A0A3B3V5D5_9TELE Loading...

Charged multivesicular body protein 2Ba

AlphaFold DB , UniProt , Accession A0A3B3V5D5, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 216 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.7	Very low	61.5	Low	241 Å²	241	139.5 Å²	139.5	100%	1.187	72%	0.723	S	S	*	*				0	62.4	0	-74.5	-81.6	-110.1	0	0	110.2
2	A	47.7	Very low	63.4	Low	103 Å²	103	133.8 Å²	133.8	85%	0.851	69%	0.694	S	S	*	*			trans	-143.9	82.6	-176.8	0	0	0	0	0	110.4
3	S	46.7	Very low	65	Low	88 Å²	88	127.7 Å²	127.7	62%	0.615	67%	0.666	S	S	*	*			trans	-172.4	43.6	159	-172	0	0	0	0	112.2
4	L	56	Low	66.4	Low	159 Å²	159	118.8 Å²	118.8	83%	0.832	62%	0.62	S	S	*	*	S	Bend	trans	-94.8	-0.3	173	-92.5	101.1	0	0	0	114.3
5	F	60.7	Low	67.7	Low	204 Å²	204	119.3 Å²	119.3	90%	0.895	62%	0.615	S	S	*	*			trans	-130.9	44.9	-177.3	-74.8	-81.7	0	0	0	113.6	K7	F5-K7 PolarHBondContact O-N 3.38Å
6	K	61.4	Low	69.1	Low	180 Å²	180	117.5 Å²	117.5	78%	0.783	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-75.2	119	160.9	-105.5	177	176.9	177.8	0	107.7	K8	K6-K8 PolarHBondContact O-N 3.39Å
7	K	62.3	Low	70.2	Confident	200 Å²	200	115.4 Å²	115.4	87%	0.87	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-51.4	125.6	169.9	-75.1	-177.8	176.4	-180	0	107.8	F5 T9	F5-K7 PolarHBondContact O-N 3.38Å; K7-T9 PolarHBondContact O-N 3.44Å; K7-T9 VanDerWaalsContact O-N 3.17Å
8	K	66.6	Low	71.2	Confident	126 Å²	126	110.4 Å²	110.4	55%	0.548	57%	0.567	S	S	.	*	P	Polyproline II helix	trans	-50.1	124.6	178.4	-83.5	177.9	177.1	172.3	0	108.6	K6 D12 V13 E16	K6-K8 PolarHBondContact O-N 3.39Å; K8-D12 HydrophobicContact CB-CB 4.35Å; K8-D12 HydrophobicContact CG-CB 4.4Å; K8-V13 HydrophobicContact CB-CG2 3.99Å; K8-V13 HydrophobicContact CD-CG2 4.39Å; K8-E16 VanDerWaalsContact CE-OE2 3.24Å; K8-E16 WeakPolarHBondContact CE-OE2 3.49Å; K8-E16 IonicContact NZ-OE1 2.78Å; K8-E16 PolarHBondContact NZ-OE1 3.01Å; K8-E16 IonicContact NZ-OE2 2.73Å; K8-E16 PolarHBondContact NZ-OE2 3.22Å
9	T	79.8	Confident	72.3	Confident	74 Å²	74	113.2 Å²	113.2	45%	0.454	58%	0.575	S	S	.	*	P	Polyproline II helix	trans	-71.8	158.6	171.1	65	0	0	0	0	108.9	K7 D11 D12 V13	K7-T9 PolarHBondContact O-N 3.44Å; K7-T9 VanDerWaalsContact O-N 3.17Å; T9-D11 PolarHBondContact O-N 3.22Å; T9-D12 WeakPolarHBondContact CB-OD2 3.47Å; T9-D12 PolarHBondContact N-OD2 3.23Å; T9-D12 VanDerWaalsContact N-OD2 3.09Å; T9-D12 WeakPolarHBondContact O-CB 3.38Å; T9-D12 PolarHBondContact O-N 3.44Å; T9-D12 PolarHBondContact OG1-N 3.38Å; T9-D12 PolarHBondContact OG1-OD2 3.14Å; T9-V13 PolarHBondContact O-N 3.5Å; T9-V13 VanDerWaalsContact O-N 3.07Å
10	V	75.7	Confident	73.4	Confident	92 Å²	92	113.8 Å²	113.8	56%	0.558	58%	0.575	S	S	*	*	H	α-helix	trans	-55.4	-35.6	175.5	179.5	0	0	0	0	110.7	D12 V13 I14 M96	V10-D12 PolarHBondContact O-N 3.42Å; V10-V13 PolarHBondContact O-N 3.35Å; V10-I14 HydrophobicContact CG1-CD1 4Å; V10-I14 WeakPolarHBondContact O-CG1 3.47Å; V10-I14 PolarHBondContact O-N 3.19Å; V10-M96 HydrophobicContact CG1-CG 4.16Å; V10-M96 HydrophobicContact CG1-SD 4.04Å
11	D	79.8	Confident	74.3	Confident	67 Å²	67	109.4 Å²	109.4	36%	0.358	55%	0.553	S	S	.	*	H	α-helix	trans	-64.1	-37.7	173.8	-79.2	-26.6	0	0	0	113.5	T9 K15	T9-D11 PolarHBondContact O-N 3.22Å; D11-K15 WeakPolarHBondContact O-CB 3.47Å; D11-K15 VanDerWaalsContact O-CG 3.27Å; D11-K15 WeakPolarHBondContact O-CG 3.34Å; D11-K15 PolarHBondContact O-N 3.21Å
12	D	84.3	Confident	76.8	Confident	71 Å²	71	105.8 Å²	105.8	38%	0.38	53%	0.526	S	S	.	.	H	α-helix	trans	-68.3	-39.3	177.1	-62.1	-43.1	0	0	0	111.1	K8 T9 V10 K15 E16	K8-D12 HydrophobicContact CB-CB 4.35Å; K8-D12 HydrophobicContact CG-CB 4.4Å; T9-D12 WeakPolarHBondContact CB-OD2 3.47Å; T9-D12 PolarHBondContact N-OD2 3.23Å; T9-D12 VanDerWaalsContact N-OD2 3.09Å; T9-D12 WeakPolarHBondContact O-CB 3.38Å; T9-D12 PolarHBondContact O-N 3.44Å; T9-D12 PolarHBondContact OG1-N 3.38Å; T9-D12 PolarHBondContact OG1-OD2 3.14Å; V10-D12 PolarHBondContact O-N 3.42Å; D12-K15 PolarHBondContact O-N 3.41Å; D12-E16 WeakPolarHBondContact O-CB 3.19Å; D12-E16 PolarHBondContact O-N 3.02Å
13	V	83.9	Confident	79.1	Confident	55 Å²	55	104.1 Å²	104.1	33%	0.333	51%	0.509	S	S	.	.	H	α-helix	trans	-62.5	-47.5	175.4	178.2	0	0	0	0	110.7	K8 T9 V10 K15 E16 Q17	K8-V13 HydrophobicContact CB-CG2 3.99Å; K8-V13 HydrophobicContact CD-CG2 4.39Å; T9-V13 PolarHBondContact O-N 3.5Å; T9-V13 VanDerWaalsContact O-N 3.07Å; V10-V13 PolarHBondContact O-N 3.35Å; V13-K15 VanDerWaalsContact C-N 3.32Å; V13-K15 PolarHBondContact O-N 2.96Å; V13-E16 PolarHBondContact O-N 2.93Å; V13-Q17 HydrophobicContact CG1-CG 4.4Å; V13-Q17 WeakPolarHBondContact O-CB 3.29Å; V13-Q17 WeakPolarHBondContact O-CG 3.44Å; V13-Q17 PolarHBondContact O-N 3.18Å
14	I	84.5	Confident	81.4	Confident	3 Å²	3	102.6 Å²	102.6	2%	0.015	50%	0.496	C	S	.	.	H	α-helix	trans	-63.8	-37.9	179.5	-67.5	169.7	0	0	0	111.6	V10 S18 T89 M92 N93 M96	V10-I14 HydrophobicContact CG1-CD1 4Å; V10-I14 WeakPolarHBondContact O-CG1 3.47Å; V10-I14 PolarHBondContact O-N 3.19Å; I14-S18 WeakPolarHBondContact O-CB 3.44Å; I14-S18 PolarHBondContact O-N 3.48Å; I14-S18 PolarHBondContact O-OG 3.25Å; I14-T89 HydrophobicContact CG2-CG2 3.79Å; I14-M92 HydrophobicContact CD1-CG 4.3Å; I14-M92 HydrophobicContact CD1-SD 4.47Å; I14-N93 HydrophobicContact CG2-CB 3.82Å; I14-N93 WeakPolarHBondContact CG2-ND2 3.34Å; I14-M96 HydrophobicContact CD1-CB 4.39Å; I14-M96 HydrophobicContact CD1-CG 3.8Å
15	K	86.7	Confident	83.2	Confident	127 Å²	127	97.2 Å²	97.2	55%	0.552	47%	0.466	S	S	*	.	H	α-helix	trans	-66.5	-41.4	175.6	-76.7	172.1	-174.1	167.6	0	112	D11 D12 V13 S18 K19	D11-K15 WeakPolarHBondContact O-CB 3.47Å; D11-K15 VanDerWaalsContact O-CG 3.27Å; D11-K15 WeakPolarHBondContact O-CG 3.34Å; D11-K15 PolarHBondContact O-N 3.21Å; D12-K15 PolarHBondContact O-N 3.41Å; V13-K15 VanDerWaalsContact C-N 3.32Å; V13-K15 PolarHBondContact O-N 2.96Å; K15-S18 PolarHBondContact O-N 3.32Å; K15-K19 PolarHBondContact O-N 3.49Å
16	E	89.3	Confident	84.9	Confident	90 Å²	90	96.2 Å²	96.2	42%	0.421	46%	0.457	S	S	.	.	H	α-helix	trans	-64.9	-48.4	176.6	-172.8	176.4	-149.4	0	0	111.3	K8 D12 V13 S18 K19 E20	K8-E16 VanDerWaalsContact CE-OE2 3.24Å; K8-E16 WeakPolarHBondContact CE-OE2 3.49Å; K8-E16 IonicContact NZ-OE1 2.78Å; K8-E16 PolarHBondContact NZ-OE1 3.01Å; K8-E16 IonicContact NZ-OE2 2.73Å; K8-E16 PolarHBondContact NZ-OE2 3.22Å; D12-E16 WeakPolarHBondContact O-CB 3.19Å; D12-E16 PolarHBondContact O-N 3.02Å; V13-E16 PolarHBondContact O-N 2.93Å; E16-S18 VanDerWaalsContact C-N 3.31Å; E16-S18 PolarHBondContact O-N 3.4Å; E16-K19 WeakPolarHBondContact O-CA 3.37Å; E16-K19 WeakPolarHBondContact O-CB 3.03Å; E16-K19 PolarHBondContact O-N 3.11Å; E16-E20 PolarHBondContact O-N 2.76Å
17	Q	88	Confident	86.5	Confident	82 Å²	82	91.1 Å²	91.1	38%	0.383	44%	0.436	S	S	.	.	H	α-helix	trans	-56.9	-44.2	173.8	-72.9	178.2	-45.9	0	0	111.6	V13 K19 E20 L21	V13-Q17 HydrophobicContact CG1-CG 4.4Å; V13-Q17 WeakPolarHBondContact O-CB 3.29Å; V13-Q17 WeakPolarHBondContact O-CG 3.44Å; V13-Q17 PolarHBondContact O-N 3.18Å; Q17-K19 VanDerWaalsContact C-N 3.27Å; Q17-K19 PolarHBondContact O-N 3.49Å; Q17-E20 PolarHBondContact O-N 3.5Å; Q17-L21 WeakPolarHBondContact O-CB 3.36Å; Q17-L21 VanDerWaalsContact O-CG 3.26Å; Q17-L21 WeakPolarHBondContact O-CG 3.5Å; Q17-L21 PolarHBondContact O-N 3.11Å
