G4M0M9_SCHMA Loading...

Coiled-coil domain-containing protein 176

AlphaFold DB , UniProt , Accession G4M0M9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 205 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	43.7	Very low	45.1	Very low	240 Å²	240	162.1 Å²	162.1	100%	1.182	88%	0.878	S	S	*	*				0	127.5	0	-62.2	-166.3	174.3	0	0	107.5
2	S	43.2	Very low	44.6	Very low	109 Å²	109	165.8 Å²	165.8	76%	0.762	88%	0.879	S	S	*	*			cis	-158.4	131.1	-11.2	-79.2	0	0	0	0	108.3
3	K	42.6	Very low	43.9	Very low	209 Å²	209	159.2 Å²	159.2	91%	0.909	88%	0.875	S	S	*	*			trans	29.9	125.4	147.9	-65.8	171.3	175.4	176	0	121.1
4	A	46.6	Very low	43.5	Very low	104 Å²	104	162.8 Å²	162.8	86%	0.86	88%	0.878	S	S	*	*				-162.5	101.9	116.7	0	0	0	0	0	111.2
5	V	46.2	Very low	43.3	Very low	154 Å²	154	165.5 Å²	165.5	93%	0.933	88%	0.878	S	S	*	*			trans	-100.5	116.8	163.5	172.1	0	0	0	0	106.9
6	S	48.7	Very low	43.1	Very low	121 Å²	121	163.9 Å²	163.9	85%	0.846	88%	0.877	S	S	*	*			trans	-166.2	142.1	159.3	85.1	0	0	0	0	106.1
7	G	44.4	Very low	43.2	Very low	64 Å²	64	165.3 Å²	165.3	66%	0.66	87%	0.873	S	S	*	*			cis	146.2	128.3	12.6	0	0	0	0	0	106.9
8	K	44.3	Very low	43.2	Very low	204 Å²	204	161.9 Å²	161.9	89%	0.887	87%	0.873	S	S	*	*			trans	69	119.1	161	-59.5	177.7	176.5	173.4	0	118.8
9	R	48.5	Very low	43.6	Very low	229 Å²	229	158.9 Å²	158.9	86%	0.864	85%	0.851	S	S	*	*				-178.3	119.3	91.3	-95.3	177.8	178.6	166.5	0	110.2	T11	R9-T11 PolarHBondContact O-N 3.2Å
10	K	39.1	Very low	44	Very low	217 Å²	217	156 Å²	156	94%	0.943	84%	0.835	S	S	*	*			trans	-78.4	106.3	162.3	-74.5	-175.2	176.1	-180	0	107.7
11	T	48.7	Very low	45.3	Very low	132 Å²	132	153.1 Å²	153.1	81%	0.81	83%	0.825	S	S	*	*			trans	-96.4	117.4	167.9	26.1	0	0	0	0	110.2	R9	R9-T11 PolarHBondContact O-N 3.2Å
12	K	39.5	Very low	46.8	Very low	206 Å²	206	146 Å²	146	90%	0.896	79%	0.794	S	S	*	*			trans	-59.2	139.6	173.8	-76.6	174.9	169.3	177.2	0	111.6
13	G	35	Very low	48.3	Very low	80 Å²	80	145.1 Å²	145.1	83%	0.825	78%	0.781	S	S	*	*			trans	50.8	91.4	137.2	0	0	0	0	0	117.5
14	K	38.5	Very low	49.8	Very low	210 Å²	210	140.9 Å²	140.9	91%	0.913	77%	0.765	S	S	*	*			trans	-118.1	116.3	147.7	-138.7	173.1	-172.9	177	0	107.5	T16	K14-T16 PolarHBondContact O-N 2.82Å
15	K	40.1	Very low	51.4	Low	204 Å²	204	140 Å²	140	89%	0.887	75%	0.749	S	S	*	*			trans	-44.4	120.1	179.9	-71.9	177.6	174.3	179.1	0	109.6	K17	K15-K17 PolarHBondContact O-N 2.96Å
16	T	39.9	Very low	53.2	Low	139 Å²	139	136.4 Å²	136.4	85%	0.853	72%	0.724	S	S	*	*			trans	-49.9	99.6	163.5	35	0	0	0	0	108.5	K14	K14-T16 PolarHBondContact O-N 2.82Å
17	K	45.6	Very low	54.8	Low	188 Å²	188	135 Å²	135	82%	0.817	70%	0.704	S	S	*	*			trans	-63.1	133.5	149.9	-75.4	-172.8	174.5	-174.9	0	105.3	K15 K19	K15-K17 PolarHBondContact O-N 2.96Å; K17-K19 PolarHBondContact O-N 3.19Å
18	A	43.9	Very low	56.8	Low	104 Å²	104	138.5 Å²	138.5	86%	0.86	70%	0.701	S	S	*	*			trans	-45.7	107.4	171.4	0	0	0	0	0	107	D20	A18-D20 PolarHBondContact O-N 2.73Å
19	K	49.4	Very low	58.8	Low	105 Å²	105	132.4 Å²	132.4	46%	0.457	68%	0.681	S	S	.	*			trans	-63.6	125	175.1	-83.4	-173.4	174.9	-172.8	0	103.9	K17 P21 E24 E27	K17-K19 PolarHBondContact O-N 3.19Å; K19-P21 VanDerWaalsContact O-N 3.11Å; K19-E24 HydrophobicContact CB-CB 4.46Å; K19-E27 IonicContact NZ-OE1 2.92Å; K19-E27 PolarHBondContact NZ-OE1 2.9Å; K19-E27 IonicContact NZ-OE2 2.66Å; K19-E27 PolarHBondContact NZ-OE2 3.42Å
20	D	53	Low	60.7	Low	101 Å²	101	127.6 Å²	127.6	54%	0.54	67%	0.669	S	S	.	*			trans	-46.3	123.3	169.3	-157.4	-26.2	0	0	0	106.5	A18 V22 N23 E24	A18-D20 PolarHBondContact O-N 2.73Å; D20-V22 CarbonylContact O-C 3.5Å; D20-V22 PolarHBondContact O-N 2.93Å; D20-N23 HydrophobicContact CB-CB 4.28Å; D20-N23 WeakPolarHBondContact O-CA 3.46Å; D20-N23 WeakPolarHBondContact O-CB 3.32Å; D20-N23 PolarHBondContact O-N 2.65Å; D20-E24 PolarHBondContact O-N 2.86Å
21	P	69.8	Low	63.2	Low	96 Å²	96	123.9 Å²	123.9	62%	0.623	65%	0.652	S	S	*	*	H	α-helix	trans	-51.4	-25.9	-177.5	15.2	-29.9	0	0	0	112.1	K19 T25	K19-P21 VanDerWaalsContact O-N 3.11Å; P21-T25 PolarHBondContact O-N 2.94Å; P21-T25 VanDerWaalsContact O-N 3.13Å; P21-T25 PolarHBondContact O-OG1 3.01Å
22	V	74.8	Confident	65.2	Low	89 Å²	89	121 Å²	121	54%	0.539	63%	0.632	S	S	.	*	H	α-helix	trans	-64.3	-41.2	171.4	-175.4	0	0	0	0	113	D20 T25 L26	D20-V22 CarbonylContact O-C 3.5Å; D20-V22 PolarHBondContact O-N 2.93Å; V22-T25 VanDerWaalsContact CA-OG1 3.32Å; V22-T25 WeakPolarHBondContact CA-OG1 3.37Å; V22-T25 PolarHBondContact O-OG1 2.63Å; V22-L26 HydrophobicContact CG1-CD1 4.18Å; V22-L26 WeakPolarHBondContact O-CB 3.3Å; V22-L26 PolarHBondContact O-N 3.13Å
23	N	75.8	Confident	67.7	Low	91 Å²	91	115.8 Å²	115.8	49%	0.487	62%	0.617	S	S	.	*	H	α-helix	trans	-74.4	-34.9	-179.2	-120.7	5.1	0	0	0	112.4	D20 L26 E27	D20-N23 HydrophobicContact CB-CB 4.28Å; D20-N23 WeakPolarHBondContact O-CA 3.46Å; D20-N23 WeakPolarHBondContact O-CB 3.32Å; D20-N23 PolarHBondContact O-N 2.65Å; N23-L26 PolarHBondContact O-N 2.85Å; N23-E27 PolarHBondContact O-N 2.97Å
24	E	74.9	Confident	70.5	Confident	120 Å²	120	118 Å²	118	56%	0.561	60%	0.604	S	S	*	*	H	α-helix	trans	-71.1	-37.9	175.3	-168.8	169.9	-162.6	0	0	111.6	K19 D20 E27 K28	K19-E24 HydrophobicContact CB-CB 4.46Å; D20-E24 PolarHBondContact O-N 2.86Å; E24-E27 PolarHBondContact O-N 2.7Å; E24-K28 WeakPolarHBondContact O-CB 3.48Å; E24-K28 PolarHBondContact O-N 3.45Å
25	T	79.5	Confident	73	Confident	85 Å²	85	111.6 Å²	111.6	52%	0.521	58%	0.58	S	S	.	*	H	α-helix	trans	-65	-38.3	170.1	31.1	0	0	0	0	112.2	P21 V22 K28 T29	P21-T25 PolarHBondContact O-N 2.94Å; P21-T25 VanDerWaalsContact O-N 3.13Å; P21-T25 PolarHBondContact O-OG1 3.01Å; V22-T25 VanDerWaalsContact CA-OG1 3.32Å; V22-T25 WeakPolarHBondContact CA-OG1 3.37Å; V22-T25 PolarHBondContact O-OG1 2.63Å; T25-K28 PolarHBondContact O-N 3.26Å; T25-T29 WeakPolarHBondContact O-CB 3.25Å; T25-T29 WeakPolarHBondContact O-CG2 3.36Å; T25-T29 PolarHBondContact O-N 3.45Å; T25-T29 PolarHBondContact O-OG1 3.48Å
26	L	83.1	Confident	75.6	Confident	80 Å²	80	106.8 Å²	106.8	42%	0.419	56%	0.563	S	S	.	*	H	α-helix	trans	-62.7	-47.3	172.7	-95	156.9	0	0	0	112.8	V22 N23 K28 T29 Q30	V22-L26 HydrophobicContact CG1-CD1 4.18Å; V22-L26 WeakPolarHBondContact O-CB 3.3Å; V22-L26 PolarHBondContact O-N 3.13Å; N23-L26 PolarHBondContact O-N 2.85Å; L26-K28 VanDerWaalsContact C-N 3.33Å; L26-K28 PolarHBondContact O-N 3.45Å; L26-T29 VanDerWaalsContact CA-OG1 3.3Å; L26-T29 WeakPolarHBondContact CA-OG1 3.43Å; L26-T29 PolarHBondContact O-N 3.47Å; L26-T29 PolarHBondContact O-OG1 2.97Å; L26-Q30 WeakPolarHBondContact O-CB 3.41Å; L26-Q30 VanDerWaalsContact O-CG 3.25Å; L26-Q30 WeakPolarHBondContact O-CG 3.23Å; L26-Q30 PolarHBondContact O-N 2.96Å
27	E	83.3	Confident	78.2	Confident	90 Å²	90	109.2 Å²	109.2	42%	0.421	56%	0.557	S	S	.	*	H	α-helix	trans	-63.2	-40	176.9	-78.9	-179.7	-169.3	0	0	111.8	K19 N23 E24 Q30 K31	K19-E27 IonicContact NZ-OE1 2.92Å; K19-E27 PolarHBondContact NZ-OE1 2.9Å; K19-E27 IonicContact NZ-OE2 2.66Å; K19-E27 PolarHBondContact NZ-OE2 3.42Å; N23-E27 PolarHBondContact O-N 2.97Å; E24-E27 PolarHBondContact O-N 2.7Å; E27-Q30 PolarHBondContact O-N 2.95Å; E27-K31 WeakPolarHBondContact O-CB 3.5Å; E27-K31 PolarHBondContact O-N 3.48Å
28	K	85.2	Confident	80.4	Confident	139 Å²	139	104.1 Å²	104.1	60%	0.604	54%	0.536	S	S	*	.	H	α-helix	trans	-65.2	-47.6	176.8	-170.4	178.2	178.2	-175.3	0	111.3	E24 T25 L26 Q30 K31 D32	E24-K28 WeakPolarHBondContact O-CB 3.48Å; E24-K28 PolarHBondContact O-N 3.45Å; T25-K28 PolarHBondContact O-N 3.26Å; L26-K28 VanDerWaalsContact C-N 3.33Å; L26-K28 PolarHBondContact O-N 3.45Å; K28-Q30 PolarHBondContact O-N 3.42Å; K28-K31 PolarHBondContact O-N 3.28Å; K28-D32 WeakPolarHBondContact O-CB 3.41Å; K28-D32 PolarHBondContact O-N 2.87Å
29	T	86.9	Confident	82.8	Confident	76 Å²	76	103.8 Å²	103.8	47%	0.466	52%	0.517	S	S	.	.	H	α-helix	trans	-63.1	-38.9	175.8	42.3	0	0	0	0	112.2	T25 L26 K31 D32 V33	T25-T29 WeakPolarHBondContact O-CB 3.25Å; T25-T29 WeakPolarHBondContact O-CG2 3.36Å; T25-T29 PolarHBondContact O-N 3.45Å; T25-T29 PolarHBondContact O-OG1 3.48Å; L26-T29 VanDerWaalsContact CA-OG1 3.3Å; L26-T29 WeakPolarHBondContact CA-OG1 3.43Å; L26-T29 PolarHBondContact O-N 3.47Å; L26-T29 PolarHBondContact O-OG1 2.97Å; T29-K31 VanDerWaalsContact C-N 3.34Å; T29-K31 PolarHBondContact O-N 3.41Å; T29-D32 PolarHBondContact O-N 2.88Å; T29-V33 WeakPolarHBondContact O-CB 3.39Å; T29-V33 VanDerWaalsContact O-CG2 3.23Å; T29-V33 WeakPolarHBondContact O-CG2 3.2Å; T29-V33 PolarHBondContact O-N 3.32Å
30	Q	89.7	Confident	84.9	Confident	128 Å²	128	102.3 Å²	102.3	60%	0.598	52%	0.516	S	S	*	.	H	α-helix	trans	-61.5	-41.8	172.9	-77.5	177.7	-1.6	0	0	112.2	L26 E27 K28 K34	L26-Q30 WeakPolarHBondContact O-CB 3.41Å; L26-Q30 VanDerWaalsContact O-CG 3.25Å; L26-Q30 WeakPolarHBondContact O-CG 3.23Å; L26-Q30 PolarHBondContact O-N 2.96Å; E27-Q30 PolarHBondContact O-N 2.95Å; K28-Q30 PolarHBondContact O-N 3.42Å; Q30-K34 WeakPolarHBondContact O-CB 3.33Å; Q30-K34 PolarHBondContact O-N 3.41Å
31	K	90.6	Very high	86.9	Confident	139 Å²	139	100.6 Å²	100.6	60%	0.604	51%	0.512	S	S	*	.	H	α-helix	trans	-67.1	-40.8	176.3	-168.6	179	-179.3	-176.3	0	111.6	E27 K28 T29 K34 N35	E27-K31 WeakPolarHBondContact O-CB 3.5Å; E27-K31 PolarHBondContact O-N 3.48Å; K28-K31 PolarHBondContact O-N 3.28Å; T29-K31 VanDerWaalsContact C-N 3.34Å; T29-K31 PolarHBondContact O-N 3.41Å; K31-K34 PolarHBondContact O-N 2.84Å; K31-N35 WeakPolarHBondContact O-CB 3.35Å; K31-N35 PolarHBondContact O-N 2.69Å; K31-N35 PolarHBondContact O-ND2 3.5Å
32	D	91.2	Very high	88	Confident	70 Å²	70	104.1 Å²	104.1	37%	0.374	51%	0.513	S	S	.	.	H	α-helix	trans	-65.2	-44.1	177.1	-67.8	-19.2	0	0	0	110.9	K28 T29 K34 N35 L36	K28-D32 WeakPolarHBondContact O-CB 3.41Å; K28-D32 PolarHBondContact O-N 2.87Å; T29-D32 PolarHBondContact O-N 2.88Å; D32-K34 VanDerWaalsContact C-N 3.32Å; D32-K34 PolarHBondContact O-N 3.17Å; D32-N35 PolarHBondContact O-N 2.84Å; D32-L36 WeakPolarHBondContact O-CB 3.46Å; D32-L36 PolarHBondContact O-N 3.47Å
33	V	91.9	Very high	89	Confident	97 Å²	97	105.9 Å²	105.9	59%	0.588	51%	0.513	S	S	*	.	H	α-helix	trans	-60.3	-41.2	173.1	169.4	0	0	0	0	111.2	T29 L36 R37	T29-V33 WeakPolarHBondContact O-CB 3.39Å; T29-V33 VanDerWaalsContact O-CG2 3.23Å; T29-V33 WeakPolarHBondContact O-CG2 3.2Å; T29-V33 PolarHBondContact O-N 3.32Å; V33-L36 PolarHBondContact O-N 3.47Å; V33-R37 WeakPolarHBondContact O-CB 3.48Å; V33-R37 PolarHBondContact O-N 2.85Å
34	K	93	Very high	89.8	Confident	128 Å²	128	106.3 Å²	106.3	56%	0.557	52%	0.515	S	S	*	.	H	α-helix	trans	-64.5	-45.6	175.9	-171.3	-175.8	176.9	-170.2	0	111.7	Q30 K31 D32 R37 E38	Q30-K34 WeakPolarHBondContact O-CB 3.33Å; Q30-K34 PolarHBondContact O-N 3.41Å; K31-K34 PolarHBondContact O-N 2.84Å; D32-K34 VanDerWaalsContact C-N 3.32Å; D32-K34 PolarHBondContact O-N 3.17Å; K34-R37 WeakPolarHBondContact O-CB 3.5Å; K34-R37 PolarHBondContact O-N 2.91Å; K34-E38 WeakPolarHBondContact CE-OE1 3.35Å; K34-E38 IonicContact NZ-OE1 2.92Å; K34-E38 WeakPolarHBondContact O-CG 3.44Å; K34-E38 PolarHBondContact O-N 2.83Å
35	N	92	Very high	90.8	Very high	75 Å²	75	106.6 Å²	106.6	40%	0.401	51%	0.514	S	S	.	.	H	α-helix	trans	-61.8	-44.5	177	-69.8	-18.1	0	0	0	111.2	K31 D32 R37 E38 E39	K31-N35 WeakPolarHBondContact O-CB 3.35Å; K31-N35 PolarHBondContact O-N 2.69Å; K31-N35 PolarHBondContact O-ND2 3.5Å; D32-N35 PolarHBondContact O-N 2.84Å; N35-R37 VanDerWaalsContact C-N 3.34Å; N35-R37 PolarHBondContact O-N 3.23Å; N35-E38 PolarHBondContact O-N 3.31Å; N35-E39 WeakPolarHBondContact O-CB 3.3Å; N35-E39 PolarHBondContact O-N 3.26Å
36	L	94	Very high	91.5	Very high	103 Å²	103	108 Å²	108	54%	0.539	52%	0.517	S	S	.	.	H	α-helix	trans	-58.1	-45.7	173.1	-94.4	146.6	0	0	0	111.2	D32 V33 E38 E39 V40	D32-L36 WeakPolarHBondContact O-CB 3.46Å; D32-L36 PolarHBondContact O-N 3.47Å; V33-L36 PolarHBondContact O-N 3.47Å; L36-E38 PolarHBondContact O-N 2.82Å; L36-E39 PolarHBondContact O-N 2.89Å; L36-V40 WeakPolarHBondContact O-CB 3.33Å; L36-V40 VanDerWaalsContact O-CG2 3.22Å; L36-V40 WeakPolarHBondContact O-CG2 3.45Å; L36-V40 PolarHBondContact O-N 3.26Å
37	R	93.6	Very high	92	Very high	190 Å²	190	106.9 Å²	106.9	72%	0.717	52%	0.52	S	S	*	.	H	α-helix	trans	-62	-42.8	176.9	-173.6	-178.2	179.4	-160.4	0.1	112	V33 K34 N35 S41	V33-R37 WeakPolarHBondContact O-CB 3.48Å; V33-R37 PolarHBondContact O-N 2.85Å; K34-R37 WeakPolarHBondContact O-CB 3.5Å; K34-R37 PolarHBondContact O-N 2.91Å; N35-R37 VanDerWaalsContact C-N 3.34Å; N35-R37 PolarHBondContact O-N 3.23Å; R37-S41 WeakPolarHBondContact O-CB 3.49Å; R37-S41 PolarHBondContact O-N 3.48Å; R37-S41 PolarHBondContact O-OG 3.49Å
