.273	32%	0.319	S	S	.	.	S	Bend	trans	-98.9	55.6	153.5	-53.1	0	0	0	0	109.3	F44 T46 S50	F44-S48 WeakPolarHBondContact O-CB 3.45Å; F44-S48 PolarHBondContact O-N 3.43Å; F44-S48 PolarHBondContact O-OG 3.31Å; T46-S48 VanDerWaalsContact C-N 3.32Å; S48-S50 PolarHBondContact O-N 2.95Å
49	R	50.3	Low	46.2	Very low	155 Å²	155	56.6 Å²	56.6	59%	0.585	30%	0.299	S	S	*	.			trans	-46.6	114.9	159.4	-88	-179.1	-178.5	-179.3	-1.7	105.4	A47 D53 H133	A47-R49 VanDerWaalsContact C-N 3.35Å; R49-D53 HydrophobicContact CB-CB 4.25Å; R49-H133 VanDerWaalsContact CB-CE1 3.4Å; R49-H133 WeakPolarHBondContact CB-CE1 3.22Å; R49-H133 PolarHBondContact O-CE1 3.13Å; R49-H133 PolarHBondContact O-ND1 3.35Å
50	S	53.4	Low	47.2	Very low	7 Å²	7	58.3 Å²	58.3	5%	0.049	30%	0.304	C	S	.	.			trans	-57.3	151.7	-168.1	162.3	0	0	0	0	108.5	S48 V52 D53 L54 E248	S48-S50 PolarHBondContact O-N 2.95Å; S50-V52 PolarHBondContact O-N 3.03Å; S50-V52 VanDerWaalsContact O-N 3.07Å; S50-V52 WeakPolarHBondContact OG-CB 3.37Å; S50-V52 WeakPolarHBondContact OG-CG2 3.27Å; S50-V52 PolarHBondContact OG-N 3.35Å; S50-D53 PolarHBondContact N-OD2 3.19Å; S50-D53 CarbonylContact O-C 3.12Å; S50-D53 WeakPolarHBondContact O-CA 3.45Å; S50-D53 VanDerWaalsContact O-CB 3.31Å; S50-D53 WeakPolarHBondContact O-CB 3.43Å; S50-D53 PolarHBondContact O-N 3.45Å; S50-L54 PolarHBondContact O-N 3.47Å; S50-E248 WeakPolarHBondContact CB-OE2 3.29Å; S50-E248 PolarHBondContact OG-OE2 3.35Å
51	L	50.9	Low	48.3	Very low	7 Å²	7	57.3 Å²	57.3	4%	0.037	29%	0.293	C	S	.	.	H	α-helix	trans	-54	-26.4	169.4	-170.1	151.8	0	0	0	111	L54 M55 K113 F114 E248	L51-L54 WeakPolarHBondContact O-CB 3.41Å; L51-L54 PolarHBondContact O-N 3.49Å; L51-M55 HydrophobicContact CD2-CG 4.06Å; L51-M55 HydrophobicContact CD2-SD 3.26Å; L51-M55 WeakPolarHBondContact CD2-SD 3.41Å; L51-M55 VanDerWaalsContact O-CB 3.24Å; L51-M55 WeakPolarHBondContact O-CB 3.44Å; L51-M55 VanDerWaalsContact O-CG 3.24Å; L51-M55 WeakPolarHBondContact O-CG 3.36Å; L51-M55 PolarHBondContact O-N 3.25Å; L51-K113 HydrophobicContact CD1-CB 3.35Å; L51-K113 HydrophobicContact CD1-CD 4.43Å; L51-K113 HydrophobicContact CG-CB 3.93Å; L51-K113 HydrophobicContact CG-CD 4.1Å; L51-F114 HydrophobicContact CD1-CB 3.85Å; L51-F114 VanDerWaalsContact CD1-N 3.27Å; L51-E248 VanDerWaalsContact CB-CD 3.46Å; L51-E248 WeakPolarHBondContact CB-OE1 3.23Å; L51-E248 WeakPolarHBondContact CB-OE2 3.37Å; L51-E248 PolarHBondContact N-OE1 3.15Å; L51-E248 VanDerWaalsContact N-OE1 3.08Å; L51-E248 PolarHBondContact N-OE2 2.85Å
52	V	49.4	Very low	50	Low	7 Å²	7	56 Å²	56	4%	0.042	28%	0.282	C	S	.	.	H	α-helix	trans	-63.1	-44.3	166.7	177.1	0	0	0	0	112.6	S50 L54 M55 G56 L241 V244 K245	S50-V52 PolarHBondContact O-N 3.03Å; S50-V52 VanDerWaalsContact O-N 3.07Å; S50-V52 WeakPolarHBondContact OG-CB 3.37Å; S50-V52 WeakPolarHBondContact OG-CG2 3.27Å; S50-V52 PolarHBondContact OG-N 3.35Å; V52-L54 VanDerWaalsContact C-N 3.27Å; V52-L54 PolarHBondContact O-N 3.1Å; V52-M55 PolarHBondContact O-N 2.91Å; V52-G56 WeakPolarHBondContact O-CA 3.21Å; V52-G56 PolarHBondContact O-N 3.23Å; V52-L241 HydrophobicContact CG1-CB 3.57Å; V52-L241 HydrophobicContact CG1-CD2 3.54Å; V52-L241 HydrophobicContact CG1-CG 4.09Å; V52-L241 WeakPolarHBondContact CG1-O 3.41Å; V52-L241 WeakPolarHBondContact CG2-O 3.4Å; V52-V244 HydrophobicContact CG2-CB 3.81Å; V52-V244 HydrophobicContact CG2-CG1 3.47Å; V52-V244 VanDerWaalsContact CG2-CG1 3.47Å; V52-K245 HydrophobicContact CB-CB 4.09Å; V52-K245 HydrophobicContact CG1-CB 4.31Å; V52-K245 HydrophobicContact CG2-CB 3.84Å
53	D	56.7	Low	51.3	Low	57 Å²	57	54.6 Å²	54.6	31%	0.305	27%	0.274	S	S	.	.	H	α-helix	trans	-63.6	-37.7	175	-55.9	-26.1	0	0	0	109.6	R49 S50 E57 K245	R49-D53 HydrophobicContact CB-CB 4.25Å; S50-D53 PolarHBondContact N-OD2 3.19Å; S50-D53 CarbonylContact O-C 3.12Å; S50-D53 WeakPolarHBondContact O-CA 3.45Å; S50-D53 VanDerWaalsContact O-CB 3.31Å; S50-D53 WeakPolarHBondContact O-CB 3.43Å; S50-D53 PolarHBondContact O-N 3.45Å; D53-E57 WeakPolarHBondContact O-CB 3.25Å; D53-E57 PolarHBondContact O-N 3.23Å; D53-K245 VanDerWaalsContact CG-NZ 3.33Å; D53-K245 IonicContact OD1-NZ 3.97Å; D53-K245 PolarHBondContact OD1-NZ 2.89Å; D53-K245 IonicContact OD2-NZ 2.67Å; D53-K245 PolarHBondContact OD2-NZ 3.13Å
54	L	52.7	Low	52.4	Low	11 Å²	11	51.7 Å²	51.7	6%	0.058	26%	0.264	C	S	.	.	H	α-helix	trans	-69.7	-42.1	175.4	-64.5	-178	0	0	0	113.9	S50 L51 V52 A58 H133 C136 L137	S50-L54 PolarHBondContact O-N 3.47Å; L51-L54 WeakPolarHBondContact O-CB 3.41Å; L51-L54 PolarHBondContact O-N 3.49Å; V52-L54 VanDerWaalsContact C-N 3.27Å; V52-L54 PolarHBondContact O-N 3.1Å; L54-A58 PolarHBondContact O-N 2.84Å; L54-H133 VanDerWaalsContact CD2-CE1 3.48Å; L54-H133 WeakPolarHBondContact CD2-CE1 3.21Å; L54-C136 HydrophobicContact CD1-CB 4.05Å; L54-L137 HydrophobicContact CD2-CD1 4.2Å; L54-L137 HydrophobicContact CD2-CD2 3.15Å; L54-L137 HydrophobicContact CD2-CG 3.43Å; L54-L137 VanDerWaalsContact CD2-CG 3.43Å
55	M	56	Low	54	Low	1 Å²	1	47.4 Å²	47.4	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-64.9	-48.7	176.7	-85.2	171.3	54.8	0	0	110.6	L51 V52 E59 Y106 S110 L282 L285	L51-M55 HydrophobicContact CD2-CG 4.06Å; L51-M55 HydrophobicContact CD2-SD 3.26Å; L51-M55 WeakPolarHBondContact CD2-SD 3.41Å; L51-M55 VanDerWaalsContact O-CB 3.24Å; L51-M55 WeakPolarHBondContact O-CB 3.44Å; L51-M55 VanDerWaalsContact O-CG 3.24Å; L51-M55 WeakPolarHBondContact O-CG 3.36Å; L51-M55 PolarHBondContact O-N 3.25Å; V52-M55 PolarHBondContact O-N 2.91Å; M55-E59 PolarHBondContact O-N 3.16Å; M55-Y106 VanDerWaalsContact C-OH 3.29Å; M55-Y106 WeakPolarHBondContact CA-OH 3.16Å; M55-Y106 HydrophobicContact CB-CE1 4.3Å; M55-Y106 WeakPolarHBondContact CB-OH 3.43Å; M55-Y106 HydrophobicContact CE-CD1 4.41Å; M55-Y106 HydrophobicContact CE-CE1 3.53Å; M55-Y106 HydrophobicContact CG-CE1 3.77Å; M55-Y106 WeakPolarHBondContact CG-OH 3.42Å; M55-Y106 PolarHBondContact O-OH 2.84Å; M55-Y106 HydrophobicContact SD-CE1 4.11Å; M55-S110 PolarHBondContact SD-OG 2.81Å; M55-L282 HydrophobicContact CE-CD2 3.94Å; M55-L282 HydrophobicContact SD-CD2 4.04Å; M55-L285 HydrophobicContact CE-CD2 3.44Å; M55-L285 VanDerWaalsContact CE-CD2 3.44Å; M55-L285 HydrophobicContact CE-CG 4.34Å
56	G	55.6	Low	55.1	Low	24 Å²	24	42.2 Å²	42.2	25%	0.247	22%	0.221	C	C	.	.	H	α-helix	trans	-60.5	-48.1	176.7	0	0	0	0	0	110.8	V52 A58 E59 F60	V52-G56 WeakPolarHBondContact O-CA 3.21Å; V52-G56 PolarHBondContact O-N 3.23Å; G56-A58 PolarHBondContact O-N 3.2Å; G56-E59 PolarHBondContact O-N 2.96Å; G56-F60 WeakPolarHBondContact O-CA 3.44Å; G56-F60 WeakPolarHBondContact O-CB 3.26Å; G56-F60 PolarHBondContact O-N 3.39Å
57	E	59	Low	56.5	Low	95 Å²	95	42 Å²	42	44%	0.444	22%	0.22	S	C	.	.	H	α-helix	trans	-60.6	-49.9	-178.7	-171.9	65	-149.5	0	0	112	D53 E59 F60 Q61	D53-E57 WeakPolarHBondContact O-CB 3.25Å; D53-E57 PolarHBondContact O-N 3.23Å; E57-E59 VanDerWaalsContact C-N 3.34Å; E57-E59 PolarHBondContact O-N 3.01Å; E57-F60 PolarHBondContact O-N 3.3Å; E57-Q61 HydrophobicContact CG-CG 4.27Å; E57-Q61 VanDerWaalsContact O-CB 3.31Å; E57-Q61 WeakPolarHBondContact O-CB 3.29Å; E57-Q61 WeakPolarHBondContact O-CG 3.31Å; E57-Q61 PolarHBondContact O-N 2.82Å; E57-Q61 WeakPolarHBondContact OE1-CG 3.22Å; E57-Q61 PolarHBondContact OE1-NE2 3.46Å
58	A	57.5	Low	57.7	Low	10 Å²	10	44 Å²	44	8%	0.083	23%	0.228	C	C	.	.	H	α-helix	trans	-62.9	-39.9	-178.1	0	0	0	0	0	112.8	L54 G56 R62 W198	L54-A58 PolarHBondContact O-N 2.84Å; G56-A58 PolarHBondContact O-N 3.2Å; A58-R62 PolarHBondContact O-N 2.95Å; A58-R62 VanDerWaalsContact O-N 3.15Å; A58-W198 HydrophobicContact CB-CZ2 4.12Å
59	E	61.6	Low	58.7	Low	13 Å²	13	42.3 Å²	42.3	6%	0.061	22%	0.216	C	C	.	.	H	α-helix	trans	-76	-35.3	176.2	-70.6	-56.2	138.1	0	0	112.7	M55 G56 E57 R62 I63 Y102 Y106 M289	M55-E59 PolarHBondContact O-N 3.16Å; G56-E59 PolarHBondContact O-N 2.96Å; E57-E59 VanDerWaalsContact C-N 3.34Å; E57-E59 PolarHBondContact O-N 3.01Å; E59-R62 WeakPolarHBondContact O-CB 3.43Å; E59-R62 PolarHBondContact O-N 3.07Å; E59-R62 IonicContact OE2-CZ 2.77Å; E59-R62 VanDerWaalsContact OE2-CZ 3.28Å; E59-R62 IonicContact OE2-NE 3.23Å; E59-R62 PolarHBondContact OE2-NE 3.16Å; E59-R62 IonicContact OE2-NH2 3.67Å; E59-R62 PolarHBondContact OE2-NH2 2.92Å; E59-I63 VanDerWaalsContact O-CG1 3.3Å; E59-I63 WeakPolarHBondContact O-CG1 3.46Å; E59-I63 PolarHBondContact O-N 3.4Å; E59-Y102 PolarHBondContact OE1-OH 3.18Å; E59-Y102 PolarHBondContact OE2-OH 3.47Å; E59-Y102 VanDerWaalsContact OE2-OH 3.08Å; E59-Y106 HydrophobicContact CG-CE2 3.58Å; E59-Y106 VanDerWaalsContact OE1-CE2 3.3Å; E59-Y106 WeakPolarHBondContact OE1-CE2 3.42Å; E59-M289 HydrophobicContact CG-CE 3.79Å
60	F	62.2	Low	59.4	Low	119 Å²	119	37.6 Å²	37.6	52%	0.522	21%	0.206	S	C	.	.	H	α-helix	trans	-63.9	-44.6	174.5	-179.1	-95.7	0	0	0	110.4	G56 E57 R62 I63 L64	G56-F60 WeakPolarHBondContact O-CA 3.44Å; G56-F60 WeakPolarHBondContact O-CB 3.26Å; G56-F60 PolarHBondContact O-N 3.39Å; E57-F60 PolarHBondContact O-N 3.3Å; F60-R62 VanDerWaalsContact C-N 3.31Å; F60-R62 PolarHBondContact O-N 2.77Å; F60-I63 PolarHBondContact O-N 3.47Å; F60-L64 HydrophobicContact CE1-CD2 4.37Å; F60-L64 VanDerWaalsContact O-CB 3.24Å; F60-L64 WeakPolarHBondContact O-CB 3.44Å; F60-L64 PolarHBondContact O-N 3.41Å
61	Q	58	Low	60.1	Low	56 Å²	56	44.8 Å²	44.8	26%	0.262	24%	0.236	S	C	.	.	H	α-helix	trans	-62.2	-37.9	174.4	-69.9	-63.5	-21.6	0	0	111.6	E57 L65 F144	E57-Q61 HydrophobicContact CG-CG 4.27Å; E57-Q61 VanDerWaalsContact O-CB 3.31Å; E57-Q61 WeakPolarHBondContact O-CB 3.29Å; E57-Q61 WeakPolarHBondContact O-CG 3.31Å; E57-Q61 PolarHBondContact O-N 2.82Å; E57-Q61 WeakPolarHBondContact OE1-CG 3.22Å; E57-Q61 PolarHBondContact OE1-NE2 3.46Å; Q61-L65 WeakPolarHBondContact O-CB 3.37Å; Q61-L65 PolarHBondContact O-N 3.24Å; Q61-F144 HydrophobicContact CB-CE1 4.09Å; Q61-F144 HydrophobicContact CB-CE2 4.23Å; Q61-F144 HydrophobicContact CB-CZ 3.68Å
62	R	71.7	Confident	60.7	Low	4 Å²	4	49 Å²	49	2%	0.015	26%	0.259	C	S	.	.	H	α-helix	trans	-62.9	-47.2	171.7	177.7	176.4	74.2	92.5	9.4	112	A58 E59 F60 L64 L65 L66 F144 W147 R201 E293	A58-R62 PolarHBondContact O-N 2.95Å; A58-R62 VanDerWaalsContact O-N 3.15Å; E59-R62 WeakPolarHBondContact O-CB 3.43Å; E59-R62 PolarHBondContact O-N 3.07Å; E59-R62 IonicContact OE2-CZ 2.77Å; E59-R62 VanDerWaalsContact OE2-CZ 3.28Å; E59-R62 IonicContact OE2-NE 3.23Å; E59-R62 PolarHBondContact OE2-NE 3.16Å; E59-R62 IonicContact OE2-NH2 3.67Å; E59-R62 PolarHBondContact OE2-NH2 2.92Å; F60-R62 VanDerWaalsContact C-N 3.31Å; F60-R62 PolarHBondContact O-N 2.77Å; R62-L64 VanDerWaalsContact C-N 3.33Å; R62-L65 PolarHBondContact O-N 3.01Å; R62-L66 HydrophobicContact CG-CD1 3.99Å; R62-L66 WeakPolarHBondContact O-CD1 3.48Å; R62-L66 VanDerWaalsContact O-CG 3.29Å; R62-L66 WeakPolarHBondContact O-CG 3.39Å; R62-L66 PolarHBondContact O-N 2.95Å; R62-L66 VanDerWaalsContact O-N 3.14Å; R62-F144 HydrophobicContact CB-CE2 4.27Å; R62-W147 HydrophobicContact CB-CH2 4.36Å; R62-W147 HydrophobicContact CB-CZ3 4.25Å; R62-W147 HydrophobicContact CG-CH2 3.47Å; R62-W147 VanDerWaalsContact CG-CH2 3.47Å; R62-W147 HydrophobicContact CG-CZ2 4.15Å; R62-W147 HydrophobicContact CG-CZ3 3.85Å; R62-R201 VanDerWaalsContact NH1-NH1 3.14Å; R62-E293 IonicContact CZ-OE1 3.06Å; R62-E293 IonicContact CZ-OE2 3.38Å; R62-E293 IonicContact NH1-OE1 2.7Å; R62-E293 IonicContact NH1-OE2 3.56Å; R62-E293 PolarHBondContact NH1-OE2 3.48Å; R62-E293 VanDerWaalsContact NH1-OE2 3.12Å; R62-E293 VanDerWaalsContact NH2-CD 3.29Å; R62-E293 IonicContact NH2-OE1 2.63Å; R62-E293 PolarHBondContact NH2-OE1 3.41Å; R62-E293 IonicContact NH2-OE2 3.47Å
63	I	63.7	Low	61.4	Low	67 Å²	67	48.8 Å²	48.8	34%	0.344	26%	0.257	S	S	.	.	H	α-helix	trans	-62.8	-45.4	178.7	-69.7	164.9	0	0	0	109.7	E59 F60 L65 L66 T67	E59-I63 VanDerWaalsContact O-CG1 3.3Å; E59-I63 WeakPolarHBondContact O-CG1 3.46Å; E59-I63 PolarHBondContact O-N 3.4Å; F60-I63 PolarHBondContact O-N 3.47Å; I63-L65 PolarHBondContact O-N 2.92Å; I63-L66 PolarHBondContact O-N 3.02Å; I63-L66 VanDerWaalsContact O-N 3.13Å; I63-T67 HydrophobicContact CG2-CG2 4.36Å; I63-T67 WeakPolarHBondContact O-CG2 3.24Å; I63-T67 PolarHBondContact O-N 3.22Å; I63-T67 PolarHBondContact O-OG1 2.98Å
64	L	58.3	Low	61.7	Low	67 Å²	67	48.4 Å²	48.4	35%	0.351	25%	0.254	S	S	.	.	H	α-helix	trans	-57.2	-51.7	177.9	-175.1	64.1	0	0	0	110.5	F60 R62 L66 T67 T68	F60-L64 HydrophobicContact CE1-CD2 4.37Å; F60-L64 VanDerWaalsContact O-CB 3.24Å; F60-L64 WeakPolarHBondContact O-CB 3.44Å; F60-L64 PolarHBondContact O-N 3.41Å; R62-L64 VanDerWaalsContact C-N 3.33Å; L64-L66 PolarHBondContact O-N 2.78Å; L64-T67 WeakPolarHBondContact CA-OG1 3.46Å; L64-T67 CarbonylContact O-C 3.58Å; L64-T67 WeakPolarHBondContact O-CA 3.49Å; L64-T67 PolarHBondContact O-N 3.33Å; L64-T67 PolarHBondContact O-OG1 3.46Å; L64-T68 HydrophobicContact CD1-CG2 4.12Å; L64-T68 HydrophobicContact CG-CG2 4.15Å; L64-T68 WeakPolarHBondContact O-CG2 3.47Å; L64-T68 PolarHBondContact O-N 3.49Å; L64-T68 PolarHBondContact O-OG1 3.4Å
65	L	66.4	Low	62.2	Low	1 Å²	1	51 Å²	51	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-50.4	-45.6	175	175	56.2	0	0	0	112.1	Q61 R62 I63 T67 T68 L69 W147 A148 L152 L162 Y166	Q61-L65 WeakPolarHBondContact O-CB 3.37Å; Q61-L65 PolarHBondContact O-N 3.24Å; R62-L65 PolarHBondContact O-N 3.01Å; I63-L65 PolarHBondContact O-N 2.92Å; L65-T67 VanDerWaalsContact C-N 3.31Å; L65-T67 PolarHBondContact O-N 3.1Å; L65-T68 WeakPolarHBondContact CA-OG1 3.23Å; L65-T68 PolarHBondContact O-N 2.94Å; L65-T68 PolarHBondContact O-OG1 3.27Å; L65-L69 WeakPolarHBondContact O-CG 3.1Å; L65-W147 HydrophobicContact CD2-CH2 4.21Å; L65-W147 HydrophobicContact CD2-CZ3 3.88Å; L65-A148 HydrophobicContact CD2-CB 3.86Å; L65-L152 HydrophobicContact CD1-CD1 4.41Å; L65-L152 HydrophobicContact CD1-CD2 4.41Å; L65-L162 HydrophobicContact CD1-CD1 4.41Å; L65-L162 HydrophobicContact CD1-CD2 3.9Å; L65-L162 HydrophobicContact CD1-CG 4.35Å; L65-Y166 HydrophobicContact CD1-CD2 4.3Å; L65-Y166 HydrophobicContact CD1-CE2 3.44Å; L65-Y166 VanDerWaalsContact CD1-CE2 3.44Å; L65-Y166 HydrophobicContact CD2-CE2 4.22Å; L65-Y166 HydrophobicContact CG-CE2 4.37Å
66	L	60.8	Low	62.6	Low	19 Å²	19	54 Å²	54	10%	0.099	28%	0.283	C	S	.	.	H	α-helix	trans	-70.4	-29.4	-179.4	-68.1	165	0	0	0	112.5	R62 I63 L64 Q74 Y151 R296	R62-L66 HydrophobicContact CG-CD1 3.99Å; R62-L66 WeakPolarHBondContact O-CD1 3.48Å; R62-L66 VanDerWaalsContact O-CG 3.29Å; R62-L66 WeakPolarHBondContact O-CG 3.39Å; R62-L66 PolarHBondContact O-N 2.95Å; R62-L66 VanDerWaalsContact O-N 3.14Å; I63-L66 PolarHBondContact O-N 3.02Å; I63-L66 VanDerWaalsContact O-N 3.13Å; L64-L66 PolarHBondContact O-N 2.78Å; L66-Q74 PolarHBondContact O-NE2 3.12Å; L66-Y151 HydrophobicContact CD2-CD1 4.47Å; L66-Y151 HydrophobicContact CD2-CE1 3.45Å; L66-Y151 VanDerWaalsContact CD2-CE1 3.45Å; L66-Y151 VanDerWaalsContact CD2-OH 3.24Å; L66-Y151 WeakPolarHBondContact CD2-OH 3.24Å; L66-R296 VanDerWaalsContact CD1-CZ 3.5Å
67	T	64.9	Low	63	Low	87 Å²	87	53 Å²	53	53%	0.534	27%	0.272	S	S	.	.	H	α-helix	trans	-85.1	-23	177	59.1	0	0	0	0	114.1	I63 L64 L65 L69	I63-T67 HydrophobicContact CG2-CG2 4.36Å; I63-T67 WeakPolarHBondContact O-CG2 3.24Å; I63-T67 PolarHBondContact O-N 3.22Å; I63-T67 PolarHBondContact O-OG1 2.98Å; L64-T67 WeakPolarHBondContact CA-OG1 3.46Å; L64-T67 CarbonylContact O-C 3.58Å; L64-T67 WeakPolarHBondContact O-CA 3.49Å; L64-T67 PolarHBondContact O-N 3.33Å; L64-T67 PolarHBondContact O-OG1 3.46Å; L65-T67 VanDerWaalsContact C-N 3.31Å; L65-T67 PolarHBondContact O-N 3.1Å; T67-L69 VanDerWaalsContact C-N 3.3Å
68	T	63	Low	63	Low	77 Å²	77	49.6 Å²	49.6	47%	0.472	26%	0.256	S	S	.	.	H	α-helix	trans	-75.6	-20.4	178.1	47.7	0	0	0	0	112.8	L64 L65	L64-T68 HydrophobicContact CD1-CG2 4.12Å; L64-T68 HydrophobicContact CG-CG2 4.15Å; L64-T68 WeakPolarHBondContact O-CG2 3.47Å; L64-T68 PolarHBondContact O-N 3.49Å; L64-T68 PolarHBondContact O-OG1 3.4Å; L65-T68 WeakPolarHBondContact CA-OG1 3.23Å; L65-T68 PolarHBondContact O-N 2.94Å; L65-T68 PolarHBondContact O-OG1 3.27Å
69	L	60	Low	63	Low	5 Å²	5	51.8 Å²	51.8	3%	0.026	27%	0.266	C	S	.	.	S	Bend	trans	-67	131.9	176.6	-68.8	162.8	0	0	0	110.6	L65 T67 E73 Q74 M77 L152 L162	L65-L69 WeakPolarHBondContact O-CG 3.1Å; T67-L69 VanDerWaalsContact C-N 3.3Å; L69-E73 HydrophobicContact CD2-CG 4.04Å; L69-Q74 HydrophobicContact CB-CG 3.77Å; L69-Q74 PolarHBondContact O-NE2 2.67Å; L69-M77 HydrophobicContact CD1-CE 3.91Å; L69-M77 HydrophobicContact CD1-SD 3.51Å; L69-M77 VanDerWaalsContact CD1-SD 3.51Å; L69-M77 HydrophobicContact CD2-SD 4.05Å; L69-M77 HydrophobicContact CG-SD 4.33Å; L69-L152 HydrophobicContact CD2-CD2 4.06Å; L69-L162 HydrophobicContact CD2-CD2 3.72Å; L69-L162 HydrophobicContact CG-CD2 4.43Å
70	P	65.6	Low	62.8	Low	56 Å²	56	54.3 Å²	54.3	36%	0.364	28%	0.278	S	S	.	.			trans	-48.5	149.1	168.7	-26.1	32.6	0	0	0	112.5	D72 E73 Q74	P70-D72 VanDerWaalsContact C-N 3.33Å; P70-D72 WeakPolarHBondContact CB-OD1 3.33Å; P70-D72 PolarHBondContact O-N 3.29Å; P70-E73 HydrophobicContact CB-CB 3.96Å; P70-E73 VanDerWaalsContact CD-OE2 3.24Å; P70-E73 WeakPolarHBondContact CD-OE2 3.3Å; P70-E73 HydrophobicContact CG-CB 4.21Å; P70-E73 CarbonylContact O-C 3.59Å; P70-E73 WeakPolarHBondContact O-CA 3.39Å; P70-E73 WeakPolarHBondContact O-CB 3.24Å; P70-E73 PolarHBondContact O-N 2.93Å; P70-E73 VanDerWaalsContact O-N 3.08Å; P70-Q74 WeakPolarHBondContact O-CG 3.29Å; P70-Q74 PolarHBondContact O-N 3.08Å
71	K	68.3	Low	62.4	Low	158 Å²	158	48.9 Å²	48.9	69%	0.687	26%	0.255	S	S	*	.	H	α-helix	trans	-61.3	-42.1	-177.6	-75.5	-176.2	179.6	176.5	0	112.4	E73 Q74 I75	K71-E73 VanDerWaalsContact C-N 3.3Å; K71-Q74 PolarHBondContact O-N 3.06Å; K71-I75 WeakPolarHBondContact O-CB 3.4Å; K71-I75 WeakPolarHBondContact O-CD1 3.38Å; K71-I75 WeakPolarHBondContact O-CG1 3.39Å; K71-I75 PolarHBondContact O-N 2.93Å
72	D	64.1	Low	62.1	Low	95 Å²	95	48.1 Å²	48.1	51%	0.508	25%	0.252	S	S	.	.	H	α-helix	trans	-63.3	-36.6	174.4	56.8	-50.9	0	0	0	111.7	P70 I75 N76	P70-D72 VanDerWaalsContact C-N 3.33Å; P70-D72 WeakPolarHBondContact CB-OD1 3.33Å; P70-D72 PolarHBondContact O-N 3.29Å; D72-I75 PolarHBondContact O-N 3.46Å; D72-N76 VanDerWaalsContact O-CB 3.27Å; D72-N76 WeakPolarHBondContact O-CB 3.49Å; D72-N76 VanDerWaalsContact O-CG 3.22Å; D72-N76 PolarHBondContact O-N 3.23Å; D72-N76 PolarHBondContact O-ND2 2.68Å
73	E	62.6	Low	61.3	Low	3 Å²	3	54.7 Å²	54.7	1%	0.014	29%	0.287	C	S	.	.	H	α-helix	trans	-67.7	-45.3	173.1	-172.3	162.2	-172.7	0	0	111.6	L69 P70 K71 I75 N76 M77 A157 T158 D159	L69-E73 HydrophobicContact CD2-CG 4.04Å; P70-E73 HydrophobicContact CB-CB 3.96Å; P70-E73 VanDerWaalsContact CD-OE2 3.24Å; P70-E73 WeakPolarHBondContact CD-OE2 3.3Å; P70-E73 HydrophobicContact CG-CB 4.21Å; P70-E73 CarbonylContact O-C 3.59Å; P70-E73 WeakPolarHBondContact O-CA 3.39Å; P70-E73 WeakPolarHBondContact O-CB 3.24Å; P70-E73 PolarHBondContact O-N 2.93Å; P70-E73 VanDerWaalsContact O-N 3.08Å; K71-E73 VanDerWaalsContact C-N 3.3Å; E73-I75 VanDerWaalsContact C-N 3.26Å; E73-I75 PolarHBondContact O-N 2.86Å; E73-N76 PolarHBondContact O-N 3.34Å; E73-M77 HydrophobicContact CG-CG 4.21Å; E73-M77 HydrophobicContact CG-SD 4Å; E73-M77 WeakPolarHBondContact O-CB 3.43Å; E73-M77 WeakPolarHBondContact O-CG 3.43Å; E73-M77 PolarHBondContact O-N 3.48Å; E73-A157 VanDerWaalsContact OE1-C 3.23Å; E73-A157 WeakPolarHBondContact OE1-CA 3.23Å; E73-A157 VanDerWaalsContact OE1-CB 3.23Å; E73-A157 WeakPolarHBondContact OE1-CB 3.34Å; E73-T158 WeakPolarHBondContact CB-OG1 3.49Å; E73-T158 VanDerWaalsContact CG-OG1 3.24Å; E73-T158 WeakPolarHBondContact CG-OG1 3.3Å; E73-T158 PolarHBondContact OE1-N 3.31Å; E73-T158 PolarHBondContact OE1-OG1 3.44Å; E73-T158 PolarHBondContact OE2-OG1 2.98Å; E73-D159 PolarHBondContact OE1-N 3.36Å; E73-D159 WeakPolarHBondContact OE2-CB 3.42Å; E73-D159 PolarHBondContact OE2-N 2.76Å
74	Q	64.5	Low	60.8	Low	48 Å²	48	57.5 Å²	57.5	22%	0.224	30%	0.297	C	S	.	.	H	α-helix	trans	-56	-43.8	171.6	-67	176.6	33.6	0	0	110.9	L66 L69 P70 K71 I78	L66-Q74 PolarHBondContact O-NE2 3.12Å; L69-Q74 HydrophobicContact CB-CG 3.77Å; L69-Q74 PolarHBondContact O-NE2 2.67Å; P70-Q74 WeakPolarHBondContact O-CG 3.29Å; P70-Q74 PolarHBondContact O-N 3.08Å; K71-Q74 PolarHBondContact O-N 3.06Å; Q74-I78 WeakPolarHBondContact O-CB 3.44Å; Q74-I78 VanDerWaalsContact O-CD1 3.23Å; Q74-I78 WeakPolarHBondContact O-CD1 3.23Å; Q74-I78 WeakPolarHBondContact O-CG1 3.35Å; Q74-I78 PolarHBondContact O-N 3.46Å
75	I	62.5	Low	60.5	Low	67 Å²	67	58.3 Å²	58.3	34%	0.344	30%	0.302	S	S	.	.	H	α-helix	trans	-64.1	-46	176.6	-69	161.1	0	0	0	111.2	K71 D72 E73 I78 I79 L304	K71-I75 WeakPolarHBondContact O-CB 3.4Å; K71-I75 WeakPolarHBondContact O-CD1 3.38Å; K71-I75 WeakPolarHBondContact O-CG1 3.39Å; K71-I75 PolarHBondContact O-N 2.93Å; D72-I75 PolarHBondContact O-N 3.46Å; E73-I75 VanDerWaalsContact C-N 3.26Å; E73-I75 PolarHBondContact O-N 2.86Å; I75-I78 WeakPolarHBondContact O-CB 3.41Å; I75-I78 PolarHBondContact O-N 3.36Å; I75-I79 HydrophobicContact CG2-CD1 3.7Å; I75-I79 HydrophobicContact CG2-CG1 4.32Å; I75-I79 VanDerWaalsContact O-CG1 3.28Å; I75-I79 WeakPolarHBondContact O-CG1 3.24Å; I75-I79 PolarHBondContact O-N 3.43Å; I75-L304 HydrophobicContact CB-CD2 4.19Å; I75-L304 HydrophobicContact CG1-CD2 3.55Å; I75-L304 HydrophobicContact CG2-CD2 4.27Å
76	N	63.5	Low	59.4	Low	62 Å²	62	63.8 Å²	63.8	33%	0.332	34%	0.34	S	S	.	.	H	α-helix	trans	-66.8	-44.2	-179	-79.8	-20.2	0	0	0	111.9	D72 E73 I78 I79 Q80	D72-N76 VanDerWaalsContact O-CB 3.27Å; D72-N76 WeakPolarHBondContact O-CB 3.49Å; D72-N76 VanDerWaalsContact O-CG 3.22Å; D72-N76 PolarHBondContact O-N 3.23Å; D72-N76 PolarHBondContact O-ND2 2.68Å; E73-N76 PolarHBondContact O-N 3.34Å; N76-I78 PolarHBondContact O-N 3.09Å; N76-I79 PolarHBondContact O-N 2.79Å; N76-I79 VanDerWaalsContact O-N 3.13Å; N76-Q80 WeakPolarHBondContact O-CG 3.43Å; N76-Q80 PolarHBondContact O-N 3.35Å
77	M	64.6	Low	58.6	Low	4 Å²	4	68.4 Å²	68.4	2%	0.02	37%	0.37	C	S	.	.	H	α-helix	trans	-54.5	-44.4	172.8	-76.4	177.4	78.7	0	0	110.2	L69 E73 A81 Y151 L152 N155	L69-M77 HydrophobicContact CD1-CE 3.91Å; L69-M77 HydrophobicContact CD1-SD 3.51Å; L69-M77 VanDerWaalsContact CD1-SD 3.51Å; L69-M77 HydrophobicContact CD2-SD 4.05Å; L69-M77 HydrophobicContact CG-SD 4.33Å; E73-M77 HydrophobicContact CG-CG 4.21Å; E73-M77 HydrophobicContact CG-SD 4Å; E73-M77 WeakPolarHBondContact O-CB 3.43Å; E73-M77 WeakPolarHBondContact O-CG 3.43Å; E73-M77 PolarHBondContact O-N 3.48Å; M77-A81 WeakPolarHBondContact O-CB 3.41Å; M77-A81 PolarHBondContact O-N 3.38Å; M77-A81 VanDerWaalsContact O-N 3.15Å; M77-Y151 HydrophobicContact CE-CD1 3.84Å; M77-Y151 HydrophobicContact CE-CE1 3.32Å; M77-L152 HydrophobicContact CE-CD2 4.26Å; M77-N155 WeakPolarHBondContact CA-O 3.24Å; M77-N155 HydrophobicContact CB-CB 3.63Å; M77-N155 HydrophobicContact CE-CB 3.51Å; M77-N155 HydrophobicContact CG-CB 3.59Å; M77-N155 VanDerWaalsContact CG-O 3.3Å; M77-N155 WeakPolarHBondContact CG-O 3.39Å; M77-N155 HydrophobicContact SD-CB 4.4Å
78	I	59	Low	57.4	Low	23 Å²	23	71.2 Å²	71.2	12%	0.118	38%	0.381	C	S	.	.	H	α-helix	trans	-64.6	-51.9	175	-68.2	163.6	0	0	0	110.5	Q74 I75 N76 Q80 A81 M82 I212 L304	Q74-I78 WeakPolarHBondContact O-CB 3.44Å; Q74-I78 VanDerWaalsContact O-CD1 3.23Å; Q74-I78 WeakPolarHBondContact O-CD1 3.23Å; Q74-I78 WeakPolarHBondContact O-CG1 3.35Å; Q74-I78 PolarHBondContact O-N 3.46Å; I75-I78 WeakPolarHBondContact O-CB 3.41Å; I75-I78 PolarHBondContact O-N 3.36Å; N76-I78 PolarHBondContact O-N 3.09Å; I78-Q80 PolarHBondContact O-N 3.45Å; I78-A81 CarbonylContact O-C 3.54Å; I78-A81 WeakPolarHBondContact O-CA 3.3Å; I78-A81 WeakPolarHBondContact O-CB 3.45Å; I78-A81 PolarHBondContact O-N 3.33Å; I78-M82 HydrophobicContact CG2-CG 4.35Å; I78-M82 HydrophobicContact CG2-SD 4.42Å; I78-M82 WeakPolarHBondContact O-CG 3.44Å; I78-M82 PolarHBondContact O-N 3.08Å; I78-I212 HydrophobicContact CG2-CB 4.28Å; I78-I212 HydrophobicContact CG2-CG2 3.42Å; I78-I212 VanDerWaalsContact CG2-CG2 3.42Å; I78-L304 HydrophobicContact CB-CD1 4.26Å; I78-L304 HydrophobicContact CD1-CD1 3.83Å; I78-L304 HydrophobicContact CD1-CD2 4.12Å; I78-L304 HydrophobicContact CD1-CG 4.38Å; I78-L304 HydrophobicContact CG2-CD1 3.52Å