18	S	88.6	Confident	88.1	Confident	25 Å²	25	82.4 Å²	82.4	18%	0.175	40%	0.398	C	S	.	.	H	α-helix	trans	-60.5	-36.7	175.8	-63.8	0	0	0	0	112.7	I14 K15 E16 R22 T89	I14-S18 WeakPolarHBondContact O-CB 3.44Å; I14-S18 PolarHBondContact O-N 3.48Å; I14-S18 PolarHBondContact O-OG 3.25Å; K15-S18 PolarHBondContact O-N 3.32Å; E16-S18 VanDerWaalsContact C-N 3.31Å; E16-S18 PolarHBondContact O-N 3.4Å; S18-R22 VanDerWaalsContact O-CG 3.29Å; S18-R22 WeakPolarHBondContact O-CG 3.48Å; S18-R22 PolarHBondContact O-N 3.23Å; S18-T89 WeakPolarHBondContact OG-CG2 3.01Å
19	K	92.7	Very high	89.4	Confident	163 Å²	163	80 Å²	80	71%	0.709	39%	0.394	S	S	*	.	H	α-helix	trans	-71.4	-42.7	177.4	-174.9	-176.7	177.1	-173.6	0	111.1	K15 E16 Q17 R22 S23	K15-K19 PolarHBondContact O-N 3.49Å; E16-K19 WeakPolarHBondContact O-CA 3.37Å; E16-K19 WeakPolarHBondContact O-CB 3.03Å; E16-K19 PolarHBondContact O-N 3.11Å; Q17-K19 VanDerWaalsContact C-N 3.27Å; Q17-K19 PolarHBondContact O-N 3.49Å; K19-R22 PolarHBondContact O-N 3.46Å; K19-S23 PolarHBondContact O-N 3.03Å
20	E	93.4	Very high	90.2	Very high	125 Å²	125	83.1 Å²	83.1	58%	0.584	40%	0.398	S	S	*	.	H	α-helix	trans	-61.8	-49.6	176.8	-172.3	173.1	-170.7	0	0	111.1	E16 Q17 R22 S23 T24	E16-E20 PolarHBondContact O-N 2.76Å; Q17-E20 PolarHBondContact O-N 3.5Å; E20-R22 VanDerWaalsContact C-N 3.29Å; E20-R22 PolarHBondContact O-N 3.02Å; E20-S23 CarbonylContact O-C 3.55Å; E20-S23 WeakPolarHBondContact O-CA 3.4Å; E20-S23 VanDerWaalsContact O-CB 3.28Å; E20-S23 WeakPolarHBondContact O-CB 3.49Å; E20-S23 PolarHBondContact O-N 3.44Å; E20-T24 PolarHBondContact O-N 3.15Å; E20-T24 PolarHBondContact O-OG1 3.19Å; E20-T24 VanDerWaalsContact O-OG1 3.11Å
21	L	92.9	Very high	91.1	Very high	22 Å²	22	82.2 Å²	82.2	12%	0.115	39%	0.39	C	S	.	.	H	α-helix	trans	-57.1	-40.3	176.7	-69.3	172	0	0	0	112.5	Q17 S23 T24 Q25 V82 M85 T89	Q17-L21 WeakPolarHBondContact O-CB 3.36Å; Q17-L21 VanDerWaalsContact O-CG 3.26Å; Q17-L21 WeakPolarHBondContact O-CG 3.5Å; Q17-L21 PolarHBondContact O-N 3.11Å; L21-S23 VanDerWaalsContact C-N 3.35Å; L21-T24 PolarHBondContact O-N 3.19Å; L21-Q25 WeakPolarHBondContact O-CB 3.33Å; L21-Q25 PolarHBondContact O-N 3.48Å; L21-V82 HydrophobicContact CD2-CG1 4.28Å; L21-M85 HydrophobicContact CD1-CB 4.31Å; L21-M85 HydrophobicContact CD2-CB 4.18Å; L21-M85 HydrophobicContact CD2-CE 4.35Å; L21-T89 WeakPolarHBondContact CD1-OG1 3.4Å
22	R	92.8	Very high	91.8	Very high	165 Å²	165	80.6 Å²	80.6	62%	0.623	38%	0.379	S	S	*	.	H	α-helix	trans	-64.9	-37.5	173.9	-74.2	174.1	-176.5	-172.1	2.1	112.6	S18 K19 E20 R26	S18-R22 VanDerWaalsContact O-CG 3.29Å; S18-R22 WeakPolarHBondContact O-CG 3.48Å; S18-R22 PolarHBondContact O-N 3.23Å; K19-R22 PolarHBondContact O-N 3.46Å; E20-R22 VanDerWaalsContact C-N 3.29Å; E20-R22 PolarHBondContact O-N 3.02Å; R22-R26 WeakPolarHBondContact O-CG 3.01Å; R22-R26 PolarHBondContact O-N 3.42Å
23	S	95.8	Very high	92.3	Very high	69 Å²	69	79.9 Å²	79.9	48%	0.483	38%	0.382	S	S	.	.	H	α-helix	trans	-66.1	-47.6	175.9	-171.3	0	0	0	0	110.7	K19 E20 L21 Q25 R26 Q27	K19-S23 PolarHBondContact O-N 3.03Å; E20-S23 CarbonylContact O-C 3.55Å; E20-S23 WeakPolarHBondContact O-CA 3.4Å; E20-S23 VanDerWaalsContact O-CB 3.28Å; E20-S23 WeakPolarHBondContact O-CB 3.49Å; E20-S23 PolarHBondContact O-N 3.44Å; L21-S23 VanDerWaalsContact C-N 3.35Å; S23-Q25 VanDerWaalsContact C-N 3.33Å; S23-Q25 PolarHBondContact O-N 3.14Å; S23-R26 WeakPolarHBondContact O-CB 3.19Å; S23-R26 PolarHBondContact O-N 3.5Å; S23-R26 VanDerWaalsContact O-N 3.1Å; S23-Q27 PolarHBondContact O-N 3.17Å
24	T	94.9	Very high	92.9	Very high	56 Å²	56	79.6 Å²	79.6	34%	0.344	39%	0.386	S	S	.	.	H	α-helix	trans	-57.8	-44.3	176	-56.7	0	0	0	0	111.3	E20 L21 R26 Q27 I28 V82	E20-T24 PolarHBondContact O-N 3.15Å; E20-T24 PolarHBondContact O-OG1 3.19Å; E20-T24 VanDerWaalsContact O-OG1 3.11Å; L21-T24 PolarHBondContact O-N 3.19Å; T24-R26 VanDerWaalsContact C-N 3.31Å; T24-R26 PolarHBondContact O-N 3.34Å; T24-Q27 WeakPolarHBondContact O-CB 3.45Å; T24-Q27 PolarHBondContact O-N 3.4Å; T24-Q27 VanDerWaalsContact O-N 3.08Å; T24-I28 HydrophobicContact CG2-CD1 3.99Å; T24-I28 HydrophobicContact CG2-CG1 4.48Å; T24-I28 WeakPolarHBondContact O-CG1 3.15Å; T24-I28 PolarHBondContact O-N 3.35Å; T24-V82 HydrophobicContact CG2-CG2 4.16Å
25	Q	93.9	Very high	93.4	Very high	46 Å²	46	80.2 Å²	80.2	22%	0.215	39%	0.389	C	S	.	.	H	α-helix	trans	-56.7	-43.9	175.1	-174.9	59.9	42.2	0	0	112.2	L21 S23 I28 T29 S79 V82	L21-Q25 WeakPolarHBondContact O-CB 3.33Å; L21-Q25 PolarHBondContact O-N 3.48Å; S23-Q25 VanDerWaalsContact C-N 3.33Å; S23-Q25 PolarHBondContact O-N 3.14Å; Q25-I28 PolarHBondContact O-N 2.88Å; Q25-T29 PolarHBondContact O-N 2.65Å; Q25-T29 VanDerWaalsContact O-N 3.15Å; Q25-T29 PolarHBondContact O-OG1 2.71Å; Q25-T29 VanDerWaalsContact O-OG1 3.1Å; Q25-S79 PolarHBondContact NE2-OG 3.26Å; Q25-S79 PolarHBondContact OE1-O 2.75Å; Q25-V82 HydrophobicContact CB-CG1 4.29Å
26	R	95.1	Very high	93.8	Very high	183 Å²	183	77.7 Å²	77.7	69%	0.691	38%	0.379	S	S	*	.	H	α-helix	trans	-70.1	-31.8	176.6	-67.3	176.5	-172.9	-153.5	0.3	112.8	R22 S23 T24 R30	R22-R26 WeakPolarHBondContact O-CG 3.01Å; R22-R26 PolarHBondContact O-N 3.42Å; S23-R26 WeakPolarHBondContact O-CB 3.19Å; S23-R26 PolarHBondContact O-N 3.5Å; S23-R26 VanDerWaalsContact O-N 3.1Å; T24-R26 VanDerWaalsContact C-N 3.31Å; T24-R26 PolarHBondContact O-N 3.34Å; R26-R30 WeakPolarHBondContact O-CG 3.26Å; R26-R30 PolarHBondContact O-N 3.13Å; R26-R30 VanDerWaalsContact O-N 3.17Å; R26-R30 PolarHBondContact O-NE 2.6Å
27	Q	95.6	Very high	94.1	Very high	73 Å²	73	79.9 Å²	79.9	34%	0.341	39%	0.387	S	S	.	.	H	α-helix	trans	-66.3	-47.3	174.5	-171.7	62.4	46.3	0	0	110	S23 T24 T29 R30 D31	S23-Q27 PolarHBondContact O-N 3.17Å; T24-Q27 WeakPolarHBondContact O-CB 3.45Å; T24-Q27 PolarHBondContact O-N 3.4Å; T24-Q27 VanDerWaalsContact O-N 3.08Å; Q27-T29 VanDerWaalsContact C-N 3.3Å; Q27-T29 PolarHBondContact O-N 3.1Å; Q27-R30 CarbonylContact O-C 3.59Å; Q27-R30 WeakPolarHBondContact O-CA 3.39Å; Q27-R30 WeakPolarHBondContact O-CB 3.39Å; Q27-R30 PolarHBondContact O-N 3.3Å; Q27-D31 PolarHBondContact NE2-OD1 3.44Å; Q27-D31 VanDerWaalsContact O-CG 3.24Å; Q27-D31 PolarHBondContact O-N 3.41Å
28	I	95.3	Very high	94.5	Very high	16 Å²	16	80.5 Å²	80.5	8%	0.082	39%	0.39	C	S	.	.	H	α-helix	trans	-56.7	-43.4	176.3	-66.5	161.7	0	0	0	111.3	T24 Q25 R30 D31 R32 V78 V82	T24-I28 HydrophobicContact CG2-CD1 3.99Å; T24-I28 HydrophobicContact CG2-CG1 4.48Å; T24-I28 WeakPolarHBondContact O-CG1 3.15Å; T24-I28 PolarHBondContact O-N 3.35Å; Q25-I28 PolarHBondContact O-N 2.88Å; I28-R30 VanDerWaalsContact C-N 3.33Å; I28-R30 PolarHBondContact O-N 3.12Å; I28-D31 PolarHBondContact O-N 3.19Å; I28-R32 WeakPolarHBondContact O-CB 3.47Å; I28-R32 PolarHBondContact O-N 3.06Å; I28-V78 HydrophobicContact CD1-CG1 3.83Å; I28-V78 HydrophobicContact CG1-CG1 4.46Å; I28-V82 HydrophobicContact CD1-CB 4.39Å; I28-V82 HydrophobicContact CD1-CG2 3.76Å
29	T	94.4	Very high	94.7	Very high	75 Å²	75	80.2 Å²	80.2	46%	0.46	39%	0.386	S	S	.	.	H	α-helix	trans	-62.2	-40.1	175.8	-52.7	0	0	0	0	112.3	Q25 Q27 A33	Q25-T29 PolarHBondContact O-N 2.65Å; Q25-T29 VanDerWaalsContact O-N 3.15Å; Q25-T29 PolarHBondContact O-OG1 2.71Å; Q25-T29 VanDerWaalsContact O-OG1 3.1Å; Q27-T29 VanDerWaalsContact C-N 3.3Å; Q27-T29 PolarHBondContact O-N 3.1Å; T29-A33 PolarHBondContact O-N 3.3Å