38	E	93.3	Very high	92.5	Very high	81 Å²	81	107.6 Å²	107.6	38%	0.379	52%	0.523	S	S	.	.	H	α-helix	trans	-65.9	-41.2	176.1	-73.6	179.5	-164.6	0	0	111.7	K34 N35 L36 S41 R42	K34-E38 WeakPolarHBondContact CE-OE1 3.35Å; K34-E38 IonicContact NZ-OE1 2.92Å; K34-E38 WeakPolarHBondContact O-CG 3.44Å; K34-E38 PolarHBondContact O-N 2.83Å; N35-E38 PolarHBondContact O-N 3.31Å; L36-E38 PolarHBondContact O-N 2.82Å; E38-S41 PolarHBondContact O-N 2.94Å; E38-R42 VanDerWaalsContact O-CG 3.3Å; E38-R42 WeakPolarHBondContact O-CG 3.36Å; E38-R42 PolarHBondContact O-N 2.87Å
39	E	93.7	Very high	92.9	Very high	97 Å²	97	103.8 Å²	103.8	45%	0.453	51%	0.509	S	S	.	.	H	α-helix	trans	-65.1	-45.5	176.7	-167.9	-169.6	152.1	0	0	111.6	N35 L36 S41 R42 K43	N35-E39 WeakPolarHBondContact O-CB 3.3Å; N35-E39 PolarHBondContact O-N 3.26Å; L36-E39 PolarHBondContact O-N 2.89Å; E39-S41 VanDerWaalsContact C-N 3.33Å; E39-S41 PolarHBondContact O-N 3.33Å; E39-R42 PolarHBondContact O-N 3.23Å; E39-K43 HydrophobicContact CG-CD 4.44Å; E39-K43 WeakPolarHBondContact O-CB 3.27Å; E39-K43 WeakPolarHBondContact O-CG 3.22Å; E39-K43 PolarHBondContact O-N 3.42Å; E39-K43 WeakPolarHBondContact OE1-CE 3.4Å; E39-K43 IonicContact OE1-NZ 2.6Å; E39-K43 PolarHBondContact OE1-NZ 2.82Å
40	V	94.3	Very high	93.2	Very high	74 Å²	74	102.3 Å²	102.3	45%	0.448	50%	0.504	S	S	.	.	H	α-helix	trans	-60.1	-44.8	174	169.8	0	0	0	0	110.2	L36 R42 K43 I44	L36-V40 WeakPolarHBondContact O-CB 3.33Å; L36-V40 VanDerWaalsContact O-CG2 3.22Å; L36-V40 WeakPolarHBondContact O-CG2 3.45Å; L36-V40 PolarHBondContact O-N 3.26Å; V40-R42 VanDerWaalsContact C-N 3.35Å; V40-R42 PolarHBondContact O-N 2.89Å; V40-K43 PolarHBondContact O-N 2.9Å; V40-I44 HydrophobicContact CG1-CD1 3.73Å; V40-I44 HydrophobicContact CG1-CG1 4.36Å; V40-I44 VanDerWaalsContact O-CG1 3.27Å; V40-I44 WeakPolarHBondContact O-CG1 3.34Å; V40-I44 PolarHBondContact O-N 3.28Å
41	S	94	Very high	93.4	Very high	64 Å²	64	102.8 Å²	102.8	45%	0.448	51%	0.507	S	S	.	.	H	α-helix	trans	-62.3	-40.7	177.7	-56.9	0	0	0	0	112.1	R37 E38 E39 I44 F45	R37-S41 WeakPolarHBondContact O-CB 3.49Å; R37-S41 PolarHBondContact O-N 3.48Å; R37-S41 PolarHBondContact O-OG 3.49Å; E38-S41 PolarHBondContact O-N 2.94Å; E39-S41 VanDerWaalsContact C-N 3.33Å; E39-S41 PolarHBondContact O-N 3.33Å; S41-I44 PolarHBondContact O-N 3.36Å; S41-F45 WeakPolarHBondContact O-CB 3.08Å; S41-F45 PolarHBondContact O-N 3.25Å
42	R	93.7	Very high	93.6	Very high	170 Å²	170	99.8 Å²	99.8	64%	0.642	50%	0.497	S	S	*	.	H	α-helix	trans	-64.6	-43.7	174.5	-73.1	175	-169.7	-140.7	5.4	111.8	E38 E39 V40 F45 I46	E38-R42 VanDerWaalsContact O-CG 3.3Å; E38-R42 WeakPolarHBondContact O-CG 3.36Å; E38-R42 PolarHBondContact O-N 2.87Å; E39-R42 PolarHBondContact O-N 3.23Å; V40-R42 VanDerWaalsContact C-N 3.35Å; V40-R42 PolarHBondContact O-N 2.89Å; R42-F45 PolarHBondContact O-N 2.82Å; R42-I46 VanDerWaalsContact O-CG1 3.26Å; R42-I46 WeakPolarHBondContact O-CG1 3.38Å; R42-I46 PolarHBondContact O-N 3.45Å
43	K	94.9	Very high	93.7	Very high	127 Å²	127	104.5 Å²	104.5	55%	0.552	51%	0.51	S	S	*	.	H	α-helix	trans	-62.5	-43.2	177.3	-78.8	174.1	169.1	166.9	0	111.4	E39 V40 I46 A47	E39-K43 HydrophobicContact CG-CD 4.44Å; E39-K43 WeakPolarHBondContact O-CB 3.27Å; E39-K43 WeakPolarHBondContact O-CG 3.22Å; E39-K43 PolarHBondContact O-N 3.42Å; E39-K43 WeakPolarHBondContact OE1-CE 3.4Å; E39-K43 IonicContact OE1-NZ 2.6Å; E39-K43 PolarHBondContact OE1-NZ 2.82Å; V40-K43 PolarHBondContact O-N 2.9Å; K43-I46 PolarHBondContact O-N 3.04Å; K43-A47 WeakPolarHBondContact O-CB 3.36Å; K43-A47 PolarHBondContact O-N 2.83Å
44	I	94	Very high	93.8	Very high	100 Å²	100	108.8 Å²	108.8	51%	0.513	52%	0.516	S	S	.	.	H	α-helix	trans	-59.6	-50.4	173.8	-68.9	167.5	0	0	0	110.1	V40 S41 I46 A47 E48	V40-I44 HydrophobicContact CG1-CD1 3.73Å; V40-I44 HydrophobicContact CG1-CG1 4.36Å; V40-I44 VanDerWaalsContact O-CG1 3.27Å; V40-I44 WeakPolarHBondContact O-CG1 3.34Å; V40-I44 PolarHBondContact O-N 3.28Å; S41-I44 PolarHBondContact O-N 3.36Å; I44-I46 VanDerWaalsContact C-N 3.33Å; I44-I46 PolarHBondContact O-N 3.48Å; I44-A47 PolarHBondContact O-N 2.68Å; I44-E48 WeakPolarHBondContact O-CB 3.34Å; I44-E48 PolarHBondContact O-N 2.95Å
45	F	94.1	Very high	93.9	Very high	126 Å²	126	110 Å²	110	55%	0.553	52%	0.517	S	S	*	.	H	α-helix	trans	-60.8	-38.4	179.5	-179.8	-103.4	0	0	0	113.4	S41 R42 N49	S41-F45 WeakPolarHBondContact O-CB 3.08Å; S41-F45 PolarHBondContact O-N 3.25Å; R42-F45 PolarHBondContact O-N 2.82Å; F45-N49 WeakPolarHBondContact CD1-ND2 3.04Å; F45-N49 WeakPolarHBondContact CE1-ND2 3.39Å; F45-N49 WeakPolarHBondContact CE2-ND2 3.32Å; F45-N49 WeakPolarHBondContact CZ-ND2 3.35Å; F45-N49 WeakPolarHBondContact O-CB 3.45Å; F45-N49 PolarHBondContact O-N 3.34Å; F45-N49 PolarHBondContact O-ND2 3.37Å
46	I	94.6	Very high	94	Very high	114 Å²	114	111.8 Å²	111.8	59%	0.585	52%	0.523	S	S	*	.	H	α-helix	trans	-67.9	-44.4	175.7	-69	166	0	0	0	110.5	R42 K43 I44 N49 A50	R42-I46 VanDerWaalsContact O-CG1 3.26Å; R42-I46 WeakPolarHBondContact O-CG1 3.38Å; R42-I46 PolarHBondContact O-N 3.45Å; K43-I46 PolarHBondContact O-N 3.04Å; I44-I46 VanDerWaalsContact C-N 3.33Å; I44-I46 PolarHBondContact O-N 3.48Å; I46-N49 PolarHBondContact O-N 2.93Å; I46-A50 WeakPolarHBondContact O-CB 3.41Å; I46-A50 PolarHBondContact O-N 3.48Å
47	A	93.8	Very high	94	Very high	57 Å²	57	112.8 Å²	112.8	47%	0.471	53%	0.526	S	S	.	.	H	α-helix	trans	-62.8	-46.3	178.5	0	0	0	0	0	111.5	K43 I44 N49 A50 E51	K43-A47 WeakPolarHBondContact O-CB 3.36Å; K43-A47 PolarHBondContact O-N 2.83Å; I44-A47 PolarHBondContact O-N 2.68Å; A47-N49 PolarHBondContact O-N 3.4Å; A47-A50 PolarHBondContact O-N 2.91Å; A47-E51 WeakPolarHBondContact O-CB 3.31Å; A47-E51 PolarHBondContact O-N 3.19Å
48	E	93.2	Very high	94	Very high	105 Å²	105	110.5 Å²	110.5	49%	0.491	52%	0.518	S	S	.	.	H	α-helix	trans	-62.5	-42	177.6	-172	178.5	-169.8	0	0	111.6	I44 E51 N52	I44-E48 WeakPolarHBondContact O-CB 3.34Å; I44-E48 PolarHBondContact O-N 2.95Å; E48-E51 PolarHBondContact O-N 2.98Å; E48-N52 VanDerWaalsContact O-CB 3.32Å; E48-N52 WeakPolarHBondContact O-CB 3.26Å; E48-N52 PolarHBondContact O-N 3.17Å; E48-N52 PolarHBondContact O-ND2 3.07Å
49	N	94.5	Very high	94.2	Very high	59 Å²	59	108.6 Å²	108.6	32%	0.316	51%	0.512	S	S	.	.	H	α-helix	trans	-66	-37.8	174.2	-79.4	-42.4	0	0	0	113.1	F45 I46 A47 R53	F45-N49 WeakPolarHBondContact CD1-ND2 3.04Å; F45-N49 WeakPolarHBondContact CE1-ND2 3.39Å; F45-N49 WeakPolarHBondContact CE2-ND2 3.32Å; F45-N49 WeakPolarHBondContact CZ-ND2 3.35Å; F45-N49 WeakPolarHBondContact O-CB 3.45Å; F45-N49 PolarHBondContact O-N 3.34Å; F45-N49 PolarHBondContact O-ND2 3.37Å; I46-N49 PolarHBondContact O-N 2.93Å; A47-N49 PolarHBondContact O-N 3.4Å; N49-R53 WeakPolarHBondContact O-CG 3.45Å; N49-R53 PolarHBondContact O-N 3.2Å
50	A	93.6	Very high	94.2	Very high	44 Å²	44	110 Å²	110	36%	0.364	52%	0.518	S	S	.	.	H	α-helix	trans	-67.3	-39.1	176.1	0	0	0	0	0	111.4	I46 A47 R54	I46-A50 WeakPolarHBondContact O-CB 3.41Å; I46-A50 PolarHBondContact O-N 3.48Å; A47-A50 PolarHBondContact O-N 2.91Å; A50-R54 WeakPolarHBondContact O-CG 3.43Å; A50-R54 PolarHBondContact O-N 2.84Å; A50-R54 VanDerWaalsContact O-N 3.07Å
51	E	93.6	Very high	94.3	Very high	139 Å²	139	113.7 Å²	113.7	65%	0.65	53%	0.528	S	S	*	.	H	α-helix	trans	-65.9	-45.5	174.2	-173.1	169.4	-164.3	0	0	111.7	A47 E48 R53 R54 Y55	A47-E51 WeakPolarHBondContact O-CB 3.31Å; A47-E51 PolarHBondContact O-N 3.19Å; E48-E51 PolarHBondContact O-N 2.98Å; E51-R53 VanDerWaalsContact C-N 3.33Å; E51-R53 PolarHBondContact O-N 3.38Å; E51-R54 PolarHBondContact O-N 3.02Å; E51-Y55 WeakPolarHBondContact O-CB 3.49Å; E51-Y55 PolarHBondContact O-N 2.92Å
52	N	94.5	Very high	94.3	Very high	76 Å²	76	113.7 Å²	113.7	41%	0.406	52%	0.523	S	S	.	.	H	α-helix	trans	-59.5	-40.5	175.5	-75.8	-26.9	0	0	0	112.4	E48 Y55 Q56	E48-N52 VanDerWaalsContact O-CB 3.32Å; E48-N52 WeakPolarHBondContact O-CB 3.26Å; E48-N52 PolarHBondContact O-N 3.17Å; E48-N52 PolarHBondContact O-ND2 3.07Å; N52-Y55 PolarHBondContact O-N 2.87Å; N52-Q56 WeakPolarHBondContact O-CB 3.33Å; N52-Q56 VanDerWaalsContact O-CG 3.31Å; N52-Q56 WeakPolarHBondContact O-CG 3.36Å; N52-Q56 PolarHBondContact O-N 2.87Å
53	R	93.2	Very high	94.4	Very high	169 Å²	169	111 Å²	111	64%	0.638	52%	0.518	S	S	*	.	H	α-helix	trans	-64.4	-45.6	174.4	-74.7	178.1	-171.4	-170.9	2.2	112.1	N49 E51 Y55 Q56 E57	N49-R53 WeakPolarHBondContact O-CG 3.45Å; N49-R53 PolarHBondContact O-N 3.2Å; E51-R53 VanDerWaalsContact C-N 3.33Å; E51-R53 PolarHBondContact O-N 3.38Å; R53-Y55 VanDerWaalsContact C-N 3.28Å; R53-Y55 PolarHBondContact O-N 3.21Å; R53-Q56 PolarHBondContact O-N 2.89Å; R53-E57 WeakPolarHBondContact O-CG 3.43Å; R53-E57 PolarHBondContact O-N 3.1Å
54	R	93.7	Very high	94.4	Very high	187 Å²	187	108.7 Å²	108.7	71%	0.706	52%	0.518	S	S	*	.	H	α-helix	trans	-60.9	-39.5	175.8	-74.1	175.9	178.7	-171.7	0.4	111.8	A50 E51 Y58	A50-R54 WeakPolarHBondContact O-CG 3.43Å; A50-R54 PolarHBondContact O-N 2.84Å; A50-R54 VanDerWaalsContact O-N 3.07Å; E51-R54 PolarHBondContact O-N 3.02Å; R54-Y58 WeakPolarHBondContact O-CB 3.43Å; R54-Y58 PolarHBondContact O-N 3.25Å
55	Y	94.9	Very high	94.5	Very high	152 Å²	152	107.5 Å²	107.5	60%	0.596	52%	0.515	S	S	*	.	H	α-helix	trans	-64.3	-45.5	175.7	-174.6	-96.7	0	0	0	111.2	E51 N52 R53 Y58 T59	E51-Y55 WeakPolarHBondContact O-CB 3.49Å; E51-Y55 PolarHBondContact O-N 2.92Å; N52-Y55 PolarHBondContact O-N 2.87Å; R53-Y55 VanDerWaalsContact C-N 3.28Å; R53-Y55 PolarHBondContact O-N 3.21Å; Y55-Y58 WeakPolarHBondContact O-CB 3.5Å; Y55-Y58 PolarHBondContact O-N 3.3Å; Y55-T59 HydrophobicContact CD1-CG2 4.12Å; Y55-T59 HydrophobicContact CE1-CG2 3.71Å; Y55-T59 WeakPolarHBondContact O-CG2 3.35Å; Y55-T59 PolarHBondContact O-N 3.41Å; Y55-T59 PolarHBondContact O-OG1 3.43Å
56	Q	94.4	Very high	94.6	Very high	113 Å²	113	109.1 Å²	109.1	53%	0.528	52%	0.517	S	S	.	.	H	α-helix	trans	-58.7	-50.3	175	-75.6	173.3	-10.6	0	0	112	N52 R53 Y58 T59 E60	N52-Q56 WeakPolarHBondContact O-CB 3.33Å; N52-Q56 VanDerWaalsContact O-CG 3.31Å; N52-Q56 WeakPolarHBondContact O-CG 3.36Å; N52-Q56 PolarHBondContact O-N 2.87Å; R53-Q56 PolarHBondContact O-N 2.89Å; Q56-Y58 VanDerWaalsContact C-N 3.27Å; Q56-Y58 PolarHBondContact O-N 2.98Å; Q56-T59 WeakPolarHBondContact CA-OG1 3.44Å; Q56-T59 PolarHBondContact O-N 3.4Å; Q56-T59 VanDerWaalsContact O-N 3.1Å; Q56-T59 PolarHBondContact O-OG1 3.23Å; Q56-E60 WeakPolarHBondContact O-CG 3.39Å; Q56-E60 PolarHBondContact O-N 2.85Å
57	E	94.7	Very high	94.7	Very high	125 Å²	125	108.1 Å²	108.1	58%	0.584	51%	0.513	S	S	*	.	H	α-helix	trans	-57.3	-40.4	176.2	-72.4	171.6	-170.4	0	0	112.1	R53 K61	R53-E57 WeakPolarHBondContact O-CG 3.43Å; R53-E57 PolarHBondContact O-N 3.1Å; E57-K61 WeakPolarHBondContact O-CB 3.33Å; E57-K61 PolarHBondContact O-N 3.22Å
58	Y	94.6	Very high	94.9	Very high	141 Å²	141	112.6 Å²	112.6	55%	0.553	52%	0.519	S	S	*	.	H	α-helix	trans	-65.5	-43.3	175.9	179.6	-103.6	0	0	0	112	R54 Y55 Q56 K61 L62	R54-Y58 WeakPolarHBondContact O-CB 3.43Å; R54-Y58 PolarHBondContact O-N 3.25Å; Y55-Y58 WeakPolarHBondContact O-CB 3.5Å; Y55-Y58 PolarHBondContact O-N 3.3Å; Q56-Y58 VanDerWaalsContact C-N 3.27Å; Q56-Y58 PolarHBondContact O-N 2.98Å; Y58-K61 PolarHBondContact O-N 3.26Å; Y58-L62 HydrophobicContact CD1-CD1 3.88Å; Y58-L62 HydrophobicContact CD1-CG 4.41Å; Y58-L62 HydrophobicContact CE1-CD1 3.29Å; Y58-L62 HydrophobicContact CE1-CG 3.99Å; Y58-L62 HydrophobicContact CE2-CG 4.42Å; Y58-L62 WeakPolarHBondContact O-CG 3.46Å; Y58-L62 PolarHBondContact O-N 3.31Å
59	T	95.5	Very high	95	Very high	42 Å²	42	111.4 Å²	111.4	26%	0.258	52%	0.516	S	S	.	.	H	α-helix	trans	-64.5	-42.4	176.8	53	0	0	0	0	112.3	Y55 Q56 K61 L62 E63	Y55-T59 HydrophobicContact CD1-CG2 4.12Å; Y55-T59 HydrophobicContact CE1-CG2 3.71Å; Y55-T59 WeakPolarHBondContact O-CG2 3.35Å; Y55-T59 PolarHBondContact O-N 3.41Å; Y55-T59 PolarHBondContact O-OG1 3.43Å; Q56-T59 WeakPolarHBondContact CA-OG1 3.44Å; Q56-T59 PolarHBondContact O-N 3.4Å; Q56-T59 VanDerWaalsContact O-N 3.1Å; Q56-T59 PolarHBondContact O-OG1 3.23Å; T59-K61 VanDerWaalsContact C-N 3.32Å; T59-K61 PolarHBondContact O-N 2.9Å; T59-L62 WeakPolarHBondContact O-CB 3.49Å; T59-L62 PolarHBondContact O-N 2.72Å; T59-E63 WeakPolarHBondContact O-CG 3.37Å; T59-E63 PolarHBondContact O-N 2.91Å
60	E	95.2	Very high	95.1	Very high	126 Å²	126	115.5 Å²	115.5	59%	0.589	53%	0.531	S	S	*	.	H	α-helix	trans	-62.5	-40.4	175.6	-71.6	177.5	-179.3	0	0	111.5	Q56 E63 S64	Q56-E60 WeakPolarHBondContact O-CG 3.39Å; Q56-E60 PolarHBondContact O-N 2.85Å; E60-E63 PolarHBondContact O-N 2.95Å; E60-S64 WeakPolarHBondContact O-CB 3.36Å; E60-S64 PolarHBondContact O-N 3.01Å