79	I	58.1	Low	56.2	Low	57 Å²	57	72.8 Å²	72.8	29%	0.292	39%	0.394	S	S	.	.	H	α-helix	trans	-53.2	-48.3	179.8	-71.6	167.3	0	0	0	111.9	I75 N76 A81 M82 D83 R216	I75-I79 HydrophobicContact CG2-CD1 3.7Å; I75-I79 HydrophobicContact CG2-CG1 4.32Å; I75-I79 VanDerWaalsContact O-CG1 3.28Å; I75-I79 WeakPolarHBondContact O-CG1 3.24Å; I75-I79 PolarHBondContact O-N 3.43Å; N76-I79 PolarHBondContact O-N 2.79Å; N76-I79 VanDerWaalsContact O-N 3.13Å; I79-A81 VanDerWaalsContact C-N 3.26Å; I79-A81 PolarHBondContact O-N 2.68Å; I79-M82 HydrophobicContact CG1-SD 4.41Å; I79-M82 WeakPolarHBondContact O-CA 3.32Å; I79-M82 WeakPolarHBondContact O-CB 3.31Å; I79-M82 PolarHBondContact O-N 3.48Å; I79-D83 PolarHBondContact O-N 2.79Å; I79-D83 VanDerWaalsContact O-N 3.13Å; I79-R216 VanDerWaalsContact CG1-NH2 3.27Å
80	Q	57.7	Low	55.9	Low	65 Å²	65	74.8 Å²	74.8	30%	0.304	41%	0.408	S	S	.	.	H	α-helix	trans	-65.4	-32.9	179.4	-70.3	179.6	17.6	0	0	112.7	N76 I78 M82 D83 N155	N76-Q80 WeakPolarHBondContact O-CG 3.43Å; N76-Q80 PolarHBondContact O-N 3.35Å; I78-Q80 PolarHBondContact O-N 3.45Å; Q80-M82 VanDerWaalsContact C-N 3.25Å; Q80-D83 PolarHBondContact O-N 3.25Å; Q80-N155 PolarHBondContact OE1-O 3.09Å; Q80-N155 VanDerWaalsContact OE1-O 3.06Å
81	A	53.2	Low	55.6	Low	5 Å²	5	73.3 Å²	73.3	4%	0.041	40%	0.396	C	S	.	.	H	α-helix	trans	-71.3	-24.4	172.9	0	0	0	0	0	111.7	M77 I78 I79 S209	M77-A81 WeakPolarHBondContact O-CB 3.41Å; M77-A81 PolarHBondContact O-N 3.38Å; M77-A81 VanDerWaalsContact O-N 3.15Å; I78-A81 CarbonylContact O-C 3.54Å; I78-A81 WeakPolarHBondContact O-CA 3.3Å; I78-A81 WeakPolarHBondContact O-CB 3.45Å; I78-A81 PolarHBondContact O-N 3.33Å; I79-A81 VanDerWaalsContact C-N 3.26Å; I79-A81 PolarHBondContact O-N 2.68Å; A81-S209 VanDerWaalsContact CB-CB 3.47Å
82	M	52	Low	55.4	Low	40 Å²	40	69.1 Å²	69.1	20%	0.197	39%	0.385	C	S	.	.	H	α-helix	trans	-69.5	-40.5	171	-49.4	177.7	40.3	0	0	113.1	I78 I79 Q80 K84 D85 A213 R216	I78-M82 HydrophobicContact CG2-CG 4.35Å; I78-M82 HydrophobicContact CG2-SD 4.42Å; I78-M82 WeakPolarHBondContact O-CG 3.44Å; I78-M82 PolarHBondContact O-N 3.08Å; I79-M82 HydrophobicContact CG1-SD 4.41Å; I79-M82 WeakPolarHBondContact O-CA 3.32Å; I79-M82 WeakPolarHBondContact O-CB 3.31Å; I79-M82 PolarHBondContact O-N 3.48Å; Q80-M82 VanDerWaalsContact C-N 3.25Å; M82-K84 PolarHBondContact O-N 3.21Å; M82-K84 VanDerWaalsContact O-N 3.15Å; M82-D85 PolarHBondContact O-N 2.74Å; M82-A213 HydrophobicContact CB-CB 3.52Å; M82-A213 HydrophobicContact CE-CB 4.44Å; M82-A213 HydrophobicContact CG-CB 3.47Å; M82-A213 VanDerWaalsContact CG-CB 3.47Å; M82-R216 PolarHBondContact SD-NH1 2.92Å
83	D	55.4	Low	55.9	Low	142 Å²	142	71.9 Å²	71.9	76%	0.759	39%	0.393	S	S	*	.	H	α-helix	trans	-64.5	-18.4	-178.4	-79.1	-13.8	0	0	0	112.6	I79 Q80	I79-D83 PolarHBondContact O-N 2.79Å; I79-D83 VanDerWaalsContact O-N 3.13Å; Q80-D83 PolarHBondContact O-N 3.25Å
84	K	53.2	Low	56.6	Low	127 Å²	127	76.3 Å²	76.3	55%	0.552	41%	0.413	S	S	*	.	H	α-helix	trans	-85.9	-25.3	-176.7	-80.9	178.1	-179.4	164.2	0	115.4	M82 K154	M82-K84 PolarHBondContact O-N 3.21Å; M82-K84 VanDerWaalsContact O-N 3.15Å; K84-K154 PolarHBondContact NZ-O 2.77Å
85	D	50.2	Low	57.4	Low	84 Å²	84	74 Å²	74	45%	0.449	40%	0.403	S	S	.	.			trans	-147	82.8	-168.3	-77.3	-46.7	0	0	0	114.2	M82 A210	M82-D85 PolarHBondContact O-N 2.74Å; D85-A210 HydrophobicContact CB-CB 4.06Å
86	S	44.7	Very low	58.5	Low	116 Å²	116	76.5 Å²	76.5	81%	0.811	41%	0.411	S	S	*	.			trans	-106	67.6	171	70.9	0	0	0	0	112.1
87	T	42.8	Very low	59.6	Low	116 Å²	116	76.7 Å²	76.7	71%	0.712	42%	0.415	S	S	*	.			trans	-139.6	119.5	166.8	54.5	0	0	0	0	113.9
88	N	40.5	Very low	60.8	Low	145 Å²	145	80.4 Å²	80.4	78%	0.775	43%	0.428	S	S	*	.			trans	82.2	140.7	144.2	-134	-3.3	0	0	0	122.3	S90 F91	N88-S90 PolarHBondContact O-N 2.88Å; N88-F91 WeakPolarHBondContact O-CD2 3.45Å; N88-F91 WeakPolarHBondContact O-CE2 3.26Å
89	C	38.2	Very low	62.1	Low	110 Å²	110	79.7 Å²	79.7	74%	0.743	43%	0.425	S	S	*	.	S	Bend	trans	-82.8	88.7	-164.5	-179.9	0	0	0	0	113.8
90	S	54.5	Low	63.5	Low	47 Å²	47	80.9 Å²	80.9	33%	0.329	43%	0.432	S	S	.	.			trans	-160.1	14.8	167.5	174.6	0	0	0	0	112.5	N88 K93 H94	N88-S90 PolarHBondContact O-N 2.88Å; S90-K93 PolarHBondContact O-N 3.28Å; S90-H94 VanDerWaalsContact CB-CD2 3.44Å; S90-H94 WeakPolarHBondContact CB-CD2 3.36Å; S90-H94 VanDerWaalsContact CB-NE2 3.33Å; S90-H94 WeakPolarHBondContact CB-NE2 3.49Å; S90-H94 PolarHBondContact O-CD2 3.16Å; S90-H94 PolarHBondContact O-N 3.33Å; S90-H94 VanDerWaalsContact O-N 3.16Å; S90-H94 PolarHBondContact OG-CD2 3.25Å; S90-H94 PolarHBondContact OG-NE2 2.59Å
91	F	57.4	Low	65.1	Low	25 Å²	25	80.1 Å²	80.1	11%	0.11	43%	0.43	C	S	.	.	H	α-helix	trans	-59.8	-42.2	-162.6	-101.1	-75.2	0	0	0	115.9	N88 K93 H94 L95 V207 A210 Y211 E214	N88-F91 WeakPolarHBondContact O-CD2 3.45Å; N88-F91 WeakPolarHBondContact O-CE2 3.26Å; F91-K93 VanDerWaalsContact C-N 3.25Å; F91-K93 PolarHBondContact O-N 3.35Å; F91-H94 PolarHBondContact O-N 2.97Å; F91-L95 VanDerWaalsContact O-CB 3.31Å; F91-L95 WeakPolarHBondContact O-CB 3.34Å; F91-L95 PolarHBondContact O-N 2.89Å; F91-V207 HydrophobicContact CD1-CG1 4.45Å; F91-A210 HydrophobicContact CE1-CB 3.46Å; F91-A210 VanDerWaalsContact CE1-CB 3.46Å; F91-A210 HydrophobicContact CZ-CB 3.54Å; F91-Y211 HydrophobicContact CB-CD2 3.87Å; F91-Y211 HydrophobicContact CB-CE2 4.38Å; F91-Y211 HydrophobicContact CD1-CD2 4.33Å; F91-Y211 HydrophobicContact CG-CD2 4.46Å; F91-E214 VanDerWaalsContact CB-OE2 3.28Å; F91-E214 WeakPolarHBondContact CB-OE2 3.35Å; F91-E214 WeakPolarHBondContact CD2-OE2 3.44Å; F91-E214 VanDerWaalsContact CG-OE2 3.3Å; F91-E214 WeakPolarHBondContact CG-OE2 3.48Å
92	P	65.7	Low	66.8	Low	71 Å²	71	80.3 Å²	80.3	46%	0.461	43%	0.429	S	S	.	.	H	α-helix	trans	-60.6	-33.1	176.3	-24.2	33.2	0	0	0	113.5	K96 Y211	P92-K96 WeakPolarHBondContact O-CB 3.2Å; P92-K96 VanDerWaalsContact O-CG 3.29Å; P92-K96 WeakPolarHBondContact O-CG 3.48Å; P92-K96 PolarHBondContact O-N 2.75Å; P92-K96 VanDerWaalsContact O-N 3.1Å; P92-Y211 HydrophobicContact CG-CE2 4.25Å
93	K	73.5	Confident	68.5	Low	152 Å²	152	80.4 Å²	80.4	66%	0.661	43%	0.429	S	S	*	.	H	α-helix	trans	-74.2	-42.6	177.7	-170.8	178.3	-179.9	-178.9	0	110.6	S90 F91 T97	S90-K93 PolarHBondContact O-N 3.28Å; F91-K93 VanDerWaalsContact C-N 3.25Å; F91-K93 PolarHBondContact O-N 3.35Å; K93-T97 WeakPolarHBondContact O-CB 3.39Å; K93-T97 PolarHBondContact O-N 2.87Å; K93-T97 PolarHBondContact O-OG1 3.13Å
94	H	78.4	Confident	70.1	Confident	97 Å²	97	80.4 Å²	80.4	45%	0.449	42%	0.419	S	S	.	.	H	α-helix	trans	-63.7	-43.4	175.3	-69.2	-64.4	0	0	0	111.9	S90 F91 T97 R98 V207	S90-H94 VanDerWaalsContact CB-CD2 3.44Å; S90-H94 WeakPolarHBondContact CB-CD2 3.36Å; S90-H94 VanDerWaalsContact CB-NE2 3.33Å; S90-H94 WeakPolarHBondContact CB-NE2 3.49Å; S90-H94 PolarHBondContact O-CD2 3.16Å; S90-H94 PolarHBondContact O-N 3.33Å; S90-H94 VanDerWaalsContact O-N 3.16Å; S90-H94 PolarHBondContact OG-CD2 3.25Å; S90-H94 PolarHBondContact OG-NE2 2.59Å; F91-H94 PolarHBondContact O-N 2.97Å; H94-T97 PolarHBondContact O-N 2.85Å; H94-R98 WeakPolarHBondContact O-CG 3.42Å; H94-R98 PolarHBondContact O-N 3.17Å; H94-V207 HydrophobicContact CB-CG1 4.31Å
95	L	81.4	Confident	71.8	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-59.2	-51.7	176.8	-175	65.6	0	0	0	111.2	F91 T97 R98 I99 L204 V207 Y211 F294 I297	F91-L95 VanDerWaalsContact O-CB 3.31Å; F91-L95 WeakPolarHBondContact O-CB 3.34Å; F91-L95 PolarHBondContact O-N 2.89Å; L95-T97 VanDerWaalsContact C-N 3.29Å; L95-T97 PolarHBondContact O-N 2.96Å; L95-R98 PolarHBondContact O-N 2.96Å; L95-R98 VanDerWaalsContact O-N 3.13Å; L95-I99 HydrophobicContact CD1-CD1 4.35Å; L95-I99 HydrophobicContact CG-CD1 3.97Å; L95-I99 WeakPolarHBondContact O-CG1 3.38Å; L95-I99 PolarHBondContact O-N 2.9Å; L95-L204 HydrophobicContact CD1-CD1 4Å; L95-V207 HydrophobicContact CB-CG1 4.25Å; L95-V207 HydrophobicContact CD1-CG1 4.15Å; L95-Y211 HydrophobicContact CD2-CD1 4.1Å; L95-Y211 HydrophobicContact CD2-CD2 4.11Å; L95-Y211 HydrophobicContact CD2-CE1 4.23Å; L95-Y211 HydrophobicContact CD2-CE2 4.32Å; L95-Y211 HydrophobicContact CD2-CG 4.05Å; L95-F294 HydrophobicContact CD2-CD2 4.36Å; L95-F294 HydrophobicContact CD2-CE2 4.34Å; L95-I297 HydrophobicContact CD1-CD1 3.77Å; L95-I297 HydrophobicContact CD1-CG2 4.47Å; L95-I297 HydrophobicContact CD2-CD1 4.43Å; L95-I297 HydrophobicContact CD2-CG2 3.85Å; L95-I297 HydrophobicContact CG-CD1 4.45Å
96	K	83.7	Confident	73.4	Confident	118 Å²	118	70.6 Å²	70.6	51%	0.513	37%	0.373	S	S	.	.	H	α-helix	trans	-57.9	-41.2	176.3	-76.2	179.1	179.7	-174.7	0	112.4	P92 N100	P92-K96 WeakPolarHBondContact O-CB 3.2Å; P92-K96 VanDerWaalsContact O-CG 3.29Å; P92-K96 WeakPolarHBondContact O-CG 3.48Å; P92-K96 PolarHBondContact O-N 2.75Å; P92-K96 VanDerWaalsContact O-N 3.1Å; K96-N100 WeakPolarHBondContact O-CB 3.29Å; K96-N100 PolarHBondContact O-N 3.13Å; K96-N100 PolarHBondContact O-ND2 3.49Å
97	T	88	Confident	75.3	Confident	67 Å²	67	66.6 Å²	66.6	41%	0.411	34%	0.34	S	S	.	.	H	α-helix	trans	-62.5	-44.9	175.7	-62.4	0	0	0	0	111.5	K93 H94 L95 N100 D101	K93-T97 WeakPolarHBondContact O-CB 3.39Å; K93-T97 PolarHBondContact O-N 2.87Å; K93-T97 PolarHBondContact O-OG1 3.13Å; H94-T97 PolarHBondContact O-N 2.85Å; L95-T97 VanDerWaalsContact C-N 3.29Å; L95-T97 PolarHBondContact O-N 2.96Å; T97-N100 PolarHBondContact O-N 3.23Å; T97-D101 WeakPolarHBondContact O-CB 3.31Å; T97-D101 PolarHBondContact O-N 3.41Å
98	R	89.5	Confident	77.4	Confident	81 Å²	81	63.3 Å²	63.3	31%	0.306	32%	0.316	S	S	.	.	H	α-helix	trans	-67.1	-39.1	178.2	-68.6	-52	-172.2	-169	1.8	113.2	H94 L95 N100 D101 Y102 L204 V207	H94-R98 WeakPolarHBondContact O-CG 3.42Å; H94-R98 PolarHBondContact O-N 3.17Å; L95-R98 PolarHBondContact O-N 2.96Å; L95-R98 VanDerWaalsContact O-N 3.13Å; R98-N100 VanDerWaalsContact C-N 3.32Å; R98-N100 PolarHBondContact O-N 3.24Å; R98-D101 IonicContact NH1-OD2 3.7Å; R98-D101 WeakPolarHBondContact O-CB 3.37Å; R98-D101 PolarHBondContact O-N 2.9Å; R98-Y102 WeakPolarHBondContact O-CB 3.34Å; R98-Y102 PolarHBondContact O-N 3.46Å; R98-L204 HydrophobicContact CB-CB 4.28Å; R98-L204 HydrophobicContact CB-CD1 3.71Å; R98-V207 HydrophobicContact CG-CB 4.03Å; R98-V207 HydrophobicContact CG-CG1 4.36Å; R98-V207 HydrophobicContact CG-CG2 3.65Å
99	I	85.7	Confident	79.6	Confident	9 Å²	9	56.4 Å²	56.4	5%	0.046	28%	0.279	C	S	.	.	H	α-helix	trans	-59.9	-45.8	172.9	-68.3	171.1	0	0	0	109.9	L95 Y102 K103 L204 F294 I297	L95-I99 HydrophobicContact CD1-CD1 4.35Å; L95-I99 HydrophobicContact CG-CD1 3.97Å; L95-I99 WeakPolarHBondContact O-CG1 3.38Å; L95-I99 PolarHBondContact O-N 2.9Å; I99-Y102 PolarHBondContact O-N 3.48Å; I99-K103 VanDerWaalsContact O-CB 3.31Å; I99-K103 WeakPolarHBondContact O-CB 3.46Å; I99-K103 PolarHBondContact O-N 3.06Å; I99-L204 HydrophobicContact CG1-CD1 3.74Å; I99-L204 HydrophobicContact CG1-CD2 4.17Å; I99-F294 HydrophobicContact CD1-CB 3.96Å; I99-F294 HydrophobicContact CD1-CD2 3.98Å; I99-F294 HydrophobicContact CD1-CG 4.48Å; I99-I297 HydrophobicContact CD1-CD1 4.14Å
100	N	88.3	Confident	81.5	Confident	81 Å²	81	51.2 Å²	51.2	43%	0.433	24%	0.244	S	C	.	.	H	α-helix	trans	-64.5	-41.3	177	-78.2	-31.2	0	0	0	113	K96 T97 R98 K103 Y104	K96-N100 WeakPolarHBondContact O-CB 3.29Å; K96-N100 PolarHBondContact O-N 3.13Å; K96-N100 PolarHBondContact O-ND2 3.49Å; T97-N100 PolarHBondContact O-N 3.23Å; R98-N100 VanDerWaalsContact C-N 3.32Å; R98-N100 PolarHBondContact O-N 3.24Å; N100-K103 PolarHBondContact O-N 3.44Å; N100-K103 VanDerWaalsContact OD1-CE 3.23Å; N100-K103 WeakPolarHBondContact OD1-CE 3.39Å; N100-K103 PolarHBondContact OD1-NZ 3.16Å; N100-Y104 WeakPolarHBondContact O-CB 3.48Å; N100-Y104 PolarHBondContact O-N 3.22Å
101	D	91.5	Very high	82.8	Confident	49 Å²	49	49.9 Å²	49.9	26%	0.262	23%	0.233	S	C	.	.	H	α-helix	trans	-58	-47.6	174.8	-92.7	9.7	0	0	0	111.6	T97 R98 Y104 A105 K200	T97-D101 WeakPolarHBondContact O-CB 3.31Å; T97-D101 PolarHBondContact O-N 3.41Å; R98-D101 IonicContact NH1-OD2 3.7Å; R98-D101 WeakPolarHBondContact O-CB 3.37Å; R98-D101 PolarHBondContact O-N 2.9Å; D101-Y104 PolarHBondContact O-N 2.93Å; D101-A105 WeakPolarHBondContact O-CB 3.31Å; D101-A105 PolarHBondContact O-N 2.88Å; D101-K200 HydrophobicContact CB-CD 4.09Å; D101-K200 IonicContact OD2-NZ 2.67Å; D101-K200 PolarHBondContact OD2-NZ 3.19Å
102	Y	88.5	Confident	84	Confident	10 Å²	10	49.6 Å²	49.6	4%	0.039	23%	0.232	C	C	.	.	H	α-helix	trans	-67.2	-47.3	178.9	167.9	-115.8	0	0	0	111.5	E59 R98 I99 Y104 A105 Y106 K197 K200 R201 L204	E59-Y102 PolarHBondContact OE1-OH 3.18Å; E59-Y102 PolarHBondContact OE2-OH 3.47Å; E59-Y102 VanDerWaalsContact OE2-OH 3.08Å; R98-Y102 WeakPolarHBondContact O-CB 3.34Å; R98-Y102 PolarHBondContact O-N 3.46Å; I99-Y102 PolarHBondContact O-N 3.48Å; Y102-Y104 VanDerWaalsContact C-N 3.32Å; Y102-Y104 PolarHBondContact O-N 2.78Å; Y102-A105 PolarHBondContact O-N 2.85Å; Y102-A105 VanDerWaalsContact O-N 3.16Å; Y102-Y106 HydrophobicContact CE2-CD2 4.22Å; Y102-Y106 WeakPolarHBondContact O-CB 3.38Å; Y102-Y106 PolarHBondContact O-N 3.26Å; Y102-K197 HydrophobicContact CE2-CG 4.22Å; Y102-K200 HydrophobicContact CD2-CB 4.44Å; Y102-R201 HydrophobicContact CD2-CB 3.89Å; Y102-R201 HydrophobicContact CE2-CB 3.77Å; Y102-R201 HydrophobicContact CE2-CG 4.27Å; Y102-L204 HydrophobicContact CD1-CD2 3.86Å; Y102-L204 HydrophobicContact CG-CD2 4.19Å
103	K	87	Confident	84.6	Confident	41 Å²	41	46.3 Å²	46.3	18%	0.178	21%	0.21	C	C	.	.	H	α-helix	trans	-52.4	-49.1	172.1	155.2	163.8	78.3	172.8	0	111.6	I99 N100 A105 Y106 Y107 V286 D287	I99-K103 VanDerWaalsContact O-CB 3.31Å; I99-K103 WeakPolarHBondContact O-CB 3.46Å; I99-K103 PolarHBondContact O-N 3.06Å; N100-K103 PolarHBondContact O-N 3.44Å; N100-K103 VanDerWaalsContact OD1-CE 3.23Å; N100-K103 WeakPolarHBondContact OD1-CE 3.39Å; N100-K103 PolarHBondContact OD1-NZ 3.16Å; K103-A105 VanDerWaalsContact C-N 3.34Å; K103-A105 PolarHBondContact O-N 3.14Å; K103-Y106 WeakPolarHBondContact O-CB 3.49Å; K103-Y106 PolarHBondContact O-N 3.33Å; K103-Y107 WeakPolarHBondContact O-CB 3.45Å; K103-Y107 PolarHBondContact O-N 2.81Å; K103-V286 HydrophobicContact CB-CG1 3.74Å; K103-V286 HydrophobicContact CD-CB 4.39Å; K103-V286 HydrophobicContact CD-CG1 4.12Å; K103-V286 VanDerWaalsContact CD-O 3.29Å; K103-V286 WeakPolarHBondContact CD-O 3.38Å; K103-V286 HydrophobicContact CG-CB 4.03Å; K103-V286 HydrophobicContact CG-CG1 3.44Å; K103-V286 VanDerWaalsContact CG-CG1 3.44Å; K103-V286 WeakPolarHBondContact O-CG1 3.48Å; K103-D287 VanDerWaalsContact CD-OD1 3.31Å; K103-D287 WeakPolarHBondContact CD-OD1 3.4Å; K103-D287 WeakPolarHBondContact CE-OD1 3.15Å; K103-D287 IonicContact NZ-OD1 3.73Å; K103-D287 PolarHBondContact NZ-OD1 3.26Å
104	Y	88.6	Confident	84.6	Confident	143 Å²	143	39.3 Å²	39.3	56%	0.561	18%	0.18	S	C	*	.	H	α-helix	trans	-66.9	-37.7	-178.6	-172.6	-114.9	0	0	0	112.2	N100 D101 Y102 Y107 K108	N100-Y104 WeakPolarHBondContact O-CB 3.48Å; N100-Y104 PolarHBondContact O-N 3.22Å; D101-Y104 PolarHBondContact O-N 2.93Å; Y102-Y104 VanDerWaalsContact C-N 3.32Å; Y102-Y104 PolarHBondContact O-N 2.78Å; Y104-Y107 HydrophobicContact CD2-CD1 4.42Å; Y104-Y107 HydrophobicContact CE2-CD1 4.34Å; Y104-Y107 PolarHBondContact O-N 2.69Å; Y104-K108 HydrophobicContact CD1-CD 4.13Å; Y104-K108 HydrophobicContact CD1-CG 4.45Å; Y104-K108 HydrophobicContact CE1-CD 3.66Å; Y104-K108 HydrophobicContact CE1-CG 4.12Å; Y104-K108 HydrophobicContact CE2-CG 4.49Å; Y104-K108 WeakPolarHBondContact O-CG 3.46Å; Y104-K108 PolarHBondContact O-N 3.11Å
105	A	89.6	Confident	84.4	Confident	2 Å²	2	37.3 Å²	37.3	2%	0.017	17%	0.172	C	C	.	.	H	α-helix	trans	-66	-38.5	173.7	0	0	0	0	0	112.4	D101 Y102 K103 K108 S109 K197 K200	D101-A105 WeakPolarHBondContact O-CB 3.31Å; D101-A105 PolarHBondContact O-N 2.88Å; Y102-A105 PolarHBondContact O-N 2.85Å; Y102-A105 VanDerWaalsContact O-N 3.16Å; K103-A105 VanDerWaalsContact C-N 3.34Å; K103-A105 PolarHBondContact O-N 3.14Å; A105-K108 PolarHBondContact O-N 3.3Å; A105-S109 WeakPolarHBondContact O-CB 3.3Å; A105-S109 PolarHBondContact O-N 3.35Å; A105-K197 HydrophobicContact CB-CB 4.42Å; A105-K200 HydrophobicContact CB-CB 4.09Å; A105-K200 HydrophobicContact CB-CG 3.7Å
106	Y	84.8	Confident	83.8	Confident	2 Å²	2	37.7 Å²	37.7	1%	0.008	18%	0.175	C	C	.	.	H	α-helix	trans	-61.8	-48.1	173.8	-163.1	-70.9	0	0	0	111.5	M55 E59 Y102 K103 S109 S110 K197 V286 M289	M55-Y106 VanDerWaalsContact C-OH 3.29Å; M55-Y106 WeakPolarHBondContact CA-OH 3.16Å; M55-Y106 HydrophobicContact CB-CE1 4.3Å; M55-Y106 WeakPolarHBondContact CB-OH 3.43Å; M55-Y106 HydrophobicContact CE-CD1 4.41Å; M55-Y106 HydrophobicContact CE-CE1 3.53Å; M55-Y106 HydrophobicContact CG-CE1 3.77Å; M55-Y106 WeakPolarHBondContact CG-OH 3.42Å; M55-Y106 PolarHBondContact O-OH 2.84Å; M55-Y106 HydrophobicContact SD-CE1 4.11Å; E59-Y106 HydrophobicContact CG-CE2 3.58Å; E59-Y106 VanDerWaalsContact OE1-CE2 3.3Å; E59-Y106 WeakPolarHBondContact OE1-CE2 3.42Å; Y102-Y106 HydrophobicContact CE2-CD2 4.22Å; Y102-Y106 WeakPolarHBondContact O-CB 3.38Å; Y102-Y106 PolarHBondContact O-N 3.26Å; K103-Y106 WeakPolarHBondContact O-CB 3.49Å; K103-Y106 PolarHBondContact O-N 3.33Å; Y106-S109 PolarHBondContact O-N 3.08Å; Y106-S110 WeakPolarHBondContact CE1-OG 2.98Å; Y106-S110 WeakPolarHBondContact O-CB 3.17Å; Y106-S110 PolarHBondContact O-N 2.89Å; Y106-S110 PolarHBondContact O-OG 2.92Å; Y106-K197 HydrophobicContact CD2-CD 3.61Å; Y106-K197 HydrophobicContact CD2-CG 4.08Å; Y106-K197 HydrophobicContact CE2-CD 4.02Å; Y106-K197 HydrophobicContact CG-CD 4.12Å; Y106-K197 HydrophobicContact CG-CG 4.49Å; Y106-V286 HydrophobicContact CD1-CG1 4.27Å; Y106-V286 HydrophobicContact CD1-CG2 3.9Å; Y106-V286 HydrophobicContact CG-CG1 4.37Å; Y106-M289 HydrophobicContact CD1-CE 4.36Å; Y106-M289 HydrophobicContact CD1-SD 4.49Å; Y106-M289 HydrophobicContact CD2-CE 4.15Å; Y106-M289 HydrophobicContact CE1-CE 3.99Å; Y106-M289 HydrophobicContact CE1-SD 4.17Å; Y106-M289 HydrophobicContact CE2-CE 3.76Å; Y106-M289 HydrophobicContact CG-CE 4.45Å
107	Y	84.5	Confident	82.9	Confident	32 Å²	32	33.2 Å²	33.2	13%	0.125	16%	0.156	C	C	.	.	H	α-helix	trans	-57.4	-50.2	174.7	170.8	-97.9	0	0	0	111.6	K103 Y104 S109 S110 I111 L282 R283	K103-Y107 WeakPolarHBondContact O-CB 3.45Å; K103-Y107 PolarHBondContact O-N 2.81Å; Y104-Y107 HydrophobicContact CD2-CD1 4.42Å; Y104-Y107 HydrophobicContact CE2-CD1 4.34Å; Y104-Y107 PolarHBondContact O-N 2.69Å; Y107-S109 VanDerWaalsContact C-N 3.31Å; Y107-S109 PolarHBondContact O-N 2.92Å; Y107-S110 WeakPolarHBondContact O-CB 3.48Å; Y107-S110 PolarHBondContact O-N 3.11Å; Y107-S110 VanDerWaalsContact O-N 3.14Å; Y107-I111 HydrophobicContact CD1-CG1 4.4Å; Y107-I111 HydrophobicContact CD2-CG1 4.3Å; Y107-I111 HydrophobicContact CE1-CG1 3.93Å; Y107-I111 HydrophobicContact CE2-CD1 4.04Å; Y107-I111 HydrophobicContact CE2-CG1 3.83Å; Y107-I111 WeakPolarHBondContact O-CG1 3.42Å; Y107-I111 PolarHBondContact O-N 3.35Å; Y107-L282 HydrophobicContact CD2-CB 4.36Å; Y107-L282 HydrophobicContact CE2-CB 4.26Å; Y107-R283 HydrophobicContact CD2-CB 4.35Å; Y107-R283 HydrophobicContact CE2-CB 4.06Å; Y107-R283 PolarHBondContact OH-NH2 3.37Å
108	K	86.9	Confident	81.6	Confident	47 Å²	47	31 Å²	31	20%	0.204	14%	0.141	C	C	.	.	H	α-helix	trans	-59.3	-41.4	177.5	-75.4	-172.4	-66.6	162.1	0	112.4	Y104 A105 S110 Q112 E196	Y104-K108 HydrophobicContact CD1-CD 4.13Å; Y104-K108 HydrophobicContact CD1-CG 4.45Å; Y104-K108 HydrophobicContact CE1-CD 3.66Å; Y104-K108 HydrophobicContact CE1-CG 4.12Å; Y104-K108 HydrophobicContact CE2-CG 4.49Å; Y104-K108 WeakPolarHBondContact O-CG 3.46Å; Y104-K108 PolarHBondContact O-N 3.11Å; A105-K108 PolarHBondContact O-N 3.3Å; K108-S110 VanDerWaalsContact C-N 3.34Å; K108-Q112 VanDerWaalsContact O-CB 3.32Å; K108-Q112 WeakPolarHBondContact O-CB 3.42Å; K108-Q112 PolarHBondContact O-N 3Å; K108-E196 IonicContact NZ-OE2 2.84Å; K108-E196 PolarHBondContact NZ-OE2 2.81Å
109	S	85.8	Confident	80	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-63.4	-41.5	176.1	178.6	0	0	0	0	111.5	A105 Y106 Y107 Q112 K113	A105-S109 WeakPolarHBondContact O-CB 3.3Å; A105-S109 PolarHBondContact O-N 3.35Å; Y106-S109 PolarHBondContact O-N 3.08Å; Y107-S109 VanDerWaalsContact C-N 3.31Å; Y107-S109 PolarHBondContact O-N 2.92Å; S109-Q112 PolarHBondContact O-N 2.96Å; S109-K113 WeakPolarHBondContact O-CG 3.48Å; S109-K113 PolarHBondContact O-N 2.95Å
110	S	79.4	Confident	78.3	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.007	15%	0.149	C	C	.	.	H	α-helix	trans	-65.7	-46.4	178.6	-53.6	0	0	0	0	111.9	M55 Y106 Y107 K108 Q112 K113 F114	M55-S110 PolarHBondContact SD-OG 2.81Å; Y106-S110 WeakPolarHBondContact CE1-OG 2.98Å; Y106-S110 WeakPolarHBondContact O-CB 3.17Å; Y106-S110 PolarHBondContact O-N 2.89Å; Y106-S110 PolarHBondContact O-OG 2.92Å; Y107-S110 WeakPolarHBondContact O-CB 3.48Å; Y107-S110 PolarHBondContact O-N 3.11Å; Y107-S110 VanDerWaalsContact O-N 3.14Å; K108-S110 VanDerWaalsContact C-N 3.34Å; S110-Q112 VanDerWaalsContact C-N 3.3Å; S110-Q112 PolarHBondContact O-N 3.16Å; S110-K113 PolarHBondContact O-N 3.37Å; S110-F114 PolarHBondContact O-N 2.98Å; S110-F114 VanDerWaalsContact O-N 3.16Å
111	I	80.5	Confident	76.6	Confident	19 Å²	19	28.4 Å²	28.4	10%	0.097	13%	0.134	C	C	.	.	H	α-helix	trans	-59.6	-42.8	173.1	-66.9	-64.7	0	0	0	110.9	Y107 K113 F114 L115 Y275 A279 L282	Y107-I111 HydrophobicContact CD1-CG1 4.4Å; Y107-I111 HydrophobicContact CD2-CG1 4.3Å; Y107-I111 HydrophobicContact CE1-CG1 3.93Å; Y107-I111 HydrophobicContact CE2-CD1 4.04Å; Y107-I111 HydrophobicContact CE2-CG1 3.83Å; Y107-I111 WeakPolarHBondContact O-CG1 3.42Å; Y107-I111 PolarHBondContact O-N 3.35Å; I111-K113 PolarHBondContact O-N 2.79Å; I111-F114 PolarHBondContact O-N 3.48Å; I111-L115 HydrophobicContact CG2-CD1 3.87Å; I111-L115 HydrophobicContact CG2-CG 4.21Å; I111-L115 WeakPolarHBondContact O-CG 3.48Å; I111-L115 PolarHBondContact O-N 2.67Å; I111-Y275 VanDerWaalsContact CG2-OH 3.32Å; I111-Y275 WeakPolarHBondContact CG2-OH 3.44Å; I111-A279 HydrophobicContact CD1-CB 3.91Å; I111-L282 HydrophobicContact CD1-CD1 3.77Å
112	Q	82.4	Confident	74.7	Confident	19 Å²	19	31.7 Å²	31.7	9%	0.089	14%	0.143	C	C	.	.	H	α-helix	trans	-64.8	-40.2	179.7	-173.8	57.3	55.3	0	0	112.5	K108 S109 S110 F114 L115 S116 L189 L190 R193	K108-Q112 VanDerWaalsContact O-CB 3.32Å; K108-Q112 WeakPolarHBondContact O-CB 3.42Å; K108-Q112 PolarHBondContact O-N 3Å; S109-Q112 PolarHBondContact O-N 2.96Å; S110-Q112 VanDerWaalsContact C-N 3.3Å; S110-Q112 PolarHBondContact O-N 3.16Å; Q112-F114 VanDerWaalsContact C-N 3.28Å; Q112-F114 PolarHBondContact O-N 2.96Å; Q112-L115 PolarHBondContact O-N 3.47Å; Q112-S116 PolarHBondContact NE2-OG 3.3Å; Q112-S116 VanDerWaalsContact NE2-OG 3.13Å; Q112-S116 VanDerWaalsContact O-CB 3.25Å; Q112-S116 WeakPolarHBondContact O-CB 3.31Å; Q112-S116 PolarHBondContact O-N 2.87Å; Q112-S116 PolarHBondContact O-OG 3.38Å; Q112-L189 HydrophobicContact CG-CG 4.3Å; Q112-L189 VanDerWaalsContact OE1-CG 3.26Å; Q112-L190 HydrophobicContact CG-CB 4.32Å; Q112-L190 HydrophobicContact CG-CD1 4.24Å; Q112-R193 HydrophobicContact CB-CB 4.08Å; Q112-R193 HydrophobicContact CB-CG 3.83Å; Q112-R193 HydrophobicContact CG-CB 4.29Å; Q112-R193 HydrophobicContact CG-CG 3.93Å