30	R	96.3	Very high	94.8	Very high	141 Å²	141	78.9 Å²	78.9	53%	0.532	38%	0.38	S	S	.	.	H	α-helix	trans	-68.5	-42.3	177.1	-77.7	-177.7	-75.2	148.5	-0.6	111.9	R26 Q27 I28 R32 A33 A34	R26-R30 WeakPolarHBondContact O-CG 3.26Å; R26-R30 PolarHBondContact O-N 3.13Å; R26-R30 VanDerWaalsContact O-N 3.17Å; R26-R30 PolarHBondContact O-NE 2.6Å; Q27-R30 CarbonylContact O-C 3.59Å; Q27-R30 WeakPolarHBondContact O-CA 3.39Å; Q27-R30 WeakPolarHBondContact O-CB 3.39Å; Q27-R30 PolarHBondContact O-N 3.3Å; I28-R30 VanDerWaalsContact C-N 3.33Å; I28-R30 PolarHBondContact O-N 3.12Å; R30-R32 VanDerWaalsContact C-N 3.31Å; R30-R32 PolarHBondContact O-N 3.01Å; R30-A33 PolarHBondContact O-N 3.42Å; R30-A34 PolarHBondContact O-N 3.1Å
31	D	94.3	Very high	94.8	Very high	72 Å²	72	77.5 Å²	77.5	39%	0.385	37%	0.374	S	S	.	.	H	α-helix	trans	-63.3	-40.4	177.5	-63.6	-15	0	0	0	110.4	Q27 I28 A33 A34 L35	Q27-D31 PolarHBondContact NE2-OD1 3.44Å; Q27-D31 VanDerWaalsContact O-CG 3.24Å; Q27-D31 PolarHBondContact O-N 3.41Å; I28-D31 PolarHBondContact O-N 3.19Å; D31-A33 PolarHBondContact O-N 3.41Å; D31-A34 WeakPolarHBondContact O-CB 3.47Å; D31-A34 PolarHBondContact O-N 3.17Å; D31-A34 VanDerWaalsContact O-N 3.16Å; D31-L35 WeakPolarHBondContact O-CG 3.31Å; D31-L35 PolarHBondContact O-N 3.06Å
32	R	94.6	Very high	94.8	Very high	34 Å²	34	77.9 Å²	77.9	13%	0.128	38%	0.376	C	S	.	.	H	α-helix	trans	-58.6	-47.1	173.4	-172.3	-177.8	-61.3	155.5	3.7	112.2	I28 R30 A34 L35 E36 K72 T75 Y76	I28-R32 WeakPolarHBondContact O-CB 3.47Å; I28-R32 PolarHBondContact O-N 3.06Å; R30-R32 VanDerWaalsContact C-N 3.31Å; R30-R32 PolarHBondContact O-N 3.01Å; R32-A34 VanDerWaalsContact C-N 3.26Å; R32-A34 PolarHBondContact O-N 3.45Å; R32-L35 PolarHBondContact O-N 2.99Å; R32-E36 WeakPolarHBondContact O-CG 3.46Å; R32-E36 PolarHBondContact O-N 3.28Å; R32-K72 HydrophobicContact CG-CG 4.34Å; R32-T75 PolarHBondContact NE-OG1 3.05Å; R32-T75 PolarHBondContact NH2-O 2.87Å; R32-T75 VanDerWaalsContact NH2-O 3.14Å; R32-Y76 VanDerWaalsContact CZ-CE1 3.47Å
33	A	95.8	Very high	94.8	Very high	55 Å²	55	72.3 Å²	72.3	46%	0.455	36%	0.357	S	S	.	.	H	α-helix	trans	-63.1	-33.6	177	0	0	0	0	0	112.4	T29 R30 D31 K37	T29-A33 PolarHBondContact O-N 3.3Å; R30-A33 PolarHBondContact O-N 3.42Å; D31-A33 PolarHBondContact O-N 3.41Å; A33-K37 PolarHBondContact O-N 3.49Å; A33-K37 VanDerWaalsContact O-N 3.17Å
34	A	96.1	Very high	94.6	Very high	50 Å²	50	74.7 Å²	74.7	41%	0.413	36%	0.363	S	S	.	.	H	α-helix	trans	-67.6	-43.1	173.5	0	0	0	0	0	111.9	R30 D31 R32 K37 Q38	R30-A34 PolarHBondContact O-N 3.1Å; D31-A34 WeakPolarHBondContact O-CB 3.47Å; D31-A34 PolarHBondContact O-N 3.17Å; D31-A34 VanDerWaalsContact O-N 3.16Å; R32-A34 VanDerWaalsContact C-N 3.26Å; R32-A34 PolarHBondContact O-N 3.45Å; A34-K37 WeakPolarHBondContact O-CB 3.39Å; A34-K37 PolarHBondContact O-N 3.48Å; A34-Q38 PolarHBondContact O-N 2.66Å
35	L	95.6	Very high	94.4	Very high	15 Å²	15	77.1 Å²	77.1	8%	0.079	37%	0.371	C	S	.	.	H	α-helix	trans	-61.7	-42.2	174.9	-68.3	170.8	0	0	0	111.6	D31 R32 K37 Q38 E39 L68 Q71 T75	D31-L35 WeakPolarHBondContact O-CG 3.31Å; D31-L35 PolarHBondContact O-N 3.06Å; R32-L35 PolarHBondContact O-N 2.99Å; L35-K37 VanDerWaalsContact C-N 3.29Å; L35-K37 PolarHBondContact O-N 3.16Å; L35-Q38 PolarHBondContact O-N 3.42Å; L35-E39 WeakPolarHBondContact O-CB 3.25Å; L35-E39 PolarHBondContact O-N 2.72Å; L35-L68 HydrophobicContact CD2-CD1 3.53Å; L35-L68 HydrophobicContact CD2-CG 4.44Å; L35-Q71 HydrophobicContact CD1-CG 4.19Å; L35-T75 HydrophobicContact CD1-CG2 3.84Å
36	E	94.8	Very high	94.2	Very high	75 Å²	75	74.9 Å²	74.9	35%	0.35	36%	0.36	S	S	.	.	H	α-helix	trans	-61.2	-36.2	175	-73.7	172.9	-170.2	0	0	112.6	R32 K40 K72	R32-E36 WeakPolarHBondContact O-CG 3.46Å; R32-E36 PolarHBondContact O-N 3.28Å; E36-K40 WeakPolarHBondContact O-CG 3.39Å; E36-K40 PolarHBondContact O-N 2.9Å; E36-K72 HydrophobicContact CG-CD 3.94Å
37	K	96.1	Very high	93.9	Very high	136 Å²	136	70.4 Å²	70.4	59%	0.591	35%	0.346	S	S	*	.	H	α-helix	trans	-69.3	-42.9	174.9	-174.7	-177.9	175.8	-175	0	111.3	A33 A34 L35 E39 K40 Q41	A33-K37 PolarHBondContact O-N 3.49Å; A33-K37 VanDerWaalsContact O-N 3.17Å; A34-K37 WeakPolarHBondContact O-CB 3.39Å; A34-K37 PolarHBondContact O-N 3.48Å; L35-K37 VanDerWaalsContact C-N 3.29Å; L35-K37 PolarHBondContact O-N 3.16Å; K37-E39 VanDerWaalsContact C-N 3.3Å; K37-K40 PolarHBondContact O-N 3.06Å; K37-Q41 WeakPolarHBondContact O-CG 3.49Å; K37-Q41 PolarHBondContact O-N 3.08Å; K37-Q41 VanDerWaalsContact O-N 3.07Å
38	Q	95.3	Very high	93.7	Very high	95 Å²	95	74 Å²	74	44%	0.444	36%	0.36	S	S	.	.	H	α-helix	trans	-62.9	-38.5	175.5	-74.9	178.7	-18.5	0	0	111.6	A34 L35 Q41 M42 L68	A34-Q38 PolarHBondContact O-N 2.66Å; L35-Q38 PolarHBondContact O-N 3.42Å; Q38-Q41 PolarHBondContact O-N 3.41Å; Q38-M42 WeakPolarHBondContact O-CB 3.41Å; Q38-M42 PolarHBondContact O-N 2.97Å; Q38-L68 HydrophobicContact CB-CD1 4.44Å; Q38-L68 HydrophobicContact CB-CD2 3.97Å
39	E	93.6	Very high	93.4	Very high	18 Å²	18	75.8 Å²	75.8	8%	0.084	37%	0.369	C	S	.	.	H	α-helix	trans	-58.2	-51.4	176.5	-172.4	179.7	-166.2	0	0	110.6	L35 K37 Q41 M42 E43 L65 L68 R69 K72	L35-E39 WeakPolarHBondContact O-CB 3.25Å; L35-E39 PolarHBondContact O-N 2.72Å; K37-E39 VanDerWaalsContact C-N 3.3Å; E39-Q41 VanDerWaalsContact C-N 3.31Å; E39-Q41 PolarHBondContact O-N 2.76Å; E39-M42 PolarHBondContact O-N 3.37Å; E39-E43 WeakPolarHBondContact O-CG 3.36Å; E39-E43 PolarHBondContact O-N 3.39Å; E39-L65 HydrophobicContact CB-CD1 4.45Å; E39-L65 HydrophobicContact CG-CD1 3.65Å; E39-L68 VanDerWaalsContact CA-CD2 3.42Å; E39-L68 HydrophobicContact CB-CD2 3.75Å; E39-L68 HydrophobicContact CG-CD2 4.47Å; E39-L68 VanDerWaalsContact N-CD2 3.31Å; E39-R69 WeakPolarHBondContact OE1-CG 3.38Å; E39-R69 IonicContact OE1-CZ 3.2Å; E39-R69 IonicContact OE1-NE 3.58Å; E39-R69 PolarHBondContact OE1-NE 3.47Å; E39-K72 VanDerWaalsContact CD-NZ 3.34Å; E39-K72 IonicContact OE1-NZ 2.68Å; E39-K72 PolarHBondContact OE1-NZ 3.1Å; E39-K72 IonicContact OE2-NZ 3.99Å; E39-K72 PolarHBondContact OE2-NZ 3.26Å
40	K	93.8	Very high	93	Very high	136 Å²	136	73.5 Å²	73.5	59%	0.591	36%	0.357	S	S	*	.	H	α-helix	trans	-60.9	-37.9	176.5	-70.6	175.9	-178.4	175	0	113	E36 K37 L44	E36-K40 WeakPolarHBondContact O-CG 3.39Å; E36-K40 PolarHBondContact O-N 2.9Å; K37-K40 PolarHBondContact O-N 3.06Å; K40-L44 WeakPolarHBondContact O-CG 3.48Å; K40-L44 PolarHBondContact O-N 2.97Å
41	Q	94.6	Very high	92.5	Very high	95 Å²	95	75.7 Å²	75.7	44%	0.444	37%	0.371	S	S	.	.	H	α-helix	trans	-65.4	-44.7	176.5	-74.3	175.3	-21.3	0	0	111.2	K37 Q38 E39 L44 E45	K37-Q41 WeakPolarHBondContact O-CG 3.49Å; K37-Q41 PolarHBondContact O-N 3.08Å; K37-Q41 VanDerWaalsContact O-N 3.07Å; Q38-Q41 PolarHBondContact O-N 3.41Å; E39-Q41 VanDerWaalsContact C-N 3.31Å; E39-Q41 PolarHBondContact O-N 2.76Å; Q41-L44 WeakPolarHBondContact O-CB 3.5Å; Q41-L44 PolarHBondContact O-N 3.2Å; Q41-E45 PolarHBondContact O-N 3.19Å