61	K	95.5	Very high	95.3	Very high	151 Å²	151	118.6 Å²	118.6	66%	0.657	54%	0.541	S	S	*	.	H	α-helix	trans	-64.4	-41.9	175.3	-170	172.7	-176.9	175.9	0	111.7	E57 Y58 T59 S64 V65	E57-K61 WeakPolarHBondContact O-CB 3.33Å; E57-K61 PolarHBondContact O-N 3.22Å; Y58-K61 PolarHBondContact O-N 3.26Å; T59-K61 VanDerWaalsContact C-N 3.32Å; T59-K61 PolarHBondContact O-N 2.9Å; K61-S64 PolarHBondContact O-N 3.38Å; K61-V65 WeakPolarHBondContact O-CG2 3.44Å; K61-V65 PolarHBondContact O-N 3.48Å
62	L	94.9	Very high	95.4	Very high	65 Å²	65	116.9 Å²	116.9	34%	0.34	53%	0.531	S	S	.	.	H	α-helix	trans	-63.5	-40.3	174.1	-76.6	179.5	0	0	0	112.1	Y58 T59 V65 R66	Y58-L62 HydrophobicContact CD1-CD1 3.88Å; Y58-L62 HydrophobicContact CD1-CG 4.41Å; Y58-L62 HydrophobicContact CE1-CD1 3.29Å; Y58-L62 HydrophobicContact CE1-CG 3.99Å; Y58-L62 HydrophobicContact CE2-CG 4.42Å; Y58-L62 WeakPolarHBondContact O-CG 3.46Å; Y58-L62 PolarHBondContact O-N 3.31Å; T59-L62 WeakPolarHBondContact O-CB 3.49Å; T59-L62 PolarHBondContact O-N 2.72Å; L62-V65 PolarHBondContact O-N 3.45Å; L62-R66 WeakPolarHBondContact O-CG 3.4Å; L62-R66 PolarHBondContact O-N 2.97Å
63	E	95.7	Very high	95.5	Very high	114 Å²	114	120 Å²	120	53%	0.533	54%	0.541	S	S	.	.	H	α-helix	trans	-64.8	-42.6	175.3	-74.9	-176	174.4	0	0	112	T59 E60 V65 R66 N67	T59-E63 WeakPolarHBondContact O-CG 3.37Å; T59-E63 PolarHBondContact O-N 2.91Å; E60-E63 PolarHBondContact O-N 2.95Å; E63-V65 PolarHBondContact O-N 3Å; E63-R66 PolarHBondContact O-N 3.4Å; E63-N67 WeakPolarHBondContact O-CB 3.32Å; E63-N67 VanDerWaalsContact O-CG 3.23Å; E63-N67 PolarHBondContact O-N 3.35Å; E63-N67 PolarHBondContact O-ND2 2.85Å
64	S	95.4	Very high	95.7	Very high	78 Å²	78	115.4 Å²	115.4	55%	0.545	54%	0.535	S	S	.	.	H	α-helix	trans	-59.5	-45.4	175	-178.2	0	0	0	0	111.8	E60 K61 R66 N67 Y68	E60-S64 WeakPolarHBondContact O-CB 3.36Å; E60-S64 PolarHBondContact O-N 3.01Å; K61-S64 PolarHBondContact O-N 3.38Å; S64-R66 PolarHBondContact O-N 2.89Å; S64-N67 PolarHBondContact O-N 2.91Å; S64-Y68 PolarHBondContact O-N 3.34Å
65	V	96	Very high	95.8	Very high	75 Å²	75	110.1 Å²	110.1	46%	0.455	52%	0.524	S	S	.	.	H	α-helix	trans	-61.2	-45	174.8	172	0	0	0	0	111.1	K61 L62 E63 N67 Y68 D69	K61-V65 WeakPolarHBondContact O-CG2 3.44Å; K61-V65 PolarHBondContact O-N 3.48Å; L62-V65 PolarHBondContact O-N 3.45Å; E63-V65 PolarHBondContact O-N 3Å; V65-N67 VanDerWaalsContact C-N 3.31Å; V65-N67 PolarHBondContact O-N 3.23Å; V65-Y68 PolarHBondContact O-N 3.04Å; V65-D69 PolarHBondContact O-N 3.42Å
66	R	96	Very high	95.9	Very high	160 Å²	160	108.3 Å²	108.3	60%	0.604	52%	0.521	S	S	*	.	H	α-helix	trans	-61.6	-38.7	176.2	-74.7	173.7	178.5	175.6	0.9	112.4	L62 E63 S64 D69 K70	L62-R66 WeakPolarHBondContact O-CG 3.4Å; L62-R66 PolarHBondContact O-N 2.97Å; E63-R66 PolarHBondContact O-N 3.4Å; S64-R66 PolarHBondContact O-N 2.89Å; R66-D69 PolarHBondContact O-N 3.38Å; R66-K70 WeakPolarHBondContact O-CG 3.47Å; R66-K70 PolarHBondContact O-N 3.48Å
67	N	96.5	Very high	96	Very high	93 Å²	93	108.5 Å²	108.5	50%	0.497	53%	0.525	S	S	.	.	H	α-helix	trans	-68.7	-40.2	177.6	-71.8	-20.7	0	0	0	111.5	E63 S64 V65 K70 L71	E63-N67 WeakPolarHBondContact O-CB 3.32Å; E63-N67 VanDerWaalsContact O-CG 3.23Å; E63-N67 PolarHBondContact O-N 3.35Å; E63-N67 PolarHBondContact O-ND2 2.85Å; S64-N67 PolarHBondContact O-N 2.91Å; V65-N67 VanDerWaalsContact C-N 3.31Å; V65-N67 PolarHBondContact O-N 3.23Å; N67-K70 PolarHBondContact O-N 2.96Å; N67-L71 WeakPolarHBondContact O-CB 3.38Å; N67-L71 PolarHBondContact O-N 3.24Å
68	Y	96.7	Very high	96.1	Very high	151 Å²	151	107.8 Å²	107.8	59%	0.592	52%	0.522	S	S	*	.	H	α-helix	trans	-61	-45.3	173	-179.9	-96.9	0	0	0	111.9	S64 V65 K70 L71 K72	S64-Y68 PolarHBondContact O-N 3.34Å; V65-Y68 PolarHBondContact O-N 3.04Å; Y68-K70 VanDerWaalsContact C-N 3.33Å; Y68-K70 PolarHBondContact O-N 3.27Å; Y68-L71 PolarHBondContact O-N 3.48Å; Y68-K72 HydrophobicContact CE1-CD 4.39Å; Y68-K72 WeakPolarHBondContact O-CB 3.49Å; Y68-K72 PolarHBondContact O-N 3.39Å
69	D	96.2	Very high	96.2	Very high	79 Å²	79	104.3 Å²	104.3	42%	0.422	52%	0.515	S	S	.	.	H	α-helix	trans	-63.2	-38.2	177.3	-79.9	-23.3	0	0	0	112.5	V65 R66 K73	V65-D69 PolarHBondContact O-N 3.42Å; R66-D69 PolarHBondContact O-N 3.38Å; D69-K73 WeakPolarHBondContact O-CB 3.36Å; D69-K73 WeakPolarHBondContact O-CG 3.46Å; D69-K73 PolarHBondContact O-N 3.01Å
70	K	96.8	Very high	96.2	Very high	145 Å²	145	104.8 Å²	104.8	63%	0.63	52%	0.523	S	S	*	.	H	α-helix	trans	-63.4	-46.8	173	-75.4	174.9	-177.8	177.2	0	111.5	R66 N67 Y68 K73 S74	R66-K70 WeakPolarHBondContact O-CG 3.47Å; R66-K70 PolarHBondContact O-N 3.48Å; N67-K70 PolarHBondContact O-N 2.96Å; Y68-K70 VanDerWaalsContact C-N 3.33Å; Y68-K70 PolarHBondContact O-N 3.27Å; K70-K73 PolarHBondContact O-N 2.9Å; K70-S74 WeakPolarHBondContact O-CB 3.34Å; K70-S74 PolarHBondContact O-N 3.4Å
71	L	97	Very high	96.3	Very high	110 Å²	110	105 Å²	105	58%	0.576	52%	0.523	S	S	*	.	H	α-helix	trans	-61.4	-46.1	178	-179	61.8	0	0	0	110.7	N67 Y68 K73 S74 T75	N67-L71 WeakPolarHBondContact O-CB 3.38Å; N67-L71 PolarHBondContact O-N 3.24Å; Y68-L71 PolarHBondContact O-N 3.48Å; L71-K73 PolarHBondContact O-N 3.41Å; L71-S74 PolarHBondContact O-N 3.38Å; L71-T75 PolarHBondContact O-N 3.44Å; L71-T75 PolarHBondContact O-OG1 2.85Å; L71-T75 VanDerWaalsContact O-OG1 3.07Å
72	K	97	Very high	96.4	Very high	103 Å²	103	100.9 Å²	100.9	45%	0.448	51%	0.507	S	S	.	.	H	α-helix	trans	-56.8	-48.9	176.8	-176.9	178.9	178.3	-179	0	111.7	Y68 T75 Q76	Y68-K72 HydrophobicContact CE1-CD 4.39Å; Y68-K72 WeakPolarHBondContact O-CB 3.49Å; Y68-K72 PolarHBondContact O-N 3.39Å; K72-T75 PolarHBondContact O-N 2.83Å; K72-Q76 WeakPolarHBondContact O-CB 3.32Å; K72-Q76 VanDerWaalsContact O-CG 3.3Å; K72-Q76 WeakPolarHBondContact O-CG 3.3Å; K72-Q76 PolarHBondContact O-N 2.91Å
73	K	96.6	Very high	96.5	Very high	140 Å²	140	101.8 Å²	101.8	61%	0.609	51%	0.512	S	S	*	.	H	α-helix	trans	-62.5	-42.6	176.6	-74.3	178.7	-179.8	-178	0	112	D69 K70 L71 Q76 N77	D69-K73 WeakPolarHBondContact O-CB 3.36Å; D69-K73 WeakPolarHBondContact O-CG 3.46Å; D69-K73 PolarHBondContact O-N 3.01Å; K70-K73 PolarHBondContact O-N 2.9Å; L71-K73 PolarHBondContact O-N 3.41Å; K73-Q76 PolarHBondContact O-N 3.2Å; K73-N77 WeakPolarHBondContact O-CB 3.48Å; K73-N77 VanDerWaalsContact O-CG 3.24Å; K73-N77 PolarHBondContact O-N 2.95Å
74	S	96.4	Very high	96.6	Very high	74 Å²	74	99.9 Å²	99.9	52%	0.517	51%	0.508	S	S	.	.	H	α-helix	trans	-61.6	-45.8	177.5	-170.5	0	0	0	0	111.7	K70 L71 N77 H78	K70-S74 WeakPolarHBondContact O-CB 3.34Å; K70-S74 PolarHBondContact O-N 3.4Å; L71-S74 PolarHBondContact O-N 3.38Å; S74-N77 PolarHBondContact O-N 2.96Å; S74-H78 WeakPolarHBondContact O-CB 3.37Å; S74-H78 PolarHBondContact O-N 3.07Å
75	T	96.9	Very high	96.6	Very high	76 Å²	76	99.3 Å²	99.3	47%	0.466	50%	0.497	S	S	.	.	H	α-helix	trans	-63.6	-43.8	177.3	-58.7	0	0	0	0	111.1	L71 K72 N77 H78 T79	L71-T75 PolarHBondContact O-N 3.44Å; L71-T75 PolarHBondContact O-OG1 2.85Å; L71-T75 VanDerWaalsContact O-OG1 3.07Å; K72-T75 PolarHBondContact O-N 2.83Å; T75-N77 PolarHBondContact O-N 3.33Å; T75-H78 PolarHBondContact O-N 2.96Å; T75-T79 WeakPolarHBondContact O-CB 3.37Å; T75-T79 PolarHBondContact O-N 3.44Å; T75-T79 PolarHBondContact O-OG1 2.87Å
76	Q	96.6	Very high	96.7	Very high	113 Å²	113	99.8 Å²	99.8	53%	0.528	50%	0.497	S	S	.	.	H	α-helix	trans	-60.1	-45.4	176.5	-74.9	175.7	-32.9	0	0	112.1	K72 K73 A80	K72-Q76 WeakPolarHBondContact O-CB 3.32Å; K72-Q76 VanDerWaalsContact O-CG 3.3Å; K72-Q76 WeakPolarHBondContact O-CG 3.3Å; K72-Q76 PolarHBondContact O-N 2.91Å; K73-Q76 PolarHBondContact O-N 3.2Å; Q76-A80 WeakPolarHBondContact O-CB 3.38Å; Q76-A80 PolarHBondContact O-N 2.93Å
77	N	96.6	Very high	96.8	Very high	118 Å²	118	97.7 Å²	97.7	63%	0.631	49%	0.494	S	S	*	.	H	α-helix	trans	-64.4	-42.2	177.5	-70.4	-9	0	0	0	112	K73 S74 T75 A80 F81	K73-N77 WeakPolarHBondContact O-CB 3.48Å; K73-N77 VanDerWaalsContact O-CG 3.24Å; K73-N77 PolarHBondContact O-N 2.95Å; S74-N77 PolarHBondContact O-N 2.96Å; T75-N77 PolarHBondContact O-N 3.33Å; N77-A80 PolarHBondContact O-N 3.48Å; N77-F81 WeakPolarHBondContact O-CB 3.42Å; N77-F81 PolarHBondContact O-N 3.49Å
78	H	96.7	Very high	96.8	Very high	110 Å²	110	97.7 Å²	97.7	51%	0.509	49%	0.493	S	S	.	.	H	α-helix	trans	-66.1	-44.8	178.7	-174	56.8	0	0	0	111.8	S74 T75 A80 F81 L82	S74-H78 WeakPolarHBondContact O-CB 3.37Å; S74-H78 PolarHBondContact O-N 3.07Å; T75-H78 PolarHBondContact O-N 2.96Å; H78-A80 PolarHBondContact O-N 3.3Å; H78-F81 PolarHBondContact O-N 3.45Å; H78-L82 WeakPolarHBondContact O-CG 3.43Å; H78-L82 PolarHBondContact O-N 3.47Å
79	T	96.5	Very high	96.8	Very high	67 Å²	67	95.1 Å²	95.1	41%	0.411	49%	0.485	S	S	.	.	H	α-helix	trans	-62.1	-43.6	175.5	-59.3	0	0	0	0	111.3	T75 F81 L82 I83	T75-T79 WeakPolarHBondContact O-CB 3.37Å; T75-T79 PolarHBondContact O-N 3.44Å; T75-T79 PolarHBondContact O-OG1 2.87Å; T79-F81 PolarHBondContact O-N 2.87Å; T79-L82 PolarHBondContact O-N 3.01Å; T79-I83 HydrophobicContact CG2-CD1 3.84Å; T79-I83 HydrophobicContact CG2-CG1 4.41Å; T79-I83 VanDerWaalsContact O-CG1 3.26Å; T79-I83 WeakPolarHBondContact O-CG1 3.39Å; T79-I83 PolarHBondContact O-N 3.45Å
80	A	96.2	Very high	96.8	Very high	52 Å²	52	95.9 Å²	95.9	43%	0.43	49%	0.492	S	S	.	.	H	α-helix	trans	-60.5	-44.6	176.3	0	0	0	0	0	111.7	Q76 N77 H78 I83 T84	Q76-A80 WeakPolarHBondContact O-CB 3.38Å; Q76-A80 PolarHBondContact O-N 2.93Å; N77-A80 PolarHBondContact O-N 3.48Å; H78-A80 PolarHBondContact O-N 3.3Å; A80-I83 PolarHBondContact O-N 2.94Å; A80-T84 PolarHBondContact O-N 3.01Å; A80-T84 PolarHBondContact O-OG1 3Å; A80-T84 VanDerWaalsContact O-OG1 3.14Å
81	F	97	Very high	96.8	Very high	131 Å²	131	92.5 Å²	92.5	58%	0.575	48%	0.484	S	S	*	.	H	α-helix	trans	-58.4	-48.9	175.4	175.1	-92.8	0	0	0	112	N77 H78 T79 I83 T84 E85	N77-F81 WeakPolarHBondContact O-CB 3.42Å; N77-F81 PolarHBondContact O-N 3.49Å; H78-F81 PolarHBondContact O-N 3.45Å; T79-F81 PolarHBondContact O-N 2.87Å; F81-I83 VanDerWaalsContact C-N 3.33Å; F81-I83 PolarHBondContact O-N 3.32Å; F81-T84 PolarHBondContact O-N 3.32Å; F81-E85 WeakPolarHBondContact CE1-OE2 3.41Å; F81-E85 WeakPolarHBondContact O-CB 3.42Å; F81-E85 PolarHBondContact O-N 3Å
82	L	97.3	Very high	96.8	Very high	64 Å²	64	91.4 Å²	91.4	34%	0.335	48%	0.478	S	S	.	.	H	α-helix	trans	-63.9	-37.6	179.6	-71.7	177.9	0	0	0	112.5	H78 T79 N86	H78-L82 WeakPolarHBondContact O-CG 3.43Å; H78-L82 PolarHBondContact O-N 3.47Å; T79-L82 PolarHBondContact O-N 3.01Å; L82-N86 VanDerWaalsContact O-CB 3.31Å; L82-N86 WeakPolarHBondContact O-CB 3.3Å; L82-N86 VanDerWaalsContact O-CG 3.25Å; L82-N86 PolarHBondContact O-N 2.94Å; L82-N86 PolarHBondContact O-ND2 3.35Å
83	I	96.6	Very high	96.8	Very high	85 Å²	85	91.2 Å²	91.2	44%	0.436	48%	0.482	S	S	.	.	H	α-helix	trans	-61.7	-53	175.1	-71.5	167.5	0	0	0	109.5	T79 A80 F81 E85 N86 E87	T79-I83 HydrophobicContact CG2-CD1 3.84Å; T79-I83 HydrophobicContact CG2-CG1 4.41Å; T79-I83 VanDerWaalsContact O-CG1 3.26Å; T79-I83 WeakPolarHBondContact O-CG1 3.39Å; T79-I83 PolarHBondContact O-N 3.45Å; A80-I83 PolarHBondContact O-N 2.94Å; F81-I83 VanDerWaalsContact C-N 3.33Å; F81-I83 PolarHBondContact O-N 3.32Å; I83-E85 PolarHBondContact O-N 3.41Å; I83-N86 PolarHBondContact O-N 3.06Å; I83-E87 HydrophobicContact CG2-CG 4.34Å; I83-E87 WeakPolarHBondContact O-CG 3.26Å; I83-E87 PolarHBondContact O-N 3.14Å
84	T	96.8	Very high	96.9	Very high	73 Å²	73	93.6 Å²	93.6	45%	0.448	49%	0.487	S	S	.	.	H	α-helix	trans	-61.5	-42.3	-179.7	-58.2	0	0	0	0	112.2	A80 F81 N86 E87 I88	A80-T84 PolarHBondContact O-N 3.01Å; A80-T84 PolarHBondContact O-OG1 3Å; A80-T84 VanDerWaalsContact O-OG1 3.14Å; F81-T84 PolarHBondContact O-N 3.32Å; T84-N86 VanDerWaalsContact C-N 3.33Å; T84-N86 PolarHBondContact O-N 3.34Å; T84-E87 PolarHBondContact O-N 3.21Å; T84-I88 HydrophobicContact CG2-CD1 4.05Å; T84-I88 VanDerWaalsContact O-CG1 3.3Å; T84-I88 WeakPolarHBondContact O-CG1 3.34Å; T84-I88 PolarHBondContact O-N 3.01Å
85	E	97.2	Very high	96.9	Very high	67 Å²	67	94.7 Å²	94.7	31%	0.313	49%	0.487	S	S	.	.	H	α-helix	trans	-61.4	-43.3	177.1	-168.9	-168.7	170.6	0	0	111.4	F81 I83 I88 K89	F81-E85 WeakPolarHBondContact CE1-OE2 3.41Å; F81-E85 WeakPolarHBondContact O-CB 3.42Å; F81-E85 PolarHBondContact O-N 3Å; I83-E85 PolarHBondContact O-N 3.41Å; E85-I88 PolarHBondContact O-N 3.45Å; E85-K89 WeakPolarHBondContact O-CG 3.34Å; E85-K89 PolarHBondContact O-N 2.86Å; E85-K89 VanDerWaalsContact OE1-CE 3.26Å; E85-K89 WeakPolarHBondContact OE1-CE 3.43Å; E85-K89 IonicContact OE1-NZ 2.65Å; E85-K89 PolarHBondContact OE1-NZ 3.48Å