113	K	79.3	Confident	72.8	Confident	2 Å²	2	33.4 Å²	33.4	1%	0.009	16%	0.16	C	C	.	.	H	α-helix	trans	-57.2	-44.2	173.5	-72.7	171.9	-174.5	-177.1	0	110.9	L51 S109 S110 I111 S116 L117 E140 L190	L51-K113 HydrophobicContact CD1-CB 3.35Å; L51-K113 HydrophobicContact CD1-CD 4.43Å; L51-K113 HydrophobicContact CG-CB 3.93Å; L51-K113 HydrophobicContact CG-CD 4.1Å; S109-K113 WeakPolarHBondContact O-CG 3.48Å; S109-K113 PolarHBondContact O-N 2.95Å; S110-K113 PolarHBondContact O-N 3.37Å; I111-K113 PolarHBondContact O-N 2.79Å; K113-S116 PolarHBondContact O-N 3.33Å; K113-L117 WeakPolarHBondContact O-CG 3.36Å; K113-L117 PolarHBondContact O-N 3.49Å; K113-E140 WeakPolarHBondContact CE-OE1 3.49Å; K113-E140 IonicContact NZ-OE1 2.79Å; K113-E140 PolarHBondContact NZ-OE1 3.37Å; K113-L190 HydrophobicContact CB-CD1 4.45Å; K113-L190 HydrophobicContact CG-CD1 3.81Å
114	F	73.5	Confident	71.1	Confident	6 Å²	6	41.5 Å²	41.5	3%	0.026	19%	0.189	C	C	.	.	H	α-helix	trans	-64.8	-49.6	177.7	179.5	-89.8	0	0	0	111.7	L51 S110 I111 Q112 S116 L117 E118 E248 A251 I252 Y275 L278	L51-F114 HydrophobicContact CD1-CB 3.85Å; L51-F114 VanDerWaalsContact CD1-N 3.27Å; S110-F114 PolarHBondContact O-N 2.98Å; S110-F114 VanDerWaalsContact O-N 3.16Å; I111-F114 PolarHBondContact O-N 3.48Å; Q112-F114 VanDerWaalsContact C-N 3.28Å; Q112-F114 PolarHBondContact O-N 2.96Å; F114-S116 PolarHBondContact O-N 2.86Å; F114-L117 WeakPolarHBondContact O-CB 3.49Å; F114-L117 PolarHBondContact O-N 3.39Å; F114-E118 PolarHBondContact O-N 3.33Å; F114-E248 HydrophobicContact CD2-CG 4.26Å; F114-E248 HydrophobicContact CE2-CG 4.42Å; F114-A251 HydrophobicContact CE2-CB 3.75Å; F114-A251 HydrophobicContact CZ-CB 3.57Å; F114-I252 HydrophobicContact CE2-CG1 4.27Å; F114-Y275 AromaticContact CD1-CD2 3.72Å; F114-Y275 HydrophobicContact CD1-CD2 3.72Å; F114-Y275 AromaticContact CD1-CE2 3.55Å; F114-Y275 HydrophobicContact CD1-CE2 3.55Å; F114-Y275 AromaticContact CE1-CD2 3.38Å; F114-Y275 HydrophobicContact CE1-CD2 3.38Å; F114-Y275 AromaticContact CE1-CE2 3.71Å; F114-Y275 HydrophobicContact CE1-CE2 3.71Å; F114-Y275 HydrophobicContact CZ-CD2 4.29Å; F114-L278 HydrophobicContact CD1-CD2 4.42Å; F114-L278 HydrophobicContact CD2-CD2 3.46Å; F114-L278 VanDerWaalsContact CD2-CD2 3.46Å; F114-L278 HydrophobicContact CE1-CD2 4.44Å; F114-L278 HydrophobicContact CE2-CD2 3.47Å; F114-L278 VanDerWaalsContact CE2-CD2 3.47Å; F114-L278 HydrophobicContact CG-CD2 3.96Å; F114-L278 HydrophobicContact CZ-CD2 3.99Å
115	L	72.8	Confident	69.4	Low	55 Å²	55	37.4 Å²	37.4	29%	0.288	18%	0.182	S	C	.	.	H	α-helix	trans	-60.7	-30.9	177.4	-70.1	176.7	0	0	0	112.3	I111 Q112 L117 E118 P119 Y275	I111-L115 HydrophobicContact CG2-CD1 3.87Å; I111-L115 HydrophobicContact CG2-CG 4.21Å; I111-L115 WeakPolarHBondContact O-CG 3.48Å; I111-L115 PolarHBondContact O-N 2.67Å; Q112-L115 PolarHBondContact O-N 3.47Å; L115-L117 VanDerWaalsContact C-N 3.33Å; L115-E118 WeakPolarHBondContact O-CB 3.37Å; L115-E118 PolarHBondContact O-N 2.86Å; L115-P119 WeakPolarHBondContact O-CD 3.46Å; L115-Y275 HydrophobicContact CD2-CE2 3.94Å
116	S	70.5	Confident	67.8	Low	8 Å²	8	42.7 Å²	42.7	6%	0.056	21%	0.214	C	C	.	.	H	α-helix	trans	-72	-26.6	175.9	-71.5	0	0	0	0	112.6	Q112 K113 F114 E118 Y132	Q112-S116 PolarHBondContact NE2-OG 3.3Å; Q112-S116 VanDerWaalsContact NE2-OG 3.13Å; Q112-S116 VanDerWaalsContact O-CB 3.25Å; Q112-S116 WeakPolarHBondContact O-CB 3.31Å; Q112-S116 PolarHBondContact O-N 2.87Å; Q112-S116 PolarHBondContact O-OG 3.38Å; K113-S116 PolarHBondContact O-N 3.33Å; F114-S116 PolarHBondContact O-N 2.86Å; S116-E118 VanDerWaalsContact C-N 3.3Å; S116-Y132 WeakPolarHBondContact O-CD1 3.34Å; S116-Y132 VanDerWaalsContact O-CE1 3.25Å; S116-Y132 WeakPolarHBondContact O-CE1 3.46Å
117	L	64.9	Low	66.7	Low	23 Å²	23	46 Å²	46	12%	0.12	23%	0.234	C	C	.	.	H	α-helix	trans	-70.8	-27.9	171	-66	168.7	0	0	0	111.8	K113 F114 L115 Y120 T121	K113-L117 WeakPolarHBondContact O-CG 3.36Å; K113-L117 PolarHBondContact O-N 3.49Å; F114-L117 WeakPolarHBondContact O-CB 3.49Å; F114-L117 PolarHBondContact O-N 3.39Å; L115-L117 VanDerWaalsContact C-N 3.33Å; L117-Y120 PolarHBondContact O-N 3.15Å; L117-T121 PolarHBondContact O-N 3.35Å; L117-T121 VanDerWaalsContact O-N 3.11Å
118	E	60.3	Low	65.7	Low	20 Å²	20	44.6 Å²	44.6	9%	0.093	23%	0.229	C	C	.	.	H	α-helix	trans	-63.5	-50.8	-170.3	-161.6	-155.8	163.4	0	0	114.5	F114 L115 S116 Y120 T121 R122 T255 Y271	F114-E118 PolarHBondContact O-N 3.33Å; L115-E118 WeakPolarHBondContact O-CB 3.37Å; L115-E118 PolarHBondContact O-N 2.86Å; S116-E118 VanDerWaalsContact C-N 3.3Å; E118-Y120 PolarHBondContact O-N 3.05Å; E118-T121 PolarHBondContact O-N 2.71Å; E118-T121 PolarHBondContact O-OG1 3.43Å; E118-R122 VanDerWaalsContact CD-NH2 3.34Å; E118-R122 WeakPolarHBondContact O-CG 3.17Å; E118-R122 PolarHBondContact O-N 2.95Å; E118-R122 IonicContact OE1-CZ 2.9Å; E118-R122 IonicContact OE1-NE 3.73Å; E118-R122 IonicContact OE1-NH2 2.81Å; E118-R122 PolarHBondContact OE1-NH2 3.15Å; E118-R122 IonicContact OE2-NH2 3.42Å; E118-T255 HydrophobicContact CG-CG2 3.67Å; E118-Y271 PolarHBondContact OE1-OH 3.17Å; E118-Y271 PolarHBondContact OE2-OH 3.4Å
119	P	55.6	Low	64.6	Low	53 Å²	53	43.1 Å²	43.1	34%	0.344	22%	0.224	S	C	.	.	H	α-helix	trans	-58.3	-23.4	178.4	-22.1	31.2	0	0	0	113.7	L115 R122 A123	L115-P119 WeakPolarHBondContact O-CD 3.46Å; P119-R122 VanDerWaalsContact O-CB 3.31Å; P119-R122 WeakPolarHBondContact O-CB 3.35Å; P119-R122 PolarHBondContact O-N 3.2Å; P119-A123 PolarHBondContact O-N 3.13Å
120	Y	50.8	Low	63.8	Low	43 Å²	43	45.2 Å²	45.2	17%	0.169	23%	0.234	C	C	.	.	H	α-helix	trans	-92.9	-23.4	-173.6	-75.2	-94.9	0	0	0	112.1	L117 E118 R122 A123 A128 Y132	L117-Y120 PolarHBondContact O-N 3.15Å; E118-Y120 PolarHBondContact O-N 3.05Å; Y120-R122 VanDerWaalsContact C-N 3.27Å; Y120-A123 PolarHBondContact O-N 2.82Å; Y120-A128 HydrophobicContact CD1-CB 3.44Å; Y120-A128 VanDerWaalsContact CD1-CB 3.44Å; Y120-A128 HydrophobicContact CE1-CB 4.48Å; Y120-A128 HydrophobicContact CG-CB 4.06Å; Y120-A128 WeakPolarHBondContact O-CB 3.3Å; Y120-Y132 AromaticContact CD1-CD2 3.49Å; Y120-Y132 HydrophobicContact CD1-CD2 3.49Å; Y120-Y132 VanDerWaalsContact CD1-CD2 3.49Å; Y120-Y132 AromaticContact CD1-CE2 3.57Å; Y120-Y132 HydrophobicContact CD1-CE2 3.57Å; Y120-Y132 HydrophobicContact CD2-CD1 4.25Å; Y120-Y132 AromaticContact CD2-CD2 3.37Å; Y120-Y132 HydrophobicContact CD2-CD2 3.37Å; Y120-Y132 AromaticContact CD2-CE1 3.99Å; Y120-Y132 HydrophobicContact CD2-CE1 3.99Å; Y120-Y132 AromaticContact CD2-CE2 3.2Å; Y120-Y132 HydrophobicContact CD2-CE2 3.2Å; Y120-Y132 AromaticContact CD2-CG 3.91Å; Y120-Y132 HydrophobicContact CD2-CG 3.91Å; Y120-Y132 AromaticContact CD2-CZ 3.44Å; Y120-Y132 VanDerWaalsContact CD2-CZ 3.44Å; Y120-Y132 AromaticContact CE1-CD2 3.66Å; Y120-Y132 HydrophobicContact CE1-CD2 3.66Å; Y120-Y132 AromaticContact CE1-CE2 3.24Å; Y120-Y132 HydrophobicContact CE1-CE2 3.24Å; Y120-Y132 AromaticContact CE2-CD2 3.61Å; Y120-Y132 HydrophobicContact CE2-CD2 3.61Å; Y120-Y132 AromaticContact CE2-CE1 3.88Å; Y120-Y132 HydrophobicContact CE2-CE1 3.88Å; Y120-Y132 AromaticContact CE2-CE2 2.89Å; Y120-Y132 HydrophobicContact CE2-CE2 2.89Å; Y120-Y132 HydrophobicContact CE2-CG 4.39Å; Y120-Y132 AromaticContact CE2-CZ 2.95Å; Y120-Y132 WeakPolarHBondContact CE2-OH 3.37Å; Y120-Y132 AromaticContact CG-CD2 3.37Å; Y120-Y132 HydrophobicContact CG-CD2 3.37Å; Y120-Y132 AromaticContact CG-CE2 3.59Å; Y120-Y132 HydrophobicContact CG-CE2 3.59Å; Y120-Y132 HydrophobicContact CG-CG 4.08Å; Y120-Y132 AromaticContact CZ-CD2 3.73Å; Y120-Y132 AromaticContact CZ-CE2 2.88Å; Y120-Y132 AromaticContact CZ-CZ 3.36Å; Y120-Y132 VanDerWaalsContact CZ-OH 3.3Å; Y120-Y132 VanDerWaalsContact OH-CE2 3.31Å; Y120-Y132 WeakPolarHBondContact OH-CE2 3.49Å; Y120-Y132 PolarHBondContact OH-OH 3.15Å; Y120-Y132 VanDerWaalsContact OH-OH 3.06Å
121	T	51.9	Low	63.5	Low	21 Å²	21	47.8 Å²	47.8	13%	0.129	25%	0.247	C	C	.	.	H	α-helix	trans	-69.1	-28.9	161.5	61.2	0	0	0	0	111.1	L117 E118 I252 T255 N256	L117-T121 PolarHBondContact O-N 3.35Å; L117-T121 VanDerWaalsContact O-N 3.11Å; E118-T121 PolarHBondContact O-N 2.71Å; E118-T121 PolarHBondContact O-OG1 3.43Å; T121-I252 HydrophobicContact CG2-CG2 4.16Å; T121-T255 WeakPolarHBondContact OG1-CG2 3.35Å; T121-N256 VanDerWaalsContact CB-OD1 3.28Å; T121-N256 WeakPolarHBondContact CB-OD1 3.28Å
122	R	50.9	Low	63.1	Low	118 Å²	118	47.2 Å²	47.2	45%	0.445	24%	0.244	S	C	.	.	H	α-helix	trans	-68.6	-36.4	171.8	-50.4	-177.6	176.7	162.4	-1	113.4	E118 P119 Y120 R124 M259	E118-R122 VanDerWaalsContact CD-NH2 3.34Å; E118-R122 WeakPolarHBondContact O-CG 3.17Å; E118-R122 PolarHBondContact O-N 2.95Å; E118-R122 IonicContact OE1-CZ 2.9Å; E118-R122 IonicContact OE1-NE 3.73Å; E118-R122 IonicContact OE1-NH2 2.81Å; E118-R122 PolarHBondContact OE1-NH2 3.15Å; E118-R122 IonicContact OE2-NH2 3.42Å; P119-R122 VanDerWaalsContact O-CB 3.31Å; P119-R122 WeakPolarHBondContact O-CB 3.35Å; P119-R122 PolarHBondContact O-N 3.2Å; Y120-R122 VanDerWaalsContact C-N 3.27Å; R122-R124 PolarHBondContact O-N 2.9Å; R122-M259 HydrophobicContact CB-CE 3.83Å; R122-M259 VanDerWaalsContact CD-CE 3.46Å; R122-M259 HydrophobicContact CG-CE 3.44Å; R122-M259 VanDerWaalsContact CG-CE 3.44Å; R122-M259 HydrophobicContact CG-CG 4.01Å; R122-M259 HydrophobicContact CG-SD 3.87Å
123	A	49.3	Very low	62.7	Low	47 Å²	47	47.3 Å²	47.3	39%	0.388	24%	0.244	S	C	.	.	S	Bend	trans	-78.1	105.6	173.5	0	0	0	0	0	107.4	P119 Y120 S125 A128	P119-A123 PolarHBondContact O-N 3.13Å; Y120-A123 PolarHBondContact O-N 2.82Å; A123-S125 PolarHBondContact O-N 3.27Å; A123-A128 HydrophobicContact CB-CB 4.3Å
124	R	51.9	Low	62.7	Low	210 Å²	210	52 Å²	52	79%	0.792	27%	0.267	S	S	*	.			trans	-53.7	5.4	176.1	-71.4	-177.6	172.3	179.8	-2.4	115.7	R122 T126 D260	R122-R124 PolarHBondContact O-N 2.9Å; R124-T126 PolarHBondContact O-N 3.3Å; R124-D260 IonicContact CZ-OD1 3.68Å; R124-D260 IonicContact NE-OD1 3.65Å; R124-D260 IonicContact NH2-OD1 2.84Å; R124-D260 PolarHBondContact NH2-OD1 3.4Å
125	S	51.4	Low	63.2	Low	58 Å²	58	51.9 Å²	51.9	41%	0.406	27%	0.266	S	S	.	.			trans	-62.1	118.9	169.5	-177.6	0	0	0	0	110	A123 T127 A128	A123-S125 PolarHBondContact O-N 3.27Å; S125-T127 PolarHBondContact O-N 3.42Å; S125-T127 PolarHBondContact OG-N 2.93Å; S125-T127 PolarHBondContact OG-OG1 3.16Å; S125-A128 WeakPolarHBondContact O-CB 3.1Å; S125-A128 PolarHBondContact O-N 3.47Å; S125-A128 VanDerWaalsContact O-N 3.15Å
126	T	56.6	Low	63.7	Low	112 Å²	112	49.4 Å²	49.4	69%	0.687	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-17	175.4	51.7	0	0	0	0	113.2	R124 H130	R124-T126 PolarHBondContact O-N 3.3Å; T126-H130 PolarHBondContact O-CD2 3.29Å; T126-H130 VanDerWaalsContact O-CD2 3.32Å
127	T	62.1	Low	64.4	Low	71 Å²	71	51.9 Å²	51.9	44%	0.436	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-14.7	-179.3	58.7	0	0	0	0	113.9	S125 H130 I131	S125-T127 PolarHBondContact O-N 3.42Å; S125-T127 PolarHBondContact OG-N 2.93Å; S125-T127 PolarHBondContact OG-OG1 3.16Å; T127-H130 WeakPolarHBondContact O-CB 3.43Å; T127-H130 PolarHBondContact O-N 3.14Å; T127-H130 VanDerWaalsContact O-N 3.16Å; T127-I131 WeakPolarHBondContact O-CG1 3.37Å; T127-I131 PolarHBondContact O-N 3.4Å
128	A	63.4	Low	65.5	Low	4 Å²	4	53.1 Å²	53.1	3%	0.033	27%	0.268	C	S	.	.	H	α-helix	trans	-60.9	-49.9	-170.9	0	0	0	0	0	112.9	Y120 A123 S125 H130 I131 Y132	Y120-A128 HydrophobicContact CD1-CB 3.44Å; Y120-A128 VanDerWaalsContact CD1-CB 3.44Å; Y120-A128 HydrophobicContact CE1-CB 4.48Å; Y120-A128 HydrophobicContact CG-CB 4.06Å; Y120-A128 WeakPolarHBondContact O-CB 3.3Å; A123-A128 HydrophobicContact CB-CB 4.3Å; S125-A128 WeakPolarHBondContact O-CB 3.1Å; S125-A128 PolarHBondContact O-N 3.47Å; S125-A128 VanDerWaalsContact O-N 3.15Å; A128-H130 VanDerWaalsContact C-N 3.31Å; A128-H130 PolarHBondContact O-N 3.45Å; A128-I131 PolarHBondContact O-N 3.26Å; A128-Y132 PolarHBondContact O-N 3.22Å
129	P	64.4	Low	67	Low	15 Å²	15	52.1 Å²	52.1	10%	0.097	26%	0.264	C	S	.	.	H	α-helix	trans	-59.5	-37.4	173.3	-26.5	35.9	0	0	0	113.7	Y132 H133	P129-Y132 PolarHBondContact O-N 3.32Å; P129-H133 WeakPolarHBondContact O-CB 3.44Å; P129-H133 PolarHBondContact O-N 2.87Å
130	H	68.7	Low	68.5	Low	45 Å²	45	50 Å²	50	21%	0.208	25%	0.249	C	C	.	.	H	α-helix	trans	-65.2	-43.4	179.8	-59.7	-40	0	0	0	112.2	A47 T126 T127 A128 Y132 H133 E134	A47-H130 WeakPolarHBondContact CB-CE1 3.47Å; A47-H130 VanDerWaalsContact CB-ND1 3.26Å; A47-H130 WeakPolarHBondContact CB-ND1 3.14Å; A47-H130 PolarHBondContact O-ND1 2.98Å; T126-H130 PolarHBondContact O-CD2 3.29Å; T126-H130 VanDerWaalsContact O-CD2 3.32Å; T127-H130 WeakPolarHBondContact O-CB 3.43Å; T127-H130 PolarHBondContact O-N 3.14Å; T127-H130 VanDerWaalsContact O-N 3.16Å; A128-H130 VanDerWaalsContact C-N 3.31Å; A128-H130 PolarHBondContact O-N 3.45Å; H130-Y132 PolarHBondContact O-N 3.33Å; H130-H133 PolarHBondContact O-N 2.71Å; H130-E134 WeakPolarHBondContact O-CB 3.35Å; H130-E134 WeakPolarHBondContact O-CG 3.5Å; H130-E134 PolarHBondContact O-N 2.93Å
131	I	72.6	Confident	70.3	Confident	54 Å²	54	52.8 Å²	52.8	28%	0.277	26%	0.262	S	S	.	.	H	α-helix	trans	-59.5	-38	177.8	-68.2	166.2	0	0	0	111	T127 A128 E135 R184	T127-I131 WeakPolarHBondContact O-CG1 3.37Å; T127-I131 PolarHBondContact O-N 3.4Å; A128-I131 PolarHBondContact O-N 3.26Å; I131-E135 WeakPolarHBondContact O-CB 3.47Å; I131-E135 PolarHBondContact O-N 3.41Å; I131-R184 HydrophobicContact CG2-CB 4.46Å; I131-R184 HydrophobicContact CG2-CG 3.7Å
132	Y	71.2	Confident	72.3	Confident	7 Å²	7	52.1 Å²	52.1	3%	0.027	26%	0.258	C	S	.	.	H	α-helix	trans	-75	-40	178.4	-95.6	-99.4	0	0	0	113.4	S116 Y120 A128 P129 H130 E134 E135 C136 R184	S116-Y132 WeakPolarHBondContact O-CD1 3.34Å; S116-Y132 VanDerWaalsContact O-CE1 3.25Å; S116-Y132 WeakPolarHBondContact O-CE1 3.46Å; Y120-Y132 AromaticContact CD1-CD2 3.49Å; Y120-Y132 HydrophobicContact CD1-CD2 3.49Å; Y120-Y132 VanDerWaalsContact CD1-CD2 3.49Å; Y120-Y132 AromaticContact CD1-CE2 3.57Å; Y120-Y132 HydrophobicContact CD1-CE2 3.57Å; Y120-Y132 HydrophobicContact CD2-CD1 4.25Å; Y120-Y132 AromaticContact CD2-CD2 3.37Å; Y120-Y132 HydrophobicContact CD2-CD2 3.37Å; Y120-Y132 AromaticContact CD2-CE1 3.99Å; Y120-Y132 HydrophobicContact CD2-CE1 3.99Å; Y120-Y132 AromaticContact CD2-CE2 3.2Å; Y120-Y132 HydrophobicContact CD2-CE2 3.2Å; Y120-Y132 AromaticContact CD2-CG 3.91Å; Y120-Y132 HydrophobicContact CD2-CG 3.91Å; Y120-Y132 AromaticContact CD2-CZ 3.44Å; Y120-Y132 VanDerWaalsContact CD2-CZ 3.44Å; Y120-Y132 AromaticContact CE1-CD2 3.66Å; Y120-Y132 HydrophobicContact CE1-CD2 3.66Å; Y120-Y132 AromaticContact CE1-CE2 3.24Å; Y120-Y132 HydrophobicContact CE1-CE2 3.24Å; Y120-Y132 AromaticContact CE2-CD2 3.61Å; Y120-Y132 HydrophobicContact CE2-CD2 3.61Å; Y120-Y132 AromaticContact CE2-CE1 3.88Å; Y120-Y132 HydrophobicContact CE2-CE1 3.88Å; Y120-Y132 AromaticContact CE2-CE2 2.89Å; Y120-Y132 HydrophobicContact CE2-CE2 2.89Å; Y120-Y132 HydrophobicContact CE2-CG 4.39Å; Y120-Y132 AromaticContact CE2-CZ 2.95Å; Y120-Y132 WeakPolarHBondContact CE2-OH 3.37Å; Y120-Y132 AromaticContact CG-CD2 3.37Å; Y120-Y132 HydrophobicContact CG-CD2 3.37Å; Y120-Y132 AromaticContact CG-CE2 3.59Å; Y120-Y132 HydrophobicContact CG-CE2 3.59Å; Y120-Y132 HydrophobicContact CG-CG 4.08Å; Y120-Y132 AromaticContact CZ-CD2 3.73Å; Y120-Y132 AromaticContact CZ-CE2 2.88Å; Y120-Y132 AromaticContact CZ-CZ 3.36Å; Y120-Y132 VanDerWaalsContact CZ-OH 3.3Å; Y120-Y132 VanDerWaalsContact OH-CE2 3.31Å; Y120-Y132 WeakPolarHBondContact OH-CE2 3.49Å; Y120-Y132 PolarHBondContact OH-OH 3.15Å; Y120-Y132 VanDerWaalsContact OH-OH 3.06Å; A128-Y132 PolarHBondContact O-N 3.22Å; P129-Y132 PolarHBondContact O-N 3.32Å; H130-Y132 PolarHBondContact O-N 3.33Å; Y132-E134 VanDerWaalsContact C-N 3.31Å; Y132-E135 PolarHBondContact O-N 3.38Å; Y132-C136 PolarHBondContact O-N 3.48Å; Y132-C136 PolarHBondContact O-SG 2.8Å; Y132-R184 WeakPolarHBondContact CE1-O 3.39Å; Y132-R184 WeakPolarHBondContact CE2-O 3.43Å; Y132-R184 PolarHBondContact OH-O 2.79Å; Y132-R184 VanDerWaalsContact OH-O 3.08Å
133	H	74.1	Confident	74.4	Confident	22 Å²	22	48 Å²	48	10%	0.102	24%	0.243	C	C	.	.	H	α-helix	trans	-59.6	-45.3	173	-176.5	81.6	0	0	0	111	R49 L54 P129 H130 E135 C136 L137	R49-H133 VanDerWaalsContact CB-CE1 3.4Å; R49-H133 WeakPolarHBondContact CB-CE1 3.22Å; R49-H133 PolarHBondContact O-CE1 3.13Å; R49-H133 PolarHBondContact O-ND1 3.35Å; L54-H133 VanDerWaalsContact CD2-CE1 3.48Å; L54-H133 WeakPolarHBondContact CD2-CE1 3.21Å; P129-H133 WeakPolarHBondContact O-CB 3.44Å; P129-H133 PolarHBondContact O-N 2.87Å; H130-H133 PolarHBondContact O-N 2.71Å; H133-E135 VanDerWaalsContact C-N 3.33Å; H133-E135 PolarHBondContact O-N 2.76Å; H133-C136 WeakPolarHBondContact O-CB 3.49Å; H133-C136 PolarHBondContact O-N 3.03Å; H133-L137 VanDerWaalsContact NE2-CD1 3.35Å; H133-L137 WeakPolarHBondContact NE2-CD1 3.48Å; H133-L137 PolarHBondContact O-N 2.91Å
134	E	79.9	Confident	76.3	Confident	101 Å²	101	46.6 Å²	46.6	47%	0.472	23%	0.228	S	C	.	.	H	α-helix	trans	-58.4	-43.5	172.5	-76	178.5	-174.7	0	0	112	H130 Y132 L137 R138 R184	H130-E134 WeakPolarHBondContact O-CB 3.35Å; H130-E134 WeakPolarHBondContact O-CG 3.5Å; H130-E134 PolarHBondContact O-N 2.93Å; Y132-E134 VanDerWaalsContact C-N 3.31Å; E134-L137 PolarHBondContact O-N 2.59Å; E134-R138 WeakPolarHBondContact O-CB 3.22Å; E134-R138 PolarHBondContact O-N 3.19Å; E134-R184 IonicContact OE2-NH1 2.67Å; E134-R184 PolarHBondContact OE2-NH1 2.9Å
135	E	84.8	Confident	78.1	Confident	3 Å²	3	36.6 Å²	36.6	1%	0.014	19%	0.19	C	C	.	.	H	α-helix	trans	-65.8	-40.3	178.4	-176.5	62.3	-173.5	0	0	112.1	I131 Y132 H133 R138 L139 R184 L190	I131-E135 WeakPolarHBondContact O-CB 3.47Å; I131-E135 PolarHBondContact O-N 3.41Å; Y132-E135 PolarHBondContact O-N 3.38Å; H133-E135 VanDerWaalsContact C-N 3.33Å; H133-E135 PolarHBondContact O-N 2.76Å; E135-R138 PolarHBondContact O-N 3.1Å; E135-R138 IonicContact OE1-CZ 2.79Å; E135-R138 IonicContact OE1-NE 2.96Å; E135-R138 IonicContact OE1-NH2 2.67Å; E135-R138 PolarHBondContact OE1-NH2 3.42Å; E135-R138 IonicContact OE2-CZ 3.99Å; E135-R138 IonicContact OE2-NE 3.6Å; E135-R138 PolarHBondContact OE2-NE 2.98Å; E135-R138 IonicContact OE2-NH2 3.57Å; E135-R138 PolarHBondContact OE2-NH2 2.99Å; E135-L139 HydrophobicContact CG-CD1 4.11Å; E135-L139 WeakPolarHBondContact O-CB 3.37Å; E135-L139 WeakPolarHBondContact O-CG 3.35Å; E135-L139 PolarHBondContact O-N 3.35Å; E135-R184 HydrophobicContact CB-CB 4.03Å; E135-R184 HydrophobicContact CG-CB 3.81Å; E135-L190 HydrophobicContact CG-CD2 4.28Å
136	C	83.3	Confident	80.1	Confident	3 Å²	3	38.6 Å²	38.6	2%	0.02	19%	0.191	C	C	.	.	H	α-helix	trans	-59.1	-50	173	-68.6	0	0	0	0	111	L54 Y132 H133 R138 L139 E140 L190	L54-C136 HydrophobicContact CD1-CB 4.05Å; Y132-C136 PolarHBondContact O-N 3.48Å; Y132-C136 PolarHBondContact O-SG 2.8Å; H133-C136 WeakPolarHBondContact O-CB 3.49Å; H133-C136 PolarHBondContact O-N 3.03Å; C136-R138 VanDerWaalsContact C-N 3.34Å; C136-R138 PolarHBondContact O-N 3.48Å; C136-L139 PolarHBondContact O-N 2.99Å; C136-E140 WeakPolarHBondContact O-CB 3.37Å; C136-E140 VanDerWaalsContact O-CG 3.31Å; C136-E140 WeakPolarHBondContact O-CG 3.39Å; C136-E140 PolarHBondContact O-N 3.31Å; C136-L190 VanDerWaalsContact SG-CD2 3.57Å
137	L	83.3	Confident	81.8	Confident	59 Å²	59	33.5 Å²	33.5	31%	0.309	16%	0.16	S	C	.	.	H	α-helix	trans	-59.4	-44.4	177.1	-84.1	171	0	0	0	112.1	L54 H133 E134 E140 K141	L54-L137 HydrophobicContact CD2-CD1 4.2Å; L54-L137 HydrophobicContact CD2-CD2 3.15Å; L54-L137 HydrophobicContact CD2-CG 3.43Å; L54-L137 VanDerWaalsContact CD2-CG 3.43Å; H133-L137 VanDerWaalsContact NE2-CD1 3.35Å; H133-L137 WeakPolarHBondContact NE2-CD1 3.48Å; H133-L137 PolarHBondContact O-N 2.91Å; E134-L137 PolarHBondContact O-N 2.59Å; L137-E140 PolarHBondContact O-N 3.08Å; L137-K141 WeakPolarHBondContact O-CB 3.45Å; L137-K141 PolarHBondContact O-N 3.5Å
138	R	89.5	Confident	83	Confident	49 Å²	49	30.1 Å²	30.1	19%	0.185	14%	0.139	C	C	.	.	H	α-helix	trans	-63.2	-45.8	-178.7	-168.4	-166.3	66.8	68.8	-2.3	111.2	E134 E135 C136 L142 D177	E134-R138 WeakPolarHBondContact O-CB 3.22Å; E134-R138 PolarHBondContact O-N 3.19Å; E135-R138 PolarHBondContact O-N 3.1Å; E135-R138 IonicContact OE1-CZ 2.79Å; E135-R138 IonicContact OE1-NE 2.96Å; E135-R138 IonicContact OE1-NH2 2.67Å; E135-R138 PolarHBondContact OE1-NH2 3.42Å; E135-R138 IonicContact OE2-CZ 3.99Å; E135-R138 IonicContact OE2-NE 3.6Å; E135-R138 PolarHBondContact OE2-NE 2.98Å; E135-R138 IonicContact OE2-NH2 3.57Å; E135-R138 PolarHBondContact OE2-NH2 2.99Å; C136-R138 VanDerWaalsContact C-N 3.34Å; C136-R138 PolarHBondContact O-N 3.48Å; R138-L142 WeakPolarHBondContact O-CB 3.44Å; R138-L142 PolarHBondContact O-N 3.41Å; R138-D177 IonicContact CZ-OD1 3.15Å; R138-D177 VanDerWaalsContact NH1-CA 3.34Å; R138-D177 IonicContact NH1-OD1 2.82Å; R138-D177 PolarHBondContact NH1-OD1 3.3Å; R138-D177 IonicContact NH2-OD1 3.66Å; R138-D177 PolarHBondContact NH2-OD1 2.97Å
139	L	90.6	Very high	84.1	Confident	0 Å²	0	31 Å²	31	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-68.1	-41.8	176.8	-70.5	172.1	0	0	0	111.8	E135 C136 L142 Y143 L190 R191 I194	E135-L139 HydrophobicContact CG-CD1 4.11Å; E135-L139 WeakPolarHBondContact O-CB 3.37Å; E135-L139 WeakPolarHBondContact O-CG 3.35Å; E135-L139 PolarHBondContact O-N 3.35Å; C136-L139 PolarHBondContact O-N 2.99Å; L139-L142 PolarHBondContact O-N 3.11Å; L139-Y143 HydrophobicContact CD2-CE2 4.28Å; L139-Y143 VanDerWaalsContact O-CD2 3.22Å; L139-Y143 WeakPolarHBondContact O-CD2 3.41Å; L139-Y143 PolarHBondContact O-N 3.24Å; L139-Y143 VanDerWaalsContact O-N 3.07Å; L139-L190 HydrophobicContact CD1-CB 4.38Å; L139-L190 HydrophobicContact CD1-CD2 3.87Å; L139-L190 HydrophobicContact CD1-CG 3.84Å; L139-R191 HydrophobicContact CD1-CB 4.09Å; L139-R191 HydrophobicContact CD2-CB 4.12Å; L139-R191 HydrophobicContact CD2-CG 4.13Å; L139-I194 HydrophobicContact CB-CD1 3.65Å; L139-I194 HydrophobicContact CD1-CD1 4.28Å
140	E	88	Confident	85.3	Confident	9 Å²	9	33.4 Å²	33.4	4%	0.042	15%	0.153	C	C	.	.	H	α-helix	trans	-59	-48.4	174.3	-77	-69.8	-169.5	0	0	111.3	K113 C136 L137 L142 Y143 F144 I194 K197 W198	K113-E140 WeakPolarHBondContact CE-OE1 3.49Å; K113-E140 IonicContact NZ-OE1 2.79Å; K113-E140 PolarHBondContact NZ-OE1 3.37Å; C136-E140 WeakPolarHBondContact O-CB 3.37Å; C136-E140 VanDerWaalsContact O-CG 3.31Å; C136-E140 WeakPolarHBondContact O-CG 3.39Å; C136-E140 PolarHBondContact O-N 3.31Å; L137-E140 PolarHBondContact O-N 3.08Å; E140-L142 VanDerWaalsContact C-N 3.33Å; E140-L142 PolarHBondContact O-N 3.37Å; E140-Y143 PolarHBondContact O-N 3.33Å; E140-F144 WeakPolarHBondContact O-CB 3.38Å; E140-F144 PolarHBondContact O-N 3.1Å; E140-I194 HydrophobicContact CG-CD1 4.19Å; E140-I194 HydrophobicContact CG-CG2 4.43Å; E140-K197 IonicContact OE1-NZ 2.59Å; E140-K197 PolarHBondContact OE1-NZ 3.07Å; E140-K197 IonicContact OE2-NZ 2.68Å; E140-K197 PolarHBondContact OE2-NZ 3.3Å; E140-W198 PolarHBondContact OE2-NE1 3.49Å
141	K	88.9	Confident	86.1	Confident	100 Å²	100	32.7 Å²	32.7	44%	0.435	15%	0.149	S	C	.	.	H	α-helix	trans	-57.3	-45.8	175.8	-177.6	170.5	-176.6	168.5	0	111.6	L137 Y143 T145 E169 A173	L137-K141 WeakPolarHBondContact O-CB 3.45Å; L137-K141 PolarHBondContact O-N 3.5Å; K141-Y143 PolarHBondContact O-N 2.97Å; K141-T145 HydrophobicContact CG-CG2 4.17Å; K141-T145 WeakPolarHBondContact O-CB 3.2Å; K141-T145 VanDerWaalsContact O-CG2 3.26Å; K141-T145 WeakPolarHBondContact O-CG2 3.31Å; K141-T145 PolarHBondContact O-N 3.49Å; K141-T145 PolarHBondContact O-OG1 3.04Å; K141-E169 WeakPolarHBondContact CE-OE2 3.4Å; K141-E169 IonicContact NZ-OE2 3.84Å; K141-A173 HydrophobicContact CG-CB 4.47Å
142	L	93.9	Very high	86.6	Confident	8 Å²	8	30.1 Å²	30.1	4%	0.042	14%	0.136	C	C	.	.	H	α-helix	trans	-58.2	-48.6	180	176.1	67.1	0	0	0	112.6	R138 L139 E140 T145 K146 Y170 A173 K174 D177	R138-L142 WeakPolarHBondContact O-CB 3.44Å; R138-L142 PolarHBondContact O-N 3.41Å; L139-L142 PolarHBondContact O-N 3.11Å; E140-L142 VanDerWaalsContact C-N 3.33Å; E140-L142 PolarHBondContact O-N 3.37Å; L142-T145 PolarHBondContact O-OG1 3.23Å; L142-K146 WeakPolarHBondContact O-CB 3.11Å; L142-K146 PolarHBondContact O-N 3.2Å; L142-Y170 HydrophobicContact CD1-CD2 4.34Å; L142-Y170 HydrophobicContact CD1-CE2 3.88Å; L142-A173 HydrophobicContact CB-CB 4.33Å; L142-A173 HydrophobicContact CD1-CB 3.97Å; L142-K174 HydrophobicContact CD1-CG 4.04Å; L142-D177 HydrophobicContact CD1-CB 4.33Å; L142-D177 HydrophobicContact CD2-CB 3.9Å; L142-D177 VanDerWaalsContact CD2-CG 3.48Å