42	M	93.1	Very high	92.2	Very high	31 Å²	31	76.5 Å²	76.5	15%	0.153	38%	0.382	C	S	.	.	H	α-helix	trans	-66.4	-38.4	179.4	-159.9	175.5	-64.1	0	0	111.7	Q38 E39 L44 E45 I46 Q64 L65 L68	Q38-M42 WeakPolarHBondContact O-CB 3.41Å; Q38-M42 PolarHBondContact O-N 2.97Å; E39-M42 PolarHBondContact O-N 3.37Å; M42-L44 VanDerWaalsContact C-N 3.33Å; M42-L44 PolarHBondContact O-N 3.2Å; M42-E45 PolarHBondContact O-N 3.21Å; M42-I46 HydrophobicContact CG-CD1 4.14Å; M42-I46 WeakPolarHBondContact O-CB 3.11Å; M42-I46 WeakPolarHBondContact O-CD1 3.47Å; M42-I46 WeakPolarHBondContact O-CG1 3.47Å; M42-I46 PolarHBondContact O-N 3.29Å; M42-Q64 HydrophobicContact CE-CB 4.1Å; M42-Q64 VanDerWaalsContact SD-C 3.57Å; M42-Q64 HydrophobicContact SD-CB 3.65Å; M42-L65 HydrophobicContact CB-CD1 4.35Å; M42-L65 HydrophobicContact CG-CB 4.42Å; M42-L65 VanDerWaalsContact SD-CA 3.51Å; M42-L65 HydrophobicContact SD-CB 3.79Å; M42-L65 HydrophobicContact SD-CD1 4.34Å; M42-L65 PolarHBondContact SD-N 3.02Å; M42-L68 HydrophobicContact CE-CD2 4.29Å
43	E	91.4	Very high	91.7	Very high	48 Å²	48	77.5 Å²	77.5	22%	0.224	40%	0.403	C	S	.	.	H	α-helix	trans	-58.9	-41.7	171.7	-74.3	176.2	178.3	0	0	112.3	E39 K47 L65 R69 I170	E39-E43 WeakPolarHBondContact O-CG 3.36Å; E39-E43 PolarHBondContact O-N 3.39Å; E43-K47 VanDerWaalsContact O-CG 3.3Å; E43-K47 WeakPolarHBondContact O-CG 3.47Å; E43-K47 PolarHBondContact O-N 2.77Å; E43-L65 HydrophobicContact CG-CD1 4.37Å; E43-L65 HydrophobicContact CG-CD2 3.99Å; E43-R69 IonicContact OE1-NH2 2.58Å; E43-R69 PolarHBondContact OE1-NH2 3.36Å; E43-I170 HydrophobicContact CG-CD1 4.4Å
44	L	92.2	Very high	91.3	Very high	119 Å²	119	78.2 Å²	78.2	62%	0.623	40%	0.399	S	S	*	.	H	α-helix	trans	-67.2	-40.6	176.4	-69.5	171.2	0	0	0	112	K40 Q41 M42 K47 K48	K40-L44 WeakPolarHBondContact O-CG 3.48Å; K40-L44 PolarHBondContact O-N 2.97Å; Q41-L44 WeakPolarHBondContact O-CB 3.5Å; Q41-L44 PolarHBondContact O-N 3.2Å; M42-L44 VanDerWaalsContact C-N 3.33Å; M42-L44 PolarHBondContact O-N 3.2Å; L44-K47 PolarHBondContact O-N 2.93Å; L44-K48 WeakPolarHBondContact O-CB 3.32Å; L44-K48 PolarHBondContact O-N 3.5Å
45	E	91	Very high	90.7	Very high	106 Å²	106	83 Å²	83	50%	0.495	41%	0.41	S	S	.	.	H	α-helix	trans	-65.2	-44.5	176	-73.5	-178.5	-177.3	0	0	111.7	Q41 M42 K47 K48 M49 L61	Q41-E45 PolarHBondContact O-N 3.19Å; M42-E45 PolarHBondContact O-N 3.21Å; E45-K47 VanDerWaalsContact C-N 3.34Å; E45-K47 PolarHBondContact O-N 3.44Å; E45-K48 WeakPolarHBondContact O-CB 3.48Å; E45-K48 PolarHBondContact O-N 3.34Å; E45-K48 VanDerWaalsContact O-N 3.09Å; E45-M49 WeakPolarHBondContact O-CG 3.21Å; E45-M49 PolarHBondContact O-N 3.5Å; E45-L61 HydrophobicContact CB-CD1 4.37Å
46	I	90.3	Very high	90.3	Very high	0 Å²	0	88.7 Å²	88.7	0%	0	44%	0.436	C	S	.	.	H	α-helix	trans	-57.3	-47.4	174.3	-71.7	163.5	0	0	0	110.2	M42 K48 M49 A50 L61 L65 L167 I170 I172	M42-I46 HydrophobicContact CG-CD1 4.14Å; M42-I46 WeakPolarHBondContact O-CB 3.11Å; M42-I46 WeakPolarHBondContact O-CD1 3.47Å; M42-I46 WeakPolarHBondContact O-CG1 3.47Å; M42-I46 PolarHBondContact O-N 3.29Å; I46-K48 VanDerWaalsContact C-N 3.31Å; I46-K48 PolarHBondContact O-N 3.31Å; I46-M49 PolarHBondContact O-N 3.25Å; I46-A50 VanDerWaalsContact O-CB 3.29Å; I46-A50 WeakPolarHBondContact O-CB 3.38Å; I46-A50 PolarHBondContact O-N 3.33Å; I46-L61 HydrophobicContact CD1-CB 4.11Å; I46-L61 HydrophobicContact CG1-CB 3.45Å; I46-L61 VanDerWaalsContact CG1-CB 3.45Å; I46-L61 HydrophobicContact CG1-CD1 4.29Å; I46-L61 HydrophobicContact CG1-CG 4.49Å; I46-L65 HydrophobicContact CD1-CB 3.98Å; I46-L65 HydrophobicContact CD1-CD2 3.66Å; I46-L65 HydrophobicContact CD1-CG 4.42Å; I46-L167 HydrophobicContact CG2-CD2 3.87Å; I46-I170 HydrophobicContact CD1-CD1 4.12Å; I46-I170 HydrophobicContact CG2-CD1 3.96Å; I46-I170 HydrophobicContact CG2-CG2 4.29Å; I46-I172 HydrophobicContact CG2-CD1 3.32Å
47	K	88.9	Confident	89.9	Confident	88 Å²	88	86.1 Å²	86.1	38%	0.383	43%	0.428	S	S	.	.	H	α-helix	trans	-59.2	-40	174.8	-74.4	176.8	-173.4	-176.3	0	112.5	E43 L44 E45 K51 I170	E43-K47 VanDerWaalsContact O-CG 3.3Å; E43-K47 WeakPolarHBondContact O-CG 3.47Å; E43-K47 PolarHBondContact O-N 2.77Å; L44-K47 PolarHBondContact O-N 2.93Å; E45-K47 VanDerWaalsContact C-N 3.34Å; E45-K47 PolarHBondContact O-N 3.44Å; K47-K51 WeakPolarHBondContact O-CG 3.44Å; K47-K51 PolarHBondContact O-N 3.47Å; K47-K51 VanDerWaalsContact O-N 3.15Å; K47-I170 HydrophobicContact CD-CG2 4.16Å; K47-I170 VanDerWaalsContact CE-CG2 3.44Å; K47-I170 VanDerWaalsContact CE-O 3.31Å; K47-I170 WeakPolarHBondContact CE-O 3.48Å; K47-I170 HydrophobicContact CG-CG2 3.52Å
48	K	90.8	Very high	89.5	Confident	150 Å²	150	80 Å²	80	65%	0.652	40%	0.403	S	S	*	.	H	α-helix	trans	-67.1	-44.6	178.1	-173.4	-176.7	177.6	-174.9	0	111.5	L44 E45 I46 A50 K51 S52	L44-K48 WeakPolarHBondContact O-CB 3.32Å; L44-K48 PolarHBondContact O-N 3.5Å; E45-K48 WeakPolarHBondContact O-CB 3.48Å; E45-K48 PolarHBondContact O-N 3.34Å; E45-K48 VanDerWaalsContact O-N 3.09Å; I46-K48 VanDerWaalsContact C-N 3.31Å; I46-K48 PolarHBondContact O-N 3.31Å; K48-A50 VanDerWaalsContact C-N 3.31Å; K48-A50 PolarHBondContact O-N 3.24Å; K48-K51 PolarHBondContact O-N 3.38Å; K48-S52 PolarHBondContact O-N 2.84Å; K48-S52 PolarHBondContact O-OG 3.25Å; K48-S52 VanDerWaalsContact O-OG 3.13Å
49	M	87.8	Confident	89.1	Confident	53 Å²	53	79.7 Å²	79.7	26%	0.261	40%	0.4	S	S	.	.	H	α-helix	trans	-68	-33.9	179.1	-64.8	-52.5	-78.8	0	0	112	E45 I46 S52 G53 N54 A57 C58 L61	E45-M49 WeakPolarHBondContact O-CG 3.21Å; E45-M49 PolarHBondContact O-N 3.5Å; I46-M49 PolarHBondContact O-N 3.25Å; M49-S52 PolarHBondContact O-N 3.29Å; M49-G53 PolarHBondContact O-N 3.27Å; M49-N54 HydrophobicContact CE-CB 4.04Å; M49-N54 PolarHBondContact O-N 3.02Å; M49-N54 VanDerWaalsContact O-N 3.17Å; M49-A57 HydrophobicContact CE-CB 3.36Å; M49-A57 HydrophobicContact CG-CB 4.45Å; M49-C58 VanDerWaalsContact CB-SG 3.59Å; M49-L61 HydrophobicContact CB-CD1 4.47Å; M49-L61 HydrophobicContact CG-CD1 3.82Å
50	A	86.1	Confident	88.9	Confident	26 Å²	26	83.6 Å²	83.6	22%	0.215	42%	0.42	C	S	.	.	H	α-helix	trans	-66.1	-43.2	176	0	0	0	0	0	112.2	I46 K48 S52 G53 C58 I172	I46-A50 VanDerWaalsContact O-CB 3.29Å; I46-A50 WeakPolarHBondContact O-CB 3.38Å; I46-A50 PolarHBondContact O-N 3.33Å; K48-A50 VanDerWaalsContact C-N 3.31Å; K48-A50 PolarHBondContact O-N 3.24Å; A50-S52 VanDerWaalsContact C-N 3.25Å; A50-S52 PolarHBondContact O-N 3.01Å; A50-G53 PolarHBondContact O-N 2.89Å; A50-C58 WeakPolarHBondContact CA-SG 3.35Å; A50-C58 PolarHBondContact N-SG 3.13Å; A50-I172 HydrophobicContact CB-CB 4.28Å; A50-I172 HydrophobicContact CB-CD1 3.41Å; A50-I172 VanDerWaalsContact CB-CD1 3.41Å; A50-I172 HydrophobicContact CB-CG1 3.57Å; A50-I172 HydrophobicContact CB-CG2 3.65Å
51	K	86.6	Confident	88.7	Confident	188 Å²	188	78.3 Å²	78.3	82%	0.817	40%	0.398	S	S	*	.	H	α-helix	trans	-61.1	-34.5	173.7	-72.8	176.6	-177.8	-174.7	0	112.7	K47 K48 G53	K47-K51 WeakPolarHBondContact O-CG 3.44Å; K47-K51 PolarHBondContact O-N 3.47Å; K47-K51 VanDerWaalsContact O-N 3.15Å; K48-K51 PolarHBondContact O-N 3.38Å; K51-G53 PolarHBondContact O-N 3.36Å
52	S	87.8	Confident	88.4	Confident	89 Å²	89	73.8 Å²	73.8	62%	0.622	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-3.5	175.3	-56	0	0	0	0	113.4	K48 M49 A50 N54	K48-S52 PolarHBondContact O-N 2.84Å; K48-S52 PolarHBondContact O-OG 3.25Å; K48-S52 VanDerWaalsContact O-OG 3.13Å; M49-S52 PolarHBondContact O-N 3.29Å; A50-S52 VanDerWaalsContact C-N 3.25Å; A50-S52 PolarHBondContact O-N 3.01Å; S52-N54 PolarHBondContact O-N 2.87Å
53	G	83.4	Confident	88.3	Confident	54 Å²	54	77.4 Å²	77.4	56%	0.557	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	9.3	-179.8	0	0	0	0	0	115	M49 A50 K51 K55	M49-G53 PolarHBondContact O-N 3.27Å; A50-G53 PolarHBondContact O-N 2.89Å; K51-G53 PolarHBondContact O-N 3.36Å; G53-K55 PolarHBondContact O-N 2.76Å