86	N	97.1	Very high	97	Very high	85 Å²	85	96.4 Å²	96.4	46%	0.455	49%	0.49	S	S	.	.	H	α-helix	trans	-69.8	-37.3	178.3	-74.3	-32.8	0	0	0	112.3	L82 I83 T84 I88 K89 V90	L82-N86 VanDerWaalsContact O-CB 3.31Å; L82-N86 WeakPolarHBondContact O-CB 3.3Å; L82-N86 VanDerWaalsContact O-CG 3.25Å; L82-N86 PolarHBondContact O-N 2.94Å; L82-N86 PolarHBondContact O-ND2 3.35Å; I83-N86 PolarHBondContact O-N 3.06Å; T84-N86 VanDerWaalsContact C-N 3.33Å; T84-N86 PolarHBondContact O-N 3.34Å; N86-I88 VanDerWaalsContact C-N 3.33Å; N86-I88 PolarHBondContact O-N 3.02Å; N86-K89 PolarHBondContact O-N 2.88Å; N86-V90 WeakPolarHBondContact O-CB 3.31Å; N86-V90 VanDerWaalsContact O-CG2 3.28Å; N86-V90 WeakPolarHBondContact O-CG2 3.26Å; N86-V90 PolarHBondContact O-N 2.97Å
87	E	97.2	Very high	97	Very high	115 Å²	115	96.1 Å²	96.1	54%	0.537	49%	0.491	S	S	.	.	H	α-helix	trans	-60.5	-42.7	173.5	-75.1	173.7	167.6	0	0	111.5	I83 T84 V90 T91	I83-E87 HydrophobicContact CG2-CG 4.34Å; I83-E87 WeakPolarHBondContact O-CG 3.26Å; I83-E87 PolarHBondContact O-N 3.14Å; T84-E87 PolarHBondContact O-N 3.21Å; E87-V90 PolarHBondContact O-N 2.68Å; E87-T91 WeakPolarHBondContact O-CB 3.44Å; E87-T91 WeakPolarHBondContact O-CG2 3.31Å; E87-T91 PolarHBondContact O-N 3.48Å; E87-T91 PolarHBondContact O-OG1 2.96Å
88	I	97.2	Very high	97.1	Very high	93 Å²	93	92.2 Å²	92.2	48%	0.477	48%	0.478	S	S	.	.	H	α-helix	trans	-63.6	-43.5	174.7	-67	166	0	0	0	110.9	T84 E85 N86 T91 N92	T84-I88 HydrophobicContact CG2-CD1 4.05Å; T84-I88 VanDerWaalsContact O-CG1 3.3Å; T84-I88 WeakPolarHBondContact O-CG1 3.34Å; T84-I88 PolarHBondContact O-N 3.01Å; E85-I88 PolarHBondContact O-N 3.45Å; N86-I88 VanDerWaalsContact C-N 3.33Å; N86-I88 PolarHBondContact O-N 3.02Å; I88-T91 WeakPolarHBondContact CA-OG1 3.28Å; I88-T91 PolarHBondContact O-N 3.42Å; I88-T91 PolarHBondContact O-OG1 2.87Å; I88-N92 WeakPolarHBondContact O-CB 3.45Å; I88-N92 PolarHBondContact O-N 3.25Å; I88-N92 PolarHBondContact O-ND2 3.25Å
89	K	96.8	Very high	97.1	Very high	97 Å²	97	93.3 Å²	93.3	42%	0.422	48%	0.481	S	S	.	.	H	α-helix	trans	-62.5	-44.7	176.9	-73.9	173.1	-174.8	166.2	0	112	E85 N86 N92 L93	E85-K89 WeakPolarHBondContact O-CG 3.34Å; E85-K89 PolarHBondContact O-N 2.86Å; E85-K89 VanDerWaalsContact OE1-CE 3.26Å; E85-K89 WeakPolarHBondContact OE1-CE 3.43Å; E85-K89 IonicContact OE1-NZ 2.65Å; E85-K89 PolarHBondContact OE1-NZ 3.48Å; N86-K89 PolarHBondContact O-N 2.88Å; K89-N92 PolarHBondContact O-N 3.33Å; K89-L93 WeakPolarHBondContact O-CB 3.49Å; K89-L93 VanDerWaalsContact O-CG 3.31Å; K89-L93 WeakPolarHBondContact O-CG 3.33Å; K89-L93 PolarHBondContact O-N 2.86Å
90	V	97.1	Very high	97.2	Very high	95 Å²	95	95.5 Å²	95.5	58%	0.576	49%	0.49	S	S	*	.	H	α-helix	trans	-65	-41.9	-179.7	168.9	0	0	0	0	111.4	N86 E87 L93 R94	N86-V90 WeakPolarHBondContact O-CB 3.31Å; N86-V90 VanDerWaalsContact O-CG2 3.28Å; N86-V90 WeakPolarHBondContact O-CG2 3.26Å; N86-V90 PolarHBondContact O-N 2.97Å; E87-V90 PolarHBondContact O-N 2.68Å; V90-L93 PolarHBondContact O-N 3.01Å; V90-R94 WeakPolarHBondContact O-CB 3.35Å; V90-R94 PolarHBondContact O-N 3.44Å
91	T	96.7	Very high	97.3	Very high	75 Å²	75	96.3 Å²	96.3	46%	0.46	49%	0.489	S	S	.	.	H	α-helix	trans	-64.4	-45.8	176.9	46.9	0	0	0	0	111.6	E87 I88 L93 R94 D95	E87-T91 WeakPolarHBondContact O-CB 3.44Å; E87-T91 WeakPolarHBondContact O-CG2 3.31Å; E87-T91 PolarHBondContact O-N 3.48Å; E87-T91 PolarHBondContact O-OG1 2.96Å; I88-T91 WeakPolarHBondContact CA-OG1 3.28Å; I88-T91 PolarHBondContact O-N 3.42Å; I88-T91 PolarHBondContact O-OG1 2.87Å; T91-L93 PolarHBondContact O-N 3.42Å; T91-R94 WeakPolarHBondContact O-CB 3.46Å; T91-R94 PolarHBondContact O-N 3.31Å; T91-D95 PolarHBondContact O-N 3.43Å
92	N	96.3	Very high	97.3	Very high	87 Å²	87	93.5 Å²	93.5	47%	0.465	48%	0.483	S	S	.	.	H	α-helix	trans	-59.6	-45.9	175.4	-71.1	-19.1	0	0	0	112.5	I88 K89 R94 D95 E96	I88-N92 WeakPolarHBondContact O-CB 3.45Å; I88-N92 PolarHBondContact O-N 3.25Å; I88-N92 PolarHBondContact O-ND2 3.25Å; K89-N92 PolarHBondContact O-N 3.33Å; N92-R94 VanDerWaalsContact C-N 3.31Å; N92-R94 PolarHBondContact O-N 2.98Å; N92-D95 PolarHBondContact O-N 2.95Å; N92-E96 WeakPolarHBondContact O-CG 3.24Å; N92-E96 PolarHBondContact O-N 2.96Å
93	L	97.7	Very high	97.3	Very high	98 Å²	98	96.9 Å²	96.9	51%	0.513	50%	0.495	S	S	.	.	H	α-helix	trans	-63.1	-38.3	177.3	-74.6	172.1	0	0	0	112	K89 V90 T91 D95 E96 I97	K89-L93 WeakPolarHBondContact O-CB 3.49Å; K89-L93 VanDerWaalsContact O-CG 3.31Å; K89-L93 WeakPolarHBondContact O-CG 3.33Å; K89-L93 PolarHBondContact O-N 2.86Å; V90-L93 PolarHBondContact O-N 3.01Å; T91-L93 PolarHBondContact O-N 3.42Å; L93-D95 VanDerWaalsContact C-N 3.34Å; L93-E96 PolarHBondContact O-N 2.9Å; L93-I97 WeakPolarHBondContact O-CB 3.36Å; L93-I97 VanDerWaalsContact O-CG1 3.24Å; L93-I97 WeakPolarHBondContact O-CG1 3.45Å; L93-I97 PolarHBondContact O-N 3.21Å
94	R	97.8	Very high	97.4	Very high	190 Å²	190	97.6 Å²	97.6	72%	0.717	50%	0.5	S	S	*	.	H	α-helix	trans	-62.8	-42.1	175.8	-176.3	179	-177.9	166.1	1	111.7	V90 T91 N92 I97 G98	V90-R94 WeakPolarHBondContact O-CB 3.35Å; V90-R94 PolarHBondContact O-N 3.44Å; T91-R94 WeakPolarHBondContact O-CB 3.46Å; T91-R94 PolarHBondContact O-N 3.31Å; N92-R94 VanDerWaalsContact C-N 3.31Å; N92-R94 PolarHBondContact O-N 2.98Å; R94-I97 PolarHBondContact O-N 2.96Å; R94-G98 PolarHBondContact O-N 3.38Å
95	D	97.2	Very high	97.5	Very high	98 Å²	98	98 Å²	98	52%	0.524	50%	0.499	S	S	.	.	H	α-helix	trans	-66.9	-39.9	177.2	-72.4	-8.7	0	0	0	111.7	T91 N92 L93 G98 K99	T91-D95 PolarHBondContact O-N 3.43Å; N92-D95 PolarHBondContact O-N 2.95Å; L93-D95 VanDerWaalsContact C-N 3.34Å; D95-G98 PolarHBondContact O-N 2.9Å; D95-K99 WeakPolarHBondContact O-CG 3.35Å; D95-K99 PolarHBondContact O-N 3.47Å
96	E	97.8	Very high	97.5	Very high	111 Å²	111	101 Å²	101	52%	0.519	51%	0.513	S	S	.	.	H	α-helix	trans	-62.6	-44.4	173.5	-75.1	-179	-174.3	0	0	112.1	N92 L93 G98 K99 L100	N92-E96 WeakPolarHBondContact O-CG 3.24Å; N92-E96 PolarHBondContact O-N 2.96Å; L93-E96 PolarHBondContact O-N 2.9Å; E96-G98 VanDerWaalsContact C-N 3.33Å; E96-G98 PolarHBondContact O-N 3.05Å; E96-K99 PolarHBondContact O-N 3.41Å; E96-L100 WeakPolarHBondContact O-CG 3.42Å; E96-L100 PolarHBondContact O-N 3.23Å
97	I	97.7	Very high	97.5	Very high	108 Å²	108	99.1 Å²	99.1	55%	0.554	51%	0.509	S	S	*	.	H	α-helix	trans	-58.5	-46.8	174.1	-71.9	166.3	0	0	0	109.9	L93 R94 K99 L100 T101	L93-I97 WeakPolarHBondContact O-CB 3.36Å; L93-I97 VanDerWaalsContact O-CG1 3.24Å; L93-I97 WeakPolarHBondContact O-CG1 3.45Å; L93-I97 PolarHBondContact O-N 3.21Å; R94-I97 PolarHBondContact O-N 2.96Å; I97-K99 VanDerWaalsContact C-N 3.33Å; I97-K99 PolarHBondContact O-N 3.1Å; I97-L100 PolarHBondContact O-N 3.46Å; I97-L100 VanDerWaalsContact O-N 3.1Å; I97-T101 PolarHBondContact O-N 3.37Å; I97-T101 PolarHBondContact O-OG1 3.23Å; I97-T101 VanDerWaalsContact O-OG1 3.05Å
98	G	98	Very high	97.6	Very high	35 Å²	35	97.1 Å²	97.1	36%	0.361	50%	0.502	S	S	.	.	H	α-helix	trans	-59.1	-41	177	0	0	0	0	0	113.4	R94 D95 E96 L100 T101 T102	R94-G98 PolarHBondContact O-N 3.38Å; D95-G98 PolarHBondContact O-N 2.9Å; E96-G98 VanDerWaalsContact C-N 3.33Å; E96-G98 PolarHBondContact O-N 3.05Å; G98-L100 VanDerWaalsContact C-N 3.35Å; G98-T101 PolarHBondContact O-N 3.48Å; G98-T102 WeakPolarHBondContact O-CG2 3.46Å; G98-T102 PolarHBondContact O-N 2.96Å; G98-T102 PolarHBondContact O-OG1 3.26Å
99	K	97.7	Very high	97.6	Very high	134 Å²	134	99.1 Å²	99.1	58%	0.583	51%	0.507	S	S	*	.	H	α-helix	trans	-65.7	-34.9	174.3	-71.4	171.6	-173.4	170.3	0	112.7	D95 E96 I97 T102 K103	D95-K99 WeakPolarHBondContact O-CG 3.35Å; D95-K99 PolarHBondContact O-N 3.47Å; E96-K99 PolarHBondContact O-N 3.41Å; I97-K99 VanDerWaalsContact C-N 3.33Å; I97-K99 PolarHBondContact O-N 3.1Å; K99-T102 WeakPolarHBondContact CA-OG1 3.34Å; K99-T102 PolarHBondContact O-OG1 3.42Å; K99-K103 WeakPolarHBondContact O-CG 3.41Å; K99-K103 PolarHBondContact O-N 2.93Å
100	L	97.9	Very high	97.7	Very high	112 Å²	112	99.4 Å²	99.4	59%	0.586	51%	0.513	S	S	*	.	H	α-helix	trans	-74.9	-39.5	177.2	-71.8	168.2	0	0	0	111.7	E96 I97 G98 K103 L104	E96-L100 WeakPolarHBondContact O-CG 3.42Å; E96-L100 PolarHBondContact O-N 3.23Å; I97-L100 PolarHBondContact O-N 3.46Å; I97-L100 VanDerWaalsContact O-N 3.1Å; G98-L100 VanDerWaalsContact C-N 3.35Å; L100-K103 PolarHBondContact O-N 2.97Å; L100-L104 WeakPolarHBondContact O-CB 3.39Å; L100-L104 PolarHBondContact O-N 3.49Å
101	T	97.8	Very high	97.7	Very high	69 Å²	69	99.3 Å²	99.3	42%	0.423	51%	0.508	S	S	.	.	H	α-helix	trans	-60.5	-45.6	174.5	-58.5	0	0	0	0	111.3	I97 G98 K103 L104 D105	I97-T101 PolarHBondContact O-N 3.37Å; I97-T101 PolarHBondContact O-OG1 3.23Å; I97-T101 VanDerWaalsContact O-OG1 3.05Å; G98-T101 PolarHBondContact O-N 3.48Å; T101-K103 PolarHBondContact O-N 3.3Å; T101-L104 WeakPolarHBondContact O-CB 3.41Å; T101-L104 PolarHBondContact O-N 2.93Å; T101-D105 PolarHBondContact O-N 2.91Å
102	T	97.5	Very high	97.7	Very high	72 Å²	72	101.7 Å²	101.7	44%	0.442	51%	0.514	S	S	.	.	H	α-helix	trans	-62	-43.8	176.8	44.9	0	0	0	0	112.7	G98 K99 L104 D105 E106	G98-T102 WeakPolarHBondContact O-CG2 3.46Å; G98-T102 PolarHBondContact O-N 2.96Å; G98-T102 PolarHBondContact O-OG1 3.26Å; K99-T102 WeakPolarHBondContact CA-OG1 3.34Å; K99-T102 PolarHBondContact O-OG1 3.42Å; T102-L104 VanDerWaalsContact C-N 3.31Å; T102-L104 PolarHBondContact O-N 3.05Å; T102-D105 PolarHBondContact O-N 2.85Å; T102-E106 WeakPolarHBondContact O-CG 3.43Å; T102-E106 PolarHBondContact O-N 2.97Å
103	K	98	Very high	97.8	Very high	135 Å²	135	103.1 Å²	103.1	59%	0.587	52%	0.519	S	S	*	.	H	α-helix	trans	-61.5	-37.6	173.3	-75.4	178.9	179.3	-175.5	0	113	K99 L100 T101 E106 A107	K99-K103 WeakPolarHBondContact O-CG 3.41Å; K99-K103 PolarHBondContact O-N 2.93Å; L100-K103 PolarHBondContact O-N 2.97Å; T101-K103 PolarHBondContact O-N 3.3Å; K103-E106 PolarHBondContact O-N 3.48Å; K103-A107 WeakPolarHBondContact O-CB 3.41Å; K103-A107 PolarHBondContact O-N 2.66Å
104	L	98.1	Very high	97.8	Very high	101 Å²	101	103.4 Å²	103.4	53%	0.529	52%	0.516	S	S	.	.	H	α-helix	trans	-65.4	-43.2	176.4	-179.9	62.5	0	0	0	111	L100 T101 T102 A107 N108	L100-L104 WeakPolarHBondContact O-CB 3.39Å; L100-L104 PolarHBondContact O-N 3.49Å; T101-L104 WeakPolarHBondContact O-CB 3.41Å; T101-L104 PolarHBondContact O-N 2.93Å; T102-L104 VanDerWaalsContact C-N 3.31Å; T102-L104 PolarHBondContact O-N 3.05Å; L104-A107 PolarHBondContact O-N 2.92Å; L104-N108 WeakPolarHBondContact O-CB 3.38Å; L104-N108 VanDerWaalsContact O-CG 3.27Å; L104-N108 PolarHBondContact O-N 2.95Å; L104-N108 PolarHBondContact O-ND2 3.18Å
105	D	97.9	Very high	97.9	Very high	81 Å²	81	98.2 Å²	98.2	43%	0.433	50%	0.503	S	S	.	.	H	α-helix	trans	-63.8	-40.9	176.5	-69.4	-21.5	0	0	0	112	T101 T102 N108 K109	T101-D105 PolarHBondContact O-N 2.91Å; T102-D105 PolarHBondContact O-N 2.85Å; D105-N108 PolarHBondContact O-N 3.18Å; D105-K109 WeakPolarHBondContact O-CG 3.34Å; D105-K109 PolarHBondContact O-N 3.43Å
106	E	98	Very high	97.9	Very high	130 Å²	130	98 Å²	98	61%	0.607	50%	0.501	S	S	*	.	H	α-helix	trans	-62	-44.1	173.6	-73	172.2	-177.7	0	0	112	T102 K103 K109 L110	T102-E106 WeakPolarHBondContact O-CG 3.43Å; T102-E106 PolarHBondContact O-N 2.97Å; K103-E106 PolarHBondContact O-N 3.48Å; E106-K109 PolarHBondContact O-N 3.37Å; E106-L110 PolarHBondContact O-N 2.99Å
107	A	97.9	Very high	97.9	Very high	45 Å²	45	97.5 Å²	97.5	37%	0.372	50%	0.499	S	S	.	.	H	α-helix	trans	-63.9	-41	177.1	0	0	0	0	0	111.9	K103 L104 L110 I111	K103-A107 WeakPolarHBondContact O-CB 3.41Å; K103-A107 PolarHBondContact O-N 2.66Å; L104-A107 PolarHBondContact O-N 2.92Å; A107-L110 WeakPolarHBondContact O-CB 3.48Å; A107-L110 PolarHBondContact O-N 3.25Å; A107-I111 WeakPolarHBondContact O-CG1 3.37Å; A107-I111 PolarHBondContact O-N 3.02Å
108	N	98	Very high	97.9	Very high	73 Å²	73	97.6 Å²	97.6	39%	0.39	50%	0.501	S	S	.	.	H	α-helix	trans	-63	-44.6	176.5	-73.7	-26	0	0	0	111.6	L104 D105 L110 I111 E112	L104-N108 WeakPolarHBondContact O-CB 3.38Å; L104-N108 VanDerWaalsContact O-CG 3.27Å; L104-N108 PolarHBondContact O-N 2.95Å; L104-N108 PolarHBondContact O-ND2 3.18Å; D105-N108 PolarHBondContact O-N 3.18Å; N108-L110 VanDerWaalsContact C-N 3.3Å; N108-L110 PolarHBondContact O-N 3Å; N108-I111 WeakPolarHBondContact O-CB 3.49Å; N108-I111 PolarHBondContact O-N 3.41Å; N108-E112 WeakPolarHBondContact O-CG 3.46Å; N108-E112 PolarHBondContact O-N 3.3Å