143	Y	94.2	Very high	87.3	Confident	31 Å²	31	32.6 Å²	32.6	12%	0.122	15%	0.154	C	C	.	.	H	α-helix	trans	-83.3	-29.8	-175.7	-70.5	-71.9	0	0	0	113.1	L139 E140 K141 W147 R191 I194 S195	L139-Y143 HydrophobicContact CD2-CE2 4.28Å; L139-Y143 VanDerWaalsContact O-CD2 3.22Å; L139-Y143 WeakPolarHBondContact O-CD2 3.41Å; L139-Y143 PolarHBondContact O-N 3.24Å; L139-Y143 VanDerWaalsContact O-N 3.07Å; E140-Y143 PolarHBondContact O-N 3.33Å; K141-Y143 PolarHBondContact O-N 2.97Å; Y143-W147 WeakPolarHBondContact O-CB 3.47Å; Y143-W147 PolarHBondContact O-N 3.47Å; Y143-R191 HydrophobicContact CE2-CG 4.02Å; Y143-R191 VanDerWaalsContact OH-CG 3.23Å; Y143-R191 WeakPolarHBondContact OH-CG 3.4Å; Y143-I194 HydrophobicContact CD2-CB 4.32Å; Y143-I194 HydrophobicContact CD2-CG2 3.65Å; Y143-I194 HydrophobicContact CE2-CG2 4.5Å; Y143-I194 HydrophobicContact CG-CG2 4.27Å; Y143-S195 VanDerWaalsContact CE1-CB 3.48Å; Y143-S195 VanDerWaalsContact CE1-OG 3.24Å; Y143-S195 WeakPolarHBondContact CE1-OG 3.5Å; Y143-S195 VanDerWaalsContact CZ-CB 3.47Å
144	F	89.4	Confident	87.6	Confident	17 Å²	17	34.1 Å²	34.1	8%	0.075	16%	0.161	C	C	.	.	H	α-helix	trans	-62.3	-52.4	170.5	169.3	-112	0	0	0	111.2	Q61 R62 E140 K146 W147 A148 Y166 W198	Q61-F144 HydrophobicContact CB-CE1 4.09Å; Q61-F144 HydrophobicContact CB-CE2 4.23Å; Q61-F144 HydrophobicContact CB-CZ 3.68Å; R62-F144 HydrophobicContact CB-CE2 4.27Å; E140-F144 WeakPolarHBondContact O-CB 3.38Å; E140-F144 PolarHBondContact O-N 3.1Å; F144-K146 VanDerWaalsContact C-N 3.32Å; F144-K146 PolarHBondContact O-N 3.11Å; F144-W147 AromaticContact CD2-CE3 3.87Å; F144-W147 HydrophobicContact CD2-CE3 3.87Å; F144-W147 HydrophobicContact CD2-CZ3 4.2Å; F144-W147 AromaticContact CE2-CE3 3.93Å; F144-W147 HydrophobicContact CE2-CE3 3.93Å; F144-W147 AromaticContact CE2-CZ3 3.78Å; F144-W147 HydrophobicContact CE2-CZ3 3.78Å; F144-W147 CarbonylContact O-C 3.52Å; F144-W147 WeakPolarHBondContact O-CA 3.49Å; F144-W147 WeakPolarHBondContact O-CB 3.26Å; F144-W147 PolarHBondContact O-N 3.06Å; F144-W147 VanDerWaalsContact O-N 3.08Å; F144-A148 WeakPolarHBondContact O-CB 3.44Å; F144-A148 PolarHBondContact O-N 2.85Å; F144-Y166 AromaticContact CE1-CE1 3.82Å; F144-Y166 HydrophobicContact CE1-CE1 3.82Å; F144-Y166 HydrophobicContact CZ-CE1 4.17Å; F144-W198 HydrophobicContact CB-CH2 4.13Å; F144-W198 HydrophobicContact CB-CZ2 3.67Å; F144-W198 AromaticContact CD2-CH2 3.44Å; F144-W198 HydrophobicContact CD2-CH2 3.44Å; F144-W198 VanDerWaalsContact CD2-CH2 3.44Å; F144-W198 AromaticContact CD2-CZ2 3.87Å; F144-W198 HydrophobicContact CD2-CZ2 3.87Å; F144-W198 AromaticContact CD2-CZ3 3.96Å; F144-W198 HydrophobicContact CD2-CZ3 3.96Å; F144-W198 HydrophobicContact CE2-CH2 4.32Å; F144-W198 HydrophobicContact CG-CH2 4.23Å; F144-W198 HydrophobicContact CG-CZ2 4.22Å
145	T	89.2	Confident	87.2	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.1	-39.4	179.8	52.2	0	0	0	0	111.4	K141 L142 W147 A148 V149 E169 Y170	K141-T145 HydrophobicContact CG-CG2 4.17Å; K141-T145 WeakPolarHBondContact O-CB 3.2Å; K141-T145 VanDerWaalsContact O-CG2 3.26Å; K141-T145 WeakPolarHBondContact O-CG2 3.31Å; K141-T145 PolarHBondContact O-N 3.49Å; K141-T145 PolarHBondContact O-OG1 3.04Å; L142-T145 PolarHBondContact O-OG1 3.23Å; T145-W147 VanDerWaalsContact C-N 3.33Å; T145-W147 PolarHBondContact O-N 2.96Å; T145-A148 PolarHBondContact O-N 3.47Å; T145-V149 WeakPolarHBondContact O-CG2 3.39Å; T145-V149 PolarHBondContact O-N 2.96Å; T145-E169 HydrophobicContact CG2-CB 3.87Å; T145-Y170 WeakPolarHBondContact OG1-CD2 3.33Å
146	K	94.6	Very high	86.3	Confident	100 Å²	100	31.8 Å²	31.8	44%	0.435	16%	0.158	S	C	.	.	H	α-helix	trans	-55.5	-47.9	170.6	-174	179.5	179.3	178.4	0	112.2	L142 F144 H150 Y170	L142-K146 WeakPolarHBondContact O-CB 3.11Å; L142-K146 PolarHBondContact O-N 3.2Å; F144-K146 VanDerWaalsContact C-N 3.32Å; F144-K146 PolarHBondContact O-N 3.11Å; K146-H150 WeakPolarHBondContact O-CB 3.3Å; K146-H150 PolarHBondContact O-N 2.86Å; K146-H150 VanDerWaalsContact O-N 3.1Å; K146-Y170 HydrophobicContact CB-CD2 3.96Å; K146-Y170 HydrophobicContact CB-CE1 4.45Å; K146-Y170 HydrophobicContact CB-CE2 3.49Å; K146-Y170 VanDerWaalsContact CB-CE2 3.49Å; K146-Y170 HydrophobicContact CD-CE2 4.44Å; K146-Y170 HydrophobicContact CG-CE1 4.29Å; K146-Y170 HydrophobicContact CG-CE2 4Å
147	W	92.1	Very high	85.3	Confident	6 Å²	6	32.2 Å²	32.2	2%	0.023	16%	0.162	C	C	.	.	H	α-helix	trans	-64.9	-44.2	178.8	165.7	81.4	0	0	0	111.4	R62 L65 Y143 F144 T145 V149 H150 Y151 W198 R201 D205	R62-W147 HydrophobicContact CB-CH2 4.36Å; R62-W147 HydrophobicContact CB-CZ3 4.25Å; R62-W147 HydrophobicContact CG-CH2 3.47Å; R62-W147 VanDerWaalsContact CG-CH2 3.47Å; R62-W147 HydrophobicContact CG-CZ2 4.15Å; R62-W147 HydrophobicContact CG-CZ3 3.85Å; L65-W147 HydrophobicContact CD2-CH2 4.21Å; L65-W147 HydrophobicContact CD2-CZ3 3.88Å; Y143-W147 WeakPolarHBondContact O-CB 3.47Å; Y143-W147 PolarHBondContact O-N 3.47Å; F144-W147 AromaticContact CD2-CE3 3.87Å; F144-W147 HydrophobicContact CD2-CE3 3.87Å; F144-W147 HydrophobicContact CD2-CZ3 4.2Å; F144-W147 AromaticContact CE2-CE3 3.93Å; F144-W147 HydrophobicContact CE2-CE3 3.93Å; F144-W147 AromaticContact CE2-CZ3 3.78Å; F144-W147 HydrophobicContact CE2-CZ3 3.78Å; F144-W147 CarbonylContact O-C 3.52Å; F144-W147 WeakPolarHBondContact O-CA 3.49Å; F144-W147 WeakPolarHBondContact O-CB 3.26Å; F144-W147 PolarHBondContact O-N 3.06Å; F144-W147 VanDerWaalsContact O-N 3.08Å; T145-W147 VanDerWaalsContact C-N 3.33Å; T145-W147 PolarHBondContact O-N 2.96Å; W147-V149 PolarHBondContact O-N 3.47Å; W147-H150 WeakPolarHBondContact O-CB 3.35Å; W147-H150 PolarHBondContact O-N 3.24Å; W147-Y151 HydrophobicContact CH2-CG 4.44Å; W147-Y151 HydrophobicContact CZ2-CD2 4.14Å; W147-Y151 HydrophobicContact CZ2-CG 4.04Å; W147-Y151 WeakPolarHBondContact O-CB 2.95Å; W147-Y151 PolarHBondContact O-N 3.44Å; W147-W198 HydrophobicContact CB-CD2 4.41Å; W147-W198 HydrophobicContact CB-CE3 3.79Å; W147-W198 HydrophobicContact CB-CZ3 4.45Å; W147-W198 AromaticContact CD2-CE3 3.93Å; W147-W198 HydrophobicContact CD2-CE3 3.93Å; W147-W198 AromaticContact CD2-CZ3 3.81Å; W147-W198 HydrophobicContact CD2-CZ3 3.81Å; W147-W198 HydrophobicContact CE3-CE3 4.27Å; W147-W198 AromaticContact CE3-CZ3 3.77Å; W147-W198 HydrophobicContact CE3-CZ3 3.77Å; W147-W198 AromaticContact CG-CE3 3.68Å; W147-W198 HydrophobicContact CG-CE3 3.68Å; W147-W198 HydrophobicContact CG-CZ3 4.08Å; W147-R201 HydrophobicContact CZ2-CG 4.4Å; W147-D205 PolarHBondContact NE1-OD2 3.3Å
148	A	86	Confident	84.4	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60.7	-46.6	179.9	0	0	0	0	0	111.6	L65 F144 T145 H150 Y151 L152 Y166	L65-A148 HydrophobicContact CD2-CB 3.86Å; F144-A148 WeakPolarHBondContact O-CB 3.44Å; F144-A148 PolarHBondContact O-N 2.85Å; T145-A148 PolarHBondContact O-N 3.47Å; A148-H150 PolarHBondContact O-N 2.8Å; A148-Y151 PolarHBondContact O-N 3.16Å; A148-L152 WeakPolarHBondContact O-CB 3.38Å; A148-L152 VanDerWaalsContact O-CG 3.31Å; A148-L152 WeakPolarHBondContact O-CG 3.37Å; A148-L152 PolarHBondContact O-N 2.95Å; A148-Y166 HydrophobicContact CB-CD1 3.73Å; A148-Y166 HydrophobicContact CB-CD2 4.46Å; A148-Y166 HydrophobicContact CB-CE1 4.04Å; A148-Y166 HydrophobicContact CB-CG 3.96Å
149	V	88.2	Confident	83.5	Confident	22 Å²	22	33.3 Å²	33.3	13%	0.133	18%	0.175	C	C	.	.	H	α-helix	trans	-57.9	-50.5	173.4	173.2	0	0	0	0	110.3	T145 W147 Y151 L152 S153 L163 Y166 E167	T145-V149 WeakPolarHBondContact O-CG2 3.39Å; T145-V149 PolarHBondContact O-N 2.96Å; W147-V149 PolarHBondContact O-N 3.47Å; V149-Y151 VanDerWaalsContact C-N 3.32Å; V149-Y151 PolarHBondContact O-N 2.99Å; V149-L152 PolarHBondContact O-N 3.35Å; V149-S153 WeakPolarHBondContact O-CB 3.48Å; V149-S153 PolarHBondContact O-N 2.9Å; V149-S153 PolarHBondContact O-OG 2.65Å; V149-L163 HydrophobicContact CG1-CD1 4.39Å; V149-Y166 WeakPolarHBondContact CG2-O 3.35Å; V149-E167 HydrophobicContact CG1-CG 4.04Å; V149-E167 HydrophobicContact CG2-CG 4.07Å
150	H	89.1	Confident	83.1	Confident	65 Å²	65	38.5 Å²	38.5	30%	0.301	20%	0.201	S	C	.	.	H	α-helix	trans	-57	-45.6	178.5	175.5	-88.2	0	0	0	112.3	K146 W147 A148 K154 E202	K146-H150 WeakPolarHBondContact O-CB 3.3Å; K146-H150 PolarHBondContact O-N 2.86Å; K146-H150 VanDerWaalsContact O-N 3.1Å; W147-H150 WeakPolarHBondContact O-CB 3.35Å; W147-H150 PolarHBondContact O-N 3.24Å; A148-H150 PolarHBondContact O-N 2.8Å; H150-K154 WeakPolarHBondContact O-CB 3.26Å; H150-K154 PolarHBondContact O-N 3.06Å; H150-E202 WeakPolarHBondContact CE1-CG 3.24Å; H150-E202 IonicContact CE1-OE1 3.12Å; H150-E202 WeakPolarHBondContact ND1-CG 3.24Å; H150-E202 IonicContact NE2-OE1 3.7Å
151	Y	84.3	Confident	83	Confident	31 Å²	31	42.9 Å²	42.9	12%	0.122	23%	0.229	C	C	.	.	H	α-helix	trans	-63.8	-47.5	-179.3	-177.8	-99	0	0	0	112	L66 M77 W147 A148 V149 N155 D205	L66-Y151 HydrophobicContact CD2-CD1 4.47Å; L66-Y151 HydrophobicContact CD2-CE1 3.45Å; L66-Y151 VanDerWaalsContact CD2-CE1 3.45Å; L66-Y151 VanDerWaalsContact CD2-OH 3.24Å; L66-Y151 WeakPolarHBondContact CD2-OH 3.24Å; M77-Y151 HydrophobicContact CE-CD1 3.84Å; M77-Y151 HydrophobicContact CE-CE1 3.32Å; W147-Y151 HydrophobicContact CH2-CG 4.44Å; W147-Y151 HydrophobicContact CZ2-CD2 4.14Å; W147-Y151 HydrophobicContact CZ2-CG 4.04Å; W147-Y151 WeakPolarHBondContact O-CB 2.95Å; W147-Y151 PolarHBondContact O-N 3.44Å; A148-Y151 PolarHBondContact O-N 3.16Å; V149-Y151 VanDerWaalsContact C-N 3.32Å; V149-Y151 PolarHBondContact O-N 2.99Å; Y151-N155 WeakPolarHBondContact CE2-ND2 3.11Å; Y151-N155 WeakPolarHBondContact O-CB 3.37Å; Y151-N155 PolarHBondContact O-N 3.4Å; Y151-N155 PolarHBondContact O-ND2 2.96Å; Y151-D205 HydrophobicContact CD2-CB 4.17Å; Y151-D205 HydrophobicContact CE2-CB 4.25Å
152	L	83.4	Confident	82.7	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-67.6	-43.4	179.4	-68.5	172.1	0	0	0	112	L65 L69 M77 A148 V149 A156 A157 L162 L163 Y166	L65-L152 HydrophobicContact CD1-CD1 4.41Å; L65-L152 HydrophobicContact CD1-CD2 4.41Å; L69-L152 HydrophobicContact CD2-CD2 4.06Å; M77-L152 HydrophobicContact CE-CD2 4.26Å; A148-L152 WeakPolarHBondContact O-CB 3.38Å; A148-L152 VanDerWaalsContact O-CG 3.31Å; A148-L152 WeakPolarHBondContact O-CG 3.37Å; A148-L152 PolarHBondContact O-N 2.95Å; V149-L152 PolarHBondContact O-N 3.35Å; L152-A156 PolarHBondContact O-N 3.49Å; L152-A157 HydrophobicContact CB-CB 4.11Å; L152-A157 HydrophobicContact CD2-CB 4.05Å; L152-A157 PolarHBondContact O-N 3.09Å; L152-A157 VanDerWaalsContact O-N 3.08Å; L152-L162 HydrophobicContact CD1-CG 4.25Å; L152-L162 HydrophobicContact CD2-CD2 4.37Å; L152-L163 HydrophobicContact CB-CD1 3.85Å; L152-Y166 HydrophobicContact CD1-CD2 3.68Å; L152-Y166 HydrophobicContact CD1-CE2 4.37Å; L152-Y166 HydrophobicContact CD1-CG 4.4Å
153	S	86.1	Confident	82.3	Confident	58 Å²	58	40.6 Å²	40.6	41%	0.406	22%	0.221	S	C	.	.	H	α-helix	trans	-66.1	-40	178.1	-58.1	0	0	0	0	112.5	V149 N155 A156	V149-S153 WeakPolarHBondContact O-CB 3.48Å; V149-S153 PolarHBondContact O-N 2.9Å; V149-S153 PolarHBondContact O-OG 2.65Å; S153-N155 VanDerWaalsContact C-N 3.3Å; S153-N155 PolarHBondContact O-N 3.35Å; S153-A156 PolarHBondContact O-N 3.42Å
154	K	81.2	Confident	82.2	Confident	55 Å²	55	43.8 Å²	43.8	24%	0.239	24%	0.237	C	C	.	.	H	α-helix	trans	-66.4	-34.9	-177.4	-178.7	171.3	177.8	174	0	112.6	K84 H150 A156 D206	K84-K154 PolarHBondContact NZ-O 2.77Å; H150-K154 WeakPolarHBondContact O-CB 3.26Å; H150-K154 PolarHBondContact O-N 3.06Å; K154-A156 VanDerWaalsContact C-N 3.34Å; K154-D206 IonicContact NZ-OD1 3.53Å; K154-D206 PolarHBondContact NZ-OD1 2.97Å; K154-D206 IonicContact NZ-OD2 2.68Å
155	N	70.7	Confident	82.1	Confident	4 Å²	4	45.6 Å²	45.6	2%	0.021	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	14.7	-177.4	-63.3	-46.7	0	0	0	112.8	M77 Q80 Y151 S153 A157	M77-N155 WeakPolarHBondContact CA-O 3.24Å; M77-N155 HydrophobicContact CB-CB 3.63Å; M77-N155 HydrophobicContact CE-CB 3.51Å; M77-N155 HydrophobicContact CG-CB 3.59Å; M77-N155 VanDerWaalsContact CG-O 3.3Å; M77-N155 WeakPolarHBondContact CG-O 3.39Å; M77-N155 HydrophobicContact SD-CB 4.4Å; Q80-N155 PolarHBondContact OE1-O 3.09Å; Q80-N155 VanDerWaalsContact OE1-O 3.06Å; Y151-N155 WeakPolarHBondContact CE2-ND2 3.11Å; Y151-N155 WeakPolarHBondContact O-CB 3.37Å; Y151-N155 PolarHBondContact O-N 3.4Å; Y151-N155 PolarHBondContact O-ND2 2.96Å; S153-N155 VanDerWaalsContact C-N 3.3Å; S153-N155 PolarHBondContact O-N 3.35Å; N155-A157 PolarHBondContact O-N 3.3Å
156	A	66.5	Low	82.1	Confident	50 Å²	50	46.6 Å²	46.6	41%	0.413	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	31.1	66.3	-172.7	0	0	0	0	0	113.8	L152 S153 K154 T158	L152-A156 PolarHBondContact O-N 3.49Å; S153-A156 PolarHBondContact O-N 3.42Å; K154-A156 VanDerWaalsContact C-N 3.34Å; A156-T158 PolarHBondContact O-N 2.92Å
157	A	61.4	Low	82	Confident	13 Å²	13	45.5 Å²	45.5	11%	0.107	25%	0.253	C	S	.	.			trans	-41.6	125	169.6	0	0	0	0	0	110.7	E73 L152 N155 D159	E73-A157 VanDerWaalsContact OE1-C 3.23Å; E73-A157 WeakPolarHBondContact OE1-CA 3.23Å; E73-A157 VanDerWaalsContact OE1-CB 3.23Å; E73-A157 WeakPolarHBondContact OE1-CB 3.34Å; L152-A157 HydrophobicContact CB-CB 4.11Å; L152-A157 HydrophobicContact CD2-CB 4.05Å; L152-A157 PolarHBondContact O-N 3.09Å; L152-A157 VanDerWaalsContact O-N 3.08Å; N155-A157 PolarHBondContact O-N 3.3Å; A157-D159 VanDerWaalsContact C-N 3.26Å
158	T	65.1	Low	82.2	Confident	75 Å²	75	50.4 Å²	50.4	46%	0.46	28%	0.279	S	S	.	.	S	Bend	trans	-71.6	-27.4	172.4	44.7	0	0	0	0	111	E73 A156 I160	E73-T158 WeakPolarHBondContact CB-OG1 3.49Å; E73-T158 VanDerWaalsContact CG-OG1 3.24Å; E73-T158 WeakPolarHBondContact CG-OG1 3.3Å; E73-T158 PolarHBondContact OE1-N 3.31Å; E73-T158 PolarHBondContact OE1-OG1 3.44Å; E73-T158 PolarHBondContact OE2-OG1 2.98Å; A156-T158 PolarHBondContact O-N 2.92Å; T158-I160 VanDerWaalsContact C-N 3.33Å; T158-I160 PolarHBondContact O-N 3.32Å
159	D	71.5	Confident	82.5	Confident	56 Å²	56	53.6 Å²	53.6	30%	0.299	29%	0.294	S	S	.	.			trans	-78.9	84	173.5	-166.2	-15.6	0	0	0	111	E73 A157 T161 L162 L163	E73-D159 PolarHBondContact OE1-N 3.36Å; E73-D159 WeakPolarHBondContact OE2-CB 3.42Å; E73-D159 PolarHBondContact OE2-N 2.76Å; A157-D159 VanDerWaalsContact C-N 3.26Å; D159-T161 PolarHBondContact O-N 2.84Å; D159-T161 WeakPolarHBondContact OD1-CA 3.35Å; D159-T161 VanDerWaalsContact OD1-CB 3.23Å; D159-T161 WeakPolarHBondContact OD1-CB 3.47Å; D159-T161 PolarHBondContact OD1-N 2.75Å; D159-L162 HydrophobicContact CB-CB 3.93Å; D159-L162 PolarHBondContact O-N 2.86Å; D159-L162 PolarHBondContact OD1-N 3.26Å; D159-L163 PolarHBondContact O-N 3.39Å; D159-L163 VanDerWaalsContact O-N 3.16Å
160	I	81.8	Confident	82.8	Confident	108 Å²	108	54.7 Å²	54.7	55%	0.554	30%	0.296	S	S	*	.	H	α-helix	trans	-56.4	-32	173.8	-61.7	172.6	0	0	0	110.8	T158 Q164	T158-I160 VanDerWaalsContact C-N 3.33Å; T158-I160 PolarHBondContact O-N 3.32Å; I160-Q164 HydrophobicContact CG2-CG 4.19Å; I160-Q164 VanDerWaalsContact O-CB 3.3Å; I160-Q164 WeakPolarHBondContact O-CB 3.37Å; I160-Q164 WeakPolarHBondContact O-CG 3.49Å; I160-Q164 PolarHBondContact O-N 3.26Å
161	T	85.8	Confident	83.2	Confident	102 Å²	102	55.8 Å²	55.8	63%	0.626	30%	0.301	S	S	*	.	H	α-helix	trans	-70	-43.2	-178.5	-48.3	0	0	0	0	110.8	D159 Q164 S165	D159-T161 PolarHBondContact O-N 2.84Å; D159-T161 WeakPolarHBondContact OD1-CA 3.35Å; D159-T161 VanDerWaalsContact OD1-CB 3.23Å; D159-T161 WeakPolarHBondContact OD1-CB 3.47Å; D159-T161 PolarHBondContact OD1-N 2.75Å; T161-Q164 PolarHBondContact O-N 3.17Å; T161-S165 WeakPolarHBondContact O-CB 3.43Å; T161-S165 PolarHBondContact O-N 2.89Å
162	L	82	Confident	83.7	Confident	31 Å²	31	59.6 Å²	59.6	16%	0.162	32%	0.32	C	S	.	.	H	α-helix	trans	-64	-45.5	177	-175.4	62.9	0	0	0	111.5	L65 L69 L152 D159 S165 Y166	L65-L162 HydrophobicContact CD1-CD1 4.41Å; L65-L162 HydrophobicContact CD1-CD2 3.9Å; L65-L162 HydrophobicContact CD1-CG 4.35Å; L69-L162 HydrophobicContact CD2-CD2 3.72Å; L69-L162 HydrophobicContact CG-CD2 4.43Å; L152-L162 HydrophobicContact CD1-CG 4.25Å; L152-L162 HydrophobicContact CD2-CD2 4.37Å; D159-L162 HydrophobicContact CB-CB 3.93Å; D159-L162 PolarHBondContact O-N 2.86Å; D159-L162 PolarHBondContact OD1-N 3.26Å; L162-S165 WeakPolarHBondContact O-CB 3.49Å; L162-S165 PolarHBondContact O-N 2.99Å; L162-Y166 HydrophobicContact CD1-CD2 4.11Å; L162-Y166 HydrophobicContact CD1-CE2 3.74Å; L162-Y166 HydrophobicContact CG-CD2 4.29Å; L162-Y166 HydrophobicContact CG-CE2 4.23Å; L162-Y166 WeakPolarHBondContact O-CD2 3.37Å; L162-Y166 PolarHBondContact O-N 2.82Å; L162-Y166 VanDerWaalsContact O-N 3.13Å
163	L	86.9	Confident	84.2	Confident	29 Å²	29	60.2 Å²	60.2	15%	0.152	33%	0.326	C	S	.	.	H	α-helix	trans	-58.9	-49.9	174.8	173.8	59.9	0	0	0	111	V149 L152 D159 S165 Y166 E167	V149-L163 HydrophobicContact CG1-CD1 4.39Å; L152-L163 HydrophobicContact CB-CD1 3.85Å; D159-L163 PolarHBondContact O-N 3.39Å; D159-L163 VanDerWaalsContact O-N 3.16Å; L163-S165 VanDerWaalsContact C-N 3.26Å; L163-S165 PolarHBondContact O-N 3.3Å; L163-Y166 PolarHBondContact O-N 3.28Å; L163-Y166 VanDerWaalsContact O-N 3.15Å; L163-E167 HydrophobicContact CD1-CG 4.08Å; L163-E167 HydrophobicContact CG-CG 4.35Å; L163-E167 WeakPolarHBondContact O-CG 3.31Å; L163-E167 PolarHBondContact O-N 3.38Å
164	Q	90.8	Very high	84.7	Confident	98 Å²	98	60.3 Å²	60.3	46%	0.458	32%	0.318	S	S	.	.	H	α-helix	trans	-59.2	-36.9	177.7	-76.7	174.1	-10.8	0	0	112.4	I160 T161 E167 N168	I160-Q164 HydrophobicContact CG2-CG 4.19Å; I160-Q164 VanDerWaalsContact O-CB 3.3Å; I160-Q164 WeakPolarHBondContact O-CB 3.37Å; I160-Q164 WeakPolarHBondContact O-CG 3.49Å; I160-Q164 PolarHBondContact O-N 3.26Å; T161-Q164 PolarHBondContact O-N 3.17Å; Q164-E167 PolarHBondContact O-N 2.67Å; Q164-N168 WeakPolarHBondContact O-CB 3.39Å; Q164-N168 PolarHBondContact O-N 2.63Å; Q164-N168 PolarHBondContact O-ND2 2.86Å; Q164-N168 VanDerWaalsContact O-ND2 3.09Å
165	S	88.6	Confident	85.4	Confident	55 Å²	55	62.8 Å²	62.8	39%	0.385	33%	0.329	S	S	.	.	H	α-helix	trans	-60.4	-49.4	175.1	-171.8	0	0	0	0	111.3	T161 L162 L163 N168 E169	T161-S165 WeakPolarHBondContact O-CB 3.43Å; T161-S165 PolarHBondContact O-N 2.89Å; L162-S165 WeakPolarHBondContact O-CB 3.49Å; L162-S165 PolarHBondContact O-N 2.99Å; L163-S165 VanDerWaalsContact C-N 3.26Å; L163-S165 PolarHBondContact O-N 3.3Å; S165-N168 PolarHBondContact O-N 3.39Å; S165-E169 PolarHBondContact O-N 2.7Å
166	Y	88.2	Confident	86.3	Confident	21 Å²	21	64.2 Å²	64.2	8%	0.082	35%	0.345	C	S	.	.	H	α-helix	trans	-69.7	-32.7	177.9	-81.1	-69.4	0	0	0	113.4	L65 F144 A148 V149 L152 L162 L163 E169 Y170	L65-Y166 HydrophobicContact CD1-CD2 4.3Å; L65-Y166 HydrophobicContact CD1-CE2 3.44Å; L65-Y166 VanDerWaalsContact CD1-CE2 3.44Å; L65-Y166 HydrophobicContact CD2-CE2 4.22Å; L65-Y166 HydrophobicContact CG-CE2 4.37Å; F144-Y166 AromaticContact CE1-CE1 3.82Å; F144-Y166 HydrophobicContact CE1-CE1 3.82Å; F144-Y166 HydrophobicContact CZ-CE1 4.17Å; A148-Y166 HydrophobicContact CB-CD1 3.73Å; A148-Y166 HydrophobicContact CB-CD2 4.46Å; A148-Y166 HydrophobicContact CB-CE1 4.04Å; A148-Y166 HydrophobicContact CB-CG 3.96Å; V149-Y166 WeakPolarHBondContact CG2-O 3.35Å; L152-Y166 HydrophobicContact CD1-CD2 3.68Å; L152-Y166 HydrophobicContact CD1-CE2 4.37Å; L152-Y166 HydrophobicContact CD1-CG 4.4Å; L162-Y166 HydrophobicContact CD1-CD2 4.11Å; L162-Y166 HydrophobicContact CD1-CE2 3.74Å; L162-Y166 HydrophobicContact CG-CD2 4.29Å; L162-Y166 HydrophobicContact CG-CE2 4.23Å; L162-Y166 WeakPolarHBondContact O-CD2 3.37Å; L162-Y166 PolarHBondContact O-N 2.82Å; L162-Y166 VanDerWaalsContact O-N 3.13Å; L163-Y166 PolarHBondContact O-N 3.28Å; L163-Y166 VanDerWaalsContact O-N 3.15Å; Y166-E169 PolarHBondContact O-N 2.67Å; Y166-Y170 VanDerWaalsContact O-CB 3.3Å; Y166-Y170 WeakPolarHBondContact O-CB 3.48Å; Y166-Y170 PolarHBondContact O-N 2.97Å
167	E	93.5	Very high	87.5	Confident	77 Å²	77	63.8 Å²	63.8	36%	0.36	34%	0.336	S	S	.	.	H	α-helix	trans	-60.2	-47.3	171.8	-75	178	154.2	0	0	110.7	V149 L163 Q164 Y170 E171	V149-E167 HydrophobicContact CG1-CG 4.04Å; V149-E167 HydrophobicContact CG2-CG 4.07Å; L163-E167 HydrophobicContact CD1-CG 4.08Å; L163-E167 HydrophobicContact CG-CG 4.35Å; L163-E167 WeakPolarHBondContact O-CG 3.31Å; L163-E167 PolarHBondContact O-N 3.38Å; Q164-E167 PolarHBondContact O-N 2.67Å; E167-Y170 PolarHBondContact O-N 2.83Å; E167-E171 WeakPolarHBondContact O-CG 3.45Å; E167-E171 PolarHBondContact O-N 2.79Å
168	N	95.3	Very high	88.9	Confident	108 Å²	108	71.3 Å²	71.3	58%	0.578	37%	0.366	S	S	*	.	H	α-helix	trans	-61.4	-46.1	175.8	-71.1	-32.6	0	0	0	111.7	Q164 S165 Y170 E171 E172	Q164-N168 WeakPolarHBondContact O-CB 3.39Å; Q164-N168 PolarHBondContact O-N 2.63Å; Q164-N168 PolarHBondContact O-ND2 2.86Å; Q164-N168 VanDerWaalsContact O-ND2 3.09Å; S165-N168 PolarHBondContact O-N 3.39Å; N168-Y170 VanDerWaalsContact C-N 3.29Å; N168-Y170 PolarHBondContact O-N 3.47Å; N168-E171 PolarHBondContact O-N 3.2Å; N168-E172 WeakPolarHBondContact O-CG 3.36Å; N168-E172 PolarHBondContact O-N 3.4Å
169	E	91.2	Very high	89.9	Confident	68 Å²	68	74.6 Å²	74.6	32%	0.318	38%	0.381	S	S	.	.	H	α-helix	trans	-61.3	-37.7	176.5	-76.1	-161.2	-128.3	0	0	112.9	K141 T145 S165 Y166 A173	K141-E169 WeakPolarHBondContact CE-OE2 3.4Å; K141-E169 IonicContact NZ-OE2 3.84Å; T145-E169 HydrophobicContact CG2-CB 3.87Å; S165-E169 PolarHBondContact O-N 2.7Å; Y166-E169 PolarHBondContact O-N 2.67Å; E169-A173 WeakPolarHBondContact O-CB 3.35Å; E169-A173 PolarHBondContact O-N 3.41Å
170	Y	95.6	Very high	90.6	Very high	45 Å²	45	73 Å²	73	18%	0.176	38%	0.375	C	S	.	.	H	α-helix	trans	-69.8	-41.5	177	-179	-134	0	0	0	111.9	L142 T145 K146 Y166 E167 N168 E172 A173 K174	L142-Y170 HydrophobicContact CD1-CD2 4.34Å; L142-Y170 HydrophobicContact CD1-CE2 3.88Å; T145-Y170 WeakPolarHBondContact OG1-CD2 3.33Å; K146-Y170 HydrophobicContact CB-CD2 3.96Å; K146-Y170 HydrophobicContact CB-CE1 4.45Å; K146-Y170 HydrophobicContact CB-CE2 3.49Å; K146-Y170 VanDerWaalsContact CB-CE2 3.49Å; K146-Y170 HydrophobicContact CD-CE2 4.44Å; K146-Y170 HydrophobicContact CG-CE1 4.29Å; K146-Y170 HydrophobicContact CG-CE2 4Å; Y166-Y170 VanDerWaalsContact O-CB 3.3Å; Y166-Y170 WeakPolarHBondContact O-CB 3.48Å; Y166-Y170 PolarHBondContact O-N 2.97Å; E167-Y170 PolarHBondContact O-N 2.83Å; N168-Y170 VanDerWaalsContact C-N 3.29Å; N168-Y170 PolarHBondContact O-N 3.47Å; Y170-E172 VanDerWaalsContact C-N 3.34Å; Y170-E172 PolarHBondContact O-N 3.36Å; Y170-A173 PolarHBondContact O-N 2.78Å; Y170-K174 HydrophobicContact CD1-CD 4.33Å; Y170-K174 HydrophobicContact CD2-CG 4.12Å; Y170-K174 HydrophobicContact CE1-CD 3.76Å; Y170-K174 HydrophobicContact CE1-CG 4.35Å; Y170-K174 HydrophobicContact CE2-CD 3.96Å; Y170-K174 HydrophobicContact CE2-CG 3.64Å; Y170-K174 WeakPolarHBondContact O-CB 3.42Å; Y170-K174 WeakPolarHBondContact O-CG 3.39Å; Y170-K174 PolarHBondContact O-N 3.39Å
171	E	97.1	Very high	90.7	Very high	88 Å²	88	71.6 Å²	71.6	41%	0.411	37%	0.369	S	S	.	.	H	α-helix	trans	-60.1	-44.2	174	-72.6	-56.1	151.7	0	0	111.8	E167 N168 K174 K175	E167-E171 WeakPolarHBondContact O-CG 3.45Å; E167-E171 PolarHBondContact O-N 2.79Å; N168-E171 PolarHBondContact O-N 3.2Å; E171-K174 PolarHBondContact O-N 2.85Å; E171-K174 WeakPolarHBondContact OE1-CE 3.48Å; E171-K174 IonicContact OE1-NZ 2.81Å; E171-K174 PolarHBondContact OE1-NZ 3.14Å; E171-K174 WeakPolarHBondContact OE2-CE 3.49Å; E171-K174 IonicContact OE2-NZ 3.57Å; E171-K174 PolarHBondContact OE2-NZ 2.88Å; E171-K175 WeakPolarHBondContact O-CG 3.48Å; E171-K175 PolarHBondContact O-N 3.44Å