54	N	87.6	Confident	88.2	Confident	71 Å²	71	79.3 Å²	79.3	38%	0.38	40%	0.401	S	S	.	.			trans	-82.5	85	-179.3	-171.6	-17.9	0	0	0	110.6	M49 S52 E56 A57 C58	M49-N54 HydrophobicContact CE-CB 4.04Å; M49-N54 PolarHBondContact O-N 3.02Å; M49-N54 VanDerWaalsContact O-N 3.17Å; S52-N54 PolarHBondContact O-N 2.87Å; N54-E56 PolarHBondContact O-N 3.29Å; N54-A57 HydrophobicContact CB-CB 4.25Å; N54-A57 VanDerWaalsContact CG-CB 3.49Å; N54-A57 PolarHBondContact O-N 2.92Å; N54-A57 WeakPolarHBondContact OD1-CB 3.45Å; N54-A57 PolarHBondContact OD1-N 2.96Å; N54-A57 VanDerWaalsContact OD1-N 3.08Å; N54-C58 PolarHBondContact O-N 3.35Å; N54-C58 VanDerWaalsContact O-N 3.12Å; N54-C58 PolarHBondContact O-SG 3.06Å
55	K	84.7	Confident	88.2	Confident	150 Å²	150	73.6 Å²	73.6	65%	0.652	37%	0.371	S	S	*	.	H	α-helix	trans	-62.9	-39.3	-176.7	-65.4	-177	179.8	-179.1	0	113.4	G53 C58 K59	G53-K55 PolarHBondContact O-N 2.76Å; K55-C58 PolarHBondContact O-N 3.36Å; K55-K59 PolarHBondContact O-N 3.25Å
56	E	86.3	Confident	88.1	Confident	134 Å²	134	69.7 Å²	69.7	63%	0.626	35%	0.354	S	S	*	.	H	α-helix	trans	-64	-46.5	179.6	-68.9	-57.5	134.1	0	0	111.4	N54 C58 K59 I60	N54-E56 PolarHBondContact O-N 3.29Å; E56-C58 VanDerWaalsContact C-N 3.33Å; E56-C58 PolarHBondContact O-N 2.87Å; E56-K59 PolarHBondContact O-N 2.88Å; E56-I60 WeakPolarHBondContact O-CG1 3.4Å; E56-I60 PolarHBondContact O-N 3.27Å; E56-I60 VanDerWaalsContact O-N 3.09Å
57	A	87.4	Confident	88.1	Confident	21 Å²	21	74.1 Å²	74.1	17%	0.174	38%	0.375	C	S	.	.	H	α-helix	trans	-64.2	-37.8	176.1	0	0	0	0	0	112.3	M49 N54 I60 L61	M49-A57 HydrophobicContact CE-CB 3.36Å; M49-A57 HydrophobicContact CG-CB 4.45Å; N54-A57 HydrophobicContact CB-CB 4.25Å; N54-A57 VanDerWaalsContact CG-CB 3.49Å; N54-A57 PolarHBondContact O-N 2.92Å; N54-A57 WeakPolarHBondContact OD1-CB 3.45Å; N54-A57 PolarHBondContact OD1-N 2.96Å; N54-A57 VanDerWaalsContact OD1-N 3.08Å; A57-I60 PolarHBondContact O-N 3.11Å; A57-L61 WeakPolarHBondContact O-CB 3.27Å; A57-L61 VanDerWaalsContact O-CG 3.31Å; A57-L61 WeakPolarHBondContact O-CG 3.38Å; A57-L61 PolarHBondContact O-N 3.09Å
58	C	87.4	Confident	88.3	Confident	9 Å²	9	70.6 Å²	70.6	6%	0.061	36%	0.36	C	S	.	.	H	α-helix	trans	-61.9	-42.9	174.6	-66.3	0	0	0	0	111.8	M49 A50 N54 K55 E56 L61 A62 L167	M49-C58 VanDerWaalsContact CB-SG 3.59Å; A50-C58 WeakPolarHBondContact CA-SG 3.35Å; A50-C58 PolarHBondContact N-SG 3.13Å; N54-C58 PolarHBondContact O-N 3.35Å; N54-C58 VanDerWaalsContact O-N 3.12Å; N54-C58 PolarHBondContact O-SG 3.06Å; K55-C58 PolarHBondContact O-N 3.36Å; E56-C58 VanDerWaalsContact C-N 3.33Å; E56-C58 PolarHBondContact O-N 2.87Å; C58-L61 PolarHBondContact O-N 3.28Å; C58-A62 WeakPolarHBondContact O-CB 3.36Å; C58-A62 PolarHBondContact O-N 2.76Å; C58-L167 HydrophobicContact CB-CD2 4.4Å
59	K	86.8	Confident	88.3	Confident	87 Å²	87	65.7 Å²	65.7	38%	0.378	34%	0.338	S	S	.	.	H	α-helix	trans	-62.8	-43.2	179	-170.5	177.5	-179.1	-179.5	0	111.6	K55 E56 K63 V163	K55-K59 PolarHBondContact O-N 3.25Å; E56-K59 PolarHBondContact O-N 2.88Å; K59-K63 PolarHBondContact O-N 3.33Å; K59-V163 HydrophobicContact CG-CG1 4.46Å
60	I	89.8	Confident	88.4	Confident	101 Å²	101	68.3 Å²	68.3	52%	0.518	35%	0.348	S	S	.	.	H	α-helix	trans	-64.6	-48.1	177.5	-65.4	168.3	0	0	0	110.9	E56 A57 A62 K63 Q64	E56-I60 WeakPolarHBondContact O-CG1 3.4Å; E56-I60 PolarHBondContact O-N 3.27Å; E56-I60 VanDerWaalsContact O-N 3.09Å; A57-I60 PolarHBondContact O-N 3.11Å; I60-A62 PolarHBondContact O-N 3.22Å; I60-K63 WeakPolarHBondContact O-CB 3.44Å; I60-K63 PolarHBondContact O-N 3.19Å; I60-Q64 WeakPolarHBondContact O-CG 3.41Å; I60-Q64 PolarHBondContact O-N 3.29Å; I60-Q64 VanDerWaalsContact O-N 3.08Å
61	L	89.3	Confident	88.6	Confident	25 Å²	25	72.3 Å²	72.3	13%	0.131	36%	0.362	C	S	.	.	H	α-helix	trans	-66.2	-37.4	179.9	-70.5	170.7	0	0	0	112.1	E45 I46 M49 A57 C58 K63 Q64 L65	E45-L61 HydrophobicContact CB-CD1 4.37Å; I46-L61 HydrophobicContact CD1-CB 4.11Å; I46-L61 HydrophobicContact CG1-CB 3.45Å; I46-L61 VanDerWaalsContact CG1-CB 3.45Å; I46-L61 HydrophobicContact CG1-CD1 4.29Å; I46-L61 HydrophobicContact CG1-CG 4.49Å; M49-L61 HydrophobicContact CB-CD1 4.47Å; M49-L61 HydrophobicContact CG-CD1 3.82Å; A57-L61 WeakPolarHBondContact O-CB 3.27Å; A57-L61 VanDerWaalsContact O-CG 3.31Å; A57-L61 WeakPolarHBondContact O-CG 3.38Å; A57-L61 PolarHBondContact O-N 3.09Å; C58-L61 PolarHBondContact O-N 3.28Å; L61-K63 VanDerWaalsContact C-N 3.34Å; L61-Q64 WeakPolarHBondContact O-CB 3.47Å; L61-Q64 PolarHBondContact O-N 2.98Å; L61-L65 PolarHBondContact O-N 3.24Å
62	A	88.4	Confident	88.8	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-65.8	-37.8	175.7	0	0	0	0	0	111.8	C58 I60 Q64 L65 V66 V163 L167	C58-A62 WeakPolarHBondContact O-CB 3.36Å; C58-A62 PolarHBondContact O-N 2.76Å; I60-A62 PolarHBondContact O-N 3.22Å; A62-Q64 PolarHBondContact O-N 3.22Å; A62-L65 WeakPolarHBondContact O-CB 3.5Å; A62-L65 PolarHBondContact O-N 3.02Å; A62-V66 WeakPolarHBondContact O-CG2 3.33Å; A62-V66 PolarHBondContact O-N 2.85Å; A62-V163 HydrophobicContact CB-CG1 3.61Å; A62-L167 HydrophobicContact CB-CD1 4.47Å; A62-L167 HydrophobicContact CB-CD2 3.82Å; A62-L167 HydrophobicContact CB-CG 3.99Å
63	K	89.8	Confident	88.9	Confident	107 Å²	107	65.9 Å²	65.9	47%	0.465	33%	0.327	S	S	.	.	H	α-helix	trans	-58.7	-47	170.8	-163.7	-176.9	-175.3	178.9	0	111.5	K59 I60 L61 L65 V66 Q67 E158	K59-K63 PolarHBondContact O-N 3.33Å; I60-K63 WeakPolarHBondContact O-CB 3.44Å; I60-K63 PolarHBondContact O-N 3.19Å; L61-K63 VanDerWaalsContact C-N 3.34Å; K63-L65 VanDerWaalsContact C-N 3.28Å; K63-L65 PolarHBondContact O-N 2.74Å; K63-V66 PolarHBondContact O-N 3.2Å; K63-Q67 WeakPolarHBondContact O-CG 3.03Å; K63-Q67 PolarHBondContact O-N 3.38Å; K63-Q67 VanDerWaalsContact O-N 3.11Å; K63-E158 WeakPolarHBondContact CD-OE2 2.72Å; K63-E158 WeakPolarHBondContact CE-OE2 3.48Å; K63-E158 WeakPolarHBondContact CG-OE2 3.5Å; K63-E158 IonicContact NZ-OE2 3.93Å
64	Q	89.9	Confident	89.1	Confident	87 Å²	87	70.1 Å²	70.1	41%	0.407	33%	0.327	S	S	.	.	H	α-helix	trans	-61.5	-36.7	175.8	-69.8	177.2	-15.6	0	0	112.2	M42 I60 L61 A62 Q67 L68	M42-Q64 HydrophobicContact CE-CB 4.1Å; M42-Q64 VanDerWaalsContact SD-C 3.57Å; M42-Q64 HydrophobicContact SD-CB 3.65Å; I60-Q64 WeakPolarHBondContact O-CG 3.41Å; I60-Q64 PolarHBondContact O-N 3.29Å; I60-Q64 VanDerWaalsContact O-N 3.08Å; L61-Q64 WeakPolarHBondContact O-CB 3.47Å; L61-Q64 PolarHBondContact O-N 2.98Å; A62-Q64 PolarHBondContact O-N 3.22Å; Q64-Q67 PolarHBondContact O-N 3.04Å; Q64-L68 WeakPolarHBondContact O-CB 3.4Å; Q64-L68 PolarHBondContact O-N 3.1Å
65	L	91.4	Very high	89.3	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-66.3	-42	178.1	-178	61.8	0	0	0	111.9	E39 M42 E43 I46 L61 A62 K63 Q67 L68 R69 V166 I170	E39-L65 HydrophobicContact CB-CD1 4.45Å; E39-L65 HydrophobicContact CG-CD1 3.65Å; M42-L65 HydrophobicContact CB-CD1 4.35Å; M42-L65 HydrophobicContact CG-CB 4.42Å; M42-L65 VanDerWaalsContact SD-CA 3.51Å; M42-L65 HydrophobicContact SD-CB 3.79Å; M42-L65 HydrophobicContact SD-CD1 4.34Å; M42-L65 PolarHBondContact SD-N 3.02Å; E43-L65 HydrophobicContact CG-CD1 4.37Å; E43-L65 HydrophobicContact CG-CD2 3.99Å; I46-L65 HydrophobicContact CD1-CB 3.98Å; I46-L65 HydrophobicContact CD1-CD2 3.66Å; I46-L65 HydrophobicContact CD1-CG 4.42Å; L61-L65 PolarHBondContact O-N 3.24Å; A62-L65 WeakPolarHBondContact O-CB 3.5Å; A62-L65 PolarHBondContact O-N 3.02Å; K63-L65 VanDerWaalsContact C-N 3.28Å; K63-L65 PolarHBondContact O-N 2.74Å; L65-Q67 VanDerWaalsContact C-N 3.34Å; L65-L68 PolarHBondContact O-N 3.35Å; L65-R69 WeakPolarHBondContact O-CB 3.47Å; L65-R69 WeakPolarHBondContact O-CG 3.19Å; L65-R69 PolarHBondContact O-N 2.83Å; L65-V166 HydrophobicContact CD2-CG1 3.61Å; L65-V166 HydrophobicContact CG-CG1 4.33Å; L65-I170 HydrophobicContact CD2-CD1 3.58Å