109	K	97.9	Very high	97.9	Very high	136 Å²	136	102.3 Å²	102.3	59%	0.591	51%	0.511	S	S	*	.	H	α-helix	trans	-59.6	-40.8	174	-72.9	174.2	-176.9	175.9	0	112.1	D105 E106 I111 E112 M113	D105-K109 WeakPolarHBondContact O-CG 3.34Å; D105-K109 PolarHBondContact O-N 3.43Å; E106-K109 PolarHBondContact O-N 3.37Å; K109-I111 VanDerWaalsContact C-N 3.35Å; K109-E112 PolarHBondContact O-N 3.5Å; K109-M113 WeakPolarHBondContact O-CG 3.41Å; K109-M113 PolarHBondContact O-N 2.87Å
110	L	98	Very high	98	Very high	102 Å²	102	99 Å²	99	53%	0.534	50%	0.504	S	S	.	.	H	α-helix	trans	-64.1	-40.6	176.7	-174.8	65.9	0	0	0	111.8	E106 A107 N108 M113 K114	E106-L110 PolarHBondContact O-N 2.99Å; A107-L110 WeakPolarHBondContact O-CB 3.48Å; A107-L110 PolarHBondContact O-N 3.25Å; N108-L110 VanDerWaalsContact C-N 3.3Å; N108-L110 PolarHBondContact O-N 3Å; L110-M113 PolarHBondContact O-N 3.39Å; L110-K114 WeakPolarHBondContact O-CG 3.37Å; L110-K114 PolarHBondContact O-N 3.39Å
111	I	97.9	Very high	98	Very high	93 Å²	93	98.7 Å²	98.7	48%	0.477	50%	0.503	S	S	.	.	H	α-helix	trans	-62.7	-43.7	175.5	-71.1	166.1	0	0	0	110.8	A107 N108 K109 K114 N115	A107-I111 WeakPolarHBondContact O-CG1 3.37Å; A107-I111 PolarHBondContact O-N 3.02Å; N108-I111 WeakPolarHBondContact O-CB 3.49Å; N108-I111 PolarHBondContact O-N 3.41Å; K109-I111 VanDerWaalsContact C-N 3.35Å; I111-K114 PolarHBondContact O-N 2.95Å; I111-N115 WeakPolarHBondContact O-CB 3.29Å; I111-N115 VanDerWaalsContact O-CG 3.28Å; I111-N115 PolarHBondContact O-N 2.96Å; I111-N115 PolarHBondContact O-ND2 2.91Å
112	E	97.7	Very high	98	Very high	126 Å²	126	104 Å²	104	59%	0.589	52%	0.515	S	S	*	.	H	α-helix	trans	-59.2	-49.1	176.1	-73	177.8	170.9	0	0	111.5	N108 K109 K114 N115 D116	N108-E112 WeakPolarHBondContact O-CG 3.46Å; N108-E112 PolarHBondContact O-N 3.3Å; K109-E112 PolarHBondContact O-N 3.5Å; E112-K114 VanDerWaalsContact C-N 3.33Å; E112-K114 PolarHBondContact O-N 3.29Å; E112-N115 PolarHBondContact O-N 3.31Å; E112-D116 PolarHBondContact O-N 3.18Å
113	M	97.6	Very high	98	Very high	116 Å²	116	105.5 Å²	105.5	57%	0.571	52%	0.517	S	S	*	.	H	α-helix	trans	-56.6	-45.7	175.9	-70.3	176.7	64.9	0	0	112	K109 L110 N115 D116 E117	K109-M113 WeakPolarHBondContact O-CG 3.41Å; K109-M113 PolarHBondContact O-N 2.87Å; L110-M113 PolarHBondContact O-N 3.39Å; M113-N115 PolarHBondContact O-N 2.95Å; M113-D116 PolarHBondContact O-N 3.36Å; M113-E117 WeakPolarHBondContact O-CG 3.5Å; M113-E117 PolarHBondContact O-N 3.31Å
114	K	98.2	Very high	98	Very high	104 Å²	104	104.5 Å²	104.5	45%	0.452	52%	0.515	S	S	.	.	H	α-helix	trans	-68.1	-33.4	178.9	-69.7	-55.7	179.6	-158.5	0	113.5	L110 I111 E112 D116 E117 L118	L110-K114 WeakPolarHBondContact O-CG 3.37Å; L110-K114 PolarHBondContact O-N 3.39Å; I111-K114 PolarHBondContact O-N 2.95Å; E112-K114 VanDerWaalsContact C-N 3.33Å; E112-K114 PolarHBondContact O-N 3.29Å; K114-D116 VanDerWaalsContact C-N 3.33Å; K114-E117 VanDerWaalsContact CD-OE2 3.29Å; K114-E117 WeakPolarHBondContact CD-OE2 3.27Å; K114-E117 IonicContact NZ-OE1 3.96Å; K114-E117 PolarHBondContact NZ-OE1 3.03Å; K114-E117 IonicContact NZ-OE2 2.86Å; K114-E117 PolarHBondContact NZ-OE2 3.34Å; K114-L118 VanDerWaalsContact O-CB 3.29Å; K114-L118 WeakPolarHBondContact O-CB 3.49Å; K114-L118 PolarHBondContact O-N 3.02Å
115	N	98.2	Very high	98.1	Very high	81 Å²	81	106.6 Å²	106.6	43%	0.433	52%	0.517	S	S	.	.	H	α-helix	trans	-65.6	-38.9	173.5	-77.7	-28	0	0	0	111.7	I111 E112 M113 L118 K119	I111-N115 WeakPolarHBondContact O-CB 3.29Å; I111-N115 VanDerWaalsContact O-CG 3.28Å; I111-N115 PolarHBondContact O-N 2.96Å; I111-N115 PolarHBondContact O-ND2 2.91Å; E112-N115 PolarHBondContact O-N 3.31Å; M113-N115 PolarHBondContact O-N 2.95Å; N115-L118 PolarHBondContact O-N 2.92Å; N115-K119 VanDerWaalsContact O-CG 3.32Å; N115-K119 WeakPolarHBondContact O-CG 3.49Å; N115-K119 PolarHBondContact O-N 2.98Å
116	D	98	Very high	98.1	Very high	93 Å²	93	106.9 Å²	106.9	50%	0.497	52%	0.518	S	S	.	.	H	α-helix	trans	-73.3	-39.5	178.1	-70.4	-19.4	0	0	0	112.3	E112 M113 K114 L118 K119 S120	E112-D116 PolarHBondContact O-N 3.18Å; M113-D116 PolarHBondContact O-N 3.36Å; K114-D116 VanDerWaalsContact C-N 3.33Å; D116-L118 VanDerWaalsContact C-N 3.31Å; D116-L118 PolarHBondContact O-N 2.93Å; D116-K119 PolarHBondContact O-N 3.25Å; D116-K119 IonicContact OD1-NZ 2.7Å; D116-K119 PolarHBondContact OD1-NZ 3.28Å; D116-S120 PolarHBondContact O-N 3.47Å
117	E	98.2	Very high	98.1	Very high	101 Å²	101	105.1 Å²	105.1	47%	0.472	51%	0.512	S	S	.	.	H	α-helix	trans	-55.8	-46.3	168.6	-74.7	177	-156.6	0	0	111.1	M113 K114 K119 S120 L121	M113-E117 WeakPolarHBondContact O-CG 3.5Å; M113-E117 PolarHBondContact O-N 3.31Å; K114-E117 VanDerWaalsContact CD-OE2 3.29Å; K114-E117 WeakPolarHBondContact CD-OE2 3.27Å; K114-E117 IonicContact NZ-OE1 3.96Å; K114-E117 PolarHBondContact NZ-OE1 3.03Å; K114-E117 IonicContact NZ-OE2 2.86Å; K114-E117 PolarHBondContact NZ-OE2 3.34Å; E117-K119 PolarHBondContact O-N 3.42Å; E117-S120 PolarHBondContact O-N 2.99Å; E117-L121 WeakPolarHBondContact O-CB 3.29Å; E117-L121 PolarHBondContact O-N 2.93Å
118	L	98.3	Very high	98.1	Very high	111 Å²	111	105.8 Å²	105.8	58%	0.581	51%	0.514	S	S	*	.	H	α-helix	trans	-65.3	-38.1	-180	-176.1	65.1	0	0	0	112.3	K114 N115 D116 R122	K114-L118 VanDerWaalsContact O-CB 3.29Å; K114-L118 WeakPolarHBondContact O-CB 3.49Å; K114-L118 PolarHBondContact O-N 3.02Å; N115-L118 PolarHBondContact O-N 2.92Å; D116-L118 VanDerWaalsContact C-N 3.31Å; D116-L118 PolarHBondContact O-N 2.93Å; L118-R122 VanDerWaalsContact O-CB 3.27Å; L118-R122 WeakPolarHBondContact O-CB 3.32Å; L118-R122 PolarHBondContact O-N 2.92Å
119	K	98.2	Very high	98.1	Very high	133 Å²	133	105.7 Å²	105.7	58%	0.578	51%	0.512	S	S	*	.	H	α-helix	trans	-62.9	-44.3	173.4	-74.8	170.9	-166.3	157.3	0	111.3	N115 D116 E117 R122 Q123	N115-K119 VanDerWaalsContact O-CG 3.32Å; N115-K119 WeakPolarHBondContact O-CG 3.49Å; N115-K119 PolarHBondContact O-N 2.98Å; D116-K119 PolarHBondContact O-N 3.25Å; D116-K119 IonicContact OD1-NZ 2.7Å; D116-K119 PolarHBondContact OD1-NZ 3.28Å; E117-K119 PolarHBondContact O-N 3.42Å; K119-R122 PolarHBondContact O-N 2.92Å; K119-Q123 PolarHBondContact O-N 3.47Å
120	S	97.9	Very high	98.1	Very high	64 Å²	64	102.1 Å²	102.1	45%	0.448	51%	0.507	S	S	.	.	H	α-helix	trans	-60.3	-50.3	176.8	-166.7	0	0	0	0	111	D116 E117 R122 Q123 E124	D116-S120 PolarHBondContact O-N 3.47Å; E117-S120 PolarHBondContact O-N 2.99Å; S120-R122 VanDerWaalsContact C-N 3.3Å; S120-R122 PolarHBondContact O-N 3.44Å; S120-Q123 WeakPolarHBondContact O-CB 3.48Å; S120-Q123 PolarHBondContact O-N 3.08Å; S120-Q123 VanDerWaalsContact O-N 3.08Å; S120-E124 PolarHBondContact O-N 3.34Å
121	L	98.2	Very high	98.2	Very high	107 Å²	107	102.1 Å²	102.1	56%	0.56	51%	0.505	S	S	*	.	H	α-helix	trans	-61.1	-39.3	179.4	-174.9	63.3	0	0	0	112.1	E117 Q123 E124 Y125	E117-L121 WeakPolarHBondContact O-CB 3.29Å; E117-L121 PolarHBondContact O-N 2.93Å; L121-Q123 VanDerWaalsContact C-N 3.34Å; L121-E124 PolarHBondContact O-N 3.33Å; L121-Y125 WeakPolarHBondContact O-CB 3.35Å; L121-Y125 PolarHBondContact O-N 3Å
122	R	98.3	Very high	98.2	Very high	180 Å²	180	103 Å²	103	68%	0.679	51%	0.505	S	S	*	.	H	α-helix	trans	-63.7	-40.3	175.3	-176	176.7	-179	176.7	0.6	111.7	L118 K119 S120 Y125 L126	L118-R122 VanDerWaalsContact O-CB 3.27Å; L118-R122 WeakPolarHBondContact O-CB 3.32Å; L118-R122 PolarHBondContact O-N 2.92Å; K119-R122 PolarHBondContact O-N 2.92Å; S120-R122 VanDerWaalsContact C-N 3.3Å; S120-R122 PolarHBondContact O-N 3.44Å; R122-Y125 PolarHBondContact O-N 3.02Å; R122-L126 HydrophobicContact CG-CD1 4.45Å; R122-L126 WeakPolarHBondContact O-CG 3.4Å; R122-L126 PolarHBondContact O-N 3.48Å
123	Q	98.3	Very high	98.2	Very high	103 Å²	103	101.3 Å²	101.3	48%	0.481	50%	0.5	S	S	.	.	H	α-helix	trans	-67	-42.9	177.1	-172.4	60.6	52.5	0	0	111.5	K119 S120 L121 Y125 L126 N127	K119-Q123 PolarHBondContact O-N 3.47Å; S120-Q123 WeakPolarHBondContact O-CB 3.48Å; S120-Q123 PolarHBondContact O-N 3.08Å; S120-Q123 VanDerWaalsContact O-N 3.08Å; L121-Q123 VanDerWaalsContact C-N 3.34Å; Q123-Y125 VanDerWaalsContact C-N 3.34Å; Q123-Y125 PolarHBondContact O-N 3.38Å; Q123-L126 PolarHBondContact O-N 2.6Å; Q123-N127 PolarHBondContact NE2-OD1 3.31Å; Q123-N127 PolarHBondContact O-N 2.96Å; Q123-N127 PolarHBondContact O-OD1 3.3Å
124	E	98.1	Very high	98.2	Very high	115 Å²	115	99 Å²	99	54%	0.537	50%	0.495	S	S	.	.	H	α-helix	trans	-59.5	-44.2	174.3	-73.2	172.5	-157.8	0	0	111.7	S120 L121 N127 C128	S120-E124 PolarHBondContact O-N 3.34Å; L121-E124 PolarHBondContact O-N 3.33Å; E124-N127 PolarHBondContact O-N 2.92Å; E124-C128 WeakPolarHBondContact O-CB 3.39Å; E124-C128 PolarHBondContact O-N 3.41Å
125	Y	98.4	Very high	98.2	Very high	145 Å²	145	98.9 Å²	98.9	57%	0.569	50%	0.495	S	S	*	.	H	α-helix	trans	-59.7	-46.8	175.4	177.7	-95.7	0	0	0	112	L121 R122 Q123 N127 C128 M129	L121-Y125 WeakPolarHBondContact O-CB 3.35Å; L121-Y125 PolarHBondContact O-N 3Å; R122-Y125 PolarHBondContact O-N 3.02Å; Q123-Y125 VanDerWaalsContact C-N 3.34Å; Q123-Y125 PolarHBondContact O-N 3.38Å; Y125-N127 PolarHBondContact O-N 3.4Å; Y125-C128 PolarHBondContact O-N 2.99Å; Y125-M129 HydrophobicContact CD1-CG 4.21Å; Y125-M129 HydrophobicContact CE1-CG 3.73Å; Y125-M129 HydrophobicContact CE2-CG 4.22Å; Y125-M129 HydrophobicContact CE2-SD 4.43Å; Y125-M129 WeakPolarHBondContact O-CG 3.2Å; Y125-M129 PolarHBondContact O-N 2.95Å
126	L	98.5	Very high	98.3	Very high	87 Å²	87	99.1 Å²	99.1	46%	0.455	50%	0.495	S	S	.	.	H	α-helix	trans	-62.3	-41.5	177.7	-74.2	172.1	0	0	0	112.1	R122 Q123 M129 A130	R122-L126 HydrophobicContact CG-CD1 4.45Å; R122-L126 WeakPolarHBondContact O-CG 3.4Å; R122-L126 PolarHBondContact O-N 3.48Å; Q123-L126 PolarHBondContact O-N 2.6Å; L126-M129 PolarHBondContact O-N 2.98Å; L126-A130 WeakPolarHBondContact O-CB 3.28Å; L126-A130 PolarHBondContact O-N 3.39Å
127	N	98.3	Very high	98.3	Very high	92 Å²	92	98 Å²	98	49%	0.492	49%	0.494	S	S	.	.	H	α-helix	trans	-63.8	-43.4	176.6	-67.7	-10.4	0	0	0	111.4	Q123 E124 Y125 A130 E131	Q123-N127 PolarHBondContact NE2-OD1 3.31Å; Q123-N127 PolarHBondContact O-N 2.96Å; Q123-N127 PolarHBondContact O-OD1 3.3Å; E124-N127 PolarHBondContact O-N 2.92Å; Y125-N127 PolarHBondContact O-N 3.4Å; N127-A130 PolarHBondContact O-N 2.92Å; N127-E131 PolarHBondContact O-N 2.96Å
128	C	98.3	Very high	98.3	Very high	59 Å²	59	97 Å²	97	40%	0.399	49%	0.492	S	S	.	.	H	α-helix	trans	-61.8	-44.5	176.2	-178.2	0	0	0	0	111.6	E124 Y125 E131 K132	E124-C128 WeakPolarHBondContact O-CB 3.39Å; E124-C128 PolarHBondContact O-N 3.41Å; Y125-C128 PolarHBondContact O-N 2.99Å; C128-E131 PolarHBondContact O-N 3.36Å; C128-K132 VanDerWaalsContact O-CG 3.28Å; C128-K132 WeakPolarHBondContact O-CG 3.49Å; C128-K132 PolarHBondContact O-N 3.47Å
129	M	98.1	Very high	98.3	Very high	72 Å²	72	97.2 Å²	97.2	36%	0.355	49%	0.493	S	S	.	.	H	α-helix	trans	-60.6	-46.5	175.9	-74.4	-58.4	-59	0	0	111.6	Y125 L126 E131 K132 D133	Y125-M129 HydrophobicContact CD1-CG 4.21Å; Y125-M129 HydrophobicContact CE1-CG 3.73Å; Y125-M129 HydrophobicContact CE2-CG 4.22Å; Y125-M129 HydrophobicContact CE2-SD 4.43Å; Y125-M129 WeakPolarHBondContact O-CG 3.2Å; Y125-M129 PolarHBondContact O-N 2.95Å; L126-M129 PolarHBondContact O-N 2.98Å; M129-E131 VanDerWaalsContact C-N 3.32Å; M129-E131 PolarHBondContact O-N 2.99Å; M129-K132 PolarHBondContact O-N 3Å; M129-K132 VanDerWaalsContact O-N 3.12Å; M129-D133 PolarHBondContact O-N 3.41Å
130	A	98.3	Very high	98.3	Very high	60 Å²	60	95.9 Å²	95.9	50%	0.496	49%	0.489	S	S	.	.	H	α-helix	trans	-60.4	-39.5	177	0	0	0	0	0	112.6	L126 N127 S134	L126-A130 WeakPolarHBondContact O-CB 3.28Å; L126-A130 PolarHBondContact O-N 3.39Å; N127-A130 PolarHBondContact O-N 2.92Å; A130-S134 WeakPolarHBondContact O-CB 3.39Å; A130-S134 PolarHBondContact O-N 3.29Å
131	E	98.4	Very high	98.3	Very high	102 Å²	102	98 Å²	98	48%	0.477	49%	0.492	S	S	.	.	H	α-helix	trans	-64	-42.1	174.6	-168.9	-166.8	160.8	0	0	111.6	N127 C128 M129 S134 K135	N127-E131 PolarHBondContact O-N 2.96Å; C128-E131 PolarHBondContact O-N 3.36Å; M129-E131 VanDerWaalsContact C-N 3.32Å; M129-E131 PolarHBondContact O-N 2.99Å; E131-S134 PolarHBondContact O-N 3.47Å; E131-K135 WeakPolarHBondContact O-CG 3.34Å; E131-K135 PolarHBondContact O-N 3.12Å; E131-K135 WeakPolarHBondContact OE1-CE 3.41Å; E131-K135 IonicContact OE1-NZ 3.47Å; E131-K135 PolarHBondContact OE1-NZ 3.37Å