172	E	95.1	Very high	90.3	Very high	110 Å²	110	77.5 Å²	77.5	51%	0.514	38%	0.38	S	S	.	.	H	α-helix	trans	-64.1	-42.1	175.2	-71	-53.7	120.8	0	0	111.8	N168 Y170 K174 K175 G176	N168-E172 WeakPolarHBondContact O-CG 3.36Å; N168-E172 PolarHBondContact O-N 3.4Å; Y170-E172 VanDerWaalsContact C-N 3.34Å; Y170-E172 PolarHBondContact O-N 3.36Å; E172-K174 VanDerWaalsContact C-N 3.32Å; E172-K174 PolarHBondContact O-N 2.96Å; E172-K175 PolarHBondContact O-N 3.32Å; E172-K175 IonicContact OE1-NZ 3.71Å; E172-K175 PolarHBondContact OE1-NZ 3.26Å; E172-G176 PolarHBondContact O-N 3.27Å
173	A	94	Very high	89.9	Confident	14 Å²	14	85.6 Å²	85.6	12%	0.116	41%	0.408	C	S	.	.	H	α-helix	trans	-62.3	-39	175.1	0	0	0	0	0	112.1	K141 L142 E169 Y170 G176 D177	K141-A173 HydrophobicContact CG-CB 4.47Å; L142-A173 HydrophobicContact CB-CB 4.33Å; L142-A173 HydrophobicContact CD1-CB 3.97Å; E169-A173 WeakPolarHBondContact O-CB 3.35Å; E169-A173 PolarHBondContact O-N 3.41Å; Y170-A173 PolarHBondContact O-N 2.78Å; A173-G176 PolarHBondContact O-N 3.16Å; A173-D177 WeakPolarHBondContact O-CB 3.06Å; A173-D177 PolarHBondContact O-N 3.5Å
174	K	96.6	Very high	89.4	Confident	59 Å²	59	87.7 Å²	87.7	26%	0.257	41%	0.414	S	S	.	.	H	α-helix	trans	-65.3	-42.1	174.7	-78.6	-173	-65.8	-177.7	0	112.5	L142 Y170 E171 E172 G176 D177 K178	L142-K174 HydrophobicContact CD1-CG 4.04Å; Y170-K174 HydrophobicContact CD1-CD 4.33Å; Y170-K174 HydrophobicContact CD2-CG 4.12Å; Y170-K174 HydrophobicContact CE1-CD 3.76Å; Y170-K174 HydrophobicContact CE1-CG 4.35Å; Y170-K174 HydrophobicContact CE2-CD 3.96Å; Y170-K174 HydrophobicContact CE2-CG 3.64Å; Y170-K174 WeakPolarHBondContact O-CB 3.42Å; Y170-K174 WeakPolarHBondContact O-CG 3.39Å; Y170-K174 PolarHBondContact O-N 3.39Å; E171-K174 PolarHBondContact O-N 2.85Å; E171-K174 WeakPolarHBondContact OE1-CE 3.48Å; E171-K174 IonicContact OE1-NZ 2.81Å; E171-K174 PolarHBondContact OE1-NZ 3.14Å; E171-K174 WeakPolarHBondContact OE2-CE 3.49Å; E171-K174 IonicContact OE2-NZ 3.57Å; E171-K174 PolarHBondContact OE2-NZ 2.88Å; E172-K174 VanDerWaalsContact C-N 3.32Å; E172-K174 PolarHBondContact O-N 2.96Å; K174-G176 VanDerWaalsContact C-N 3.34Å; K174-D177 PolarHBondContact O-N 3.47Å; K174-K178 WeakPolarHBondContact O-CG 3.4Å; K174-K178 PolarHBondContact O-N 2.9Å
175	K	95.1	Very high	88.6	Confident	108 Å²	108	83.6 Å²	83.6	47%	0.47	40%	0.395	S	S	.	.	H	α-helix	trans	-61.2	-45.9	174.3	-70.9	173	-169.2	168	0	110.6	E171 E172 D177 K178 N179	E171-K175 WeakPolarHBondContact O-CG 3.48Å; E171-K175 PolarHBondContact O-N 3.44Å; E172-K175 PolarHBondContact O-N 3.32Å; E172-K175 IonicContact OE1-NZ 3.71Å; E172-K175 PolarHBondContact OE1-NZ 3.26Å; K175-D177 VanDerWaalsContact C-N 3.28Å; K175-D177 PolarHBondContact O-N 3.42Å; K175-K178 PolarHBondContact O-N 2.87Å; K175-N179 PolarHBondContact O-N 3.29Å; K175-N179 PolarHBondContact O-ND2 3.45Å
176	G	90.1	Very high	87.3	Confident	34 Å²	34	91.1 Å²	91.1	35%	0.351	42%	0.415	S	S	.	.	H	α-helix	trans	-58.6	-38.7	173.7	0	0	0	0	0	112.8	E172 A173 K174 N179 A180	E172-G176 PolarHBondContact O-N 3.27Å; A173-G176 PolarHBondContact O-N 3.16Å; K174-G176 VanDerWaalsContact C-N 3.34Å; G176-N179 PolarHBondContact O-N 3.48Å; G176-A180 PolarHBondContact O-N 2.9Å; G176-A180 VanDerWaalsContact O-N 3.1Å
177	D	92.4	Very high	86.5	Confident	40 Å²	40	93.8 Å²	93.8	21%	0.214	44%	0.437	C	S	.	.	H	α-helix	trans	-67.3	-39.9	178.4	-165.4	56.2	0	0	0	113.8	R138 L142 A173 K174 K175 N179 A180 R191	R138-D177 IonicContact CZ-OD1 3.15Å; R138-D177 VanDerWaalsContact NH1-CA 3.34Å; R138-D177 IonicContact NH1-OD1 2.82Å; R138-D177 PolarHBondContact NH1-OD1 3.3Å; R138-D177 IonicContact NH2-OD1 3.66Å; R138-D177 PolarHBondContact NH2-OD1 2.97Å; L142-D177 HydrophobicContact CD1-CB 4.33Å; L142-D177 HydrophobicContact CD2-CB 3.9Å; L142-D177 VanDerWaalsContact CD2-CG 3.48Å; A173-D177 WeakPolarHBondContact O-CB 3.06Å; A173-D177 PolarHBondContact O-N 3.5Å; K174-D177 PolarHBondContact O-N 3.47Å; K175-D177 VanDerWaalsContact C-N 3.28Å; K175-D177 PolarHBondContact O-N 3.42Å; D177-N179 PolarHBondContact O-N 2.99Å; D177-A180 PolarHBondContact O-N 3.2Å; D177-R191 VanDerWaalsContact CG-NH1 3.3Å; D177-R191 IonicContact OD1-CZ 2.65Å; D177-R191 VanDerWaalsContact OD1-CZ 3.23Å; D177-R191 IonicContact OD1-NH1 2.63Å; D177-R191 PolarHBondContact OD1-NH1 3.4Å; D177-R191 IonicContact OD1-NH2 2.77Å; D177-R191 PolarHBondContact OD1-NH2 3.29Å; D177-R191 IonicContact OD2-CZ 3.06Å; D177-R191 IonicContact OD2-NH1 2.7Å; D177-R191 PolarHBondContact OD2-NH1 2.85Å; D177-R191 IonicContact OD2-NH2 3.61Å
178	K	89.3	Confident	86	Confident	171 Å²	171	91.5 Å²	91.5	74%	0.743	43%	0.434	S	S	*	.	H	α-helix	trans	-61.3	-34.9	176.7	-72.4	176.5	-177.8	179.2	0	112.4	K174 K175	K174-K178 WeakPolarHBondContact O-CG 3.4Å; K174-K178 PolarHBondContact O-N 2.9Å; K175-K178 PolarHBondContact O-N 2.87Å
179	N	87.6	Confident	85.5	Confident	144 Å²	144	89.2 Å²	89.2	77%	0.77	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-0.5	-176.7	-63.5	-26.3	0	0	0	113.4	K175 G176 D177	K175-N179 PolarHBondContact O-N 3.29Å; K175-N179 PolarHBondContact O-ND2 3.45Å; G176-N179 PolarHBondContact O-N 3.48Å; D177-N179 PolarHBondContact O-N 2.99Å
180	A	86.5	Confident	85.3	Confident	22 Å²	22	86 Å²	86	18%	0.182	41%	0.406	C	S	.	.	S	Bend	trans	-69.4	140.7	-176.8	0	0	0	0	0	111.8	G176 D177 R182	G176-A180 PolarHBondContact O-N 2.9Å; G176-A180 VanDerWaalsContact O-N 3.1Å; D177-A180 PolarHBondContact O-N 3.2Å; A180-R182 PolarHBondContact O-N 3.37Å; A180-R182 VanDerWaalsContact O-N 3.08Å
181	D	82.6	Confident	85.2	Confident	79 Å²	79	86.9 Å²	86.9	42%	0.422	41%	0.409	S	S	.	.			trans	-67.4	109.3	172.2	178.6	3.7	0	0	0	109.7	R183 R184	D181-R183 PolarHBondContact O-N 2.91Å; D181-R183 VanDerWaalsContact OD1-CB 3.26Å; D181-R183 WeakPolarHBondContact OD1-CB 3.38Å; D181-R183 WeakPolarHBondContact OD1-CG 3.42Å; D181-R183 PolarHBondContact OD1-N 3.45Å; D181-R184 HydrophobicContact CB-CG 4.02Å; D181-R184 VanDerWaalsContact O-CB 3.31Å; D181-R184 WeakPolarHBondContact O-CB 3.37Å; D181-R184 WeakPolarHBondContact O-CG 3.32Å; D181-R184 PolarHBondContact O-N 3.43Å
182	R	77.6	Confident	84.9	Confident	226 Å²	226	86 Å²	86	85%	0.853	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-61	-18.6	-178.6	-61	-174.5	-177.2	-177.5	1.1	113.2	A180 R184 D185	A180-R182 PolarHBondContact O-N 3.37Å; A180-R182 VanDerWaalsContact O-N 3.08Å; R182-R184 PolarHBondContact O-N 3.02Å; R182-D185 PolarHBondContact O-N 3.42Å
183	R	74.8	Confident	84.7	Confident	201 Å²	201	83.7 Å²	83.7	76%	0.758	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-71.4	-19.1	176.3	-58.7	174.5	-176.9	-179.3	2.1	112.6	D181 D185 W186	D181-R183 PolarHBondContact O-N 2.91Å; D181-R183 VanDerWaalsContact OD1-CB 3.26Å; D181-R183 WeakPolarHBondContact OD1-CB 3.38Å; D181-R183 WeakPolarHBondContact OD1-CG 3.42Å; D181-R183 PolarHBondContact OD1-N 3.45Å; R183-D185 PolarHBondContact O-N 2.81Å; R183-W186 PolarHBondContact O-N 2.85Å
184	R	75.5	Confident	84.6	Confident	74 Å²	74	83 Å²	83	28%	0.279	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-67.9	-21.8	176.6	-61.8	-177.6	-180	-151.3	-0.8	113.1	I131 Y132 E134 E135 D181 R182	I131-R184 HydrophobicContact CG2-CB 4.46Å; I131-R184 HydrophobicContact CG2-CG 3.7Å; Y132-R184 WeakPolarHBondContact CE1-O 3.39Å; Y132-R184 WeakPolarHBondContact CE2-O 3.43Å; Y132-R184 PolarHBondContact OH-O 2.79Å; Y132-R184 VanDerWaalsContact OH-O 3.08Å; E134-R184 IonicContact OE2-NH1 2.67Å; E134-R184 PolarHBondContact OE2-NH1 2.9Å; E135-R184 HydrophobicContact CB-CB 4.03Å; E135-R184 HydrophobicContact CG-CB 3.81Å; D181-R184 HydrophobicContact CB-CG 4.02Å; D181-R184 VanDerWaalsContact O-CB 3.31Å; D181-R184 WeakPolarHBondContact O-CB 3.37Å; D181-R184 WeakPolarHBondContact O-CG 3.32Å; D181-R184 PolarHBondContact O-N 3.43Å; R182-R184 PolarHBondContact O-N 3.02Å
185	D	73.9	Confident	84.5	Confident	11 Å²	11	82.1 Å²	82.1	6%	0.059	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-119.1	66.6	168	-175.4	11	0	0	0	108.9	R182 R183 S187 G188 L189 L190 R191	R182-D185 PolarHBondContact O-N 3.42Å; R183-D185 PolarHBondContact O-N 2.81Å; D185-S187 PolarHBondContact O-N 3.24Å; D185-G188 VanDerWaalsContact CG-CA 3.41Å; D185-G188 PolarHBondContact O-N 3.07Å; D185-G188 WeakPolarHBondContact OD1-CA 3.45Å; D185-G188 PolarHBondContact OD1-N 2.86Å; D185-G188 WeakPolarHBondContact OD2-CA 3.05Å; D185-L189 PolarHBondContact OD1-N 2.88Å; D185-L190 WeakPolarHBondContact OD1-CB 3.39Å; D185-L190 PolarHBondContact OD1-N 3.07Å; D185-R191 WeakPolarHBondContact OD2-CB 3.44Å; D185-R191 PolarHBondContact OD2-N 3.05Å
186	W	62.4	Low	84.5	Confident	213 Å²	213	80 Å²	80	81%	0.807	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-41.7	-49.6	-175	-173.1	-35.6	0	0	0	112.6	R183	R183-W186 PolarHBondContact O-N 2.85Å
187	S	70.1	Confident	84.6	Confident	78 Å²	78	78.5 Å²	78.5	55%	0.545	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-14.8	-177.5	66.7	0	0	0	0	114.7	D185 L189	D185-S187 PolarHBondContact O-N 3.24Å; S187-L189 PolarHBondContact O-N 3.08Å; S187-L189 VanDerWaalsContact O-N 3.09Å; S187-L189 WeakPolarHBondContact OG-CB 3.31Å; S187-L189 PolarHBondContact OG-N 2.54Å; S187-L189 VanDerWaalsContact OG-N 3.1Å
188	G	82.4	Confident	84.7	Confident	28 Å²	28	76.9 Å²	76.9	29%	0.289	36%	0.358	S	S	.	.	S	Bend	trans	67.3	-5.1	-165.3	0	0	0	0	0	114.1	D185 V192	D185-G188 VanDerWaalsContact CG-CA 3.41Å; D185-G188 PolarHBondContact O-N 3.07Å; D185-G188 WeakPolarHBondContact OD1-CA 3.45Å; D185-G188 PolarHBondContact OD1-N 2.86Å; D185-G188 WeakPolarHBondContact OD2-CA 3.05Å; G188-V192 VanDerWaalsContact O-CG2 3.31Å; G188-V192 WeakPolarHBondContact O-CG2 3.22Å; G188-V192 PolarHBondContact O-N 2.93Å; G188-V192 VanDerWaalsContact O-N 3.11Å
189	L	86.3	Confident	85	Confident	60 Å²	60	73.4 Å²	73.4	31%	0.314	34%	0.343	S	S	.	.	H	α-helix	trans	-74.2	-31.1	-170.2	-166.6	56.5	0	0	0	111.2	Q112 D185 S187 V192 R193	Q112-L189 HydrophobicContact CG-CG 4.3Å; Q112-L189 VanDerWaalsContact OE1-CG 3.26Å; D185-L189 PolarHBondContact OD1-N 2.88Å; S187-L189 PolarHBondContact O-N 3.08Å; S187-L189 VanDerWaalsContact O-N 3.09Å; S187-L189 WeakPolarHBondContact OG-CB 3.31Å; S187-L189 PolarHBondContact OG-N 2.54Å; S187-L189 VanDerWaalsContact OG-N 3.1Å; L189-V192 PolarHBondContact O-N 2.85Å; L189-R193 HydrophobicContact CD1-CG 4.33Å; L189-R193 HydrophobicContact CG-CG 4.29Å; L189-R193 WeakPolarHBondContact O-CB 3.35Å; L189-R193 VanDerWaalsContact O-CG 3.25Å; L189-R193 WeakPolarHBondContact O-CG 3.34Å; L189-R193 PolarHBondContact O-N 3.49Å
190	L	86.7	Confident	85.2	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-61.1	-50.3	176.1	179.9	63.7	0	0	0	110.4	Q112 K113 E135 C136 L139 D185 V192 R193 I194	Q112-L190 HydrophobicContact CG-CB 4.32Å; Q112-L190 HydrophobicContact CG-CD1 4.24Å; K113-L190 HydrophobicContact CB-CD1 4.45Å; K113-L190 HydrophobicContact CG-CD1 3.81Å; E135-L190 HydrophobicContact CG-CD2 4.28Å; C136-L190 VanDerWaalsContact SG-CD2 3.57Å; L139-L190 HydrophobicContact CD1-CB 4.38Å; L139-L190 HydrophobicContact CD1-CD2 3.87Å; L139-L190 HydrophobicContact CD1-CG 3.84Å; D185-L190 WeakPolarHBondContact OD1-CB 3.39Å; D185-L190 PolarHBondContact OD1-N 3.07Å; L190-V192 PolarHBondContact O-N 2.87Å; L190-R193 PolarHBondContact O-N 3.36Å; L190-I194 HydrophobicContact CD1-CD1 3.78Å; L190-I194 HydrophobicContact CD1-CG1 4.31Å; L190-I194 HydrophobicContact CG-CD1 3.91Å; L190-I194 WeakPolarHBondContact O-CG1 3.4Å; L190-I194 PolarHBondContact O-N 3.28Å
191	R	92.3	Very high	85.4	Confident	65 Å²	65	68.6 Å²	68.6	25%	0.245	31%	0.311	C	S	.	.	H	α-helix	trans	-56.8	-48.7	174.1	177.5	-176.9	-64.6	-94.7	3.7	111.8	L139 Y143 D177 D185 R193 I194 S195	L139-R191 HydrophobicContact CD1-CB 4.09Å; L139-R191 HydrophobicContact CD2-CB 4.12Å; L139-R191 HydrophobicContact CD2-CG 4.13Å; Y143-R191 HydrophobicContact CE2-CG 4.02Å; Y143-R191 VanDerWaalsContact OH-CG 3.23Å; Y143-R191 WeakPolarHBondContact OH-CG 3.4Å; D177-R191 VanDerWaalsContact CG-NH1 3.3Å; D177-R191 IonicContact OD1-CZ 2.65Å; D177-R191 VanDerWaalsContact OD1-CZ 3.23Å; D177-R191 IonicContact OD1-NH1 2.63Å; D177-R191 PolarHBondContact OD1-NH1 3.4Å; D177-R191 IonicContact OD1-NH2 2.77Å; D177-R191 PolarHBondContact OD1-NH2 3.29Å; D177-R191 IonicContact OD2-CZ 3.06Å; D177-R191 IonicContact OD2-NH1 2.7Å; D177-R191 PolarHBondContact OD2-NH1 2.85Å; D177-R191 IonicContact OD2-NH2 3.61Å; D185-R191 WeakPolarHBondContact OD2-CB 3.44Å; D185-R191 PolarHBondContact OD2-N 3.05Å; R191-R193 VanDerWaalsContact C-N 3.34Å; R191-R193 PolarHBondContact O-N 3Å; R191-I194 PolarHBondContact O-N 3.3Å; R191-S195 VanDerWaalsContact O-CB 3.23Å; R191-S195 WeakPolarHBondContact O-CB 3.43Å; R191-S195 PolarHBondContact O-N 3.12Å
192	V	92.3	Very high	85.7	Confident	68 Å²	68	66.5 Å²	66.5	41%	0.412	30%	0.299	S	S	.	.	H	α-helix	trans	-57.9	-47.1	179.9	169.2	0	0	0	0	110.7	G188 L189 L190 S195 E196	G188-V192 VanDerWaalsContact O-CG2 3.31Å; G188-V192 WeakPolarHBondContact O-CG2 3.22Å; G188-V192 PolarHBondContact O-N 2.93Å; G188-V192 VanDerWaalsContact O-N 3.11Å; L189-V192 PolarHBondContact O-N 2.85Å; L190-V192 PolarHBondContact O-N 2.87Å; V192-S195 PolarHBondContact O-N 3.42Å; V192-E196 HydrophobicContact CG1-CG 4.39Å; V192-E196 WeakPolarHBondContact O-CB 3.34Å; V192-E196 VanDerWaalsContact O-CG 3.31Å; V192-E196 WeakPolarHBondContact O-CG 3.38Å; V192-E196 PolarHBondContact O-N 2.91Å
193	R	91.1	Very high	86.3	Confident	63 Å²	63	58 Å²	58	24%	0.238	27%	0.27	C	S	.	.	H	α-helix	trans	-69.1	-40.3	-178.1	-65.2	-54.9	-172.3	-157.4	-4.1	113.4	Q112 L189 L190 R191 E196 K197	Q112-R193 HydrophobicContact CB-CB 4.08Å; Q112-R193 HydrophobicContact CB-CG 3.83Å; Q112-R193 HydrophobicContact CG-CB 4.29Å; Q112-R193 HydrophobicContact CG-CG 3.93Å; L189-R193 HydrophobicContact CD1-CG 4.33Å; L189-R193 HydrophobicContact CG-CG 4.29Å; L189-R193 WeakPolarHBondContact O-CB 3.35Å; L189-R193 VanDerWaalsContact O-CG 3.25Å; L189-R193 WeakPolarHBondContact O-CG 3.34Å; L189-R193 PolarHBondContact O-N 3.49Å; L190-R193 PolarHBondContact O-N 3.36Å; R191-R193 VanDerWaalsContact C-N 3.34Å; R191-R193 PolarHBondContact O-N 3Å; R193-E196 IonicContact CZ-OE2 3.22Å; R193-E196 IonicContact NH1-OE1 3.28Å; R193-E196 PolarHBondContact NH1-OE1 3.06Å; R193-E196 IonicContact NH1-OE2 3.66Å; R193-E196 PolarHBondContact NH1-OE2 2.94Å; R193-E196 PolarHBondContact O-N 3.18Å; R193-K197 WeakPolarHBondContact O-CB 3.23Å; R193-K197 PolarHBondContact O-N 2.89Å
194	I	90.4	Very high	86.8	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-65.4	-43.9	175.3	-66.6	170.4	0	0	0	109.9	L139 E140 Y143 L190 R191 E196 K197 W198	L139-I194 HydrophobicContact CB-CD1 3.65Å; L139-I194 HydrophobicContact CD1-CD1 4.28Å; E140-I194 HydrophobicContact CG-CD1 4.19Å; E140-I194 HydrophobicContact CG-CG2 4.43Å; Y143-I194 HydrophobicContact CD2-CB 4.32Å; Y143-I194 HydrophobicContact CD2-CG2 3.65Å; Y143-I194 HydrophobicContact CE2-CG2 4.5Å; Y143-I194 HydrophobicContact CG-CG2 4.27Å; L190-I194 HydrophobicContact CD1-CD1 3.78Å; L190-I194 HydrophobicContact CD1-CG1 4.31Å; L190-I194 HydrophobicContact CG-CD1 3.91Å; L190-I194 WeakPolarHBondContact O-CG1 3.4Å; L190-I194 PolarHBondContact O-N 3.28Å; R191-I194 PolarHBondContact O-N 3.3Å; I194-E196 PolarHBondContact O-N 3.4Å; I194-K197 WeakPolarHBondContact O-CB 3.24Å; I194-K197 PolarHBondContact O-N 3.34Å; I194-W198 VanDerWaalsContact O-CD1 3.24Å; I194-W198 PolarHBondContact O-N 3Å; I194-W198 VanDerWaalsContact O-N 3.16Å
195	S	95.1	Very high	87.3	Confident	39 Å²	39	45.3 Å²	45.3	27%	0.273	22%	0.223	S	C	.	.	H	α-helix	trans	-60.8	-44.4	175.6	-171.7	0	0	0	0	112.2	Y143 R191 V192 K197 W198 K199	Y143-S195 VanDerWaalsContact CE1-CB 3.48Å; Y143-S195 VanDerWaalsContact CE1-OG 3.24Å; Y143-S195 WeakPolarHBondContact CE1-OG 3.5Å; Y143-S195 VanDerWaalsContact CZ-CB 3.47Å; R191-S195 VanDerWaalsContact O-CB 3.23Å; R191-S195 WeakPolarHBondContact O-CB 3.43Å; R191-S195 PolarHBondContact O-N 3.12Å; V192-S195 PolarHBondContact O-N 3.42Å; S195-K197 VanDerWaalsContact C-N 3.34Å; S195-W198 PolarHBondContact O-N 2.63Å; S195-K199 WeakPolarHBondContact O-CB 3.43Å; S195-K199 PolarHBondContact O-N 3.16Å
196	E	95.6	Very high	87.7	Confident	65 Å²	65	46.8 Å²	46.8	30%	0.304	23%	0.231	S	C	.	.	H	α-helix	trans	-58.8	-45.7	176.3	-81.4	178.3	-177.4	0	0	111	K108 V192 R193 I194 W198 K199 K200	K108-E196 IonicContact NZ-OE2 2.84Å; K108-E196 PolarHBondContact NZ-OE2 2.81Å; V192-E196 HydrophobicContact CG1-CG 4.39Å; V192-E196 WeakPolarHBondContact O-CB 3.34Å; V192-E196 VanDerWaalsContact O-CG 3.31Å; V192-E196 WeakPolarHBondContact O-CG 3.38Å; V192-E196 PolarHBondContact O-N 2.91Å; R193-E196 IonicContact CZ-OE2 3.22Å; R193-E196 IonicContact NH1-OE1 3.28Å; R193-E196 PolarHBondContact NH1-OE1 3.06Å; R193-E196 IonicContact NH1-OE2 3.66Å; R193-E196 PolarHBondContact NH1-OE2 2.94Å; R193-E196 PolarHBondContact O-N 3.18Å; I194-E196 PolarHBondContact O-N 3.4Å; E196-W198 PolarHBondContact O-N 2.92Å; E196-K199 PolarHBondContact O-N 3.42Å; E196-K200 WeakPolarHBondContact O-CG 3.21Å; E196-K200 PolarHBondContact O-N 2.83Å
197	K	92.7	Very high	88.7	Confident	1 Å²	1	37.7 Å²	37.7	0%	0.004	20%	0.199	C	C	.	.	H	α-helix	trans	-55.1	-53.6	178.1	-179.3	-167.7	70.9	163.4	0	111.5	Y102 A105 Y106 E140 R193 I194 S195 K199 K200 R201	Y102-K197 HydrophobicContact CE2-CG 4.22Å; A105-K197 HydrophobicContact CB-CB 4.42Å; Y106-K197 HydrophobicContact CD2-CD 3.61Å; Y106-K197 HydrophobicContact CD2-CG 4.08Å; Y106-K197 HydrophobicContact CE2-CD 4.02Å; Y106-K197 HydrophobicContact CG-CD 4.12Å; Y106-K197 HydrophobicContact CG-CG 4.49Å; E140-K197 IonicContact OE1-NZ 2.59Å; E140-K197 PolarHBondContact OE1-NZ 3.07Å; E140-K197 IonicContact OE2-NZ 2.68Å; E140-K197 PolarHBondContact OE2-NZ 3.3Å; R193-K197 WeakPolarHBondContact O-CB 3.23Å; R193-K197 PolarHBondContact O-N 2.89Å; I194-K197 WeakPolarHBondContact O-CB 3.24Å; I194-K197 PolarHBondContact O-N 3.34Å; S195-K197 VanDerWaalsContact C-N 3.34Å; K197-K199 VanDerWaalsContact C-N 3.34Å; K197-K199 PolarHBondContact O-N 3.44Å; K197-K200 PolarHBondContact O-N 2.95Å; K197-R201 PolarHBondContact O-N 2.91Å
198	W	93.8	Very high	89.2	Confident	7 Å²	7	34.7 Å²	34.7	3%	0.027	18%	0.176	C	C	.	.	H	α-helix	trans	-67.9	-33.6	-179.4	-72.7	109.3	0	0	0	112.8	A58 E140 F144 W147 I194 S195 E196 K200 R201 E202	A58-W198 HydrophobicContact CB-CZ2 4.12Å; E140-W198 PolarHBondContact OE2-NE1 3.49Å; F144-W198 HydrophobicContact CB-CH2 4.13Å; F144-W198 HydrophobicContact CB-CZ2 3.67Å; F144-W198 AromaticContact CD2-CH2 3.44Å; F144-W198 HydrophobicContact CD2-CH2 3.44Å; F144-W198 VanDerWaalsContact CD2-CH2 3.44Å; F144-W198 AromaticContact CD2-CZ2 3.87Å; F144-W198 HydrophobicContact CD2-CZ2 3.87Å; F144-W198 AromaticContact CD2-CZ3 3.96Å; F144-W198 HydrophobicContact CD2-CZ3 3.96Å; F144-W198 HydrophobicContact CE2-CH2 4.32Å; F144-W198 HydrophobicContact CG-CH2 4.23Å; F144-W198 HydrophobicContact CG-CZ2 4.22Å; W147-W198 HydrophobicContact CB-CD2 4.41Å; W147-W198 HydrophobicContact CB-CE3 3.79Å; W147-W198 HydrophobicContact CB-CZ3 4.45Å; W147-W198 AromaticContact CD2-CE3 3.93Å; W147-W198 HydrophobicContact CD2-CE3 3.93Å; W147-W198 AromaticContact CD2-CZ3 3.81Å; W147-W198 HydrophobicContact CD2-CZ3 3.81Å; W147-W198 HydrophobicContact CE3-CE3 4.27Å; W147-W198 AromaticContact CE3-CZ3 3.77Å; W147-W198 HydrophobicContact CE3-CZ3 3.77Å; W147-W198 AromaticContact CG-CE3 3.68Å; W147-W198 HydrophobicContact CG-CE3 3.68Å; W147-W198 HydrophobicContact CG-CZ3 4.08Å; I194-W198 VanDerWaalsContact O-CD1 3.24Å; I194-W198 PolarHBondContact O-N 3Å; I194-W198 VanDerWaalsContact O-N 3.16Å; S195-W198 PolarHBondContact O-N 2.63Å; E196-W198 PolarHBondContact O-N 2.92Å; W198-K200 VanDerWaalsContact C-N 3.33Å; W198-K200 PolarHBondContact O-N 3.41Å; W198-R201 HydrophobicContact CE3-CB 4.31Å; W198-R201 HydrophobicContact CE3-CG 4.45Å; W198-R201 HydrophobicContact CZ3-CG 4.47Å; W198-R201 WeakPolarHBondContact O-CB 3.32Å; W198-R201 PolarHBondContact O-N 3.4Å; W198-E202 PolarHBondContact O-N 2.97Å
199	K	94.9	Very high	88.9	Confident	98 Å²	98	34.1 Å²	34.1	43%	0.426	17%	0.168	S	C	.	.	H	α-helix	trans	-66.3	-35.6	173	-170.5	54.6	170.4	177.4	0	112.4	S195 E196 K197 R201 E202 L203	S195-K199 WeakPolarHBondContact O-CB 3.43Å; S195-K199 PolarHBondContact O-N 3.16Å; E196-K199 PolarHBondContact O-N 3.42Å; K197-K199 VanDerWaalsContact C-N 3.34Å; K197-K199 PolarHBondContact O-N 3.44Å; K199-R201 VanDerWaalsContact C-N 3.35Å; K199-E202 HydrophobicContact CD-CB 4.49Å; K199-E202 VanDerWaalsContact CD-OE2 3.22Å; K199-E202 WeakPolarHBondContact CD-OE2 3.47Å; K199-E202 IonicContact NZ-OE1 2.89Å; K199-E202 PolarHBondContact NZ-OE1 3.46Å; K199-E202 IonicContact NZ-OE2 2.92Å; K199-E202 PolarHBondContact NZ-OE2 3.37Å; K199-E202 WeakPolarHBondContact O-CB 3.25Å; K199-E202 PolarHBondContact O-N 3.43Å; K199-L203 WeakPolarHBondContact O-CG 3.32Å; K199-L203 PolarHBondContact O-N 3.49Å; K199-L203 VanDerWaalsContact O-N 3.15Å
200	K	93.1	Very high	88.4	Confident	63 Å²	63	31.6 Å²	31.6	27%	0.274	16%	0.155	S	C	.	.	H	α-helix	trans	-69.4	-32.6	173.4	-69	-52.9	-163.9	164.2	0	112.4	D101 Y102 A105 E196 K197 W198 L203 L204	D101-K200 HydrophobicContact CB-CD 4.09Å; D101-K200 IonicContact OD2-NZ 2.67Å; D101-K200 PolarHBondContact OD2-NZ 3.19Å; Y102-K200 HydrophobicContact CD2-CB 4.44Å; A105-K200 HydrophobicContact CB-CB 4.09Å; A105-K200 HydrophobicContact CB-CG 3.7Å; E196-K200 WeakPolarHBondContact O-CG 3.21Å; E196-K200 PolarHBondContact O-N 2.83Å; K197-K200 PolarHBondContact O-N 2.95Å; W198-K200 VanDerWaalsContact C-N 3.33Å; W198-K200 PolarHBondContact O-N 3.41Å; K200-L203 HydrophobicContact CD-CD1 4.19Å; K200-L204 WeakPolarHBondContact O-CB 3.31Å; K200-L204 PolarHBondContact O-N 3.2Å
201	R	89.7	Confident	87.8	Confident	2 Å²	2	32.5 Å²	32.5	1%	0.008	16%	0.159	C	C	.	.	H	α-helix	trans	-63.6	-47.5	171.3	-174	62.9	-117.5	-172	-5	111.3	R62 Y102 W147 K197 W198 K199 L203 L204 D205 E208 E293	R62-R201 VanDerWaalsContact NH1-NH1 3.14Å; Y102-R201 HydrophobicContact CD2-CB 3.89Å; Y102-R201 HydrophobicContact CE2-CB 3.77Å; Y102-R201 HydrophobicContact CE2-CG 4.27Å; W147-R201 HydrophobicContact CZ2-CG 4.4Å; K197-R201 PolarHBondContact O-N 2.91Å; W198-R201 HydrophobicContact CE3-CB 4.31Å; W198-R201 HydrophobicContact CE3-CG 4.45Å; W198-R201 HydrophobicContact CZ3-CG 4.47Å; W198-R201 WeakPolarHBondContact O-CB 3.32Å; W198-R201 PolarHBondContact O-N 3.4Å; K199-R201 VanDerWaalsContact C-N 3.35Å; R201-L203 VanDerWaalsContact C-N 3.31Å; R201-L203 PolarHBondContact O-N 3.3Å; R201-L204 VanDerWaalsContact NH1-CD2 3.29Å; R201-L204 CarbonylContact O-C 3.59Å; R201-L204 WeakPolarHBondContact O-CA 3.4Å; R201-L204 WeakPolarHBondContact O-CB 3.23Å; R201-L204 PolarHBondContact O-N 2.92Å; R201-D205 IonicContact CZ-OD1 3.51Å; R201-D205 IonicContact NE-OD1 3.55Å; R201-D205 PolarHBondContact NE-OD1 3.47Å; R201-D205 IonicContact NE-OD2 3.75Å; R201-D205 IonicContact NH2-OD1 2.83Å; R201-D205 PolarHBondContact NH2-OD1 3.28Å; R201-D205 PolarHBondContact O-N 3.46Å; R201-E208 IonicContact NH2-OE2 2.69Å; R201-E208 PolarHBondContact NH2-OE2 2.59Å; R201-E293 IonicContact CZ-OE2 3.17Å; R201-E293 IonicContact NH1-OE2 3.35Å; R201-E293 PolarHBondContact NH1-OE2 3.07Å; R201-E293 IonicContact NH2-OE2 2.69Å
202	E	89	Confident	86.8	Confident	34 Å²	34	29.6 Å²	29.6	16%	0.159	15%	0.148	C	C	.	.	H	α-helix	trans	-53.8	-47.2	175.6	-165.3	-167.2	131.4	0	0	111.8	H150 W198 K199 L204 D205 D206	H150-E202 WeakPolarHBondContact CE1-CG 3.24Å; H150-E202 IonicContact CE1-OE1 3.12Å; H150-E202 WeakPolarHBondContact ND1-CG 3.24Å; H150-E202 IonicContact NE2-OE1 3.7Å; W198-E202 PolarHBondContact O-N 2.97Å; K199-E202 HydrophobicContact CD-CB 4.49Å; K199-E202 VanDerWaalsContact CD-OE2 3.22Å; K199-E202 WeakPolarHBondContact CD-OE2 3.47Å; K199-E202 IonicContact NZ-OE1 2.89Å; K199-E202 PolarHBondContact NZ-OE1 3.46Å; K199-E202 IonicContact NZ-OE2 2.92Å; K199-E202 PolarHBondContact NZ-OE2 3.37Å; K199-E202 WeakPolarHBondContact O-CB 3.25Å; K199-E202 PolarHBondContact O-N 3.43Å; E202-L204 VanDerWaalsContact C-N 3.28Å; E202-L204 PolarHBondContact O-N 3.31Å; E202-D205 PolarHBondContact O-N 2.85Å; E202-D206 PolarHBondContact O-N 3.04Å