66	V	90.4	Very high	89.5	Confident	23 Å²	23	66.1 Å²	66.1	14%	0.139	31%	0.305	C	S	.	.	H	α-helix	trans	-60	-46.2	174.3	172.7	0	0	0	0	110.5	A62 K63 L68 R69 K70 I162 V166	A62-V66 WeakPolarHBondContact O-CG2 3.33Å; A62-V66 PolarHBondContact O-N 2.85Å; K63-V66 PolarHBondContact O-N 3.2Å; V66-L68 VanDerWaalsContact C-N 3.34Å; V66-L68 PolarHBondContact O-N 3.18Å; V66-R69 PolarHBondContact O-N 2.93Å; V66-K70 PolarHBondContact O-N 3.38Å; V66-I162 HydrophobicContact CG1-CG2 4.15Å; V66-I162 HydrophobicContact CG2-CG2 4.06Å; V66-V166 HydrophobicContact CG2-CG2 3.89Å
67	Q	89	Confident	89.6	Confident	93 Å²	93	60.9 Å²	60.9	44%	0.435	29%	0.285	S	S	.	.	H	α-helix	trans	-61.7	-42.4	177.1	-69.9	-179.6	-7.4	0	0	112.2	K63 Q64 L65 K70 Q71 E158	K63-Q67 WeakPolarHBondContact O-CG 3.03Å; K63-Q67 PolarHBondContact O-N 3.38Å; K63-Q67 VanDerWaalsContact O-N 3.11Å; Q64-Q67 PolarHBondContact O-N 3.04Å; L65-Q67 VanDerWaalsContact C-N 3.34Å; Q67-K70 PolarHBondContact O-N 2.9Å; Q67-Q71 WeakPolarHBondContact O-CB 3.3Å; Q67-Q71 PolarHBondContact O-N 2.81Å; Q67-E158 WeakPolarHBondContact CG-OE1 3Å; Q67-E158 PolarHBondContact NE2-OE1 3.42Å
68	L	93.8	Very high	89.7	Confident	14 Å²	14	62.6 Å²	62.6	7%	0.073	29%	0.293	C	S	.	.	H	α-helix	trans	-63.1	-42	176.6	-168	78.4	0	0	0	111.5	L35 Q38 E39 M42 Q64 L65 V66 Q71 K72	L35-L68 HydrophobicContact CD2-CD1 3.53Å; L35-L68 HydrophobicContact CD2-CG 4.44Å; Q38-L68 HydrophobicContact CB-CD1 4.44Å; Q38-L68 HydrophobicContact CB-CD2 3.97Å; E39-L68 VanDerWaalsContact CA-CD2 3.42Å; E39-L68 HydrophobicContact CB-CD2 3.75Å; E39-L68 HydrophobicContact CG-CD2 4.47Å; E39-L68 VanDerWaalsContact N-CD2 3.31Å; M42-L68 HydrophobicContact CE-CD2 4.29Å; Q64-L68 WeakPolarHBondContact O-CB 3.4Å; Q64-L68 PolarHBondContact O-N 3.1Å; L65-L68 PolarHBondContact O-N 3.35Å; V66-L68 VanDerWaalsContact C-N 3.34Å; V66-L68 PolarHBondContact O-N 3.18Å; L68-Q71 PolarHBondContact O-N 3.45Å; L68-K72 WeakPolarHBondContact O-CB 3.33Å; L68-K72 PolarHBondContact O-N 2.87Å
69	R	91.2	Very high	89.9	Confident	47 Å²	47	63.1 Å²	63.1	18%	0.177	30%	0.296	C	S	.	.	H	α-helix	trans	-62.6	-42.3	174.4	-77.5	179.1	173.8	-178.3	2.9	111.7	E39 E43 L65 V66 K72 N73 E169	E39-R69 WeakPolarHBondContact OE1-CG 3.38Å; E39-R69 IonicContact OE1-CZ 3.2Å; E39-R69 IonicContact OE1-NE 3.58Å; E39-R69 PolarHBondContact OE1-NE 3.47Å; E43-R69 IonicContact OE1-NH2 2.58Å; E43-R69 PolarHBondContact OE1-NH2 3.36Å; L65-R69 WeakPolarHBondContact O-CB 3.47Å; L65-R69 WeakPolarHBondContact O-CG 3.19Å; L65-R69 PolarHBondContact O-N 2.83Å; V66-R69 PolarHBondContact O-N 2.93Å; R69-K72 WeakPolarHBondContact O-CB 3.42Å; R69-K72 PolarHBondContact O-N 3.44Å; R69-N73 PolarHBondContact O-N 2.92Å; R69-E169 IonicContact CZ-OE2 3.85Å; R69-E169 IonicContact NH1-OE2 2.92Å; R69-E169 PolarHBondContact NH1-OE2 3.43Å; R69-E169 IonicContact NH2-OE2 3.19Å
70	K	89.6	Confident	90	Very high	109 Å²	109	61.9 Å²	61.9	47%	0.474	30%	0.299	S	S	.	.	H	α-helix	trans	-62.3	-44	173.9	-171.3	172.7	-177.2	171.6	0	111.3	V66 Q67 N73 R74 S153	V66-K70 PolarHBondContact O-N 3.38Å; Q67-K70 PolarHBondContact O-N 2.9Å; K70-N73 PolarHBondContact O-N 3.26Å; K70-R74 WeakPolarHBondContact O-CB 3.4Å; K70-R74 PolarHBondContact O-N 3.27Å; K70-S153 WeakPolarHBondContact CE-O 3.5Å; K70-S153 PolarHBondContact NZ-O 3.28Å
71	Q	89.6	Confident	89.8	Confident	110 Å²	110	61 Å²	61	51%	0.514	29%	0.291	S	S	.	.	H	α-helix	trans	-61.8	-45.1	175.9	-171.3	179.9	12.3	0	0	111.5	L35 Q67 L68 N73 R74 T75	L35-Q71 HydrophobicContact CD1-CG 4.19Å; Q67-Q71 WeakPolarHBondContact O-CB 3.3Å; Q67-Q71 PolarHBondContact O-N 2.81Å; L68-Q71 PolarHBondContact O-N 3.45Å; Q71-N73 PolarHBondContact O-N 2.93Å; Q71-R74 WeakPolarHBondContact O-CB 3.36Å; Q71-R74 PolarHBondContact O-N 3.42Å; Q71-T75 WeakPolarHBondContact O-CG2 3.48Å; Q71-T75 PolarHBondContact O-N 2.93Å; Q71-T75 VanDerWaalsContact O-N 3.1Å
72	K	91.6	Very high	90	Very high	38 Å²	38	60.6 Å²	60.6	17%	0.165	29%	0.29	C	S	.	.	H	α-helix	trans	-57	-47.9	173.7	-173.9	-176.1	69	-176.7	0	110.8	R32 E36 E39 L68 R69 R74 T75 Y76	R32-K72 HydrophobicContact CG-CG 4.34Å; E36-K72 HydrophobicContact CG-CD 3.94Å; E39-K72 VanDerWaalsContact CD-NZ 3.34Å; E39-K72 IonicContact OE1-NZ 2.68Å; E39-K72 PolarHBondContact OE1-NZ 3.1Å; E39-K72 IonicContact OE2-NZ 3.99Å; E39-K72 PolarHBondContact OE2-NZ 3.26Å; L68-K72 WeakPolarHBondContact O-CB 3.33Å; L68-K72 PolarHBondContact O-N 2.87Å; R69-K72 WeakPolarHBondContact O-CB 3.42Å; R69-K72 PolarHBondContact O-N 3.44Å; K72-R74 PolarHBondContact O-N 2.82Å; K72-T75 WeakPolarHBondContact O-CB 3.47Å; K72-T75 PolarHBondContact O-N 3.37Å; K72-T75 VanDerWaalsContact O-N 3.11Å; K72-T75 PolarHBondContact O-OG1 3.4Å; K72-Y76 WeakPolarHBondContact O-CD2 3.45Å
73	N	88.9	Confident	90	Very high	103 Å²	103	64 Å²	64	55%	0.551	31%	0.311	S	S	*	.	H	α-helix	trans	-61.1	-43.2	177.2	-76.5	-2.6	0	0	0	112	R69 K70 Q71 T75 Y76	R69-N73 PolarHBondContact O-N 2.92Å; K70-N73 PolarHBondContact O-N 3.26Å; Q71-N73 PolarHBondContact O-N 2.93Å; N73-T75 PolarHBondContact O-N 3.26Å; N73-Y76 WeakPolarHBondContact O-CB 3.47Å; N73-Y76 PolarHBondContact O-N 2.94Å
74	R	88.3	Confident	90	Very high	144 Å²	144	61 Å²	61	54%	0.543	30%	0.303	S	S	.	.	H	α-helix	trans	-58.8	-30.9	175.6	-166.6	172.5	-177.4	140.8	2	112.5	K70 Q71 K72 Y76 A77 V78 F150	K70-R74 WeakPolarHBondContact O-CB 3.4Å; K70-R74 PolarHBondContact O-N 3.27Å; Q71-R74 WeakPolarHBondContact O-CB 3.36Å; Q71-R74 PolarHBondContact O-N 3.42Å; K72-R74 PolarHBondContact O-N 2.82Å; R74-Y76 PolarHBondContact O-N 3.29Å; R74-A77 PolarHBondContact O-N 3.44Å; R74-V78 HydrophobicContact CG-CG2 4.36Å; R74-V78 WeakPolarHBondContact O-CG2 3.42Å; R74-V78 PolarHBondContact O-N 3.46Å; R74-F150 HydrophobicContact CG-CE1 4.48Å
75	T	90.8	Very high	89.9	Confident	19 Å²	19	61 Å²	61	12%	0.117	30%	0.304	C	S	.	.	H	α-helix	trans	-62.7	-25.2	175.3	73.8	0	0	0	0	113.6	R32 L35 Q71 K72 N73 S79	R32-T75 PolarHBondContact NE-OG1 3.05Å; R32-T75 PolarHBondContact NH2-O 2.87Å; R32-T75 VanDerWaalsContact NH2-O 3.14Å; L35-T75 HydrophobicContact CD1-CG2 3.84Å; Q71-T75 WeakPolarHBondContact O-CG2 3.48Å; Q71-T75 PolarHBondContact O-N 2.93Å; Q71-T75 VanDerWaalsContact O-N 3.1Å; K72-T75 WeakPolarHBondContact O-CB 3.47Å; K72-T75 PolarHBondContact O-N 3.37Å; K72-T75 VanDerWaalsContact O-N 3.11Å; K72-T75 PolarHBondContact O-OG1 3.4Å; N73-T75 PolarHBondContact O-N 3.26Å; T75-S79 WeakPolarHBondContact O-CB 3.33Å; T75-S79 PolarHBondContact O-N 3.06Å
76	Y	89.4	Confident	89.8	Confident	118 Å²	118	62 Å²	62	46%	0.463	31%	0.311	S	S	.	.	H	α-helix	trans	-71.2	-44.8	174.4	-69.4	-88.2	0	0	0	111.3	R32 K72 N73 R74 S79 S80	R32-Y76 VanDerWaalsContact CZ-CE1 3.47Å; K72-Y76 WeakPolarHBondContact O-CD2 3.45Å; N73-Y76 WeakPolarHBondContact O-CB 3.47Å; N73-Y76 PolarHBondContact O-N 2.94Å; R74-Y76 PolarHBondContact O-N 3.29Å; Y76-S79 WeakPolarHBondContact O-CB 3.35Å; Y76-S79 PolarHBondContact O-N 2.97Å; Y76-S80 PolarHBondContact O-N 2.84Å