132	K	98.4	Very high	98.3	Very high	111 Å²	111	98.9 Å²	98.9	48%	0.483	49%	0.491	S	S	.	.	H	α-helix	trans	-65.5	-44.8	177.6	-69.2	-71.3	-179.6	175	0	111.6	C128 M129 S134 K135 I136	C128-K132 VanDerWaalsContact O-CG 3.28Å; C128-K132 WeakPolarHBondContact O-CG 3.49Å; C128-K132 PolarHBondContact O-N 3.47Å; M129-K132 PolarHBondContact O-N 3Å; M129-K132 VanDerWaalsContact O-N 3.12Å; K132-S134 VanDerWaalsContact C-N 3.32Å; K132-S134 PolarHBondContact O-N 3Å; K132-K135 PolarHBondContact O-N 2.88Å; K132-I136 WeakPolarHBondContact O-CG1 3.4Å; K132-I136 PolarHBondContact O-N 3.19Å
133	D	98.5	Very high	98.3	Very high	91 Å²	91	95.8 Å²	95.8	49%	0.487	49%	0.487	S	S	.	.	H	α-helix	trans	-61.9	-41.5	177.4	-69.6	-20.7	0	0	0	111.2	M129 I136 S137	M129-D133 PolarHBondContact O-N 3.41Å; D133-I136 PolarHBondContact O-N 3.45Å; D133-S137 PolarHBondContact O-N 3.37Å
134	S	98.1	Very high	98.3	Very high	67 Å²	67	98 Å²	98	47%	0.469	50%	0.495	S	S	.	.	H	α-helix	trans	-61.4	-44.4	173.7	-178.5	0	0	0	0	112.2	A130 E131 K132 I136 S137 I138	A130-S134 WeakPolarHBondContact O-CB 3.39Å; A130-S134 PolarHBondContact O-N 3.29Å; E131-S134 PolarHBondContact O-N 3.47Å; K132-S134 VanDerWaalsContact C-N 3.32Å; K132-S134 PolarHBondContact O-N 3Å; S134-I136 PolarHBondContact O-N 2.86Å; S134-S137 PolarHBondContact O-N 2.85Å; S134-I138 WeakPolarHBondContact O-CG1 3.39Å; S134-I138 PolarHBondContact O-N 3Å
135	K	98.4	Very high	98.3	Very high	102 Å²	102	97.6 Å²	97.6	44%	0.443	49%	0.493	S	S	.	.	H	α-helix	trans	-62.9	-41.1	175.7	-76	176.5	-175.6	170.5	0	112.3	E131 K132 I138 L139	E131-K135 WeakPolarHBondContact O-CG 3.34Å; E131-K135 PolarHBondContact O-N 3.12Å; E131-K135 WeakPolarHBondContact OE1-CE 3.41Å; E131-K135 IonicContact OE1-NZ 3.47Å; E131-K135 PolarHBondContact OE1-NZ 3.37Å; K132-K135 PolarHBondContact O-N 2.88Å; K135-I138 PolarHBondContact O-N 3.5Å; K135-L139 WeakPolarHBondContact O-CG 3.43Å; K135-L139 PolarHBondContact O-N 3.32Å
136	I	98.4	Very high	98.2	Very high	86 Å²	86	95.6 Å²	95.6	44%	0.441	49%	0.489	S	S	.	.	H	α-helix	trans	-60.7	-48.1	175.6	-71.2	166.8	0	0	0	109.6	K132 D133 S134 I138 L139 E140	K132-I136 WeakPolarHBondContact O-CG1 3.4Å; K132-I136 PolarHBondContact O-N 3.19Å; D133-I136 PolarHBondContact O-N 3.45Å; S134-I136 PolarHBondContact O-N 2.86Å; I136-I138 VanDerWaalsContact C-N 3.34Å; I136-I138 PolarHBondContact O-N 3.1Å; I136-L139 PolarHBondContact O-N 2.94Å; I136-L139 VanDerWaalsContact O-N 3.1Å; I136-E140 HydrophobicContact CG2-CG 4.28Å; I136-E140 WeakPolarHBondContact O-CG 3.34Å; I136-E140 PolarHBondContact O-N 2.99Å
137	S	98.3	Very high	98.2	Very high	69 Å²	69	94.1 Å²	94.1	48%	0.483	49%	0.49	S	S	.	.	H	α-helix	trans	-58.3	-42.7	178.5	-172.6	0	0	0	0	112.8	D133 S134 E140 Q141	D133-S137 PolarHBondContact O-N 3.37Å; S134-S137 PolarHBondContact O-N 2.85Å; S137-E140 PolarHBondContact O-N 3.35Å; S137-Q141 PolarHBondContact O-N 3.03Å
138	I	98.1	Very high	98.1	Very high	81 Å²	81	92.7 Å²	92.7	42%	0.415	49%	0.49	S	S	.	.	H	α-helix	trans	-63.3	-43.2	175.2	-67.8	165.6	0	0	0	111.3	S134 K135 I136 Q141 K142	S134-I138 WeakPolarHBondContact O-CG1 3.39Å; S134-I138 PolarHBondContact O-N 3Å; K135-I138 PolarHBondContact O-N 3.5Å; I136-I138 VanDerWaalsContact C-N 3.34Å; I136-I138 PolarHBondContact O-N 3.1Å; I138-Q141 PolarHBondContact O-N 3.42Å; I138-K142 HydrophobicContact CG2-CD 4.39Å; I138-K142 WeakPolarHBondContact O-CG 3.4Å; I138-K142 PolarHBondContact O-N 3.31Å
139	L	98.4	Very high	98.1	Very high	116 Å²	116	95 Å²	95	61%	0.607	50%	0.499	S	S	*	.	H	α-helix	trans	-66.3	-40.1	178.9	-73.1	172.2	0	0	0	111.8	K135 I136 Q141 K142 L143	K135-L139 WeakPolarHBondContact O-CG 3.43Å; K135-L139 PolarHBondContact O-N 3.32Å; I136-L139 PolarHBondContact O-N 2.94Å; I136-L139 VanDerWaalsContact O-N 3.1Å; L139-Q141 VanDerWaalsContact C-N 3.33Å; L139-Q141 PolarHBondContact O-N 3.5Å; L139-K142 PolarHBondContact O-N 3.36Å; L139-L143 WeakPolarHBondContact O-CB 3.42Å; L139-L143 PolarHBondContact O-N 2.91Å
140	E	98.3	Very high	98	Very high	105 Å²	105	97.1 Å²	97.1	49%	0.491	51%	0.506	S	S	.	.	H	α-helix	trans	-61.8	-41.2	173.9	-73.3	-178.6	164.1	0	0	111.9	I136 S137 L143 K144	I136-E140 HydrophobicContact CG2-CG 4.28Å; I136-E140 WeakPolarHBondContact O-CG 3.34Å; I136-E140 PolarHBondContact O-N 2.99Å; S137-E140 PolarHBondContact O-N 3.35Å; E140-L143 PolarHBondContact O-N 3.39Å; E140-K144 WeakPolarHBondContact O-CG 3.32Å; E140-K144 PolarHBondContact O-N 2.91Å
141	Q	98.3	Very high	98	Very high	109 Å²	109	104.1 Å²	104.1	51%	0.509	52%	0.519	S	S	.	.	H	α-helix	trans	-62.6	-49.1	175.1	-177.4	-179.3	-14.4	0	0	111.2	S137 I138 L139 L143 K144 E145	S137-Q141 PolarHBondContact O-N 3.03Å; I138-Q141 PolarHBondContact O-N 3.42Å; L139-Q141 VanDerWaalsContact C-N 3.33Å; L139-Q141 PolarHBondContact O-N 3.5Å; Q141-L143 VanDerWaalsContact C-N 3.28Å; Q141-L143 PolarHBondContact O-N 2.92Å; Q141-K144 WeakPolarHBondContact O-CB 3.33Å; Q141-K144 PolarHBondContact O-N 3.31Å; Q141-K144 VanDerWaalsContact O-N 3.12Å; Q141-E145 WeakPolarHBondContact CG-OE1 3.4Å; Q141-E145 PolarHBondContact NE2-OE1 2.93Å; Q141-E145 WeakPolarHBondContact O-CG 3.37Å; Q141-E145 PolarHBondContact O-N 3.47Å
142	K	98.3	Very high	97.9	Very high	124 Å²	124	103 Å²	103	54%	0.539	52%	0.517	S	S	.	.	H	α-helix	trans	-58.6	-40.1	177.1	-74.6	-178.8	177.2	-176	0	112.2	I138 L139 E145 Q146	I138-K142 HydrophobicContact CG2-CD 4.39Å; I138-K142 WeakPolarHBondContact O-CG 3.4Å; I138-K142 PolarHBondContact O-N 3.31Å; L139-K142 PolarHBondContact O-N 3.36Å; K142-E145 PolarHBondContact O-N 3.48Å; K142-Q146 WeakPolarHBondContact O-CB 3.46Å; K142-Q146 PolarHBondContact O-N 3.42Å
143	L	98	Very high	97.9	Very high	116 Å²	116	101.2 Å²	101.2	61%	0.607	52%	0.515	S	S	*	.	H	α-helix	trans	-63.4	-41.9	176.7	-176.6	63.4	0	0	0	111.6	L139 E140 Q141 Q146 A147	L139-L143 WeakPolarHBondContact O-CB 3.42Å; L139-L143 PolarHBondContact O-N 2.91Å; E140-L143 PolarHBondContact O-N 3.39Å; Q141-L143 VanDerWaalsContact C-N 3.28Å; Q141-L143 PolarHBondContact O-N 2.92Å; L143-Q146 PolarHBondContact O-N 2.95Å; L143-A147 WeakPolarHBondContact O-CB 3.26Å; L143-A147 PolarHBondContact O-N 3.42Å
144	K	98.1	Very high	97.8	Very high	150 Å²	150	101.6 Å²	101.6	65%	0.652	52%	0.515	S	S	*	.	H	α-helix	trans	-63.7	-45.1	175.6	-73.5	173	-177	172.3	0	112.1	E140 Q141 A147 A148	E140-K144 WeakPolarHBondContact O-CG 3.32Å; E140-K144 PolarHBondContact O-N 2.91Å; Q141-K144 WeakPolarHBondContact O-CB 3.33Å; Q141-K144 PolarHBondContact O-N 3.31Å; Q141-K144 VanDerWaalsContact O-N 3.12Å; K144-A147 PolarHBondContact O-N 2.89Å; K144-A148 PolarHBondContact O-N 2.94Å
145	E	97.7	Very high	97.7	Very high	105 Å²	105	101.1 Å²	101.1	49%	0.491	51%	0.512	S	S	.	.	H	α-helix	trans	-60.8	-45.6	176.9	-71.8	169.9	-173.6	0	0	111.2	Q141 K142 A148 L149	Q141-E145 WeakPolarHBondContact CG-OE1 3.4Å; Q141-E145 PolarHBondContact NE2-OE1 2.93Å; Q141-E145 WeakPolarHBondContact O-CG 3.37Å; Q141-E145 PolarHBondContact O-N 3.47Å; K142-E145 PolarHBondContact O-N 3.48Å; E145-A148 PolarHBondContact O-N 3.45Å; E145-L149 PolarHBondContact O-N 2.99Å
146	Q	97.9	Very high	97.6	Very high	103 Å²	103	101.8 Å²	101.8	48%	0.481	52%	0.515	S	S	.	.	H	α-helix	trans	-65.6	-40.9	178.2	-170.9	176.9	6.7	0	0	112.2	K142 L143 A148 L149 F150	K142-Q146 WeakPolarHBondContact O-CB 3.46Å; K142-Q146 PolarHBondContact O-N 3.42Å; L143-Q146 PolarHBondContact O-N 2.95Å; Q146-A148 VanDerWaalsContact C-N 3.32Å; Q146-A148 PolarHBondContact O-N 3.12Å; Q146-L149 PolarHBondContact O-N 3.03Å; Q146-F150 HydrophobicContact CG-CD2 3.8Å; Q146-F150 HydrophobicContact CG-CE2 3.49Å; Q146-F150 VanDerWaalsContact CG-CE2 3.49Å; Q146-F150 HydrophobicContact CG-CZ 4.32Å; Q146-F150 VanDerWaalsContact NE2-CE2 3.32Å; Q146-F150 VanDerWaalsContact O-CD2 3.26Å; Q146-F150 WeakPolarHBondContact O-CD2 3.46Å; Q146-F150 PolarHBondContact O-N 3.34Å
147	A	97.4	Very high	97.6	Very high	57 Å²	57	99.9 Å²	99.9	47%	0.471	51%	0.512	S	S	.	.	H	α-helix	trans	-62.7	-39.1	175.2	0	0	0	0	0	112.1	L143 K144 R151	L143-A147 WeakPolarHBondContact O-CB 3.26Å; L143-A147 PolarHBondContact O-N 3.42Å; K144-A147 PolarHBondContact O-N 2.89Å; A147-R151 WeakPolarHBondContact O-CB 3.31Å; A147-R151 PolarHBondContact O-N 2.99Å
148	A	97.3	Very high	97.5	Very high	61 Å²	61	102.4 Å²	102.4	50%	0.504	51%	0.514	S	S	.	.	H	α-helix	trans	-64.8	-43.7	175.1	0	0	0	0	0	111.7	K144 E145 Q146 R151 D152	K144-A148 PolarHBondContact O-N 2.94Å; E145-A148 PolarHBondContact O-N 3.45Å; Q146-A148 VanDerWaalsContact C-N 3.32Å; Q146-A148 PolarHBondContact O-N 3.12Å; A148-R151 PolarHBondContact O-N 3.32Å; A148-D152 PolarHBondContact O-N 3.49Å
149	L	97.5	Very high	97.4	Very high	109 Å²	109	103.3 Å²	103.3	57%	0.571	52%	0.52	S	S	*	.	H	α-helix	trans	-63.8	-44.2	177.3	-169.4	143.5	0	0	0	111.8	E145 Q146 R151 D152 V153	E145-L149 PolarHBondContact O-N 2.99Å; Q146-L149 PolarHBondContact O-N 3.03Å; L149-R151 PolarHBondContact O-N 3Å; L149-D152 PolarHBondContact O-N 3.32Å; L149-V153 HydrophobicContact CD2-CG2 4.07Å; L149-V153 VanDerWaalsContact O-CG2 3.31Å; L149-V153 WeakPolarHBondContact O-CG2 3.4Å; L149-V153 PolarHBondContact O-N 2.86Å
150	F	96.7	Very high	97.4	Very high	116 Å²	116	104.1 Å²	104.1	51%	0.509	52%	0.521	S	S	.	.	H	α-helix	trans	-62.1	-42.1	174.5	-78.9	-51.2	0	0	0	112.4	Q146 D152 V153 M154	Q146-F150 HydrophobicContact CG-CD2 3.8Å; Q146-F150 HydrophobicContact CG-CE2 3.49Å; Q146-F150 VanDerWaalsContact CG-CE2 3.49Å; Q146-F150 HydrophobicContact CG-CZ 4.32Å; Q146-F150 VanDerWaalsContact NE2-CE2 3.32Å; Q146-F150 VanDerWaalsContact O-CD2 3.26Å; Q146-F150 WeakPolarHBondContact O-CD2 3.46Å; Q146-F150 PolarHBondContact O-N 3.34Å; F150-D152 VanDerWaalsContact C-N 3.34Å; F150-D152 PolarHBondContact O-N 3.3Å; F150-V153 PolarHBondContact O-N 3.45Å; F150-M154 VanDerWaalsContact O-CB 3.3Å; F150-M154 WeakPolarHBondContact O-CB 3.17Å; F150-M154 VanDerWaalsContact O-CG 3.24Å; F150-M154 WeakPolarHBondContact O-CG 3.22Å; F150-M154 PolarHBondContact O-N 2.89Å
151	R	97.4	Very high	97.3	Very high	206 Å²	206	103.9 Å²	103.9	78%	0.777	52%	0.522	S	S	*	.	H	α-helix	trans	-59.6	-44.9	176.1	178	-179.5	-88.6	179.3	-6.7	111.3	A147 A148 L149 S155	A147-R151 WeakPolarHBondContact O-CB 3.31Å; A147-R151 PolarHBondContact O-N 2.99Å; A148-R151 PolarHBondContact O-N 3.32Å; L149-R151 PolarHBondContact O-N 3Å; R151-S155 VanDerWaalsContact O-CB 3.22Å; R151-S155 WeakPolarHBondContact O-CB 3.46Å; R151-S155 PolarHBondContact O-N 3.33Å
152	D	97.2	Very high	97.2	Very high	78 Å²	78	102.9 Å²	102.9	42%	0.417	52%	0.524	S	S	.	.	H	α-helix	trans	-64.5	-48.1	178.3	-178.3	51.5	0	0	0	112	A148 L149 F150 M154 S155 K156	A148-D152 PolarHBondContact O-N 3.49Å; L149-D152 PolarHBondContact O-N 3.32Å; F150-D152 VanDerWaalsContact C-N 3.34Å; F150-D152 PolarHBondContact O-N 3.3Å; D152-M154 PolarHBondContact O-N 3.49Å; D152-S155 PolarHBondContact O-N 2.7Å; D152-K156 WeakPolarHBondContact O-CG 3.31Å; D152-K156 PolarHBondContact O-N 2.95Å; D152-K156 VanDerWaalsContact OD1-CE 3.31Å; D152-K156 WeakPolarHBondContact OD1-CE 3.45Å; D152-K156 IonicContact OD1-NZ 2.68Å; D152-K156 PolarHBondContact OD1-NZ 2.96Å; D152-K156 WeakPolarHBondContact OD2-CE 3.34Å; D152-K156 IonicContact OD2-NZ 2.68Å; D152-K156 PolarHBondContact OD2-NZ 3.35Å
153	V	97.4	Very high	97.1	Very high	75 Å²	75	103.1 Å²	103.1	46%	0.455	53%	0.527	S	S	.	.	H	α-helix	trans	-60.4	-48.2	178.3	171.2	0	0	0	0	111.3	L149 F150 K156 A157	L149-V153 HydrophobicContact CD2-CG2 4.07Å; L149-V153 VanDerWaalsContact O-CG2 3.31Å; L149-V153 WeakPolarHBondContact O-CG2 3.4Å; L149-V153 PolarHBondContact O-N 2.86Å; F150-V153 PolarHBondContact O-N 3.45Å; V153-K156 PolarHBondContact O-N 2.97Å; V153-A157 WeakPolarHBondContact O-CB 3.39Å; V153-A157 PolarHBondContact O-N 3.35Å
154	M	95.8	Very high	97	Very high	98 Å²	98	102.1 Å²	102.1	48%	0.483	52%	0.519	S	S	.	.	H	α-helix	trans	-63.7	-42.6	178	-70.6	-60.5	-61.7	0	0	111.1	F150 D152 K156 A157 F158	F150-M154 VanDerWaalsContact O-CB 3.3Å; F150-M154 WeakPolarHBondContact O-CB 3.17Å; F150-M154 VanDerWaalsContact O-CG 3.24Å; F150-M154 WeakPolarHBondContact O-CG 3.22Å; F150-M154 PolarHBondContact O-N 2.89Å; D152-M154 PolarHBondContact O-N 3.49Å; M154-K156 VanDerWaalsContact C-N 3.34Å; M154-K156 PolarHBondContact O-N 2.91Å; M154-A157 PolarHBondContact O-N 3.47Å; M154-F158 HydrophobicContact CB-CD2 4.42Å; M154-F158 HydrophobicContact CE-CD2 4.22Å; M154-F158 HydrophobicContact CE-CE2 3.54Å; M154-F158 HydrophobicContact CE-CZ 4.19Å; M154-F158 WeakPolarHBondContact O-CB 3.24Å; M154-F158 WeakPolarHBondContact O-CD2 3.3Å; M154-F158 PolarHBondContact O-N 2.97Å