203	L	89.5	Confident	85.6	Confident	47 Å²	47	27.2 Å²	27.2	25%	0.246	14%	0.136	C	C	.	.	H	α-helix	trans	-67.4	-26.4	176.6	-67.9	171.5	0	0	0	113.8	K199 K200 R201	K199-L203 WeakPolarHBondContact O-CG 3.32Å; K199-L203 PolarHBondContact O-N 3.49Å; K199-L203 VanDerWaalsContact O-N 3.15Å; K200-L203 HydrophobicContact CD-CD1 4.19Å; R201-L203 VanDerWaalsContact C-N 3.31Å; R201-L203 PolarHBondContact O-N 3.3Å
204	L	86.6	Confident	84.5	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-74.8	-40.5	173.9	174.1	57	0	0	0	110.3	L95 R98 I99 Y102 K200 R201 E202 D206 V207 E208	L95-L204 HydrophobicContact CD1-CD1 4Å; R98-L204 HydrophobicContact CB-CB 4.28Å; R98-L204 HydrophobicContact CB-CD1 3.71Å; I99-L204 HydrophobicContact CG1-CD1 3.74Å; I99-L204 HydrophobicContact CG1-CD2 4.17Å; Y102-L204 HydrophobicContact CD1-CD2 3.86Å; Y102-L204 HydrophobicContact CG-CD2 4.19Å; K200-L204 WeakPolarHBondContact O-CB 3.31Å; K200-L204 PolarHBondContact O-N 3.2Å; R201-L204 VanDerWaalsContact NH1-CD2 3.29Å; R201-L204 CarbonylContact O-C 3.59Å; R201-L204 WeakPolarHBondContact O-CA 3.4Å; R201-L204 WeakPolarHBondContact O-CB 3.23Å; R201-L204 PolarHBondContact O-N 2.92Å; E202-L204 VanDerWaalsContact C-N 3.28Å; E202-L204 PolarHBondContact O-N 3.31Å; L204-D206 VanDerWaalsContact C-N 3.26Å; L204-D206 PolarHBondContact O-N 2.94Å; L204-V207 PolarHBondContact O-N 2.94Å; L204-V207 VanDerWaalsContact O-N 3.16Å; L204-E208 VanDerWaalsContact O-CB 3.3Å; L204-E208 WeakPolarHBondContact O-CB 3.43Å; L204-E208 PolarHBondContact O-N 3.42Å
205	D	84.8	Confident	83.2	Confident	9 Å²	9	28.8 Å²	28.8	5%	0.048	15%	0.147	C	C	.	.	H	α-helix	trans	-59.5	-38.5	176.5	-56.7	-34.4	0	0	0	111.8	W147 Y151 R201 E202 E208 S209	W147-D205 PolarHBondContact NE1-OD2 3.3Å; Y151-D205 HydrophobicContact CD2-CB 4.17Å; Y151-D205 HydrophobicContact CE2-CB 4.25Å; R201-D205 IonicContact CZ-OD1 3.51Å; R201-D205 IonicContact NE-OD1 3.55Å; R201-D205 PolarHBondContact NE-OD1 3.47Å; R201-D205 IonicContact NE-OD2 3.75Å; R201-D205 IonicContact NH2-OD1 2.83Å; R201-D205 PolarHBondContact NH2-OD1 3.28Å; R201-D205 PolarHBondContact O-N 3.46Å; E202-D205 PolarHBondContact O-N 2.85Å; D205-E208 PolarHBondContact O-N 2.88Å; D205-S209 VanDerWaalsContact O-CB 3.26Å; D205-S209 WeakPolarHBondContact O-CB 3.23Å; D205-S209 PolarHBondContact O-N 3.33Å; D205-S209 PolarHBondContact O-OG 3.47Å
206	D	83.5	Confident	81.4	Confident	43 Å²	43	31.8 Å²	31.8	23%	0.23	15%	0.152	C	C	.	.	H	α-helix	trans	-60.8	-45.7	175.8	-67.1	-8.9	0	0	0	111.9	K154 E202 L204 A210	K154-D206 IonicContact NZ-OD1 3.53Å; K154-D206 PolarHBondContact NZ-OD1 2.97Å; K154-D206 IonicContact NZ-OD2 2.68Å; E202-D206 PolarHBondContact O-N 3.04Å; L204-D206 VanDerWaalsContact C-N 3.26Å; L204-D206 PolarHBondContact O-N 2.94Å; D206-A210 PolarHBondContact O-N 3.08Å
207	V	81.8	Confident	79.3	Confident	21 Å²	21	34.3 Å²	34.3	13%	0.127	17%	0.172	C	C	.	.	H	α-helix	trans	-75.6	-35.8	-179.9	174.8	0	0	0	0	111.8	F91 H94 L95 R98 L204 S209 A210 Y211	F91-V207 HydrophobicContact CD1-CG1 4.45Å; H94-V207 HydrophobicContact CB-CG1 4.31Å; L95-V207 HydrophobicContact CB-CG1 4.25Å; L95-V207 HydrophobicContact CD1-CG1 4.15Å; R98-V207 HydrophobicContact CG-CB 4.03Å; R98-V207 HydrophobicContact CG-CG1 4.36Å; R98-V207 HydrophobicContact CG-CG2 3.65Å; L204-V207 PolarHBondContact O-N 2.94Å; L204-V207 VanDerWaalsContact O-N 3.16Å; V207-S209 VanDerWaalsContact C-N 3.35Å; V207-A210 PolarHBondContact O-N 2.86Å; V207-Y211 WeakPolarHBondContact O-CB 3.49Å; V207-Y211 PolarHBondContact O-N 2.68Å
208	E	80.6	Confident	77.4	Confident	15 Å²	15	42.6 Å²	42.6	7%	0.07	21%	0.208	C	C	.	.	H	α-helix	trans	-58.7	-49	173	174	173.5	166.2	0	0	110.4	R201 L204 D205 A210 Y211 I212 I297 L300	R201-E208 IonicContact NH2-OE2 2.69Å; R201-E208 PolarHBondContact NH2-OE2 2.59Å; L204-E208 VanDerWaalsContact O-CB 3.3Å; L204-E208 WeakPolarHBondContact O-CB 3.43Å; L204-E208 PolarHBondContact O-N 3.42Å; D205-E208 PolarHBondContact O-N 2.88Å; E208-A210 PolarHBondContact O-N 3.33Å; E208-Y211 WeakPolarHBondContact O-CB 3.43Å; E208-Y211 PolarHBondContact O-N 3.11Å; E208-I212 HydrophobicContact CG-CD1 3.78Å; E208-I212 VanDerWaalsContact O-CG1 3.25Å; E208-I212 WeakPolarHBondContact O-CG1 3.16Å; E208-I212 PolarHBondContact O-N 2.7Å; E208-I297 HydrophobicContact CB-CD1 4.43Å; E208-I297 HydrophobicContact CG-CD1 4.25Å; E208-I297 HydrophobicContact CG-CG1 3.92Å; E208-I297 HydrophobicContact CG-CG2 4.34Å; E208-L300 WeakPolarHBondContact OE1-CD1 3.28Å
209	S	76	Confident	75.5	Confident	17 Å²	17	45.1 Å²	45.1	12%	0.119	22%	0.224	C	C	.	.	H	α-helix	trans	-56.3	-50.6	177.1	-64.8	0	0	0	0	112.4	A81 D205 V207 Y211 I212 A213	A81-S209 VanDerWaalsContact CB-CB 3.47Å; D205-S209 VanDerWaalsContact O-CB 3.26Å; D205-S209 WeakPolarHBondContact O-CB 3.23Å; D205-S209 PolarHBondContact O-N 3.33Å; D205-S209 PolarHBondContact O-OG 3.47Å; V207-S209 VanDerWaalsContact C-N 3.35Å; S209-Y211 PolarHBondContact O-N 3.49Å; S209-I212 PolarHBondContact O-N 3.4Å; S209-A213 PolarHBondContact O-N 2.94Å
210	A	75.7	Confident	73.9	Confident	6 Å²	6	48.4 Å²	48.4	5%	0.05	25%	0.246	C	C	.	.	H	α-helix	trans	-69.3	-32.1	179.5	0	0	0	0	0	112.8	D85 F91 D206 V207 E208 A213 E214	D85-A210 HydrophobicContact CB-CB 4.06Å; F91-A210 HydrophobicContact CE1-CB 3.46Å; F91-A210 VanDerWaalsContact CE1-CB 3.46Å; F91-A210 HydrophobicContact CZ-CB 3.54Å; D206-A210 PolarHBondContact O-N 3.08Å; V207-A210 PolarHBondContact O-N 2.86Å; E208-A210 PolarHBondContact O-N 3.33Å; A210-A213 WeakPolarHBondContact O-CB 3.44Å; A210-A213 PolarHBondContact O-N 3.3Å; A210-E214 PolarHBondContact O-N 3.45Å
211	Y	74.5	Confident	72.6	Confident	19 Å²	19	47 Å²	47	8%	0.075	24%	0.243	C	C	.	.	H	α-helix	trans	-63.3	-44.9	172.3	-177.6	-98.3	0	0	0	112	F91 P92 L95 V207 E208 S209 A213 E214 T215 I297 L298 T301	F91-Y211 HydrophobicContact CB-CD2 3.87Å; F91-Y211 HydrophobicContact CB-CE2 4.38Å; F91-Y211 HydrophobicContact CD1-CD2 4.33Å; F91-Y211 HydrophobicContact CG-CD2 4.46Å; P92-Y211 HydrophobicContact CG-CE2 4.25Å; L95-Y211 HydrophobicContact CD2-CD1 4.1Å; L95-Y211 HydrophobicContact CD2-CD2 4.11Å; L95-Y211 HydrophobicContact CD2-CE1 4.23Å; L95-Y211 HydrophobicContact CD2-CE2 4.32Å; L95-Y211 HydrophobicContact CD2-CG 4.05Å; V207-Y211 WeakPolarHBondContact O-CB 3.49Å; V207-Y211 PolarHBondContact O-N 2.68Å; E208-Y211 WeakPolarHBondContact O-CB 3.43Å; E208-Y211 PolarHBondContact O-N 3.11Å; S209-Y211 PolarHBondContact O-N 3.49Å; Y211-A213 VanDerWaalsContact C-N 3.3Å; Y211-A213 PolarHBondContact O-N 3.07Å; Y211-E214 PolarHBondContact O-N 2.84Å; Y211-T215 HydrophobicContact CD1-CG2 4.37Å; Y211-T215 HydrophobicContact CD2-CG2 4.42Å; Y211-T215 HydrophobicContact CE1-CG2 3.95Å; Y211-T215 HydrophobicContact CE2-CG2 3.95Å; Y211-T215 WeakPolarHBondContact O-CG2 3.21Å; Y211-T215 PolarHBondContact O-N 2.84Å; Y211-T215 PolarHBondContact O-OG1 3.47Å; Y211-I297 HydrophobicContact CD1-CG2 3.73Å; Y211-I297 HydrophobicContact CE1-CG2 4.13Å; Y211-L298 HydrophobicContact CE1-CD2 4.47Å; Y211-T301 HydrophobicContact CD1-CG2 3.74Å; Y211-T301 HydrophobicContact CE1-CG2 3.64Å
212	I	71.1	Confident	72	Confident	4 Å²	4	51.8 Å²	51.8	2%	0.021	27%	0.269	C	S	.	.	H	α-helix	trans	-65.3	-38.1	178.7	-64.1	163.9	0	0	0	110.5	I78 E208 S209 E214 T215 L300 T301 L304	I78-I212 HydrophobicContact CG2-CB 4.28Å; I78-I212 HydrophobicContact CG2-CG2 3.42Å; I78-I212 VanDerWaalsContact CG2-CG2 3.42Å; E208-I212 HydrophobicContact CG-CD1 3.78Å; E208-I212 VanDerWaalsContact O-CG1 3.25Å; E208-I212 WeakPolarHBondContact O-CG1 3.16Å; E208-I212 PolarHBondContact O-N 2.7Å; S209-I212 PolarHBondContact O-N 3.4Å; I212-E214 PolarHBondContact O-N 2.89Å; I212-T215 PolarHBondContact O-N 3.37Å; I212-L300 HydrophobicContact CD1-CB 4.13Å; I212-L300 HydrophobicContact CD1-CD1 4.38Å; I212-T301 HydrophobicContact CB-CG2 4.36Å; I212-T301 HydrophobicContact CG1-CG2 3.84Å; I212-L304 HydrophobicContact CG2-CD1 3.38Å
213	A	67.8	Low	71.3	Confident	19 Å²	19	54.9 Å²	54.9	16%	0.157	28%	0.282	C	S	.	.	H	α-helix	trans	-58.1	-45.5	174.9	0	0	0	0	0	113.5	M82 S209 A210 Y211	M82-A213 HydrophobicContact CB-CB 3.52Å; M82-A213 HydrophobicContact CE-CB 4.44Å; M82-A213 HydrophobicContact CG-CB 3.47Å; M82-A213 VanDerWaalsContact CG-CB 3.47Å; S209-A213 PolarHBondContact O-N 2.94Å; A210-A213 WeakPolarHBondContact O-CB 3.44Å; A210-A213 PolarHBondContact O-N 3.3Å; Y211-A213 VanDerWaalsContact C-N 3.3Å; Y211-A213 PolarHBondContact O-N 3.07Å
214	E	67.4	Low	70.9	Confident	79 Å²	79	57.6 Å²	57.6	37%	0.369	29%	0.293	S	S	.	.	H	α-helix	trans	-72.1	-36.3	-177.3	-169.5	-174.2	-167.8	0	0	112.6	F91 A210 Y211 I212 R216	F91-E214 VanDerWaalsContact CB-OE2 3.28Å; F91-E214 WeakPolarHBondContact CB-OE2 3.35Å; F91-E214 WeakPolarHBondContact CD2-OE2 3.44Å; F91-E214 VanDerWaalsContact CG-OE2 3.3Å; F91-E214 WeakPolarHBondContact CG-OE2 3.48Å; A210-E214 PolarHBondContact O-N 3.45Å; Y211-E214 PolarHBondContact O-N 2.84Å; I212-E214 PolarHBondContact O-N 2.89Å; E214-R216 PolarHBondContact O-N 3.36Å
215	T	64.6	Low	70.7	Confident	16 Å²	16	63.6 Å²	63.6	10%	0.098	32%	0.319	C	S	.	.	H	α-helix	trans	-84.6	-5.6	-165.1	48.2	0	0	0	0	115.8	Y211 I212 T217 K218 V219 T301	Y211-T215 HydrophobicContact CD1-CG2 4.37Å; Y211-T215 HydrophobicContact CD2-CG2 4.42Å; Y211-T215 HydrophobicContact CE1-CG2 3.95Å; Y211-T215 HydrophobicContact CE2-CG2 3.95Å; Y211-T215 WeakPolarHBondContact O-CG2 3.21Å; Y211-T215 PolarHBondContact O-N 2.84Å; Y211-T215 PolarHBondContact O-OG1 3.47Å; I212-T215 PolarHBondContact O-N 3.37Å; T215-T217 PolarHBondContact O-N 3.41Å; T215-K218 PolarHBondContact O-N 3.41Å; T215-V219 HydrophobicContact CG2-CG2 3.97Å; T215-T301 WeakPolarHBondContact OG1-CG2 3.35Å
216	R	57.4	Low	70.4	Confident	103 Å²	103	63.7 Å²	63.7	39%	0.389	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-20.8	177.5	-90.9	-167.8	177.9	173.2	-0.2	115.2	I79 M82 E214	I79-R216 VanDerWaalsContact CG1-NH2 3.27Å; M82-R216 PolarHBondContact SD-NH1 2.92Å; E214-R216 PolarHBondContact O-N 3.36Å
217	T	50.3	Low	70.3	Confident	118 Å²	118	66 Å²	66	72%	0.724	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	-5.9	-173.8	53.5	0	0	0	0	115.6	T215	T215-T217 PolarHBondContact O-N 3.41Å
218	K	53.5	Low	70.5	Confident	175 Å²	175	72.2 Å²	72.2	76%	0.761	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.7	-14.6	-162.4	-69.9	-179.2	-175	172.4	0	117.4	T215	T215-K218 PolarHBondContact O-N 3.41Å
219	V	54.5	Low	70.6	Confident	60 Å²	60	75.4 Å²	75.4	36%	0.364	37%	0.368	S	S	.	.			trans	-106.1	97.2	-167.1	-156.4	0	0	0	0	112.4	T215 V221	T215-V219 HydrophobicContact CG2-CG2 3.97Å; V219-V221 VanDerWaalsContact C-N 3.31Å; V219-V221 HydrophobicContact CB-CG1 4.4Å; V219-V221 HydrophobicContact CG1-CG1 3.33Å; V219-V221 PolarHBondContact O-N 3.28Å
220	N	60.6	Low	71	Confident	166 Å²	166	75.5 Å²	75.5	89%	0.888	37%	0.367	S	S	*	.			trans	-77.5	80.7	165.3	-174.8	7.9	0	0	0	109.5
221	V	65.1	Low	71.2	Confident	34 Å²	34	78.6 Å²	78.6	21%	0.206	39%	0.385	C	S	.	.			trans	-88.4	139.5	172.5	-64	0	0	0	0	111.7	V219 K223	V219-V221 VanDerWaalsContact C-N 3.31Å; V219-V221 HydrophobicContact CB-CG1 4.4Å; V219-V221 HydrophobicContact CG1-CG1 3.33Å; V219-V221 PolarHBondContact O-N 3.28Å; V221-K223 HydrophobicContact CG2-CG 4.42Å; V221-K223 PolarHBondContact O-N 3.5Å
222	N	76.7	Confident	71.9	Confident	103 Å²	103	81.6 Å²	81.6	55%	0.551	40%	0.403	S	S	*	.			trans	-74.3	94.4	166.3	-175.7	-31	0	0	0	109.3	E224 K225 L226	N222-E224 VanDerWaalsContact C-N 3.31Å; N222-E224 PolarHBondContact O-N 3.31Å; N222-E224 PolarHBondContact OD1-N 2.99Å; N222-K225 HydrophobicContact CB-CB 3.93Å; N222-K225 WeakPolarHBondContact O-CB 3.43Å; N222-K225 PolarHBondContact O-N 3.2Å; N222-K225 PolarHBondContact OD1-N 2.94Å; N222-L226 PolarHBondContact O-N 2.87Å
223	K	75.5	Confident	72.4	Confident	98 Å²	98	81.8 Å²	81.8	43%	0.426	40%	0.404	S	S	.	.	H	α-helix	trans	-53.5	-44.7	-176.7	-60.3	-176.1	179.8	-175.9	0	112.9	V221 L226 K227 S302	V221-K223 HydrophobicContact CG2-CG 4.42Å; V221-K223 PolarHBondContact O-N 3.5Å; K223-L226 PolarHBondContact O-N 2.84Å; K223-K227 WeakPolarHBondContact O-CG 3.42Å; K223-K227 PolarHBondContact O-N 3.02Å; K223-S302 WeakPolarHBondContact CE-O 3.37Å; K223-S302 PolarHBondContact NZ-O 3.09Å
224	E	80.5	Confident	73.1	Confident	105 Å²	105	85.1 Å²	85.1	49%	0.491	42%	0.417	S	S	.	.	H	α-helix	trans	-68.6	-37.4	-178.2	-71.1	-55.7	124.2	0	0	112.3	N222 K227 K228	N222-E224 VanDerWaalsContact C-N 3.31Å; N222-E224 PolarHBondContact O-N 3.31Å; N222-E224 PolarHBondContact OD1-N 2.99Å; E224-K227 IonicContact OE1-NZ 3.94Å; E224-K227 PolarHBondContact OE1-NZ 3.4Å; E224-K228 WeakPolarHBondContact O-CG 3.47Å; E224-K228 PolarHBondContact O-N 3.17Å; E224-K228 VanDerWaalsContact O-N 3.12Å
225	K	83.6	Confident	74	Confident	125 Å²	125	85.7 Å²	85.7	54%	0.543	42%	0.422	S	S	.	.	H	α-helix	trans	-62.2	-45	171.9	-176.1	180	177.3	-179	0	110.9	N222 K228 Q229	N222-K225 HydrophobicContact CB-CB 3.93Å; N222-K225 WeakPolarHBondContact O-CB 3.43Å; N222-K225 PolarHBondContact O-N 3.2Å; N222-K225 PolarHBondContact OD1-N 2.94Å; K225-K228 PolarHBondContact O-N 3.35Å; K225-Q229 WeakPolarHBondContact O-CG 3.48Å; K225-Q229 PolarHBondContact O-N 2.69Å
226	L	77.9	Confident	75.1	Confident	12 Å²	12	89.9 Å²	89.9	6%	0.063	44%	0.439	C	S	.	.	H	α-helix	trans	-67.8	-41.4	-177.7	-172.2	62.4	0	0	0	112.4	N222 K223 K228 Q229 L230 Q295 L298 L299	N222-L226 PolarHBondContact O-N 2.87Å; K223-L226 PolarHBondContact O-N 2.84Å; L226-K228 PolarHBondContact O-N 2.69Å; L226-Q229 WeakPolarHBondContact O-CB 3.38Å; L226-Q229 PolarHBondContact O-N 2.77Å; L226-L230 WeakPolarHBondContact O-CB 3.35Å; L226-L230 PolarHBondContact O-N 3.2Å; L226-Q295 HydrophobicContact CD1-CB 4.16Å; L226-Q295 HydrophobicContact CD1-CG 4.27Å; L226-L298 HydrophobicContact CD1-CB 4.38Å; L226-L298 VanDerWaalsContact CD2-C 3.46Å; L226-L298 HydrophobicContact CD2-CB 3.63Å; L226-L299 HydrophobicContact CB-CD1 4.47Å; L226-L299 HydrophobicContact CD2-CB 3.77Å; L226-L299 HydrophobicContact CD2-CD1 4.06Å; L226-L299 HydrophobicContact CG-CB 4.38Å; L226-L299 HydrophobicContact CG-CD1 4.4Å
227	K	80.9	Confident	76.2	Confident	90 Å²	90	86.2 Å²	86.2	39%	0.391	43%	0.427	S	S	.	.	H	α-helix	trans	-57.5	-47.6	172.2	-73.2	176.6	-172	168.2	0	111.7	K223 E224 Q229 L230 T231 L299	K223-K227 WeakPolarHBondContact O-CG 3.42Å; K223-K227 PolarHBondContact O-N 3.02Å; E224-K227 IonicContact OE1-NZ 3.94Å; E224-K227 PolarHBondContact OE1-NZ 3.4Å; K227-Q229 VanDerWaalsContact C-N 3.29Å; K227-Q229 PolarHBondContact O-N 3.24Å; K227-L230 PolarHBondContact O-N 3.39Å; K227-T231 PolarHBondContact O-N 2.69Å; K227-T231 PolarHBondContact O-OG1 3Å; K227-T231 VanDerWaalsContact O-OG1 3.11Å; K227-L299 HydrophobicContact CG-CD1 3.93Å; K227-L299 HydrophobicContact CG-CD2 4.1Å
228	K	85.5	Confident	77.6	Confident	153 Å²	153	86.3 Å²	86.3	67%	0.665	42%	0.419	S	S	*	.	H	α-helix	trans	-61.3	-38.1	176.7	-73.1	177.9	-179	-177.8	0	112.3	E224 K225 L226 N232	E224-K228 WeakPolarHBondContact O-CG 3.47Å; E224-K228 PolarHBondContact O-N 3.17Å; E224-K228 VanDerWaalsContact O-N 3.12Å; K225-K228 PolarHBondContact O-N 3.35Å; L226-K228 PolarHBondContact O-N 2.69Å; K228-N232 VanDerWaalsContact O-CB 3.3Å; K228-N232 WeakPolarHBondContact O-CB 3.08Å; K228-N232 PolarHBondContact O-N 3.2Å; K228-N232 VanDerWaalsContact O-N 3.08Å
229	Q	84.3	Confident	79.1	Confident	81 Å²	81	80.6 Å²	80.6	38%	0.379	40%	0.404	S	S	.	.	H	α-helix	trans	-64.9	-46.5	174.8	-73.8	175.6	-54.2	0	0	111.5	K225 L226 K227 N232 T233 Q295	K225-Q229 WeakPolarHBondContact O-CG 3.48Å; K225-Q229 PolarHBondContact O-N 2.69Å; L226-Q229 WeakPolarHBondContact O-CB 3.38Å; L226-Q229 PolarHBondContact O-N 2.77Å; K227-Q229 VanDerWaalsContact C-N 3.29Å; K227-Q229 PolarHBondContact O-N 3.24Å; Q229-N232 PolarHBondContact O-N 3.23Å; Q229-T233 PolarHBondContact O-N 2.84Å; Q229-T233 PolarHBondContact O-OG1 3.37Å; Q229-Q295 PolarHBondContact O-OE1 2.87Å
230	L	82.6	Confident	80.6	Confident	20 Å²	20	78.8 Å²	78.8	11%	0.105	39%	0.392	C	S	.	.	H	α-helix	trans	-58.8	-52.8	177.2	-179.1	58.9	0	0	0	111.6	L226 K227 N232 T233 E234 A292 Q295 L299	L226-L230 WeakPolarHBondContact O-CB 3.35Å; L226-L230 PolarHBondContact O-N 3.2Å; K227-L230 PolarHBondContact O-N 3.39Å; L230-N232 VanDerWaalsContact C-N 3.28Å; L230-N232 PolarHBondContact O-N 3.34Å; L230-T233 CarbonylContact O-C 3.57Å; L230-T233 WeakPolarHBondContact O-CA 3.34Å; L230-T233 WeakPolarHBondContact O-CB 3.32Å; L230-T233 PolarHBondContact O-N 3.06Å; L230-E234 HydrophobicContact CD1-CG 4.22Å; L230-E234 HydrophobicContact CG-CG 4.41Å; L230-E234 WeakPolarHBondContact O-CG 3.36Å; L230-E234 PolarHBondContact O-N 3.41Å; L230-A292 HydrophobicContact CD1-CB 4.15Å; L230-Q295 VanDerWaalsContact CA-OE1 3.22Å; L230-Q295 HydrophobicContact CB-CB 4.4Å; L230-Q295 HydrophobicContact CD1-CB 4.12Å; L230-L299 HydrophobicContact CD2-CD2 4.21Å
231	T	81.8	Confident	81.6	Confident	70 Å²	70	72.5 Å²	72.5	43%	0.429	36%	0.358	S	S	.	.	H	α-helix	trans	-57.8	-40.6	177.4	-57.1	0	0	0	0	112.3	K227 T233 E234 N235	K227-T231 PolarHBondContact O-N 2.69Å; K227-T231 PolarHBondContact O-OG1 3Å; K227-T231 VanDerWaalsContact O-OG1 3.11Å; T231-T233 VanDerWaalsContact C-N 3.34Å; T231-T233 PolarHBondContact O-N 3.28Å; T231-E234 WeakPolarHBondContact CA-OE2 3.37Å; T231-E234 PolarHBondContact O-N 2.91Å; T231-N235 PolarHBondContact O-N 2.99Å; T231-N235 PolarHBondContact O-ND2 2.91Å; T231-N235 PolarHBondContact O-OD1 2.67Å
232	N	88.9	Confident	82.4	Confident	83 Å²	83	75.1 Å²	75.1	44%	0.444	37%	0.371	S	S	.	.	H	α-helix	trans	-65.8	-36.2	175.6	178.7	66.5	0	0	0	112.5	K228 Q229 L230 K236	K228-N232 VanDerWaalsContact O-CB 3.3Å; K228-N232 WeakPolarHBondContact O-CB 3.08Å; K228-N232 PolarHBondContact O-N 3.2Å; K228-N232 VanDerWaalsContact O-N 3.08Å; Q229-N232 PolarHBondContact O-N 3.23Å; L230-N232 VanDerWaalsContact C-N 3.28Å; L230-N232 PolarHBondContact O-N 3.34Å; N232-K236 WeakPolarHBondContact O-CG 3.42Å; N232-K236 PolarHBondContact O-N 2.92Å
233	T	82	Confident	82.9	Confident	8 Å²	8	73.6 Å²	73.6	5%	0.049	36%	0.362	C	S	.	.	H	α-helix	trans	-68.8	-43.1	174.2	-52.5	0	0	0	0	111.1	Q229 L230 T231 N235 K236 I237 L288 E291 A292 Q295	Q229-T233 PolarHBondContact O-N 2.84Å; Q229-T233 PolarHBondContact O-OG1 3.37Å; L230-T233 CarbonylContact O-C 3.57Å; L230-T233 WeakPolarHBondContact O-CA 3.34Å; L230-T233 WeakPolarHBondContact O-CB 3.32Å; L230-T233 PolarHBondContact O-N 3.06Å; T231-T233 VanDerWaalsContact C-N 3.34Å; T231-T233 PolarHBondContact O-N 3.28Å; T233-N235 PolarHBondContact O-N 3.13Å; T233-K236 WeakPolarHBondContact O-CB 3.21Å; T233-K236 PolarHBondContact O-N 2.89Å; T233-K236 VanDerWaalsContact O-N 3.1Å; T233-I237 HydrophobicContact CG2-CD1 4.31Å; T233-I237 WeakPolarHBondContact O-CG1 3.25Å; T233-I237 PolarHBondContact O-N 3.12Å; T233-L288 WeakPolarHBondContact CG2-O 3.4Å; T233-E291 HydrophobicContact CG2-CB 4.26Å; T233-E291 HydrophobicContact CG2-CG 4.17Å; T233-A292 HydrophobicContact CG2-CB 3.92Å; T233-Q295 PolarHBondContact OG1-NE2 2.89Å; T233-Q295 PolarHBondContact OG1-OE1 3.36Å
234	E	82.6	Confident	83.1	Confident	89 Å²	89	69 Å²	69	42%	0.416	34%	0.342	S	S	.	.	H	α-helix	trans	-58.5	-45.4	175.9	-70.9	170	153.6	0	0	111.5	L230 T231 K236 I237 E238	L230-E234 HydrophobicContact CD1-CG 4.22Å; L230-E234 HydrophobicContact CG-CG 4.41Å; L230-E234 WeakPolarHBondContact O-CG 3.36Å; L230-E234 PolarHBondContact O-N 3.41Å; T231-E234 WeakPolarHBondContact CA-OE2 3.37Å; T231-E234 PolarHBondContact O-N 2.91Å; E234-K236 VanDerWaalsContact C-N 3.28Å; E234-K236 PolarHBondContact O-N 3.29Å; E234-I237 WeakPolarHBondContact O-CB 3.43Å; E234-I237 PolarHBondContact O-N 3.45Å; E234-I237 VanDerWaalsContact O-N 3.11Å; E234-E238 PolarHBondContact O-N 2.9Å
235	N	84.6	Confident	83.1	Confident	90 Å²	90	67.9 Å²	67.9	48%	0.481	34%	0.336	S	S	.	.	H	α-helix	trans	-61.3	-36	174.9	-67.7	-15	0	0	0	112.5	T231 T233 A239	T231-N235 PolarHBondContact O-N 2.99Å; T231-N235 PolarHBondContact O-ND2 2.91Å; T231-N235 PolarHBondContact O-OD1 2.67Å; T233-N235 PolarHBondContact O-N 3.13Å; N235-A239 PolarHBondContact O-N 3.35Å
236	K	88.6	Confident	83	Confident	104 Å²	104	67.8 Å²	67.8	45%	0.452	34%	0.337	S	S	.	.	H	α-helix	trans	-69.6	-38.2	174.4	-72.2	173	-178.8	-175.9	0	111.9	N232 T233 E234 E238 A239 Q240 L288	N232-K236 WeakPolarHBondContact O-CG 3.42Å; N232-K236 PolarHBondContact O-N 2.92Å; T233-K236 WeakPolarHBondContact O-CB 3.21Å; T233-K236 PolarHBondContact O-N 2.89Å; T233-K236 VanDerWaalsContact O-N 3.1Å; E234-K236 VanDerWaalsContact C-N 3.28Å; E234-K236 PolarHBondContact O-N 3.29Å; K236-E238 VanDerWaalsContact C-N 3.34Å; K236-A239 PolarHBondContact O-N 2.95Å; K236-Q240 VanDerWaalsContact O-CB 3.26Å; K236-Q240 WeakPolarHBondContact O-CB 3.22Å; K236-Q240 PolarHBondContact O-N 3.03Å; K236-L288 HydrophobicContact CB-CD1 4.08Å; K236-L288 HydrophobicContact CB-CD2 4.06Å; K236-L288 HydrophobicContact CD-CD2 4.24Å
237	I	80.6	Confident	83.4	Confident	26 Å²	26	68.4 Å²	68.4	13%	0.133	34%	0.34	C	S	.	.	H	α-helix	trans	-60.1	-47.9	174	-70.3	168.6	0	0	0	109.2	T233 E234 A239 Q240 L241 L285 L288 M289 A292	T233-I237 HydrophobicContact CG2-CD1 4.31Å; T233-I237 WeakPolarHBondContact O-CG1 3.25Å; T233-I237 PolarHBondContact O-N 3.12Å; E234-I237 WeakPolarHBondContact O-CB 3.43Å; E234-I237 PolarHBondContact O-N 3.45Å; E234-I237 VanDerWaalsContact O-N 3.11Å; I237-A239 PolarHBondContact O-N 3.49Å; I237-Q240 PolarHBondContact O-N 3.34Å; I237-L241 HydrophobicContact CG2-CD1 3.81Å; I237-L241 HydrophobicContact CG2-CG 4.17Å; I237-L241 WeakPolarHBondContact O-CB 3.39Å; I237-L241 VanDerWaalsContact O-CG 3.24Å; I237-L241 WeakPolarHBondContact O-CG 3.09Å; I237-L241 PolarHBondContact O-N 3.44Å; I237-L285 HydrophobicContact CG2-CD1 3.98Å; I237-L288 HydrophobicContact CD1-CB 4.37Å; I237-L288 HydrophobicContact CG1-CB 3.58Å; I237-M289 HydrophobicContact CD1-CG 4.23Å; I237-M289 HydrophobicContact CG1-CG 4.5Å; I237-M289 HydrophobicContact CG2-CG 4.48Å; I237-A292 HydrophobicContact CD1-CB 3.65Å
238	E	79.9	Confident	83.2	Confident	121 Å²	121	64.6 Å²	64.6	57%	0.565	32%	0.324	S	S	*	.	H	α-helix	trans	-58.4	-47.6	177.5	-172.5	-179.3	-178.6	0	0	112.2	E234 K236 Q240 L241 N242	E234-E238 PolarHBondContact O-N 2.9Å; K236-E238 VanDerWaalsContact C-N 3.34Å; E238-Q240 VanDerWaalsContact C-N 3.33Å; E238-Q240 PolarHBondContact O-N 2.65Å; E238-L241 WeakPolarHBondContact O-CB 3.24Å; E238-L241 PolarHBondContact O-N 3.09Å; E238-N242 PolarHBondContact O-N 2.79Å; E238-N242 VanDerWaalsContact O-N 3.14Å; E238-N242 PolarHBondContact O-ND2 3.43Å
239	A	84.7	Confident	82.8	Confident	54 Å²	54	61 Å²	61	45%	0.446	32%	0.318	S	S	.	.	H	α-helix	trans	-60.5	-42.1	175.7	0	0	0	0	0	112.2	N235 K236 I237 N242 I243	N235-A239 PolarHBondContact O-N 3.35Å; K236-A239 PolarHBondContact O-N 2.95Å; I237-A239 PolarHBondContact O-N 3.49Å; A239-N242 PolarHBondContact O-N 3.25Å; A239-I243 WeakPolarHBondContact O-CG1 3.13Å; A239-I243 PolarHBondContact O-N 3.42Å; A239-I243 VanDerWaalsContact O-N 3.16Å
240	Q	85.3	Confident	82.8	Confident	23 Å²	23	62.6 Å²	62.6	11%	0.107	32%	0.324	C	S	.	.	H	α-helix	trans	-69.7	-36.4	179.3	-171.1	68	30.6	0	0	112.2	K236 I237 E238 N242 I243 V244 E281 L285 L288	K236-Q240 VanDerWaalsContact O-CB 3.26Å; K236-Q240 WeakPolarHBondContact O-CB 3.22Å; K236-Q240 PolarHBondContact O-N 3.03Å; I237-Q240 PolarHBondContact O-N 3.34Å; E238-Q240 VanDerWaalsContact C-N 3.33Å; E238-Q240 PolarHBondContact O-N 2.65Å; Q240-N242 VanDerWaalsContact C-N 3.29Å; Q240-N242 PolarHBondContact O-N 3.5Å; Q240-I243 PolarHBondContact O-N 2.84Å; Q240-V244 WeakPolarHBondContact O-CG2 3.42Å; Q240-V244 PolarHBondContact O-N 3.1Å; Q240-E281 PolarHBondContact NE2-O 3.3Å; Q240-E281 PolarHBondContact NE2-OE2 3.41Å; Q240-L285 HydrophobicContact CB-CD1 4.06Å; Q240-L285 HydrophobicContact CG-CB 3.65Å; Q240-L285 HydrophobicContact CG-CD1 4.03Å; Q240-L285 HydrophobicContact CG-CG 4.36Å; Q240-L288 HydrophobicContact CB-CD1 3.87Å; Q240-L288 HydrophobicContact CG-CD1 4.18Å