77	A	87.9	Confident	89.7	Confident	23 Å²	23	64.4 Å²	64.4	19%	0.19	33%	0.326	C	S	.	.	H	α-helix	trans	-62.5	-44.4	175.2	0	0	0	0	0	111.4	R74 S79 S80 K81 F150	R74-A77 PolarHBondContact O-N 3.44Å; A77-S79 PolarHBondContact O-N 3.33Å; A77-S80 WeakPolarHBondContact O-CB 3.49Å; A77-S80 PolarHBondContact O-N 2.94Å; A77-S80 VanDerWaalsContact O-N 3.17Å; A77-K81 PolarHBondContact O-N 2.79Å; A77-F150 HydrophobicContact CB-CE1 3.72Å; A77-F150 HydrophobicContact CB-CE2 4.25Å; A77-F150 HydrophobicContact CB-CZ 3.43Å; A77-F150 VanDerWaalsContact CB-CZ 3.43Å
78	V	90.2	Very high	89.6	Confident	58 Å²	58	64.6 Å²	64.6	35%	0.352	33%	0.327	S	S	.	.	H	α-helix	trans	-61.7	-42.5	175.5	176.5	0	0	0	0	111.5	I28 R74 S80 K81 V82	I28-V78 HydrophobicContact CD1-CG1 3.83Å; I28-V78 HydrophobicContact CG1-CG1 4.46Å; R74-V78 HydrophobicContact CG-CG2 4.36Å; R74-V78 WeakPolarHBondContact O-CG2 3.42Å; R74-V78 PolarHBondContact O-N 3.46Å; V78-S80 VanDerWaalsContact C-N 3.32Å; V78-S80 PolarHBondContact O-N 3.38Å; V78-K81 PolarHBondContact O-N 3.36Å; V78-V82 WeakPolarHBondContact O-CG2 3.33Å; V78-V82 PolarHBondContact O-N 3.42Å
79	S	91.1	Very high	89.3	Confident	19 Å²	19	64.7 Å²	64.7	13%	0.133	33%	0.328	C	S	.	.	H	α-helix	trans	-59.9	-40.8	174.2	175.8	0	0	0	0	112.3	Q25 T75 Y76 A77 T83	Q25-S79 PolarHBondContact NE2-OG 3.26Å; Q25-S79 PolarHBondContact OE1-O 2.75Å; T75-S79 WeakPolarHBondContact O-CB 3.33Å; T75-S79 PolarHBondContact O-N 3.06Å; Y76-S79 WeakPolarHBondContact O-CB 3.35Å; Y76-S79 PolarHBondContact O-N 2.97Å; A77-S79 PolarHBondContact O-N 3.33Å; S79-T83 WeakPolarHBondContact O-CB 3.27Å; S79-T83 PolarHBondContact O-N 2.88Å; S79-T83 PolarHBondContact O-OG1 3.36Å
80	S	89	Confident	89.1	Confident	61 Å²	61	68 Å²	68	43%	0.427	34%	0.344	S	S	.	.	H	α-helix	trans	-63.4	-46.5	175.6	-172.2	0	0	0	0	111	Y76 A77 V78 V82 T83 S84	Y76-S80 PolarHBondContact O-N 2.84Å; A77-S80 WeakPolarHBondContact O-CB 3.49Å; A77-S80 PolarHBondContact O-N 2.94Å; A77-S80 VanDerWaalsContact O-N 3.17Å; V78-S80 VanDerWaalsContact C-N 3.32Å; V78-S80 PolarHBondContact O-N 3.38Å; S80-V82 PolarHBondContact O-N 3.06Å; S80-T83 CarbonylContact O-C 3.56Å; S80-T83 WeakPolarHBondContact O-CA 3.32Å; S80-T83 WeakPolarHBondContact O-CB 3.47Å; S80-T83 PolarHBondContact O-N 3.23Å; S80-S84 PolarHBondContact O-N 3.26Å
81	K	87.3	Confident	89	Confident	84 Å²	84	65.8 Å²	65.8	37%	0.365	34%	0.339	S	S	.	.	H	α-helix	trans	-59.7	-44.2	178.3	-162.4	159.9	-171.1	158.6	0	112	A77 V78 T83 S84 M85 D147 F150	A77-K81 PolarHBondContact O-N 2.79Å; V78-K81 PolarHBondContact O-N 3.36Å; K81-T83 VanDerWaalsContact C-N 3.32Å; K81-T83 PolarHBondContact O-N 3.45Å; K81-S84 WeakPolarHBondContact O-CB 3.49Å; K81-S84 PolarHBondContact O-N 2.93Å; K81-M85 WeakPolarHBondContact O-CG 3.29Å; K81-M85 PolarHBondContact O-N 3.39Å; K81-D147 IonicContact NZ-OD1 3.52Å; K81-F150 HydrophobicContact CD-CE2 4.48Å
82	V	91.8	Very high	88.7	Confident	15 Å²	15	64.7 Å²	64.7	9%	0.091	34%	0.335	C	S	.	.	H	α-helix	trans	-62.8	-38.4	174.5	172.2	0	0	0	0	112	L21 T24 Q25 I28 V78 S80 M85 S86	L21-V82 HydrophobicContact CD2-CG1 4.28Å; T24-V82 HydrophobicContact CG2-CG2 4.16Å; Q25-V82 HydrophobicContact CB-CG1 4.29Å; I28-V82 HydrophobicContact CD1-CB 4.39Å; I28-V82 HydrophobicContact CD1-CG2 3.76Å; V78-V82 WeakPolarHBondContact O-CG2 3.33Å; V78-V82 PolarHBondContact O-N 3.42Å; S80-V82 PolarHBondContact O-N 3.06Å; V82-M85 PolarHBondContact O-N 3.5Å; V82-S86 PolarHBondContact O-N 2.94Å
83	T	88.9	Confident	88.4	Confident	72 Å²	72	64.1 Å²	64.1	44%	0.442	33%	0.334	S	S	.	.	H	α-helix	trans	-66	-42.3	176.1	-59.3	0	0	0	0	111.4	S79 S80 K81 S86 T87	S79-T83 WeakPolarHBondContact O-CB 3.27Å; S79-T83 PolarHBondContact O-N 2.88Å; S79-T83 PolarHBondContact O-OG1 3.36Å; S80-T83 CarbonylContact O-C 3.56Å; S80-T83 WeakPolarHBondContact O-CA 3.32Å; S80-T83 WeakPolarHBondContact O-CB 3.47Å; S80-T83 PolarHBondContact O-N 3.23Å; K81-T83 VanDerWaalsContact C-N 3.32Å; K81-T83 PolarHBondContact O-N 3.45Å; T83-S86 WeakPolarHBondContact O-CB 3.46Å; T83-S86 PolarHBondContact O-N 3.02Å; T83-T87 PolarHBondContact O-N 3.17Å; T83-T87 PolarHBondContact O-OG1 3.02Å
84	S	89.6	Confident	88.2	Confident	43 Å²	43	62.8 Å²	62.8	30%	0.301	33%	0.333	S	S	.	.	H	α-helix	trans	-58.9	-49.9	173.5	-176	0	0	0	0	111.3	S80 K81 S86 T87 Q88	S80-S84 PolarHBondContact O-N 3.26Å; K81-S84 WeakPolarHBondContact O-CB 3.49Å; K81-S84 PolarHBondContact O-N 2.93Å; S84-S86 VanDerWaalsContact C-N 3.25Å; S84-S86 PolarHBondContact O-N 3.07Å; S84-T87 CarbonylContact O-C 3.41Å; S84-T87 WeakPolarHBondContact O-CA 3.38Å; S84-T87 WeakPolarHBondContact O-CB 3.43Å; S84-T87 PolarHBondContact O-N 3.09Å; S84-Q88 PolarHBondContact O-N 3.2Å
85	M	88	Confident	88	Confident	88 Å²	88	59.1 Å²	59.1	43%	0.433	32%	0.322	S	S	.	.	H	α-helix	trans	-58.3	-36.6	175	-68.7	175	75.2	0	0	112.4	L21 K81 V82 T87 Q88 T89	L21-M85 HydrophobicContact CD1-CB 4.31Å; L21-M85 HydrophobicContact CD2-CB 4.18Å; L21-M85 HydrophobicContact CD2-CE 4.35Å; K81-M85 WeakPolarHBondContact O-CG 3.29Å; K81-M85 PolarHBondContact O-N 3.39Å; V82-M85 PolarHBondContact O-N 3.5Å; M85-T87 VanDerWaalsContact C-N 3.35Å; M85-Q88 PolarHBondContact O-N 3.02Å; M85-T89 WeakPolarHBondContact O-CB 3.47Å; M85-T89 PolarHBondContact O-N 3.25Å; M85-T89 PolarHBondContact O-OG1 3.24Å
86	S	89.3	Confident	87.6	Confident	21 Å²	21	61.6 Å²	61.6	15%	0.147	33%	0.333	C	S	.	.	H	α-helix	trans	-65.1	-38.9	174.7	-172.6	0	0	0	0	112.1	V82 T83 S84 K90	V82-S86 PolarHBondContact O-N 2.94Å; T83-S86 WeakPolarHBondContact O-CB 3.46Å; T83-S86 PolarHBondContact O-N 3.02Å; S84-S86 VanDerWaalsContact C-N 3.25Å; S84-S86 PolarHBondContact O-N 3.07Å; S86-K90 WeakPolarHBondContact O-CG 3.48Å; S86-K90 PolarHBondContact O-N 3.4Å; S86-K90 VanDerWaalsContact O-N 3.1Å
87	T	89.4	Confident	87.4	Confident	74 Å²	74	62.3 Å²	62.3	45%	0.454	34%	0.338	S	S	.	.	H	α-helix	trans	-67.1	-46.2	174.6	-61	0	0	0	0	111	T83 S84 M85 T89 K90 V91	T83-T87 PolarHBondContact O-N 3.17Å; T83-T87 PolarHBondContact O-OG1 3.02Å; S84-T87 CarbonylContact O-C 3.41Å; S84-T87 WeakPolarHBondContact O-CA 3.38Å; S84-T87 WeakPolarHBondContact O-CB 3.43Å; S84-T87 PolarHBondContact O-N 3.09Å; M85-T87 VanDerWaalsContact C-N 3.35Å; T87-T89 VanDerWaalsContact C-N 3.29Å; T87-T89 PolarHBondContact O-N 2.67Å; T87-K90 WeakPolarHBondContact O-CB 3.42Å; T87-K90 PolarHBondContact O-N 2.83Å; T87-V91 WeakPolarHBondContact O-CG2 3.44Å; T87-V91 PolarHBondContact O-N 2.87Å
88	Q	85.8	Confident	87.2	Confident	96 Å²	96	65.6 Å²	65.6	45%	0.449	35%	0.351	S	S	.	.	H	α-helix	trans	-57.7	-42.6	175.2	-168.3	-179	26.8	0	0	111.5	S84 M85 K90 V91 M92 E139	S84-Q88 PolarHBondContact O-N 3.2Å; M85-Q88 PolarHBondContact O-N 3.02Å; Q88-K90 VanDerWaalsContact C-N 3.32Å; Q88-K90 PolarHBondContact O-N 3.36Å; Q88-V91 WeakPolarHBondContact O-CB 3.43Å; Q88-V91 PolarHBondContact O-N 3.25Å; Q88-M92 WeakPolarHBondContact O-CB 3.34Å; Q88-M92 PolarHBondContact O-N 2.96Å; Q88-E139 VanDerWaalsContact CD-OE1 3.29Å; Q88-E139 WeakPolarHBondContact CG-OE1 3.17Å; Q88-E139 PolarHBondContact NE2-OE1 3.01Å
89	T	86.8	Confident	86.7	Confident	16 Å²	16	65.1 Å²	65.1	10%	0.098	35%	0.353	C	S	.	.	H	α-helix	trans	-61.8	-38	175.3	-57.3	0	0	0	0	112	I14 S18 L21 M85 T87 M92 N93	I14-T89 HydrophobicContact CG2-CG2 3.79Å; S18-T89 WeakPolarHBondContact OG-CG2 3.01Å; L21-T89 WeakPolarHBondContact CD1-OG1 3.4Å; M85-T89 WeakPolarHBondContact O-CB 3.47Å; M85-T89 PolarHBondContact O-N 3.25Å; M85-T89 PolarHBondContact O-OG1 3.24Å; T87-T89 VanDerWaalsContact C-N 3.29Å; T87-T89 PolarHBondContact O-N 2.67Å; T89-M92 PolarHBondContact O-N 3.19Å; T89-N93 PolarHBondContact O-N 2.96Å