155	S	97.1	Very high	96.9	Very high	58 Å²	58	99.9 Å²	99.9	41%	0.406	51%	0.514	S	S	.	.	H	α-helix	trans	-60.6	-43.2	177.1	-170.1	0	0	0	0	111.8	R151 D152 N159	R151-S155 VanDerWaalsContact O-CB 3.22Å; R151-S155 WeakPolarHBondContact O-CB 3.46Å; R151-S155 PolarHBondContact O-N 3.33Å; D152-S155 PolarHBondContact O-N 2.7Å; S155-N159 WeakPolarHBondContact O-CB 3.4Å; S155-N159 PolarHBondContact O-N 3.47Å; S155-N159 PolarHBondContact O-ND2 2.97Å; S155-N159 PolarHBondContact O-OD1 3.44Å
156	K	96.9	Very high	96.8	Very high	116 Å²	116	97.9 Å²	97.9	50%	0.504	51%	0.511	S	S	.	.	H	α-helix	trans	-63	-47	176.1	-76.1	169.8	177.2	163.4	0	111.8	D152 V153 M154 N159 Q160	D152-K156 WeakPolarHBondContact O-CG 3.31Å; D152-K156 PolarHBondContact O-N 2.95Å; D152-K156 VanDerWaalsContact OD1-CE 3.31Å; D152-K156 WeakPolarHBondContact OD1-CE 3.45Å; D152-K156 IonicContact OD1-NZ 2.68Å; D152-K156 PolarHBondContact OD1-NZ 2.96Å; D152-K156 WeakPolarHBondContact OD2-CE 3.34Å; D152-K156 IonicContact OD2-NZ 2.68Å; D152-K156 PolarHBondContact OD2-NZ 3.35Å; V153-K156 PolarHBondContact O-N 2.97Å; M154-K156 VanDerWaalsContact C-N 3.34Å; M154-K156 PolarHBondContact O-N 2.91Å; K156-N159 PolarHBondContact O-N 3.3Å; K156-Q160 WeakPolarHBondContact O-CG 3.41Å; K156-Q160 PolarHBondContact O-N 3.49Å
157	A	96.7	Very high	96.6	Very high	46 Å²	46	96.3 Å²	96.3	38%	0.38	51%	0.506	S	S	.	.	H	α-helix	trans	-62.7	-42.7	178.5	0	0	0	0	0	112.2	V153 M154 Q160 L161	V153-A157 WeakPolarHBondContact O-CB 3.39Å; V153-A157 PolarHBondContact O-N 3.35Å; M154-A157 PolarHBondContact O-N 3.47Å; A157-Q160 PolarHBondContact O-N 2.91Å; A157-L161 WeakPolarHBondContact O-CB 3.42Å; A157-L161 PolarHBondContact O-N 3.29Å
158	F	97	Very high	96.5	Very high	121 Å²	121	97 Å²	97	53%	0.531	50%	0.501	S	S	.	.	H	α-helix	trans	-63	-43.3	175	-87.2	-63.6	0	0	0	112.1	M154 L161 T162	M154-F158 HydrophobicContact CB-CD2 4.42Å; M154-F158 HydrophobicContact CE-CD2 4.22Å; M154-F158 HydrophobicContact CE-CE2 3.54Å; M154-F158 HydrophobicContact CE-CZ 4.19Å; M154-F158 WeakPolarHBondContact O-CB 3.24Å; M154-F158 WeakPolarHBondContact O-CD2 3.3Å; M154-F158 PolarHBondContact O-N 2.97Å; F158-L161 PolarHBondContact O-N 3.25Å; F158-T162 WeakPolarHBondContact O-CB 3.3Å; F158-T162 PolarHBondContact O-N 3.48Å; F158-T162 PolarHBondContact O-OG1 3.48Å
159	N	96.8	Very high	96.2	Very high	100 Å²	100	101.6 Å²	101.6	54%	0.535	51%	0.507	S	S	.	.	H	α-helix	trans	-62.8	-45.1	177.6	-71.6	-13.6	0	0	0	111.4	S155 K156 L161 T162 E163	S155-N159 WeakPolarHBondContact O-CB 3.4Å; S155-N159 PolarHBondContact O-N 3.47Å; S155-N159 PolarHBondContact O-ND2 2.97Å; S155-N159 PolarHBondContact O-OD1 3.44Å; K156-N159 PolarHBondContact O-N 3.3Å; N159-L161 PolarHBondContact O-N 2.93Å; N159-T162 PolarHBondContact O-N 3.39Å; N159-E163 WeakPolarHBondContact O-CB 3.43Å; N159-E163 PolarHBondContact O-N 2.86Å
160	Q	96.7	Very high	95.9	Very high	134 Å²	134	101.5 Å²	101.5	63%	0.626	50%	0.503	S	S	*	.	H	α-helix	trans	-60.1	-45	176.1	-74.8	175.8	-22.5	0	0	112.3	K156 A157 T162 E163 Q164	K156-Q160 WeakPolarHBondContact O-CG 3.41Å; K156-Q160 PolarHBondContact O-N 3.49Å; A157-Q160 PolarHBondContact O-N 2.91Å; Q160-T162 VanDerWaalsContact C-N 3.33Å; Q160-T162 PolarHBondContact O-N 2.72Å; Q160-E163 PolarHBondContact O-N 3.49Å; Q160-Q164 WeakPolarHBondContact O-CB 3.35Å; Q160-Q164 PolarHBondContact O-N 2.84Å
161	L	97.3	Very high	95.7	Very high	100 Å²	100	100.3 Å²	100.3	52%	0.524	50%	0.502	S	S	.	.	H	α-helix	trans	-63	-41.8	177.3	-177.3	67.8	0	0	0	111.4	A157 F158 N159 Q164 L165	A157-L161 WeakPolarHBondContact O-CB 3.42Å; A157-L161 PolarHBondContact O-N 3.29Å; F158-L161 PolarHBondContact O-N 3.25Å; N159-L161 PolarHBondContact O-N 2.93Å; L161-Q164 PolarHBondContact O-N 3.46Å; L161-L165 HydrophobicContact CG-CD1 4.1Å; L161-L165 WeakPolarHBondContact O-CB 3.38Å; L161-L165 VanDerWaalsContact O-CG 3.3Å; L161-L165 WeakPolarHBondContact O-CG 3.39Å; L161-L165 PolarHBondContact O-N 2.92Å
162	T	95.6	Very high	95.3	Very high	87 Å²	87	95.1 Å²	95.1	53%	0.534	49%	0.493	S	S	.	.	H	α-helix	trans	-65.9	-42	179.2	-53.4	0	0	0	0	111.3	F158 N159 Q160 L165 S166	F158-T162 WeakPolarHBondContact O-CB 3.3Å; F158-T162 PolarHBondContact O-N 3.48Å; F158-T162 PolarHBondContact O-OG1 3.48Å; N159-T162 PolarHBondContact O-N 3.39Å; Q160-T162 VanDerWaalsContact C-N 3.33Å; Q160-T162 PolarHBondContact O-N 2.72Å; T162-L165 PolarHBondContact O-N 2.92Å; T162-S166 PolarHBondContact O-N 2.88Å
163	E	96.2	Very high	94.7	Very high	129 Å²	129	97 Å²	97	60%	0.603	50%	0.499	S	S	*	.	H	α-helix	trans	-64.1	-45.3	175.9	-172.7	172.7	-166.4	0	0	111.4	N159 Q160 L165 S166 I167	N159-E163 WeakPolarHBondContact O-CB 3.43Å; N159-E163 PolarHBondContact O-N 2.86Å; Q160-E163 PolarHBondContact O-N 3.49Å; E163-L165 PolarHBondContact O-N 3.42Å; E163-S166 WeakPolarHBondContact O-CB 3.41Å; E163-S166 PolarHBondContact O-N 3.45Å; E163-I167 HydrophobicContact CG-CD1 4.29Å; E163-I167 WeakPolarHBondContact O-CG1 3.38Å; E163-I167 PolarHBondContact O-N 3.22Å
164	Q	96.3	Very high	94.1	Very high	96 Å²	96	99 Å²	99	45%	0.449	51%	0.508	S	S	.	.	H	α-helix	trans	-62	-44.3	175.8	-172.9	61.6	48.4	0	0	112	Q160 L161 S166 I167 D168	Q160-Q164 WeakPolarHBondContact O-CB 3.35Å; Q160-Q164 PolarHBondContact O-N 2.84Å; L161-Q164 PolarHBondContact O-N 3.46Å; Q164-S166 VanDerWaalsContact C-N 3.27Å; Q164-S166 PolarHBondContact O-N 3.38Å; Q164-I167 PolarHBondContact O-N 2.97Å; Q164-D168 PolarHBondContact NE2-OD1 2.92Å; Q164-D168 WeakPolarHBondContact O-CB 3.38Å; Q164-D168 PolarHBondContact O-N 3.18Å
165	L	95.9	Very high	93.3	Very high	103 Å²	103	99 Å²	99	54%	0.539	52%	0.517	S	S	.	.	H	α-helix	trans	-60.7	-37.3	175.1	-78.5	167.2	0	0	0	112.1	L161 T162 E163 Y169	L161-L165 HydrophobicContact CG-CD1 4.1Å; L161-L165 WeakPolarHBondContact O-CB 3.38Å; L161-L165 VanDerWaalsContact O-CG 3.3Å; L161-L165 WeakPolarHBondContact O-CG 3.39Å; L161-L165 PolarHBondContact O-N 2.92Å; T162-L165 PolarHBondContact O-N 2.92Å; E163-L165 PolarHBondContact O-N 3.42Å; L165-Y169 VanDerWaalsContact O-CB 3.27Å; L165-Y169 WeakPolarHBondContact O-CB 3.31Å; L165-Y169 PolarHBondContact O-N 2.94Å
166	S	95	Very high	92.2	Very high	63 Å²	63	104.1 Å²	104.1	44%	0.441	53%	0.529	S	S	.	.	H	α-helix	trans	-63.9	-46.2	175	-165.8	0	0	0	0	111.3	T162 E163 Q164 Y169 E170	T162-S166 PolarHBondContact O-N 2.88Å; E163-S166 WeakPolarHBondContact O-CB 3.41Å; E163-S166 PolarHBondContact O-N 3.45Å; Q164-S166 VanDerWaalsContact C-N 3.27Å; Q164-S166 PolarHBondContact O-N 3.38Å; S166-Y169 PolarHBondContact O-N 3.4Å; S166-E170 WeakPolarHBondContact O-CG 3.49Å; S166-E170 PolarHBondContact O-N 3.26Å
167	I	95	Very high	90.7	Very high	70 Å²	70	104.8 Å²	104.8	36%	0.359	53%	0.531	S	S	.	.	H	α-helix	trans	-62.8	-46	177.1	-68	164.4	0	0	0	110.8	E163 Q164 Y169 E170 N171	E163-I167 HydrophobicContact CG-CD1 4.29Å; E163-I167 WeakPolarHBondContact O-CG1 3.38Å; E163-I167 PolarHBondContact O-N 3.22Å; Q164-I167 PolarHBondContact O-N 2.97Å; I167-Y169 VanDerWaalsContact C-N 3.31Å; I167-Y169 PolarHBondContact O-N 2.97Å; I167-E170 PolarHBondContact O-N 2.77Å; I167-N171 WeakPolarHBondContact CG2-ND2 3.42Å; I167-N171 WeakPolarHBondContact O-CB 3.2Å; I167-N171 VanDerWaalsContact O-CG 3.27Å; I167-N171 PolarHBondContact O-N 3.48Å; I167-N171 PolarHBondContact O-ND2 3.34Å
168	D	94.1	Very high	89.4	Confident	71 Å²	71	108.5 Å²	108.5	38%	0.38	54%	0.543	S	S	.	.	H	α-helix	trans	-62.3	-41.7	179	-69.4	-14.5	0	0	0	110.9	Q164 N171 V172	Q164-D168 PolarHBondContact NE2-OD1 2.92Å; Q164-D168 WeakPolarHBondContact O-CB 3.38Å; Q164-D168 PolarHBondContact O-N 3.18Å; D168-N171 PolarHBondContact O-N 3.45Å; D168-V172 VanDerWaalsContact O-CG2 3.31Å; D168-V172 WeakPolarHBondContact O-CG2 3.26Å; D168-V172 PolarHBondContact O-N 3.38Å
169	Y	92.4	Very high	88.1	Confident	158 Å²	158	107.1 Å²	107.1	62%	0.62	54%	0.537	S	S	*	.	H	α-helix	trans	-60.1	-48.3	174	175.2	-93.3	0	0	0	111.8	L165 S166 I167 N171 V172 H173	L165-Y169 VanDerWaalsContact O-CB 3.27Å; L165-Y169 WeakPolarHBondContact O-CB 3.31Å; L165-Y169 PolarHBondContact O-N 2.94Å; S166-Y169 PolarHBondContact O-N 3.4Å; I167-Y169 VanDerWaalsContact C-N 3.31Å; I167-Y169 PolarHBondContact O-N 2.97Å; Y169-N171 PolarHBondContact O-N 3.14Å; Y169-V172 PolarHBondContact O-N 3.27Å; Y169-H173 VanDerWaalsContact O-CB 3.22Å; Y169-H173 WeakPolarHBondContact O-CB 3.48Å; Y169-H173 PolarHBondContact O-N 2.95Å
170	E	91.3	Very high	87	Confident	107 Å²	107	105.4 Å²	105.4	50%	0.5	53%	0.533	S	S	.	.	H	α-helix	trans	-61.8	-41.9	177.3	-75.4	-178.5	-176.9	0	0	112.1	S166 I167 H173 N174	S166-E170 WeakPolarHBondContact O-CG 3.49Å; S166-E170 PolarHBondContact O-N 3.26Å; I167-E170 PolarHBondContact O-N 2.77Å; E170-H173 PolarHBondContact O-N 2.99Å; E170-N174 VanDerWaalsContact O-CB 3.26Å; E170-N174 WeakPolarHBondContact O-CB 3.27Å; E170-N174 PolarHBondContact O-N 3.39Å; E170-N174 PolarHBondContact O-ND2 2.88Å; E170-N174 VanDerWaalsContact O-ND2 3.14Å
171	N	90.8	Very high	86	Confident	90 Å²	90	103.5 Å²	103.5	48%	0.481	52%	0.524	S	S	.	.	H	α-helix	trans	-63	-45.2	177.7	-75.4	-29.3	0	0	0	112.1	I167 D168 Y169 S175	I167-N171 WeakPolarHBondContact CG2-ND2 3.42Å; I167-N171 WeakPolarHBondContact O-CB 3.2Å; I167-N171 VanDerWaalsContact O-CG 3.27Å; I167-N171 PolarHBondContact O-N 3.48Å; I167-N171 PolarHBondContact O-ND2 3.34Å; D168-N171 PolarHBondContact O-N 3.45Å; Y169-N171 PolarHBondContact O-N 3.14Å; N171-S175 WeakPolarHBondContact O-CB 3.12Å; N171-S175 PolarHBondContact O-N 2.84Å; N171-S175 PolarHBondContact O-OG 3.25Å
172	V	88.8	Confident	84.9	Confident	97 Å²	97	103 Å²	103	59%	0.588	53%	0.527	S	S	*	.	H	α-helix	trans	-63.1	-49.2	174.6	171.5	0	0	0	0	109.5	D168 Y169 N174 S175 Y176	D168-V172 VanDerWaalsContact O-CG2 3.31Å; D168-V172 WeakPolarHBondContact O-CG2 3.26Å; D168-V172 PolarHBondContact O-N 3.38Å; Y169-V172 PolarHBondContact O-N 3.27Å; V172-N174 VanDerWaalsContact C-N 3.34Å; V172-N174 PolarHBondContact O-N 2.98Å; V172-S175 PolarHBondContact O-N 2.84Å; V172-Y176 WeakPolarHBondContact O-CB 3.22Å; V172-Y176 PolarHBondContact O-N 3.38Å
173	H	85.6	Confident	84	Confident	118 Å²	118	101.5 Å²	101.5	55%	0.546	52%	0.518	S	S	.	.	H	α-helix	trans	-58.5	-44.2	-178.8	-172.3	70.5	0	0	0	112.4	Y169 E170	Y169-H173 VanDerWaalsContact O-CB 3.22Å; Y169-H173 WeakPolarHBondContact O-CB 3.48Å; Y169-H173 PolarHBondContact O-N 2.95Å; E170-H173 PolarHBondContact O-N 2.99Å
174	N	84.3	Confident	83	Confident	118 Å²	118	97.6 Å²	97.6	63%	0.631	50%	0.501	S	S	*	.	H	α-helix	trans	-73.8	-31.2	-180	-68.9	-26.9	0	0	0	113.1	E170 V172	E170-N174 VanDerWaalsContact O-CB 3.26Å; E170-N174 WeakPolarHBondContact O-CB 3.27Å; E170-N174 PolarHBondContact O-N 3.39Å; E170-N174 PolarHBondContact O-ND2 2.88Å; E170-N174 VanDerWaalsContact O-ND2 3.14Å; V172-N174 VanDerWaalsContact C-N 3.34Å; V172-N174 PolarHBondContact O-N 2.98Å
175	S	79.8	Confident	82	Confident	97 Å²	97	96.2 Å²	96.2	68%	0.678	50%	0.497	S	S	*	.	H	α-helix	trans	-87	-15.5	179	-54	0	0	0	0	112.9	N171 V172 K177	N171-S175 WeakPolarHBondContact O-CB 3.12Å; N171-S175 PolarHBondContact O-N 2.84Å; N171-S175 PolarHBondContact O-OG 3.25Å; V172-S175 PolarHBondContact O-N 2.84Å; S175-K177 VanDerWaalsContact C-N 3.35Å; S175-K177 PolarHBondContact O-N 2.82Å
176	Y	72.8	Confident	81	Confident	166 Å²	166	96 Å²	96	65%	0.651	50%	0.496	S	S	*	.			trans	-77	85.5	-179.8	-166.9	-100.4	0	0	0	110.4	V172 I178	V172-Y176 WeakPolarHBondContact O-CB 3.22Å; V172-Y176 PolarHBondContact O-N 3.38Å; Y176-I178 HydrophobicContact CD1-CG1 4.06Å; Y176-I178 HydrophobicContact CE1-CG1 3.65Å
177	K	66.9	Low	79.9	Confident	130 Å²	130	95.4 Å²	95.4	57%	0.565	49%	0.487	S	S	*	.			trans	-83.1	116	160.8	-67.6	-172.1	173.7	-176	0	108.3	S175 F179	S175-K177 VanDerWaalsContact C-N 3.35Å; S175-K177 PolarHBondContact O-N 2.82Å; K177-F179 WeakPolarHBondContact CB-O 3.42Å; K177-F179 PolarHBondContact O-N 2.75Å
178	I	68.5	Low	78.8	Confident	123 Å²	123	97.8 Å²	97.8	63%	0.631	50%	0.497	S	S	*	.	S	Bend	trans	-56.3	-32.2	174.9	-64.7	168.6	0	0	0	110.8	Y176	Y176-I178 HydrophobicContact CD1-CG1 4.06Å; Y176-I178 HydrophobicContact CE1-CG1 3.65Å
179	F	69.4	Low	77.4	Confident	93 Å²	93	99.4 Å²	99.4	41%	0.408	51%	0.505	S	S	.	.	S	Bend	trans	-121.5	138.4	-175.7	-61.5	-59.3	0	0	0	110	K177 T183 N184 I187	K177-F179 WeakPolarHBondContact CB-O 3.42Å; K177-F179 PolarHBondContact O-N 2.75Å; F179-T183 HydrophobicContact CB-CG2 3.91Å; F179-T183 HydrophobicContact CD1-CG2 3.65Å; F179-T183 HydrophobicContact CG-CG2 4.05Å; F179-N184 VanDerWaalsContact CB-OD1 3.25Å; F179-N184 WeakPolarHBondContact CB-OD1 3.39Å; F179-I187 HydrophobicContact CD1-CD1 4.13Å; F179-I187 HydrophobicContact CD2-CD1 3.89Å; F179-I187 HydrophobicContact CE1-CD1 4.29Å; F179-I187 HydrophobicContact CE2-CD1 4.07Å; F179-I187 HydrophobicContact CG-CD1 3.93Å; F179-I187 HydrophobicContact CZ-CD1 4.26Å