241	L	81.3	Confident	82.7	Confident	33 Å²	33	61.7 Å²	61.7	17%	0.173	32%	0.319	C	S	.	.	H	α-helix	trans	-57.5	-44.5	172.4	-76.9	168.4	0	0	0	110.1	V52 I237 E238 I243 V244 K245 L285	V52-L241 HydrophobicContact CG1-CB 3.57Å; V52-L241 HydrophobicContact CG1-CD2 3.54Å; V52-L241 HydrophobicContact CG1-CG 4.09Å; V52-L241 WeakPolarHBondContact CG1-O 3.41Å; V52-L241 WeakPolarHBondContact CG2-O 3.4Å; I237-L241 HydrophobicContact CG2-CD1 3.81Å; I237-L241 HydrophobicContact CG2-CG 4.17Å; I237-L241 WeakPolarHBondContact O-CB 3.39Å; I237-L241 VanDerWaalsContact O-CG 3.24Å; I237-L241 WeakPolarHBondContact O-CG 3.09Å; I237-L241 PolarHBondContact O-N 3.44Å; E238-L241 WeakPolarHBondContact O-CB 3.24Å; E238-L241 PolarHBondContact O-N 3.09Å; L241-I243 PolarHBondContact O-N 3.39Å; L241-V244 PolarHBondContact O-N 3.18Å; L241-K245 WeakPolarHBondContact O-CB 3.35Å; L241-K245 PolarHBondContact O-N 3.21Å; L241-L285 HydrophobicContact CD2-CD1 3.94Å; L241-L285 HydrophobicContact CD2-CD2 3.53Å; L241-L285 HydrophobicContact CD2-CG 4.35Å; L241-L285 HydrophobicContact CG-CD1 3.88Å; L241-L285 HydrophobicContact CG-CD2 4.26Å
242	N	82.6	Confident	82.3	Confident	89 Å²	89	59.5 Å²	59.5	48%	0.476	31%	0.305	S	S	.	.	H	α-helix	trans	-62.3	-41.8	175.9	-70.2	-35.4	0	0	0	112.6	E238 A239 Q240 K245 E246	E238-N242 PolarHBondContact O-N 2.79Å; E238-N242 VanDerWaalsContact O-N 3.14Å; E238-N242 PolarHBondContact O-ND2 3.43Å; A239-N242 PolarHBondContact O-N 3.25Å; Q240-N242 VanDerWaalsContact C-N 3.29Å; Q240-N242 PolarHBondContact O-N 3.5Å; N242-K245 WeakPolarHBondContact O-CB 3.48Å; N242-K245 PolarHBondContact O-N 2.76Å; N242-E246 PolarHBondContact O-N 3.48Å; N242-E246 VanDerWaalsContact O-N 3.09Å
243	I	87	Confident	81.9	Confident	72 Å²	72	59 Å²	59	37%	0.369	30%	0.3	S	S	.	.	H	α-helix	trans	-60.9	-48	175.2	-67.4	167.8	0	0	0	111	A239 Q240 L241 K245 E246 L247 E281	A239-I243 WeakPolarHBondContact O-CG1 3.13Å; A239-I243 PolarHBondContact O-N 3.42Å; A239-I243 VanDerWaalsContact O-N 3.16Å; Q240-I243 PolarHBondContact O-N 2.84Å; L241-I243 PolarHBondContact O-N 3.39Å; I243-K245 VanDerWaalsContact C-N 3.28Å; I243-K245 PolarHBondContact O-N 3.39Å; I243-E246 PolarHBondContact O-N 2.81Å; I243-L247 HydrophobicContact CG2-CD1 3.86Å; I243-L247 HydrophobicContact CG2-CG 4.46Å; I243-L247 WeakPolarHBondContact O-CG 3.13Å; I243-L247 PolarHBondContact O-N 2.81Å; I243-E281 HydrophobicContact CG2-CB 4.46Å; I243-E281 HydrophobicContact CG2-CG 4.15Å
244	V	80.8	Confident	81.9	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.006	30%	0.301	C	S	.	.	H	α-helix	trans	-61.3	-39.3	178.9	171.6	0	0	0	0	110.7	V52 Q240 L241 L247 E248 L278 E281 L282 L285	V52-V244 HydrophobicContact CG2-CB 3.81Å; V52-V244 HydrophobicContact CG2-CG1 3.47Å; V52-V244 VanDerWaalsContact CG2-CG1 3.47Å; Q240-V244 WeakPolarHBondContact O-CG2 3.42Å; Q240-V244 PolarHBondContact O-N 3.1Å; L241-V244 PolarHBondContact O-N 3.18Å; V244-L247 PolarHBondContact O-N 3.46Å; V244-E248 WeakPolarHBondContact O-CB 3.18Å; V244-E248 PolarHBondContact O-N 2.86Å; V244-L278 HydrophobicContact CG1-CD1 3.95Å; V244-E281 HydrophobicContact CG2-CB 4.12Å; V244-L282 HydrophobicContact CG1-CD2 3.5Å; V244-L282 VanDerWaalsContact CG1-CD2 3.5Å; V244-L282 HydrophobicContact CG1-CG 3.96Å; V244-L282 HydrophobicContact CG2-CD2 4.37Å; V244-L285 HydrophobicContact CB-CD2 4.46Å; V244-L285 HydrophobicContact CG2-CB 4.34Å; V244-L285 HydrophobicContact CG2-CD2 4Å
245	K	79	Confident	81.6	Confident	81 Å²	81	55 Å²	55	35%	0.352	28%	0.282	S	S	.	.	H	α-helix	trans	-62.5	-44.1	178.5	179.9	162.2	-173.4	165.1	0	111.8	V52 D53 L241 N242 I243 S249	V52-K245 HydrophobicContact CB-CB 4.09Å; V52-K245 HydrophobicContact CG1-CB 4.31Å; V52-K245 HydrophobicContact CG2-CB 3.84Å; D53-K245 VanDerWaalsContact CG-NZ 3.33Å; D53-K245 IonicContact OD1-NZ 3.97Å; D53-K245 PolarHBondContact OD1-NZ 2.89Å; D53-K245 IonicContact OD2-NZ 2.67Å; D53-K245 PolarHBondContact OD2-NZ 3.13Å; L241-K245 WeakPolarHBondContact O-CB 3.35Å; L241-K245 PolarHBondContact O-N 3.21Å; N242-K245 WeakPolarHBondContact O-CB 3.48Å; N242-K245 PolarHBondContact O-N 2.76Å; I243-K245 VanDerWaalsContact C-N 3.28Å; I243-K245 PolarHBondContact O-N 3.39Å; K245-S249 PolarHBondContact O-N 3.48Å
246	E	83.2	Confident	81.2	Confident	123 Å²	123	53 Å²	53	58%	0.575	27%	0.271	S	S	*	.	H	α-helix	trans	-65.7	-41.4	175.5	-71	-174.8	-176.3	0	0	112.5	N242 I243 S249 K250	N242-E246 PolarHBondContact O-N 3.48Å; N242-E246 VanDerWaalsContact O-N 3.09Å; I243-E246 PolarHBondContact O-N 2.81Å; E246-S249 PolarHBondContact O-N 3.15Å; E246-K250 WeakPolarHBondContact O-CG 3.32Å; E246-K250 PolarHBondContact O-N 2.82Å; E246-K250 VanDerWaalsContact O-N 3.12Å
247	L	84.6	Confident	80.9	Confident	25 Å²	25	51.2 Å²	51.2	13%	0.131	27%	0.265	C	S	.	.	H	α-helix	trans	-69.3	-35	178.9	-72.9	173.1	0	0	0	112.6	I243 V244 K250 A251 T277 L278 E281	I243-L247 HydrophobicContact CG2-CD1 3.86Å; I243-L247 HydrophobicContact CG2-CG 4.46Å; I243-L247 WeakPolarHBondContact O-CG 3.13Å; I243-L247 PolarHBondContact O-N 2.81Å; V244-L247 PolarHBondContact O-N 3.46Å; L247-K250 HydrophobicContact CD2-CD 4.37Å; L247-K250 PolarHBondContact O-N 3.32Å; L247-A251 VanDerWaalsContact O-CB 3.32Å; L247-A251 WeakPolarHBondContact O-CB 3.44Å; L247-A251 PolarHBondContact O-N 2.8Å; L247-T277 HydrophobicContact CD1-CG2 3.92Å; L247-T277 HydrophobicContact CD2-CG2 3.74Å; L247-T277 HydrophobicContact CG-CG2 4.5Å; L247-L278 HydrophobicContact CB-CB 4.43Å; L247-L278 HydrophobicContact CB-CD1 3.94Å; L247-E281 HydrophobicContact CD1-CB 3.69Å; L247-E281 HydrophobicContact CD1-CG 3.33Å
248	E	77.9	Confident	80.9	Confident	11 Å²	11	51 Å²	51	5%	0.051	26%	0.263	C	S	.	.	H	α-helix	trans	-59.8	-48.3	173.3	-176.5	-171.7	-176.2	0	0	110.6	S50 L51 F114 V244 K250 A251 I252 L278	S50-E248 WeakPolarHBondContact CB-OE2 3.29Å; S50-E248 PolarHBondContact OG-OE2 3.35Å; L51-E248 VanDerWaalsContact CB-CD 3.46Å; L51-E248 WeakPolarHBondContact CB-OE1 3.23Å; L51-E248 WeakPolarHBondContact CB-OE2 3.37Å; L51-E248 PolarHBondContact N-OE1 3.15Å; L51-E248 VanDerWaalsContact N-OE1 3.08Å; L51-E248 PolarHBondContact N-OE2 2.85Å; F114-E248 HydrophobicContact CD2-CG 4.26Å; F114-E248 HydrophobicContact CE2-CG 4.42Å; V244-E248 WeakPolarHBondContact O-CB 3.18Å; V244-E248 PolarHBondContact O-N 2.86Å; E248-K250 VanDerWaalsContact C-N 3.33Å; E248-K250 PolarHBondContact O-N 3.38Å; E248-A251 PolarHBondContact O-N 3.35Å; E248-I252 HydrophobicContact CG-CD1 4.08Å; E248-I252 WeakPolarHBondContact O-CG1 3.25Å; E248-I252 PolarHBondContact O-N 2.9Å; E248-L278 HydrophobicContact CB-CD1 4.32Å; E248-L278 HydrophobicContact CB-CD2 4.49Å
249	S	77.1	Confident	80.6	Confident	78 Å²	78	46.7 Å²	46.7	55%	0.545	24%	0.243	S	C	.	.	H	α-helix	trans	-58.8	-44.1	177	-174.9	0	0	0	0	111.9	K245 E246 I252 Q253	K245-S249 PolarHBondContact O-N 3.48Å; E246-S249 PolarHBondContact O-N 3.15Å; S249-I252 PolarHBondContact O-N 3.39Å; S249-Q253 PolarHBondContact O-N 3.22Å
250	K	83.7	Confident	80.4	Confident	113 Å²	113	49.2 Å²	49.2	49%	0.491	25%	0.249	S	C	.	.	H	α-helix	trans	-63.5	-40.8	175.5	-71.4	170.7	-177	167	0	112.4	E246 L247 E248 Q253 A254	E246-K250 WeakPolarHBondContact O-CG 3.32Å; E246-K250 PolarHBondContact O-N 2.82Å; E246-K250 VanDerWaalsContact O-N 3.12Å; L247-K250 HydrophobicContact CD2-CD 4.37Å; L247-K250 PolarHBondContact O-N 3.32Å; E248-K250 VanDerWaalsContact C-N 3.33Å; E248-K250 PolarHBondContact O-N 3.38Å; K250-Q253 PolarHBondContact O-N 3.16Å; K250-A254 WeakPolarHBondContact O-CB 3.43Å; K250-A254 PolarHBondContact O-N 3.07Å
251	A	79.7	Confident	80.4	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.008	26%	0.264	C	S	.	.	H	α-helix	trans	-67.3	-38.9	178.9	0	0	0	0	0	111.6	F114 L247 E248 A254 T255 A274 L278	F114-A251 HydrophobicContact CE2-CB 3.75Å; F114-A251 HydrophobicContact CZ-CB 3.57Å; L247-A251 VanDerWaalsContact O-CB 3.32Å; L247-A251 WeakPolarHBondContact O-CB 3.44Å; L247-A251 PolarHBondContact O-N 2.8Å; E248-A251 PolarHBondContact O-N 3.35Å; A251-A254 PolarHBondContact O-N 3.32Å; A251-T255 WeakPolarHBondContact O-CB 3.17Å; A251-T255 PolarHBondContact O-N 3.04Å; A251-T255 PolarHBondContact O-OG1 2.97Å; A251-A274 HydrophobicContact CB-CB 4.2Å; A251-L278 HydrophobicContact CB-CD2 3.98Å
252	I	75.1	Confident	80.4	Confident	24 Å²	24	58 Å²	58	12%	0.123	29%	0.285	C	S	.	.	H	α-helix	trans	-62.2	-44.7	172.4	-69.2	167.1	0	0	0	110.5	F114 T121 E248 S249 T255 N256	F114-I252 HydrophobicContact CE2-CG1 4.27Å; T121-I252 HydrophobicContact CG2-CG2 4.16Å; E248-I252 HydrophobicContact CG-CD1 4.08Å; E248-I252 WeakPolarHBondContact O-CG1 3.25Å; E248-I252 PolarHBondContact O-N 2.9Å; S249-I252 PolarHBondContact O-N 3.39Å; I252-T255 WeakPolarHBondContact O-CB 3.14Å; I252-T255 PolarHBondContact O-N 3.3Å; I252-N256 PolarHBondContact O-N 3.27Å; I252-N256 PolarHBondContact O-ND2 3.37Å
253	Q	79.5	Confident	80.7	Confident	73 Å²	73	61.2 Å²	61.2	34%	0.341	30%	0.302	S	S	.	.	H	α-helix	trans	-60.7	-51.3	176.4	177.8	173.9	-3.4	0	0	111.9	Q3 S249 K250 T255 N256 E257	Q3-Q253 VanDerWaalsContact OE1-NE2 3.13Å; S249-Q253 PolarHBondContact O-N 3.22Å; K250-Q253 PolarHBondContact O-N 3.16Å; Q253-T255 VanDerWaalsContact C-N 3.25Å; Q253-T255 PolarHBondContact O-N 3.48Å; Q253-N256 WeakPolarHBondContact O-CB 3.26Å; Q253-N256 PolarHBondContact O-N 2.83Å; Q253-N256 VanDerWaalsContact O-N 3.07Å; Q253-E257 HydrophobicContact CG-CG 4.45Å; Q253-E257 WeakPolarHBondContact CG-OE1 3.47Å; Q253-E257 PolarHBondContact NE2-OE1 3.39Å; Q253-E257 WeakPolarHBondContact O-CG 3.45Å; Q253-E257 PolarHBondContact O-N 2.95Å
254	A	81.7	Confident	80.9	Confident	10 Å²	10	60.5 Å²	60.5	8%	0.083	30%	0.299	C	S	.	.	H	α-helix	trans	-61.3	-35.9	179.2	0	0	0	0	0	112	K250 A251 H258 A274	K250-A254 WeakPolarHBondContact O-CB 3.43Å; K250-A254 PolarHBondContact O-N 3.07Å; A251-A254 PolarHBondContact O-N 3.32Å; A254-H258 WeakPolarHBondContact O-CB 3.37Å; A254-H258 PolarHBondContact O-N 3.08Å; A254-A274 HydrophobicContact CB-CB 3.94Å
255	T	76.1	Confident	81.5	Confident	2 Å²	2	67.6 Å²	67.6	1%	0.012	33%	0.33	C	S	.	.	H	α-helix	trans	-59.8	-52.1	171.2	-55.6	0	0	0	0	110.6	E118 T121 A251 I252 Q253 E257 H258 M259 Y271	E118-T255 HydrophobicContact CG-CG2 3.67Å; T121-T255 WeakPolarHBondContact OG1-CG2 3.35Å; A251-T255 WeakPolarHBondContact O-CB 3.17Å; A251-T255 PolarHBondContact O-N 3.04Å; A251-T255 PolarHBondContact O-OG1 2.97Å; I252-T255 WeakPolarHBondContact O-CB 3.14Å; I252-T255 PolarHBondContact O-N 3.3Å; Q253-T255 VanDerWaalsContact C-N 3.25Å; Q253-T255 PolarHBondContact O-N 3.48Å; T255-E257 VanDerWaalsContact C-N 3.35Å; T255-E257 PolarHBondContact O-N 3.2Å; T255-H258 PolarHBondContact O-N 3.3Å; T255-M259 HydrophobicContact CG2-CG 4.22Å; T255-M259 WeakPolarHBondContact O-CB 3.47Å; T255-M259 WeakPolarHBondContact O-CG 3.46Å; T255-M259 PolarHBondContact O-N 3.34Å; T255-Y271 HydrophobicContact CG2-CD2 4.31Å; T255-Y271 HydrophobicContact CG2-CE2 4.03Å; T255-Y271 WeakPolarHBondContact OG1-CD2 3.46Å; T255-Y271 VanDerWaalsContact OG1-CE2 3.32Å; T255-Y271 WeakPolarHBondContact OG1-CE2 3.47Å
256	N	76.4	Confident	82.2	Confident	48 Å²	48	66.5 Å²	66.5	26%	0.257	33%	0.333	S	S	.	.	H	α-helix	trans	-58.3	-46.4	179.9	-71	-29	0	0	0	112.2	T121 I252 Q253 M259 D260	T121-N256 VanDerWaalsContact CB-OD1 3.28Å; T121-N256 WeakPolarHBondContact CB-OD1 3.28Å; I252-N256 PolarHBondContact O-N 3.27Å; I252-N256 PolarHBondContact O-ND2 3.37Å; Q253-N256 WeakPolarHBondContact O-CB 3.26Å; Q253-N256 PolarHBondContact O-N 2.83Å; Q253-N256 VanDerWaalsContact O-N 3.07Å; N256-M259 PolarHBondContact O-N 3.1Å; N256-D260 PolarHBondContact O-N 3.34Å
257	E	82.4	Confident	82.5	Confident	67 Å²	67	62 Å²	62	31%	0.313	31%	0.312	S	S	.	.	H	α-helix	trans	-62.7	-48.5	-179.6	-69.7	174.9	-174.2	0	0	111.9	Q253 T255 M259 D260 N261 L267	Q253-E257 HydrophobicContact CG-CG 4.45Å; Q253-E257 WeakPolarHBondContact CG-OE1 3.47Å; Q253-E257 PolarHBondContact NE2-OE1 3.39Å; Q253-E257 WeakPolarHBondContact O-CG 3.45Å; Q253-E257 PolarHBondContact O-N 2.95Å; T255-E257 VanDerWaalsContact C-N 3.35Å; T255-E257 PolarHBondContact O-N 3.2Å; E257-M259 PolarHBondContact O-N 3.11Å; E257-D260 PolarHBondContact O-N 3.32Å; E257-N261 PolarHBondContact O-N 3.39Å; E257-L267 HydrophobicContact CB-CD2 4.24Å; E257-L267 WeakPolarHBondContact O-CD1 3.04Å
258	H	81.2	Confident	82.6	Confident	23 Å²	23	65.3 Å²	65.3	11%	0.106	33%	0.326	C	S	.	.	H	α-helix	trans	-58.2	-38.2	174.6	175	40.9	0	0	0	112.1	A254 T255 N261 R262 L267 K268 Y271	A254-H258 WeakPolarHBondContact O-CB 3.37Å; A254-H258 PolarHBondContact O-N 3.08Å; T255-H258 PolarHBondContact O-N 3.3Å; H258-N261 CarbonylContact O-C 3.58Å; H258-N261 PolarHBondContact O-N 3.34Å; H258-R262 VanDerWaalsContact O-CA 3.31Å; H258-R262 WeakPolarHBondContact O-CA 3.36Å; H258-R262 PolarHBondContact O-N 3.29Å; H258-R262 VanDerWaalsContact O-N 3.17Å; H258-L267 HydrophobicContact CB-CB 4.16Å; H258-K268 WeakPolarHBondContact ND1-CA 3.34Å; H258-K268 PolarHBondContact ND1-N 3.06Å; H258-Y271 HydrophobicContact CB-CG 4.47Å
259	M	74	Confident	83.2	Confident	29 Å²	29	70 Å²	70	14%	0.143	35%	0.348	C	S	.	.	H	α-helix	trans	-73.4	-31.3	-178.2	-67.6	-60.2	-49.4	0	0	113.1	R122 T255 N256 E257 N261 R262	R122-M259 HydrophobicContact CB-CE 3.83Å; R122-M259 VanDerWaalsContact CD-CE 3.46Å; R122-M259 HydrophobicContact CG-CE 3.44Å; R122-M259 VanDerWaalsContact CG-CE 3.44Å; R122-M259 HydrophobicContact CG-CG 4.01Å; R122-M259 HydrophobicContact CG-SD 3.87Å; T255-M259 HydrophobicContact CG2-CG 4.22Å; T255-M259 WeakPolarHBondContact O-CB 3.47Å; T255-M259 WeakPolarHBondContact O-CG 3.46Å; T255-M259 PolarHBondContact O-N 3.34Å; N256-M259 PolarHBondContact O-N 3.1Å; E257-M259 PolarHBondContact O-N 3.11Å; M259-N261 VanDerWaalsContact C-N 3.3Å; M259-R262 VanDerWaalsContact CE-NE 3.29Å
260	D	78.8	Confident	83.8	Confident	107 Å²	107	70.8 Å²	70.8	57%	0.572	34%	0.343	S	S	*	.	H	α-helix	trans	-71	-24.7	173.9	-84.7	-30.4	0	0	0	112.7	R124 N256 E257	R124-D260 IonicContact CZ-OD1 3.68Å; R124-D260 IonicContact NE-OD1 3.65Å; R124-D260 IonicContact NH2-OD1 2.84Å; R124-D260 PolarHBondContact NH2-OD1 3.4Å; N256-D260 PolarHBondContact O-N 3.34Å; E257-D260 PolarHBondContact O-N 3.32Å
261	N	86	Confident	83.8	Confident	77 Å²	77	66.4 Å²	66.4	41%	0.412	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.4	77.1	175.3	-171.9	4.4	0	0	0	111.7	E257 H258 M259 D263 D264 L267	E257-N261 PolarHBondContact O-N 3.39Å; H258-N261 CarbonylContact O-C 3.58Å; H258-N261 PolarHBondContact O-N 3.34Å; M259-N261 VanDerWaalsContact C-N 3.3Å; N261-D263 VanDerWaalsContact C-N 3.25Å; N261-D263 PolarHBondContact O-N 2.98Å; N261-D264 HydrophobicContact CB-CB 4.3Å; N261-D264 WeakPolarHBondContact O-CB 3.31Å; N261-D264 PolarHBondContact O-N 3.43Å; N261-D264 VanDerWaalsContact O-N 3.14Å; N261-L267 HydrophobicContact CB-CD1 3.88Å
262	R	81	Confident	84.1	Confident	163 Å²	163	72.5 Å²	72.5	62%	0.615	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-25.8	-172.5	-64.5	-172.2	-170.4	-169.1	3.2	114.5	H258 M259 D264	H258-R262 VanDerWaalsContact O-CA 3.31Å; H258-R262 WeakPolarHBondContact O-CA 3.36Å; H258-R262 PolarHBondContact O-N 3.29Å; H258-R262 VanDerWaalsContact O-N 3.17Å; M259-R262 VanDerWaalsContact CE-NE 3.29Å; R262-D264 VanDerWaalsContact C-N 3.27Å
263	D	90.2	Very high	84.8	Confident	158 Å²	158	77.1 Å²	77.1	85%	0.845	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-13.5	-179.4	-61.7	-32.1	0	0	0	111.8	N261 K265	N261-D263 VanDerWaalsContact C-N 3.25Å; N261-D263 PolarHBondContact O-N 2.98Å; D263-K265 PolarHBondContact O-N 3.4Å
264	D	91.3	Very high	85.1	Confident	57 Å²	57	74.6 Å²	74.6	31%	0.305	36%	0.359	S	S	.	.			trans	-75.8	106.4	174.8	-167	-32.7	0	0	0	111.1	N261 R262 S266 L267 K268	N261-D264 HydrophobicContact CB-CB 4.3Å; N261-D264 WeakPolarHBondContact O-CB 3.31Å; N261-D264 PolarHBondContact O-N 3.43Å; N261-D264 VanDerWaalsContact O-N 3.14Å; R262-D264 VanDerWaalsContact C-N 3.27Å; D264-S266 VanDerWaalsContact C-N 3.26Å; D264-S266 PolarHBondContact O-N 2.99Å; D264-S266 WeakPolarHBondContact OD1-CA 3.37Å; D264-S266 VanDerWaalsContact OD1-CB 3.26Å; D264-S266 WeakPolarHBondContact OD1-CB 3.46Å; D264-S266 PolarHBondContact OD1-N 2.75Å; D264-L267 HydrophobicContact CB-CB 4.24Å; D264-L267 HydrophobicContact CB-CD1 3.92Å; D264-L267 HydrophobicContact CB-CG 4.03Å; D264-L267 PolarHBondContact O-N 3Å; D264-L267 PolarHBondContact OD1-N 3.23Å; D264-K268 PolarHBondContact O-N 3.08Å
265	K	92.8	Very high	85.1	Confident	150 Å²	150	76.7 Å²	76.7	65%	0.652	37%	0.366	S	S	*	.	H	α-helix	trans	-60.7	-34.1	177.7	-169	-176.1	177.4	-163.1	0	112.5	D263 K268 E269	D263-K265 PolarHBondContact O-N 3.4Å; K265-K268 WeakPolarHBondContact O-CB 3.34Å; K265-K268 PolarHBondContact O-N 3.45Å; K265-E269 VanDerWaalsContact CE-OE1 3.24Å; K265-E269 WeakPolarHBondContact CE-OE1 2.99Å; K265-E269 IonicContact NZ-OE1 2.69Å; K265-E269 WeakPolarHBondContact O-CG 3Å; K265-E269 PolarHBondContact O-N 3.39Å
266	S	93.9	Very high	85.5	Confident	58 Å²	58	79.8 Å²	79.8	41%	0.406	39%	0.387	S	S	.	.	H	α-helix	trans	-67.6	-42.4	-179.9	-176	0	0	0	0	111.3	D264 K268 E269 Q270	D264-S266 VanDerWaalsContact C-N 3.26Å; D264-S266 PolarHBondContact O-N 2.99Å; D264-S266 WeakPolarHBondContact OD1-CA 3.37Å; D264-S266 VanDerWaalsContact OD1-CB 3.26Å; D264-S266 WeakPolarHBondContact OD1-CB 3.46Å; D264-S266 PolarHBondContact OD1-N 2.75Å; S266-K268 VanDerWaalsContact C-N 3.32Å; S266-K268 PolarHBondContact O-N 3.25Å; S266-E269 PolarHBondContact O-N 3.42Å; S266-Q270 WeakPolarHBondContact O-CG 3.31Å; S266-Q270 PolarHBondContact O-N 3.07Å; S266-Q270 PolarHBondContact OG-NE2 3.48Å
267	L	89.5	Confident	86.2	Confident	28 Å²	28	79.5 Å²	79.5	15%	0.147	39%	0.387	C	S	.	.	H	α-helix	trans	-66.9	-36.7	177.1	-63.3	177.5	0	0	0	111.7	E257 H258 N261 D264 E269 Q270 Y271	E257-L267 HydrophobicContact CB-CD2 4.24Å; E257-L267 WeakPolarHBondContact O-CD1 3.04Å; H258-L267 HydrophobicContact CB-CB 4.16Å; N261-L267 HydrophobicContact CB-CD1 3.88Å; D264-L267 HydrophobicContact CB-CB 4.24Å; D264-L267 HydrophobicContact CB-CD1 3.92Å; D264-L267 HydrophobicContact CB-CG 4.03Å; D264-L267 PolarHBondContact O-N 3Å; D264-L267 PolarHBondContact OD1-N 3.23Å; L267-E269 VanDerWaalsContact C-N 3.35Å; L267-E269 PolarHBondContact O-N 3Å; L267-Q270 PolarHBondContact O-N 3.34Å; L267-Y271 WeakPolarHBondContact O-CB 3.4Å; L267-Y271 PolarHBondContact O-N 2.81Å
268	K	87.2	Confident	86.2	Confident	94 Å²	94	76.5 Å²	76.5	41%	0.409	37%	0.373	S	S	.	.	H	α-helix	trans	-58.8	-45.9	172.3	-175.5	175.6	177.9	178.5	0	111.7	H258 D264 K265 S266 Y271 Y272	H258-K268 WeakPolarHBondContact ND1-CA 3.34Å; H258-K268 PolarHBondContact ND1-N 3.06Å; D264-K268 PolarHBondContact O-N 3.08Å; K265-K268 WeakPolarHBondContact O-CB 3.34Å; K265-K268 PolarHBondContact O-N 3.45Å; S266-K268 VanDerWaalsContact C-N 3.32Å; S266-K268 PolarHBondContact O-N 3.25Å; K268-Y271 PolarHBondContact O-N 3.34Å; K268-Y272 HydrophobicContact CD-CE2 4.22Å; K268-Y272 HydrophobicContact CG-CD2 3.94Å; K268-Y272 HydrophobicContact CG-CE2 3.56Å; K268-Y272 WeakPolarHBondContact O-CD2 3.25Å; K268-Y272 PolarHBondContact O-N 2.69Å; K268-Y272 VanDerWaalsContact O-N 3.12Å
269	E	90.8	Very high	86.2	Confident	111 Å²	111	76 Å²	76	52%	0.519	37%	0.373	S	S	.	.	H	α-helix	trans	-63.3	-44.2	176.9	-73.6	169.8	-175.3	0	0	111.7	K265 S266 L267 Y271 Y272 E273	K265-E269 VanDerWaalsContact CE-OE1 3.24Å; K265-E269 WeakPolarHBondContact CE-OE1 2.99Å; K265-E269 IonicContact NZ-OE1 2.69Å; K265-E269 WeakPolarHBondContact O-CG 3Å; K265-E269 PolarHBondContact O-N 3.39Å; S266-E269 PolarHBondContact O-N 3.42Å; L267-E269 VanDerWaalsContact C-N 3.35Å; L267-E269 PolarHBondContact O-N 3Å; E269-Y271 PolarHBondContact O-N 3.47Å; E269-Y272 PolarHBondContact O-N 2.83Å; E269-E273 WeakPolarHBondContact O-CB 3.18Å; E269-E273 PolarHBondContact O-N 3.06Å
270	Q	89.4	Confident	86.8	Confident	93 Å²	93	81.2 Å²	81.2	44%	0.435	40%	0.395	S	S	.	.	H	α-helix	trans	-61.5	-41.4	176.3	-71.3	176.5	58.3	0	0	112.6	S266 L267 E273 A274	S266-Q270 WeakPolarHBondContact O-CG 3.31Å; S266-Q270 PolarHBondContact O-N 3.07Å; S266-Q270 PolarHBondContact OG-NE2 3.48Å; L267-Q270 PolarHBondContact O-N 3.34Å; Q270-E273 PolarHBondContact O-N 3.34Å; Q270-A274 WeakPolarHBondContact O-CB 3.26Å; Q270-A274 PolarHBondContact O-N 3.47Å
271	Y	82.5	Confident	87.3	Confident	21 Å²	21	78 Å²	78	8%	0.082	38%	0.376	C	S	.	.	H	α-helix	trans	-59	-49.7	174.2	159.5	-98	0	0	0	111.8	E118 T255 H258 L267 K268 E269 E273 A274 Y275	E118-Y271 PolarHBondContact OE1-OH 3.17Å; E118-Y271 PolarHBondContact OE2-OH 3.4Å; T255-Y271 HydrophobicContact CG2-CD2 4.31Å; T255-Y271 HydrophobicContact CG2-CE2 4.03Å; T255-Y271 WeakPolarHBondContact OG1-CD2 3.46Å; T255-Y271 VanDerWaalsContact OG1-CE2 3.32Å; T255-Y271 WeakPolarHBondContact OG1-CE2 3.47Å; H258-Y271 HydrophobicContact CB-CG 4.47Å; L267-Y271 WeakPolarHBondContact O-CB 3.4Å; L267-Y271 PolarHBondContact O-N 2.81Å; K268-Y271 PolarHBondContact O-N 3.34Å; E269-Y271 PolarHBondContact O-N 3.47Å; Y271-E273 VanDerWaalsContact C-N 3.34Å; Y271-E273 PolarHBondContact O-N 2.96Å; Y271-A274 PolarHBondContact O-N 3.29Å; Y271-Y275 PolarHBondContact O-N 2.94Å
272	Y	85.9	Confident	87.2	Confident	130 Å²	130	74.4 Å²	74.4	51%	0.51	36%	0.357	S	S	.	.	H	α-helix	trans	-64.5	-38.6	178.7	-77.1	-62.8	0	0	0	112.4	K268 E269 Y275 S276	K268-Y272 HydrophobicContact CD-CE2 4.22Å; K268-Y272 HydrophobicContact CG-CD2 3.94Å; K268-Y272 HydrophobicContact CG-CE2 3.56Å; K268-Y272 WeakPolarHBondContact O-CD2 3.25Å; K268-Y272 PolarHBondContact O-N 2.69Å; K268-Y272 VanDerWaalsContact O-N 3.12Å; E269-Y272 PolarHBondContact O-N 2.83Å; Y272-Y275 PolarHBondContact O-N 3.27Å; Y272-S276 WeakPolarHBondContact O-CB 3.46Å; Y272-S276 PolarHBondContact O-N 2.88Å
273	E	90.8	Very high	87.4	Confident	121 Å²	121	73 Å²	73	57%	0.565	35%	0.352	S	S	*	.	H	α-helix	trans	-66.8	-42.7	178.2	-175.3	59.1	-162.1	0	0	112	E269 Q270 Y271 Y275 S276 T277	E269-E273 WeakPolarHBondContact O-CB 3.18Å; E269-E273 PolarHBondContact O-N 3.06Å; Q270-E273 PolarHBondContact O-N 3.34Å; Y271-E273 VanDerWaalsContact C-N 3.34Å; Y271-E273 PolarHBondContact O-N 2.96Å; E273-Y275 PolarHBondContact O-N 3.29Å; E273-S276 PolarHBondContact O-N 3.48Å; E273-T277 WeakPolarHBondContact O-CB 3.5Å; E273-T277 PolarHBondContact O-N 3.29Å; E273-T277 PolarHBondContact O-OG1 3.35Å
274	A	85.4	Confident	87.3	Confident	19 Å²	19	67.5 Å²	67.5	16%	0.157	33%	0.326	C	S	.	.	H	α-helix	trans	-62.1	-43.9	176.2	0	0	0	0	0	111.4	A251 A254 Q270 Y271 T277 L278	A251-A274 HydrophobicContact CB-CB 4.2Å; A254-A274 HydrophobicContact CB-CB 3.94Å; Q270-A274 WeakPolarHBondContact O-CB 3.26Å; Q270-A274 PolarHBondContact O-N 3.47Å; Y271-A274 PolarHBondContact O-N 3.29Å; A274-T277 PolarHBondContact O-N 2.81Å; A274-L278 WeakPolarHBondContact O-CB 3.34Å; A274-L278 PolarHBondContact O-N 2.98Å
275	Y	82	Confident	86.9	Confident	55 Å²	55	64.8 Å²	64.8	22%	0.216	31%	0.311	C	S	.	.	H	α-helix	trans	-65.5	-44.3	175.9	-179.9	-106.1	0	0	0	112.6	I111 F114 L115 Y271 Y272 E273 T277 L278 A279	I111-Y275 VanDerWaalsContact CG2-OH 3.32Å; I111-Y275 WeakPolarHBondContact CG2-OH 3.44Å; F114-Y275 AromaticContact CD1-CD2 3.72Å; F114-Y275 HydrophobicContact CD1-CD2 3.72Å; F114-Y275 AromaticContact CD1-CE2 3.55Å; F114-Y275 HydrophobicContact CD1-CE2 3.55Å; F114-Y275 AromaticContact CE1-CD2 3.38Å; F114-Y275 HydrophobicContact CE1-CD2 3.38Å; F114-Y275 AromaticContact CE1-CE2 3.71Å; F114-Y275 HydrophobicContact CE1-CE2 3.71Å; F114-Y275 HydrophobicContact CZ-CD2 4.29Å; L115-Y275 HydrophobicContact CD2-CE2 3.94Å; Y271-Y275 PolarHBondContact O-N 2.94Å; Y272-Y275 PolarHBondContact O-N 3.27Å; E273-Y275 PolarHBondContact O-N 3.29Å; Y275-T277 VanDerWaalsContact C-N 3.33Å; Y275-T277 PolarHBondContact O-N 3.48Å; Y275-L278 PolarHBondContact O-N 3.49Å; Y275-A279 WeakPolarHBondContact O-CB 3.44Å; Y275-A279 PolarHBondContact O-N 3.33Å