180	S	73.8	Confident	76.1	Confident	63 Å²	63	97.2 Å²	97.2	44%	0.441	50%	0.5	S	S	.	.			trans	-60.8	155.1	171.2	77	0	0	0	0	109.8	P182 T183 N184	S180-P182 VanDerWaalsContact C-N 3.29Å; S180-P182 WeakPolarHBondContact OG-CD 3.37Å; S180-T183 CarbonylContact O-C 3.59Å; S180-T183 WeakPolarHBondContact O-CA 3.3Å; S180-T183 WeakPolarHBondContact O-CB 3.47Å; S180-T183 PolarHBondContact O-N 2.87Å; S180-T183 PolarHBondContact OG-N 3.19Å; S180-T183 PolarHBondContact OG-OG1 2.85Å; S180-N184 PolarHBondContact O-N 3.38Å
181	Q	75.2	Confident	74.8	Confident	94 Å²	94	100.4 Å²	100.4	44%	0.439	51%	0.513	S	S	.	.	H	α-helix	trans	-52.8	-44.4	176.8	-166.9	67.3	34.9	0	0	112	T183 N184 D185	Q181-T183 VanDerWaalsContact C-N 3.3Å; Q181-T183 PolarHBondContact O-N 3.15Å; Q181-N184 WeakPolarHBondContact O-CB 3.4Å; Q181-N184 PolarHBondContact O-N 3.07Å; Q181-N184 VanDerWaalsContact O-N 3.15Å; Q181-D185 PolarHBondContact NE2-OD1 3.31Å; Q181-D185 VanDerWaalsContact NE2-OD1 3.07Å; Q181-D185 PolarHBondContact O-N 3.2Å
182	P	76.1	Confident	73.4	Confident	91 Å²	91	102.6 Å²	102.6	59%	0.591	52%	0.524	S	S	*	.	H	α-helix	trans	-58.9	-36	171.9	-24.3	32.9	0	0	0	114.4	S180 L186	S180-P182 VanDerWaalsContact C-N 3.29Å; S180-P182 WeakPolarHBondContact OG-CD 3.37Å; P182-L186 VanDerWaalsContact O-CB 3.3Å; P182-L186 WeakPolarHBondContact O-CB 3.25Å; P182-L186 PolarHBondContact O-N 2.89Å
183	T	76.2	Confident	72.1	Confident	55 Å²	55	103.7 Å²	103.7	34%	0.337	53%	0.526	S	S	.	.	H	α-helix	trans	-70	-39.8	176.2	-50.8	0	0	0	0	111.2	F179 S180 Q181 L186 I187	F179-T183 HydrophobicContact CB-CG2 3.91Å; F179-T183 HydrophobicContact CD1-CG2 3.65Å; F179-T183 HydrophobicContact CG-CG2 4.05Å; S180-T183 CarbonylContact O-C 3.59Å; S180-T183 WeakPolarHBondContact O-CA 3.3Å; S180-T183 WeakPolarHBondContact O-CB 3.47Å; S180-T183 PolarHBondContact O-N 2.87Å; S180-T183 PolarHBondContact OG-N 3.19Å; S180-T183 PolarHBondContact OG-OG1 2.85Å; Q181-T183 VanDerWaalsContact C-N 3.3Å; Q181-T183 PolarHBondContact O-N 3.15Å; T183-L186 PolarHBondContact O-N 2.85Å; T183-I187 HydrophobicContact CG2-CD1 4Å; T183-I187 HydrophobicContact CG2-CG1 4.49Å; T183-I187 WeakPolarHBondContact O-CB 3.49Å; T183-I187 WeakPolarHBondContact O-CD1 3.42Å; T183-I187 WeakPolarHBondContact O-CG1 3.42Å; T183-I187 PolarHBondContact O-N 2.83Å
184	N	73.9	Confident	71	Confident	47 Å²	47	99.3 Å²	99.3	25%	0.251	51%	0.508	S	S	.	.	H	α-helix	trans	-62.3	-46.1	171.9	-87.7	-6.7	0	0	0	111.2	F179 S180 Q181 L186 I187 E188	F179-N184 VanDerWaalsContact CB-OD1 3.25Å; F179-N184 WeakPolarHBondContact CB-OD1 3.39Å; S180-N184 PolarHBondContact O-N 3.38Å; Q181-N184 WeakPolarHBondContact O-CB 3.4Å; Q181-N184 PolarHBondContact O-N 3.07Å; Q181-N184 VanDerWaalsContact O-N 3.15Å; N184-L186 VanDerWaalsContact C-N 3.29Å; N184-L186 PolarHBondContact O-N 2.85Å; N184-I187 PolarHBondContact O-N 2.78Å; N184-E188 WeakPolarHBondContact O-CB 3.18Å; N184-E188 WeakPolarHBondContact O-CG 3.42Å; N184-E188 PolarHBondContact O-N 3.41Å
185	D	77.1	Confident	69.9	Low	66 Å²	66	99.1 Å²	99.1	35%	0.353	51%	0.514	S	S	.	.	H	α-helix	trans	-63.1	-37.8	178.3	-57.4	-15.1	0	0	0	110.6	Q181 E188 L189	Q181-D185 PolarHBondContact NE2-OD1 3.31Å; Q181-D185 VanDerWaalsContact NE2-OD1 3.07Å; Q181-D185 PolarHBondContact O-N 3.2Å; D185-E188 PolarHBondContact O-N 3.3Å; D185-L189 VanDerWaalsContact O-CB 3.28Å; D185-L189 WeakPolarHBondContact O-CB 3.25Å; D185-L189 WeakPolarHBondContact O-CD1 3.29Å; D185-L189 WeakPolarHBondContact O-CG 3.44Å; D185-L189 PolarHBondContact O-N 3.24Å
186	L	75	Confident	69.1	Low	100 Å²	100	102.1 Å²	102.1	52%	0.524	52%	0.515	S	S	.	.	H	α-helix	trans	-68.2	-41.6	174.9	-157.8	87.3	0	0	0	112	P182 T183 N184 L189 E190	P182-L186 VanDerWaalsContact O-CB 3.3Å; P182-L186 WeakPolarHBondContact O-CB 3.25Å; P182-L186 PolarHBondContact O-N 2.89Å; T183-L186 PolarHBondContact O-N 2.85Å; N184-L186 VanDerWaalsContact C-N 3.29Å; N184-L186 PolarHBondContact O-N 2.85Å; L186-L189 CarbonylContact O-C 3.55Å; L186-L189 PolarHBondContact O-N 3.28Å; L186-E190 WeakPolarHBondContact O-CB 3.28Å; L186-E190 WeakPolarHBondContact O-CG 3.45Å; L186-E190 PolarHBondContact O-N 3.42Å
187	I	71.3	Confident	68.2	Low	50 Å²	50	98.4 Å²	98.4	26%	0.256	51%	0.505	S	S	.	.	H	α-helix	trans	-62.1	-47.1	174.1	-70.9	165.2	0	0	0	109.2	F179 T183 N184 L189 E190 F191	F179-I187 HydrophobicContact CD1-CD1 4.13Å; F179-I187 HydrophobicContact CD2-CD1 3.89Å; F179-I187 HydrophobicContact CE1-CD1 4.29Å; F179-I187 HydrophobicContact CE2-CD1 4.07Å; F179-I187 HydrophobicContact CG-CD1 3.93Å; F179-I187 HydrophobicContact CZ-CD1 4.26Å; T183-I187 HydrophobicContact CG2-CD1 4Å; T183-I187 HydrophobicContact CG2-CG1 4.49Å; T183-I187 WeakPolarHBondContact O-CB 3.49Å; T183-I187 WeakPolarHBondContact O-CD1 3.42Å; T183-I187 WeakPolarHBondContact O-CG1 3.42Å; T183-I187 PolarHBondContact O-N 2.83Å; N184-I187 PolarHBondContact O-N 2.78Å; I187-L189 VanDerWaalsContact C-N 3.31Å; I187-L189 PolarHBondContact O-N 2.89Å; I187-E190 PolarHBondContact O-N 2.9Å; I187-F191 HydrophobicContact CG2-CD2 3.75Å; I187-F191 HydrophobicContact CG2-CE2 3.88Å; I187-F191 WeakPolarHBondContact O-CB 3.44Å; I187-F191 VanDerWaalsContact O-CD2 3.29Å; I187-F191 WeakPolarHBondContact O-CD2 3.45Å; I187-F191 PolarHBondContact O-N 3.38Å
188	E	71.5	Confident	67.8	Low	119 Å²	119	96.8 Å²	96.8	56%	0.556	50%	0.503	S	S	*	.	H	α-helix	trans	-60	-40.2	175.4	-74.8	-176.9	-169.3	0	0	111.7	N184 D185 F191 L192	N184-E188 WeakPolarHBondContact O-CB 3.18Å; N184-E188 WeakPolarHBondContact O-CG 3.42Å; N184-E188 PolarHBondContact O-N 3.41Å; D185-E188 PolarHBondContact O-N 3.3Å; E188-F191 PolarHBondContact O-N 3.49Å; E188-L192 WeakPolarHBondContact O-CB 3.46Å; E188-L192 WeakPolarHBondContact O-CD1 3.34Å; E188-L192 WeakPolarHBondContact O-CG 3.35Å; E188-L192 PolarHBondContact O-N 2.81Å
189	L	65.6	Low	67.2	Low	106 Å²	106	99.9 Å²	99.9	56%	0.555	52%	0.515	S	S	*	.	H	α-helix	trans	-66.6	-41.5	174.4	-88.7	156.5	0	0	0	113	D185 L186 I187 F191 L192 N193	D185-L189 VanDerWaalsContact O-CB 3.28Å; D185-L189 WeakPolarHBondContact O-CB 3.25Å; D185-L189 WeakPolarHBondContact O-CD1 3.29Å; D185-L189 WeakPolarHBondContact O-CG 3.44Å; D185-L189 PolarHBondContact O-N 3.24Å; L186-L189 CarbonylContact O-C 3.55Å; L186-L189 PolarHBondContact O-N 3.28Å; I187-L189 VanDerWaalsContact C-N 3.31Å; I187-L189 PolarHBondContact O-N 2.89Å; L189-F191 VanDerWaalsContact C-N 3.29Å; L189-F191 PolarHBondContact O-N 2.78Å; L189-L192 PolarHBondContact O-N 3.5Å; L189-N193 PolarHBondContact O-N 3.28Å
190	E	63.8	Low	66.6	Low	112 Å²	112	103 Å²	103	52%	0.523	53%	0.531	S	S	.	.	H	α-helix	trans	-67.1	-31.5	174.7	-79.1	-177.9	177.1	0	0	111.7	L186 I187 N193 P194	L186-E190 WeakPolarHBondContact O-CB 3.28Å; L186-E190 WeakPolarHBondContact O-CG 3.45Å; L186-E190 PolarHBondContact O-N 3.42Å; I187-E190 PolarHBondContact O-N 2.9Å; E190-N193 CarbonylContact O-C 3.6Å; E190-P194 VanDerWaalsContact O-CA 3.25Å; E190-P194 WeakPolarHBondContact O-CA 3.47Å; E190-P194 VanDerWaalsContact O-N 3.16Å
191	F	63.9	Low	65.9	Low	174 Å²	174	102 Å²	102	76%	0.763	52%	0.524	S	S	*	.	H	α-helix	trans	-73.4	-34.3	172.1	-93.3	-78.6	0	0	0	112.7	I187 E188 L189	I187-F191 HydrophobicContact CG2-CD2 3.75Å; I187-F191 HydrophobicContact CG2-CE2 3.88Å; I187-F191 WeakPolarHBondContact O-CB 3.44Å; I187-F191 VanDerWaalsContact O-CD2 3.29Å; I187-F191 WeakPolarHBondContact O-CD2 3.45Å; I187-F191 PolarHBondContact O-N 3.38Å; E188-F191 PolarHBondContact O-N 3.49Å; L189-F191 VanDerWaalsContact C-N 3.29Å; L189-F191 PolarHBondContact O-N 2.78Å
192	L	61.6	Low	64.9	Low	136 Å²	136	102.6 Å²	102.6	71%	0.712	53%	0.533	S	S	*	.	H	α-helix	trans	-83	-25.7	178.9	-79.6	161	0	0	0	113.4	E188 L189	E188-L192 WeakPolarHBondContact O-CB 3.46Å; E188-L192 WeakPolarHBondContact O-CD1 3.34Å; E188-L192 WeakPolarHBondContact O-CG 3.35Å; E188-L192 PolarHBondContact O-N 2.81Å; L189-L192 PolarHBondContact O-N 3.5Å
193	N	62.6	Low	63.9	Low	120 Å²	120	106 Å²	106	64%	0.642	54%	0.542	S	S	*	.	S	Bend	trans	-140.6	72	178.8	-111.5	-1.7	0	0	0	109.5	L189 E190	L189-N193 PolarHBondContact O-N 3.28Å; E190-N193 CarbonylContact O-C 3.6Å
194	P	62.2	Low	62.8	Low	26 Å²	26	113.4 Å²	113.4	17%	0.169	57%	0.565	C	S	.	*			trans	-55.1	134.9	175.2	13.1	-24.4	0	0	0	110.2	E190 F196 L197	E190-P194 VanDerWaalsContact O-CA 3.25Å; E190-P194 WeakPolarHBondContact O-CA 3.47Å; E190-P194 VanDerWaalsContact O-N 3.16Å; P194-F196 HydrophobicContact CB-CD1 4.26Å; P194-F196 HydrophobicContact CB-CD2 3.6Å; P194-F196 HydrophobicContact CB-CE1 3.87Å; P194-F196 HydrophobicContact CB-CE2 3.16Å; P194-F196 HydrophobicContact CB-CG 4.13Å; P194-F196 HydrophobicContact CB-CZ 3.3Å; P194-F196 HydrophobicContact CG-CD2 4.33Å; P194-F196 HydrophobicContact CG-CE2 3.97Å; P194-F196 HydrophobicContact CG-CZ 4.48Å; P194-F196 PolarHBondContact O-N 2.81Å; P194-L197 HydrophobicContact CG-CD1 3.65Å; P194-L197 HydrophobicContact CG-CG 3.99Å; P194-L197 PolarHBondContact O-N 2.93Å
195	P	61.6	Low	61.4	Low	114 Å²	114	122.2 Å²	122.2	74%	0.74	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	4.7	-175.5	25	-33.7	0	0	0	114.5
196	F	62.1	Low	60.7	Low	160 Å²	160	125 Å²	125	70%	0.702	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.4	5.9	175.6	29.3	-85.5	0	0	0	112.7	P194 D198 S201	P194-F196 HydrophobicContact CB-CD1 4.26Å; P194-F196 HydrophobicContact CB-CD2 3.6Å; P194-F196 HydrophobicContact CB-CE1 3.87Å; P194-F196 HydrophobicContact CB-CE2 3.16Å; P194-F196 HydrophobicContact CB-CG 4.13Å; P194-F196 HydrophobicContact CB-CZ 3.3Å; P194-F196 HydrophobicContact CG-CD2 4.33Å; P194-F196 HydrophobicContact CG-CE2 3.97Å; P194-F196 HydrophobicContact CG-CZ 4.48Å; P194-F196 PolarHBondContact O-N 2.81Å; F196-D198 PolarHBondContact O-N 3.11Å; F196-S201 PolarHBondContact O-OG 2.57Å
197	L	54.5	Low	59.9	Low	87 Å²	87	126.3 Å²	126.3	46%	0.455	63%	0.628	S	S	.	*			trans	-88.7	78.6	163.9	-73	170.5	0	0	0	109.6	P194 S201	P194-L197 HydrophobicContact CG-CD1 3.65Å; P194-L197 HydrophobicContact CG-CG 3.99Å; P194-L197 PolarHBondContact O-N 2.93Å; L197-S201 VanDerWaalsContact CA-OG 3.25Å; L197-S201 WeakPolarHBondContact CA-OG 3.39Å
198	D	58.3	Low	59.3	Low	97 Å²	97	130.6 Å²	130.6	52%	0.519	65%	0.648	S	S	.	*			trans	-66.3	156.9	161.5	40.1	18.5	0	0	0	110.6	F196 E200 S201	F196-D198 PolarHBondContact O-N 3.11Å; D198-E200 PolarHBondContact O-N 2.9Å; D198-S201 PolarHBondContact N-OG 3.38Å; D198-S201 VanDerWaalsContact N-OG 3.11Å; D198-S201 PolarHBondContact O-N 3.47Å; D198-S201 PolarHBondContact O-OG 2.87Å; D198-S201 WeakPolarHBondContact OD1-CB 3.25Å; D198-S201 PolarHBondContact OD1-OG 3.42Å
199	E	56.5	Low	58.6	Low	188 Å²	188	131.2 Å²	131.2	88%	0.879	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.8	-18.9	-179.1	-76.7	179.8	159.4	0	0	113.2
200	E	57	Low	58.1	Low	157 Å²	157	132.8 Å²	132.8	73%	0.734	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-22.8	174.5	-68.6	-173.7	167.3	0	0	114.2	D198 V202	D198-E200 PolarHBondContact O-N 2.9Å; E200-V202 VanDerWaalsContact C-N 3.3Å; E200-V202 PolarHBondContact O-N 2.86Å
201	S	57.1	Low	57.7	Low	42 Å²	42	134.2 Å²	134.2	29%	0.294	67%	0.669	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.8	1.6	179.5	37.9	0	0	0	0	114.1	F196 L197 D198	F196-S201 PolarHBondContact O-OG 2.57Å; L197-S201 VanDerWaalsContact CA-OG 3.25Å; L197-S201 WeakPolarHBondContact CA-OG 3.39Å; D198-S201 PolarHBondContact N-OG 3.38Å; D198-S201 VanDerWaalsContact N-OG 3.11Å; D198-S201 PolarHBondContact O-N 3.47Å; D198-S201 PolarHBondContact O-OG 2.87Å; D198-S201 WeakPolarHBondContact OD1-CB 3.25Å; D198-S201 PolarHBondContact OD1-OG 3.42Å
202	V	54.8	Low	57.3	Low	107 Å²	107	131.4 Å²	131.4	65%	0.648	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-9.2	170	-174.6	0	0	0	0	112.2	E200 Y204	E200-V202 VanDerWaalsContact C-N 3.3Å; E200-V202 PolarHBondContact O-N 2.86Å; V202-Y204 VanDerWaalsContact C-N 3.29Å; V202-Y204 PolarHBondContact O-N 3.36Å
203	E	55.9	Low	57	Low	164 Å²	164	131 Å²	131	77%	0.766	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	4.4	178.2	-93.2	-173.5	166.3	0	0	115
204	Y	52.4	Low	56.5	Low	209 Å²	209	131.9 Å²	131.9	82%	0.82	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133	49.7	-178	-81	-81.7	0	0	0	114.2	V202	V202-Y204 VanDerWaalsContact C-N 3.29Å; V202-Y204 PolarHBondContact O-N 3.36Å
205	I	45.8	Very low	56	Low	232 Å²	232	141.5 Å²	141.5	100%	1.19	70%	0.704	S	S	*	*			trans	-144.9	0	154.6	-57.3	-176.5	0	0	0	108.4

Retrieved 205 of 205 residues in 35.2 ms (Link to these results)

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