276	S	84.9	Confident	86.4	Confident	67 Å²	67	57.8 Å²	57.8	47%	0.469	28%	0.281	S	S	.	.	H	α-helix	trans	-57.9	-46	176.5	179.3	0	0	0	0	111.4	Y272 E273 A279 K280	Y272-S276 WeakPolarHBondContact O-CB 3.46Å; Y272-S276 PolarHBondContact O-N 2.88Å; E273-S276 PolarHBondContact O-N 3.48Å; S276-A279 PolarHBondContact O-N 2.78Å; S276-K280 WeakPolarHBondContact O-CB 3.37Å; S276-K280 PolarHBondContact O-N 2.88Å
277	T	89.6	Confident	86.1	Confident	42 Å²	42	58.6 Å²	58.6	26%	0.258	28%	0.281	S	S	.	.	H	α-helix	trans	-63.7	-47	177.3	-57.3	0	0	0	0	111.4	L247 E273 A274 Y275 A279 K280 E281	L247-T277 HydrophobicContact CD1-CG2 3.92Å; L247-T277 HydrophobicContact CD2-CG2 3.74Å; L247-T277 HydrophobicContact CG-CG2 4.5Å; E273-T277 WeakPolarHBondContact O-CB 3.5Å; E273-T277 PolarHBondContact O-N 3.29Å; E273-T277 PolarHBondContact O-OG1 3.35Å; A274-T277 PolarHBondContact O-N 2.81Å; Y275-T277 VanDerWaalsContact C-N 3.33Å; Y275-T277 PolarHBondContact O-N 3.48Å; T277-A279 PolarHBondContact O-N 3.33Å; T277-K280 WeakPolarHBondContact O-CB 3.42Å; T277-K280 PolarHBondContact O-N 2.82Å; T277-E281 PolarHBondContact O-N 3.46Å
278	L	83.6	Confident	85.9	Confident	4 Å²	4	59.2 Å²	59.2	2%	0.021	28%	0.284	C	S	.	.	H	α-helix	trans	-59.1	-45.9	176.2	176.6	60.9	0	0	0	111.8	F114 V244 L247 E248 A251 A274 Y275 K280 E281 L282	F114-L278 HydrophobicContact CD1-CD2 4.42Å; F114-L278 HydrophobicContact CD2-CD2 3.46Å; F114-L278 VanDerWaalsContact CD2-CD2 3.46Å; F114-L278 HydrophobicContact CE1-CD2 4.44Å; F114-L278 HydrophobicContact CE2-CD2 3.47Å; F114-L278 VanDerWaalsContact CE2-CD2 3.47Å; F114-L278 HydrophobicContact CG-CD2 3.96Å; F114-L278 HydrophobicContact CZ-CD2 3.99Å; V244-L278 HydrophobicContact CG1-CD1 3.95Å; L247-L278 HydrophobicContact CB-CB 4.43Å; L247-L278 HydrophobicContact CB-CD1 3.94Å; E248-L278 HydrophobicContact CB-CD1 4.32Å; E248-L278 HydrophobicContact CB-CD2 4.49Å; A251-L278 HydrophobicContact CB-CD2 3.98Å; A274-L278 WeakPolarHBondContact O-CB 3.34Å; A274-L278 PolarHBondContact O-N 2.98Å; Y275-L278 PolarHBondContact O-N 3.49Å; L278-K280 VanDerWaalsContact C-N 3.31Å; L278-K280 PolarHBondContact O-N 2.9Å; L278-E281 PolarHBondContact O-N 3.07Å; L278-L282 HydrophobicContact CD1-CD1 4.14Å; L278-L282 HydrophobicContact CD1-CG 4.18Å; L278-L282 HydrophobicContact CG-CD1 3.98Å; L278-L282 HydrophobicContact CG-CG 4.47Å; L278-L282 WeakPolarHBondContact O-CB 3.42Å; L278-L282 WeakPolarHBondContact O-CG 3.18Å; L278-L282 PolarHBondContact O-N 3.48Å
279	A	81.4	Confident	85.6	Confident	13 Å²	13	56 Å²	56	11%	0.107	27%	0.271	C	S	.	.	H	α-helix	trans	-63	-37.7	179.1	0	0	0	0	0	112.2	I111 Y275 S276 T277 R283	I111-A279 HydrophobicContact CD1-CB 3.91Å; Y275-A279 WeakPolarHBondContact O-CB 3.44Å; Y275-A279 PolarHBondContact O-N 3.33Å; S276-A279 PolarHBondContact O-N 2.78Å; T277-A279 PolarHBondContact O-N 3.33Å; A279-R283 PolarHBondContact O-N 3.49Å; A279-R283 VanDerWaalsContact O-N 3.1Å
280	K	87	Confident	85.1	Confident	138 Å²	138	51 Å²	51	60%	0.6	25%	0.25	S	S	*	.	H	α-helix	trans	-63.5	-49.3	174.2	-177.8	-173.6	173.3	-168.6	0	111.5	S276 T277 L278 L282 R283 S284	S276-K280 WeakPolarHBondContact O-CB 3.37Å; S276-K280 PolarHBondContact O-N 2.88Å; T277-K280 WeakPolarHBondContact O-CB 3.42Å; T277-K280 PolarHBondContact O-N 2.82Å; L278-K280 VanDerWaalsContact C-N 3.31Å; L278-K280 PolarHBondContact O-N 2.9Å; K280-L282 PolarHBondContact O-N 2.83Å; K280-R283 WeakPolarHBondContact O-CB 3.31Å; K280-R283 PolarHBondContact O-N 2.91Å; K280-R283 VanDerWaalsContact O-N 3.11Å; K280-S284 PolarHBondContact O-N 3.25Å; K280-S284 VanDerWaalsContact O-N 3.11Å; K280-S284 PolarHBondContact O-OG 3.05Å
281	E	88.1	Confident	84.9	Confident	38 Å²	38	50.8 Å²	50.8	18%	0.178	25%	0.249	C	C	.	.	H	α-helix	trans	-71.3	-30.3	-178.5	-66.2	-45.2	134.5	0	0	113.1	Q240 I243 V244 L247 T277 L278 R283 S284 L285	Q240-E281 PolarHBondContact NE2-O 3.3Å; Q240-E281 PolarHBondContact NE2-OE2 3.41Å; I243-E281 HydrophobicContact CG2-CB 4.46Å; I243-E281 HydrophobicContact CG2-CG 4.15Å; V244-E281 HydrophobicContact CG2-CB 4.12Å; L247-E281 HydrophobicContact CD1-CB 3.69Å; L247-E281 HydrophobicContact CD1-CG 3.33Å; T277-E281 PolarHBondContact O-N 3.46Å; L278-E281 PolarHBondContact O-N 3.07Å; E281-R283 VanDerWaalsContact C-N 3.32Å; E281-S284 PolarHBondContact O-N 2.83Å; E281-L285 WeakPolarHBondContact O-CB 3.29Å; E281-L285 PolarHBondContact O-N 3.44Å
282	L	83.1	Confident	84.8	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-61.8	-40.3	167.8	-81.8	169.8	0	0	0	111.4	M55 Y107 I111 V244 L278 K280 L285 V286	M55-L282 HydrophobicContact CE-CD2 3.94Å; M55-L282 HydrophobicContact SD-CD2 4.04Å; Y107-L282 HydrophobicContact CD2-CB 4.36Å; Y107-L282 HydrophobicContact CE2-CB 4.26Å; I111-L282 HydrophobicContact CD1-CD1 3.77Å; V244-L282 HydrophobicContact CG1-CD2 3.5Å; V244-L282 VanDerWaalsContact CG1-CD2 3.5Å; V244-L282 HydrophobicContact CG1-CG 3.96Å; V244-L282 HydrophobicContact CG2-CD2 4.37Å; L278-L282 HydrophobicContact CD1-CD1 4.14Å; L278-L282 HydrophobicContact CD1-CG 4.18Å; L278-L282 HydrophobicContact CG-CD1 3.98Å; L278-L282 HydrophobicContact CG-CG 4.47Å; L278-L282 WeakPolarHBondContact O-CB 3.42Å; L278-L282 WeakPolarHBondContact O-CG 3.18Å; L278-L282 PolarHBondContact O-N 3.48Å; K280-L282 PolarHBondContact O-N 2.83Å; L282-L285 WeakPolarHBondContact O-CB 3.4Å; L282-L285 PolarHBondContact O-N 2.91Å; L282-V286 WeakPolarHBondContact O-CG2 3.24Å; L282-V286 PolarHBondContact O-N 3.16Å
283	R	85.7	Confident	84.6	Confident	134 Å²	134	44.7 Å²	44.7	51%	0.506	23%	0.227	S	C	.	.	H	α-helix	trans	-63.1	-46.4	176.2	-173.4	172.2	-64.4	157.1	6.4	111.5	Y107 A279 K280 E281 L285 V286 D287	Y107-R283 HydrophobicContact CD2-CB 4.35Å; Y107-R283 HydrophobicContact CE2-CB 4.06Å; Y107-R283 PolarHBondContact OH-NH2 3.37Å; A279-R283 PolarHBondContact O-N 3.49Å; A279-R283 VanDerWaalsContact O-N 3.1Å; K280-R283 WeakPolarHBondContact O-CB 3.31Å; K280-R283 PolarHBondContact O-N 2.91Å; K280-R283 VanDerWaalsContact O-N 3.11Å; E281-R283 VanDerWaalsContact C-N 3.32Å; R283-L285 VanDerWaalsContact C-N 3.28Å; R283-L285 PolarHBondContact O-N 2.65Å; R283-V286 PolarHBondContact O-N 2.82Å; R283-D287 PolarHBondContact O-N 3.49Å
284	S	88.4	Confident	84.1	Confident	42 Å²	42	41.3 Å²	41.3	29%	0.294	21%	0.211	S	C	.	.	H	α-helix	trans	-56.4	-42.5	174.8	-56.9	0	0	0	0	112	K280 E281 D287 L288	K280-S284 PolarHBondContact O-N 3.25Å; K280-S284 VanDerWaalsContact O-N 3.11Å; K280-S284 PolarHBondContact O-OG 3.05Å; E281-S284 PolarHBondContact O-N 2.83Å; S284-D287 PolarHBondContact O-N 3.15Å; S284-L288 WeakPolarHBondContact O-CG 3.4Å; S284-L288 PolarHBondContact O-N 3.3Å; S284-L288 VanDerWaalsContact O-N 3.11Å
285	L	84	Confident	83.8	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-60.4	-50.3	176.4	176.3	56.6	0	0	0	112.2	M55 I237 Q240 L241 V244 E281 L282 R283 D287 L288 M289	M55-L285 HydrophobicContact CE-CD2 3.44Å; M55-L285 VanDerWaalsContact CE-CD2 3.44Å; M55-L285 HydrophobicContact CE-CG 4.34Å; I237-L285 HydrophobicContact CG2-CD1 3.98Å; Q240-L285 HydrophobicContact CB-CD1 4.06Å; Q240-L285 HydrophobicContact CG-CB 3.65Å; Q240-L285 HydrophobicContact CG-CD1 4.03Å; Q240-L285 HydrophobicContact CG-CG 4.36Å; L241-L285 HydrophobicContact CD2-CD1 3.94Å; L241-L285 HydrophobicContact CD2-CD2 3.53Å; L241-L285 HydrophobicContact CD2-CG 4.35Å; L241-L285 HydrophobicContact CG-CD1 3.88Å; L241-L285 HydrophobicContact CG-CD2 4.26Å; V244-L285 HydrophobicContact CB-CD2 4.46Å; V244-L285 HydrophobicContact CG2-CB 4.34Å; V244-L285 HydrophobicContact CG2-CD2 4Å; E281-L285 WeakPolarHBondContact O-CB 3.29Å; E281-L285 PolarHBondContact O-N 3.44Å; L282-L285 WeakPolarHBondContact O-CB 3.4Å; L282-L285 PolarHBondContact O-N 2.91Å; R283-L285 VanDerWaalsContact C-N 3.28Å; R283-L285 PolarHBondContact O-N 2.65Å; L285-D287 VanDerWaalsContact C-N 3.27Å; L285-D287 PolarHBondContact O-N 3.26Å; L285-L288 WeakPolarHBondContact O-CB 3.41Å; L285-L288 PolarHBondContact O-N 2.96Å; L285-L288 VanDerWaalsContact O-N 3.16Å; L285-M289 HydrophobicContact CD1-CG 4.45Å; L285-M289 HydrophobicContact CD1-SD 4.48Å; L285-M289 HydrophobicContact CG-SD 4.25Å; L285-M289 WeakPolarHBondContact O-CG 3.42Å; L285-M289 PolarHBondContact O-N 3.44Å
286	V	82.1	Confident	83.8	Confident	3 Å²	3	40.3 Å²	40.3	2%	0.018	20%	0.203	C	C	.	.	H	α-helix	trans	-70.4	-27	-178.4	-160.3	0	0	0	0	111.7	K103 Y106 L282 R283 M289 G290	K103-V286 HydrophobicContact CB-CG1 3.74Å; K103-V286 HydrophobicContact CD-CB 4.39Å; K103-V286 HydrophobicContact CD-CG1 4.12Å; K103-V286 VanDerWaalsContact CD-O 3.29Å; K103-V286 WeakPolarHBondContact CD-O 3.38Å; K103-V286 HydrophobicContact CG-CB 4.03Å; K103-V286 HydrophobicContact CG-CG1 3.44Å; K103-V286 VanDerWaalsContact CG-CG1 3.44Å; K103-V286 WeakPolarHBondContact O-CG1 3.48Å; Y106-V286 HydrophobicContact CD1-CG1 4.27Å; Y106-V286 HydrophobicContact CD1-CG2 3.9Å; Y106-V286 HydrophobicContact CG-CG1 4.37Å; L282-V286 WeakPolarHBondContact O-CG2 3.24Å; L282-V286 PolarHBondContact O-N 3.16Å; R283-V286 PolarHBondContact O-N 2.82Å; V286-M289 HydrophobicContact CG1-SD 4.49Å; V286-M289 PolarHBondContact O-N 3.39Å; V286-G290 PolarHBondContact O-N 2.91Å
287	D	87.4	Confident	83.4	Confident	76 Å²	76	37.1 Å²	37.1	41%	0.406	18%	0.181	S	C	.	.	H	α-helix	trans	-60.9	-44	169.5	-76.4	-30.9	0	0	0	112	K103 R283 S284 L285 G290 E291	K103-D287 VanDerWaalsContact CD-OD1 3.31Å; K103-D287 WeakPolarHBondContact CD-OD1 3.4Å; K103-D287 WeakPolarHBondContact CE-OD1 3.15Å; K103-D287 IonicContact NZ-OD1 3.73Å; K103-D287 PolarHBondContact NZ-OD1 3.26Å; R283-D287 PolarHBondContact O-N 3.49Å; S284-D287 PolarHBondContact O-N 3.15Å; L285-D287 VanDerWaalsContact C-N 3.27Å; L285-D287 PolarHBondContact O-N 3.26Å; D287-G290 PolarHBondContact O-N 3.37Å; D287-E291 PolarHBondContact O-N 3.14Å; D287-E291 VanDerWaalsContact O-N 3.09Å
288	L	83.8	Confident	82.7	Confident	40 Å²	40	36.5 Å²	36.5	21%	0.209	18%	0.176	C	C	.	.	H	α-helix	trans	-63.8	-41.5	174.4	-68.7	168.2	0	0	0	112	T233 K236 I237 Q240 S284 L285 G290 E291 A292	T233-L288 WeakPolarHBondContact CG2-O 3.4Å; K236-L288 HydrophobicContact CB-CD1 4.08Å; K236-L288 HydrophobicContact CB-CD2 4.06Å; K236-L288 HydrophobicContact CD-CD2 4.24Å; I237-L288 HydrophobicContact CD1-CB 4.37Å; I237-L288 HydrophobicContact CG1-CB 3.58Å; Q240-L288 HydrophobicContact CB-CD1 3.87Å; Q240-L288 HydrophobicContact CG-CD1 4.18Å; S284-L288 WeakPolarHBondContact O-CG 3.4Å; S284-L288 PolarHBondContact O-N 3.3Å; S284-L288 VanDerWaalsContact O-N 3.11Å; L285-L288 WeakPolarHBondContact O-CB 3.41Å; L285-L288 PolarHBondContact O-N 2.96Å; L285-L288 VanDerWaalsContact O-N 3.16Å; L288-G290 VanDerWaalsContact C-N 3.33Å; L288-G290 PolarHBondContact O-N 3.21Å; L288-E291 PolarHBondContact O-N 3.22Å; L288-A292 PolarHBondContact O-N 3.2Å
289	M	82.6	Confident	82.2	Confident	26 Å²	26	37.3 Å²	37.3	13%	0.128	18%	0.18	C	C	.	.	H	α-helix	trans	-61.4	-41.6	175.7	-65.9	171.8	65.8	0	0	111.8	E59 Y106 I237 L285 V286 E291 A292 E293	E59-M289 HydrophobicContact CG-CE 3.79Å; Y106-M289 HydrophobicContact CD1-CE 4.36Å; Y106-M289 HydrophobicContact CD1-SD 4.49Å; Y106-M289 HydrophobicContact CD2-CE 4.15Å; Y106-M289 HydrophobicContact CE1-CE 3.99Å; Y106-M289 HydrophobicContact CE1-SD 4.17Å; Y106-M289 HydrophobicContact CE2-CE 3.76Å; Y106-M289 HydrophobicContact CG-CE 4.45Å; I237-M289 HydrophobicContact CD1-CG 4.23Å; I237-M289 HydrophobicContact CG1-CG 4.5Å; I237-M289 HydrophobicContact CG2-CG 4.48Å; L285-M289 HydrophobicContact CD1-CG 4.45Å; L285-M289 HydrophobicContact CD1-SD 4.48Å; L285-M289 HydrophobicContact CG-SD 4.25Å; L285-M289 WeakPolarHBondContact O-CG 3.42Å; L285-M289 PolarHBondContact O-N 3.44Å; V286-M289 HydrophobicContact CG1-SD 4.49Å; V286-M289 PolarHBondContact O-N 3.39Å; M289-E291 VanDerWaalsContact C-N 3.32Å; M289-E291 PolarHBondContact O-N 3.27Å; M289-A292 PolarHBondContact O-N 3.41Å; M289-E293 WeakPolarHBondContact O-CG 3.31Å; M289-E293 PolarHBondContact O-N 3.12Å
290	G	80.7	Confident	81.8	Confident	8 Å²	8	38 Å²	38	8%	0.082	18%	0.182	C	C	.	.	H	α-helix	trans	-63.2	-37.2	175.8	0	0	0	0	0	113	V286 D287 L288 F294	V286-G290 PolarHBondContact O-N 2.91Å; D287-G290 PolarHBondContact O-N 3.37Å; L288-G290 VanDerWaalsContact C-N 3.33Å; L288-G290 PolarHBondContact O-N 3.21Å; G290-F294 PolarHBondContact O-N 3.27Å; G290-F294 VanDerWaalsContact O-N 3.08Å
291	E	83.1	Confident	80.9	Confident	87 Å²	87	31.9 Å²	31.9	41%	0.407	16%	0.156	S	C	.	.	H	α-helix	trans	-66.6	-43.4	173.7	-179.8	60.6	-155.6	0	0	111.7	T233 D287 L288 M289 E293 F294 Q295	T233-E291 HydrophobicContact CG2-CB 4.26Å; T233-E291 HydrophobicContact CG2-CG 4.17Å; D287-E291 PolarHBondContact O-N 3.14Å; D287-E291 VanDerWaalsContact O-N 3.09Å; L288-E291 PolarHBondContact O-N 3.22Å; M289-E291 VanDerWaalsContact C-N 3.32Å; M289-E291 PolarHBondContact O-N 3.27Å; E291-E293 PolarHBondContact O-N 3.43Å; E291-F294 PolarHBondContact O-N 3.17Å; E291-Q295 VanDerWaalsContact O-CG 3.29Å; E291-Q295 WeakPolarHBondContact O-CG 3.34Å; E291-Q295 PolarHBondContact O-N 3.05Å; E291-Q295 PolarHBondContact OE1-NE2 3.33Å
292	A	82.3	Confident	79.8	Confident	9 Å²	9	30.5 Å²	30.5	7%	0.074	15%	0.15	C	C	.	.	H	α-helix	trans	-61.5	-42.9	175.9	0	0	0	0	0	111.8	L230 T233 I237 L288 M289 F294 Q295 R296	L230-A292 HydrophobicContact CD1-CB 4.15Å; T233-A292 HydrophobicContact CG2-CB 3.92Å; I237-A292 HydrophobicContact CD1-CB 3.65Å; L288-A292 PolarHBondContact O-N 3.2Å; M289-A292 PolarHBondContact O-N 3.41Å; A292-F294 VanDerWaalsContact C-N 3.34Å; A292-F294 PolarHBondContact O-N 3.47Å; A292-Q295 PolarHBondContact O-N 3.34Å; A292-R296 VanDerWaalsContact O-CB 3.27Å; A292-R296 WeakPolarHBondContact O-CB 3.26Å; A292-R296 PolarHBondContact O-N 2.84Å
293	E	80.2	Confident	78.5	Confident	14 Å²	14	35.5 Å²	35.5	7%	0.065	18%	0.175	C	C	.	.	H	α-helix	trans	-60.8	-43.4	175	-73.8	-58.8	120.7	0	0	111.8	R62 R201 M289 E291 R296 I297	R62-E293 IonicContact CZ-OE1 3.06Å; R62-E293 IonicContact CZ-OE2 3.38Å; R62-E293 IonicContact NH1-OE1 2.7Å; R62-E293 IonicContact NH1-OE2 3.56Å; R62-E293 PolarHBondContact NH1-OE2 3.48Å; R62-E293 VanDerWaalsContact NH1-OE2 3.12Å; R62-E293 VanDerWaalsContact NH2-CD 3.29Å; R62-E293 IonicContact NH2-OE1 2.63Å; R62-E293 PolarHBondContact NH2-OE1 3.41Å; R62-E293 IonicContact NH2-OE2 3.47Å; R201-E293 IonicContact CZ-OE2 3.17Å; R201-E293 IonicContact NH1-OE2 3.35Å; R201-E293 PolarHBondContact NH1-OE2 3.07Å; R201-E293 IonicContact NH2-OE2 2.69Å; M289-E293 WeakPolarHBondContact O-CG 3.31Å; M289-E293 PolarHBondContact O-N 3.12Å; E291-E293 PolarHBondContact O-N 3.43Å; E293-R296 PolarHBondContact O-N 3.27Å; E293-I297 WeakPolarHBondContact O-CD1 3.44Å; E293-I297 WeakPolarHBondContact O-CG1 3.31Å; E293-I297 PolarHBondContact O-N 2.93Å
294	F	81.2	Confident	77	Confident	50 Å²	50	32.8 Å²	32.8	22%	0.219	17%	0.17	C	C	.	.	H	α-helix	trans	-61.8	-46.6	176.4	-176.8	-106	0	0	0	112	L95 I99 G290 E291 A292 R296 I297 L298	L95-F294 HydrophobicContact CD2-CD2 4.36Å; L95-F294 HydrophobicContact CD2-CE2 4.34Å; I99-F294 HydrophobicContact CD1-CB 3.96Å; I99-F294 HydrophobicContact CD1-CD2 3.98Å; I99-F294 HydrophobicContact CD1-CG 4.48Å; G290-F294 PolarHBondContact O-N 3.27Å; G290-F294 VanDerWaalsContact O-N 3.08Å; E291-F294 PolarHBondContact O-N 3.17Å; A292-F294 VanDerWaalsContact C-N 3.34Å; A292-F294 PolarHBondContact O-N 3.47Å; F294-R296 VanDerWaalsContact C-N 3.33Å; F294-R296 PolarHBondContact O-N 3.48Å; F294-I297 PolarHBondContact O-N 3.31Å; F294-L298 HydrophobicContact CD1-CD1 3.95Å; F294-L298 HydrophobicContact CE1-CD1 3.4Å; F294-L298 VanDerWaalsContact CE1-CD1 3.4Å; F294-L298 HydrophobicContact CE1-CG 4.14Å; F294-L298 HydrophobicContact CZ-CD1 3.79Å; F294-L298 HydrophobicContact CZ-CD2 4.36Å; F294-L298 HydrophobicContact CZ-CG 4.17Å; F294-L298 WeakPolarHBondContact O-CG 3.4Å; F294-L298 PolarHBondContact O-N 3.3Å
295	Q	77.9	Confident	76.4	Confident	12 Å²	12	32.3 Å²	32.3	6%	0.056	16%	0.164	C	C	.	.	H	α-helix	trans	-62.8	-39.5	178	-70.8	170.2	-2.6	0	0	111.9	L226 Q229 L230 T233 E291 A292 L298 L299	L226-Q295 HydrophobicContact CD1-CB 4.16Å; L226-Q295 HydrophobicContact CD1-CG 4.27Å; Q229-Q295 PolarHBondContact O-OE1 2.87Å; L230-Q295 VanDerWaalsContact CA-OE1 3.22Å; L230-Q295 HydrophobicContact CB-CB 4.4Å; L230-Q295 HydrophobicContact CD1-CB 4.12Å; T233-Q295 PolarHBondContact OG1-NE2 2.89Å; T233-Q295 PolarHBondContact OG1-OE1 3.36Å; E291-Q295 VanDerWaalsContact O-CG 3.29Å; E291-Q295 WeakPolarHBondContact O-CG 3.34Å; E291-Q295 PolarHBondContact O-N 3.05Å; E291-Q295 PolarHBondContact OE1-NE2 3.33Å; A292-Q295 PolarHBondContact O-N 3.34Å; Q295-L298 PolarHBondContact O-N 3.48Å; Q295-L299 PolarHBondContact O-N 3.29Å
296	R	81.9	Confident	76	Confident	41 Å²	41	34 Å²	34	16%	0.155	17%	0.172	C	C	.	.	H	α-helix	trans	-62.1	-48	175.6	-178.1	-174.3	-179.8	166.6	8.6	111.6	L66 A292 E293 F294 L298 L299 L300	L66-R296 VanDerWaalsContact CD1-CZ 3.5Å; A292-R296 VanDerWaalsContact O-CB 3.27Å; A292-R296 WeakPolarHBondContact O-CB 3.26Å; A292-R296 PolarHBondContact O-N 2.84Å; E293-R296 PolarHBondContact O-N 3.27Å; F294-R296 VanDerWaalsContact C-N 3.33Å; F294-R296 PolarHBondContact O-N 3.48Å; R296-L298 VanDerWaalsContact C-N 3.31Å; R296-L298 PolarHBondContact O-N 2.84Å; R296-L299 WeakPolarHBondContact O-CA 3.47Å; R296-L299 WeakPolarHBondContact O-CB 3.12Å; R296-L299 PolarHBondContact O-N 2.93Å; R296-L300 HydrophobicContact CG-CD1 4.37Å; R296-L300 WeakPolarHBondContact O-CG 3.21Å; R296-L300 PolarHBondContact O-N 2.98Å
297	I	77.1	Confident	75.7	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-61.1	-43.3	179.1	-66.4	163.9	0	0	0	110.3	L95 I99 E208 Y211 E293 F294 L299 L300 T301	L95-I297 HydrophobicContact CD1-CD1 3.77Å; L95-I297 HydrophobicContact CD1-CG2 4.47Å; L95-I297 HydrophobicContact CD2-CD1 4.43Å; L95-I297 HydrophobicContact CD2-CG2 3.85Å; L95-I297 HydrophobicContact CG-CD1 4.45Å; I99-I297 HydrophobicContact CD1-CD1 4.14Å; E208-I297 HydrophobicContact CB-CD1 4.43Å; E208-I297 HydrophobicContact CG-CD1 4.25Å; E208-I297 HydrophobicContact CG-CG1 3.92Å; E208-I297 HydrophobicContact CG-CG2 4.34Å; Y211-I297 HydrophobicContact CD1-CG2 3.73Å; Y211-I297 HydrophobicContact CE1-CG2 4.13Å; E293-I297 WeakPolarHBondContact O-CD1 3.44Å; E293-I297 WeakPolarHBondContact O-CG1 3.31Å; E293-I297 PolarHBondContact O-N 2.93Å; F294-I297 PolarHBondContact O-N 3.31Å; I297-L299 PolarHBondContact O-N 2.72Å; I297-L300 PolarHBondContact O-N 2.88Å; I297-T301 WeakPolarHBondContact O-CG2 3.39Å; I297-T301 PolarHBondContact O-N 2.95Å; I297-T301 VanDerWaalsContact O-N 3.12Å
298	L	76.2	Confident	75	Confident	30 Å²	30	33.4 Å²	33.4	16%	0.157	17%	0.168	C	C	.	.	H	α-helix	trans	-62.3	-28.4	173.8	-70.8	-178.3	0	0	0	113.6	Y211 L226 F294 Q295 R296 T301	Y211-L298 HydrophobicContact CE1-CD2 4.47Å; L226-L298 HydrophobicContact CD1-CB 4.38Å; L226-L298 VanDerWaalsContact CD2-C 3.46Å; L226-L298 HydrophobicContact CD2-CB 3.63Å; F294-L298 HydrophobicContact CD1-CD1 3.95Å; F294-L298 HydrophobicContact CE1-CD1 3.4Å; F294-L298 VanDerWaalsContact CE1-CD1 3.4Å; F294-L298 HydrophobicContact CE1-CG 4.14Å; F294-L298 HydrophobicContact CZ-CD1 3.79Å; F294-L298 HydrophobicContact CZ-CD2 4.36Å; F294-L298 HydrophobicContact CZ-CG 4.17Å; F294-L298 WeakPolarHBondContact O-CG 3.4Å; F294-L298 PolarHBondContact O-N 3.3Å; Q295-L298 PolarHBondContact O-N 3.48Å; R296-L298 VanDerWaalsContact C-N 3.31Å; R296-L298 PolarHBondContact O-N 2.84Å; L298-T301 PolarHBondContact O-OG1 3.45Å
299	L	73	Confident	74.4	Confident	21 Å²	21	32.9 Å²	32.9	11%	0.11	17%	0.165	C	C	.	.	H	α-helix	trans	-77.5	-40.2	177.5	-171.7	66.8	0	0	0	110.4	L226 K227 L230 Q295 R296 I297 T301 S302 M303	L226-L299 HydrophobicContact CB-CD1 4.47Å; L226-L299 HydrophobicContact CD2-CB 3.77Å; L226-L299 HydrophobicContact CD2-CD1 4.06Å; L226-L299 HydrophobicContact CG-CB 4.38Å; L226-L299 HydrophobicContact CG-CD1 4.4Å; K227-L299 HydrophobicContact CG-CD1 3.93Å; K227-L299 HydrophobicContact CG-CD2 4.1Å; L230-L299 HydrophobicContact CD2-CD2 4.21Å; Q295-L299 PolarHBondContact O-N 3.29Å; R296-L299 WeakPolarHBondContact O-CA 3.47Å; R296-L299 WeakPolarHBondContact O-CB 3.12Å; R296-L299 PolarHBondContact O-N 2.93Å; I297-L299 PolarHBondContact O-N 2.72Å; L299-T301 VanDerWaalsContact C-N 3.33Å; L299-T301 PolarHBondContact O-N 3.06Å; L299-S302 WeakPolarHBondContact O-CA 3.44Å; L299-S302 WeakPolarHBondContact O-CB 3.44Å; L299-S302 PolarHBondContact O-N 2.78Å; L299-S302 PolarHBondContact O-OG 2.87Å; L299-M303 HydrophobicContact CG-SD 4.35Å; L299-M303 WeakPolarHBondContact O-CG 3.29Å; L299-M303 PolarHBondContact O-N 3.13Å; L299-M303 VanDerWaalsContact O-N 3.15Å
300	L	71.1	Confident	73.9	Confident	28 Å²	28	33.4 Å²	33.4	15%	0.147	17%	0.168	C	C	.	.	H	α-helix	trans	-60.6	-40.2	176.5	-71.2	173.5	0	0	0	112	E208 I212 R296 I297 S302 M303	E208-L300 WeakPolarHBondContact OE1-CD1 3.28Å; I212-L300 HydrophobicContact CD1-CB 4.13Å; I212-L300 HydrophobicContact CD1-CD1 4.38Å; R296-L300 HydrophobicContact CG-CD1 4.37Å; R296-L300 WeakPolarHBondContact O-CG 3.21Å; R296-L300 PolarHBondContact O-N 2.98Å; I297-L300 PolarHBondContact O-N 2.88Å; L300-S302 PolarHBondContact O-N 3.39Å; L300-S302 VanDerWaalsContact O-N 3.11Å; L300-M303 PolarHBondContact O-N 3Å
301	T	69.7	Low	73.4	Confident	9 Å²	9	35.2 Å²	35.2	6%	0.055	17%	0.174	C	C	.	.	H	α-helix	trans	-64.4	-16	174.6	60.6	0	0	0	0	113.7	Y211 I212 T215 I297 L298 L299	Y211-T301 HydrophobicContact CD1-CG2 3.74Å; Y211-T301 HydrophobicContact CE1-CG2 3.64Å; I212-T301 HydrophobicContact CB-CG2 4.36Å; I212-T301 HydrophobicContact CG1-CG2 3.84Å; T215-T301 WeakPolarHBondContact OG1-CG2 3.35Å; I297-T301 WeakPolarHBondContact O-CG2 3.39Å; I297-T301 PolarHBondContact O-N 2.95Å; I297-T301 VanDerWaalsContact O-N 3.12Å; L298-T301 PolarHBondContact O-OG1 3.45Å; L299-T301 VanDerWaalsContact C-N 3.33Å; L299-T301 PolarHBondContact O-N 3.06Å
302	S	64	Low	72.6	Confident	8 Å²	8	31.2 Å²	31.2	6%	0.056	16%	0.156	C	C	.	.	H	α-helix	trans	-96.6	-21.5	178.3	87.3	0	0	0	0	113.7	K223 L299 L300 L304	K223-S302 WeakPolarHBondContact CE-O 3.37Å; K223-S302 PolarHBondContact NZ-O 3.09Å; L299-S302 WeakPolarHBondContact O-CA 3.44Å; L299-S302 WeakPolarHBondContact O-CB 3.44Å; L299-S302 PolarHBondContact O-N 2.78Å; L299-S302 PolarHBondContact O-OG 2.87Å; L300-S302 PolarHBondContact O-N 3.39Å; L300-S302 VanDerWaalsContact O-N 3.11Å; S302-L304 VanDerWaalsContact C-N 3.3Å
303	M	56.5	Low	71.8	Confident	107 Å²	107	33.1 Å²	33.1	53%	0.527	16%	0.163	S	C	.	.	H	α-helix	trans	-81.1	-13.3	-175.2	-75.3	-177.4	63.1	0	0	113.1	L299 L300	L299-M303 HydrophobicContact CG-SD 4.35Å; L299-M303 WeakPolarHBondContact O-CG 3.29Å; L299-M303 PolarHBondContact O-N 3.13Å; L299-M303 VanDerWaalsContact O-N 3.15Å; L300-M303 PolarHBondContact O-N 3Å
304	L	53.2	Low	71.1	Confident	77 Å²	77	34.8 Å²	34.8	40%	0.403	17%	0.171	S	C	.	.			trans	-98.2	0	178	-55.6	169.7	0	0	0	111.2	I75 I78 I212 S302	I75-L304 HydrophobicContact CB-CD2 4.19Å; I75-L304 HydrophobicContact CG1-CD2 3.55Å; I75-L304 HydrophobicContact CG2-CD2 4.27Å; I78-L304 HydrophobicContact CB-CD1 4.26Å; I78-L304 HydrophobicContact CD1-CD1 3.83Å; I78-L304 HydrophobicContact CD1-CD2 4.12Å; I78-L304 HydrophobicContact CD1-CG 4.38Å; I78-L304 HydrophobicContact CG2-CD1 3.52Å; I212-L304 HydrophobicContact CG2-CD1 3.38Å; S302-L304 VanDerWaalsContact C-N 3.3Å

Retrieved 304 of 304 residues in 173.1 ms (Link to these results)

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