90	K	87.9	Confident	86.3	Confident	118 Å²	118	66 Å²	66	51%	0.513	37%	0.365	S	S	.	.	H	α-helix	trans	-66.9	-42.1	174.1	-71.7	171.1	-172.3	167.5	0	111.8	S86 T87 Q88 M92 N93 S94	S86-K90 WeakPolarHBondContact O-CG 3.48Å; S86-K90 PolarHBondContact O-N 3.4Å; S86-K90 VanDerWaalsContact O-N 3.1Å; T87-K90 WeakPolarHBondContact O-CB 3.42Å; T87-K90 PolarHBondContact O-N 2.83Å; Q88-K90 VanDerWaalsContact C-N 3.32Å; Q88-K90 PolarHBondContact O-N 3.36Å; K90-M92 VanDerWaalsContact C-N 3.33Å; K90-N93 WeakPolarHBondContact O-CB 3.44Å; K90-N93 PolarHBondContact O-N 2.95Å; K90-S94 PolarHBondContact O-N 3.21Å; K90-S94 PolarHBondContact O-OG 3.17Å
91	V	87.4	Confident	86	Confident	62 Å²	62	65.7 Å²	65.7	38%	0.376	37%	0.366	S	S	.	.	H	α-helix	trans	-60.3	-46.7	175.1	172.5	0	0	0	0	109.6	T87 Q88 N93 S94 Q95 M135	T87-V91 WeakPolarHBondContact O-CG2 3.44Å; T87-V91 PolarHBondContact O-N 2.87Å; Q88-V91 WeakPolarHBondContact O-CB 3.43Å; Q88-V91 PolarHBondContact O-N 3.25Å; V91-N93 VanDerWaalsContact C-N 3.33Å; V91-N93 PolarHBondContact O-N 3.46Å; V91-S94 WeakPolarHBondContact O-CB 3.28Å; V91-S94 PolarHBondContact O-N 3.25Å; V91-S94 VanDerWaalsContact O-N 3.13Å; V91-Q95 HydrophobicContact CG1-CG 4.33Å; V91-Q95 VanDerWaalsContact CG1-NE2 3.35Å; V91-Q95 WeakPolarHBondContact O-CG 3.26Å; V91-Q95 PolarHBondContact O-N 2.98Å; V91-M135 HydrophobicContact CG1-SD 4.46Å
92	M	82.7	Confident	85.7	Confident	87 Å²	87	66.1 Å²	66.1	43%	0.429	37%	0.371	S	S	.	.	H	α-helix	trans	-58.5	-42.1	175.3	-164	-175.4	-147.2	0	0	111.9	I14 Q88 T89 K90 S94 Q95 M96	I14-M92 HydrophobicContact CD1-CG 4.3Å; I14-M92 HydrophobicContact CD1-SD 4.47Å; Q88-M92 WeakPolarHBondContact O-CB 3.34Å; Q88-M92 PolarHBondContact O-N 2.96Å; T89-M92 PolarHBondContact O-N 3.19Å; K90-M92 VanDerWaalsContact C-N 3.33Å; M92-S94 PolarHBondContact O-N 3.44Å; M92-Q95 PolarHBondContact O-N 2.68Å; M92-M96 WeakPolarHBondContact O-CB 3.41Å; M92-M96 VanDerWaalsContact O-CG 3.27Å; M92-M96 WeakPolarHBondContact O-CG 3.44Å; M92-M96 PolarHBondContact O-N 2.6Å
93	N	85.4	Confident	85.2	Confident	25 Å²	25	68.2 Å²	68.2	13%	0.134	39%	0.386	C	S	.	.	H	α-helix	trans	-59.3	-46.1	174.6	-165.7	-81.2	0	0	0	112	I14 T89 K90 V91 M96 K97	I14-N93 HydrophobicContact CG2-CB 3.82Å; I14-N93 WeakPolarHBondContact CG2-ND2 3.34Å; T89-N93 PolarHBondContact O-N 2.96Å; K90-N93 WeakPolarHBondContact O-CB 3.44Å; K90-N93 PolarHBondContact O-N 2.95Å; V91-N93 VanDerWaalsContact C-N 3.33Å; V91-N93 PolarHBondContact O-N 3.46Å; N93-M96 PolarHBondContact O-N 2.98Å; N93-K97 WeakPolarHBondContact O-CG 3.49Å; N93-K97 PolarHBondContact O-N 3.11Å; N93-K97 WeakPolarHBondContact OD1-CE 3.44Å; N93-K97 PolarHBondContact OD1-NZ 2.96Å
94	S	86.1	Confident	85	Confident	76 Å²	76	69 Å²	69	53%	0.531	39%	0.391	S	S	.	.	H	α-helix	trans	-65.1	-42.1	178.4	-63.7	0	0	0	0	111.7	K90 V91 M92 K97 M98	K90-S94 PolarHBondContact O-N 3.21Å; K90-S94 PolarHBondContact O-OG 3.17Å; V91-S94 WeakPolarHBondContact O-CB 3.28Å; V91-S94 PolarHBondContact O-N 3.25Å; V91-S94 VanDerWaalsContact O-N 3.13Å; M92-S94 PolarHBondContact O-N 3.44Å; S94-K97 PolarHBondContact O-N 3.14Å; S94-M98 WeakPolarHBondContact O-CB 3.38Å; S94-M98 PolarHBondContact O-N 3.1Å
95	Q	83.4	Confident	84.5	Confident	67 Å²	67	70.9 Å²	70.9	31%	0.313	40%	0.401	S	S	.	.	H	α-helix	trans	-62.2	-41.1	174.5	-73.1	176.4	9.5	0	0	111.8	V91 M92 M98 A99	V91-Q95 HydrophobicContact CG1-CG 4.33Å; V91-Q95 VanDerWaalsContact CG1-NE2 3.35Å; V91-Q95 WeakPolarHBondContact O-CG 3.26Å; V91-Q95 PolarHBondContact O-N 2.98Å; M92-Q95 PolarHBondContact O-N 2.68Å; Q95-M98 CarbonylContact O-C 3.21Å; Q95-M98 PolarHBondContact O-N 3.3Å; Q95-A99 WeakPolarHBondContact O-CB 3.41Å; Q95-A99 PolarHBondContact O-N 3.2Å
96	M	82.8	Confident	84	Confident	71 Å²	71	69.2 Å²	69.2	35%	0.35	40%	0.401	S	S	.	.	H	α-helix	trans	-65.2	-41.7	176.9	-72.7	-62.3	136.5	0	0	112.2	V10 I14 M92 N93 M98 A99 G100	V10-M96 HydrophobicContact CG1-CG 4.16Å; V10-M96 HydrophobicContact CG1-SD 4.04Å; I14-M96 HydrophobicContact CD1-CB 4.39Å; I14-M96 HydrophobicContact CD1-CG 3.8Å; M92-M96 WeakPolarHBondContact O-CB 3.41Å; M92-M96 VanDerWaalsContact O-CG 3.27Å; M92-M96 WeakPolarHBondContact O-CG 3.44Å; M92-M96 PolarHBondContact O-N 2.6Å; N93-M96 PolarHBondContact O-N 2.98Å; M96-M98 VanDerWaalsContact C-N 3.34Å; M96-A99 PolarHBondContact O-N 2.91Å; M96-G100 PolarHBondContact O-N 3.39Å
97	K	85.4	Confident	83.7	Confident	132 Å²	132	75 Å²	75	57%	0.574	42%	0.423	S	S	*	.	H	α-helix	trans	-62	-43	172.5	-74.1	173.9	177.8	160.6	0	111.8	N93 S94 A99 G100 A101	N93-K97 WeakPolarHBondContact O-CG 3.49Å; N93-K97 PolarHBondContact O-N 3.11Å; N93-K97 WeakPolarHBondContact OD1-CE 3.44Å; N93-K97 PolarHBondContact OD1-NZ 2.96Å; S94-K97 PolarHBondContact O-N 3.14Å; K97-A99 VanDerWaalsContact C-N 3.34Å; K97-G100 PolarHBondContact O-N 3.45Å; K97-A101 WeakPolarHBondContact O-CB 3.43Å; K97-A101 PolarHBondContact O-N 2.87Å
98	M	82.5	Confident	83.3	Confident	92 Å²	92	75.5 Å²	75.5	45%	0.453	43%	0.427	S	S	.	.	H	α-helix	trans	-63.2	-41.3	175.4	-169.9	171.7	74.2	0	0	111	S94 Q95 M96 G100 A101 M102 F128	S94-M98 WeakPolarHBondContact O-CB 3.38Å; S94-M98 PolarHBondContact O-N 3.1Å; Q95-M98 CarbonylContact O-C 3.21Å; Q95-M98 PolarHBondContact O-N 3.3Å; M96-M98 VanDerWaalsContact C-N 3.34Å; M98-G100 PolarHBondContact O-N 3.15Å; M98-A101 PolarHBondContact O-N 3.1Å; M98-M102 HydrophobicContact CE-SD 4.4Å; M98-M102 HydrophobicContact CG-CG 4.26Å; M98-M102 HydrophobicContact CG-SD 4.01Å; M98-M102 VanDerWaalsContact O-CB 3.26Å; M98-M102 WeakPolarHBondContact O-CB 3.45Å; M98-M102 WeakPolarHBondContact O-CG 3.43Å; M98-M102 PolarHBondContact O-N 3.41Å; M98-F128 HydrophobicContact CE-CE2 4.23Å
99	A	79.8	Confident	82.6	Confident	49 Å²	49	74.6 Å²	74.6	41%	0.405	42%	0.423	S	S	.	.	H	α-helix	trans	-64.4	-38.1	175	0	0	0	0	0	112.2	Q95 M96 K97 S103	Q95-A99 WeakPolarHBondContact O-CB 3.41Å; Q95-A99 PolarHBondContact O-N 3.2Å; M96-A99 PolarHBondContact O-N 2.91Å; K97-A99 VanDerWaalsContact C-N 3.34Å; A99-S103 WeakPolarHBondContact O-CB 3.24Å; A99-S103 PolarHBondContact O-N 2.9Å
100	G	83.9	Confident	82.1	Confident	38 Å²	38	80.8 Å²	80.8	39%	0.392	45%	0.451	S	S	.	.	H	α-helix	trans	-64.4	-43.9	172.4	0	0	0	0	0	112.5	M96 K97 M98 S103 T104	M96-G100 PolarHBondContact O-N 3.39Å; K97-G100 PolarHBondContact O-N 3.45Å; M98-G100 PolarHBondContact O-N 3.15Å; G100-S103 PolarHBondContact O-N 3.08Å; G100-T104 PolarHBondContact O-N 3.44Å; G100-T104 VanDerWaalsContact O-N 3.08Å; G100-T104 PolarHBondContact O-OG1 3.47Å
101	A	82.8	Confident	81.4	Confident	54 Å²	54	78.6 Å²	78.6	45%	0.446	46%	0.455	S	S	.	.	H	α-helix	trans	-63.6	-49.1	174.4	0	0	0	0	0	111.1	K97 M98 S103 T104 T105	K97-A101 WeakPolarHBondContact O-CB 3.43Å; K97-A101 PolarHBondContact O-N 2.87Å; M98-A101 PolarHBondContact O-N 3.1Å; A101-S103 VanDerWaalsContact C-N 3.3Å; A101-S103 PolarHBondContact O-N 3.33Å; A101-T104 CarbonylContact O-C 3.53Å; A101-T104 WeakPolarHBondContact O-CA 3.49Å; A101-T104 WeakPolarHBondContact O-CB 3.32Å; A101-T104 PolarHBondContact O-N 2.84Å; A101-T105 WeakPolarHBondContact O-CB 3.46Å; A101-T105 PolarHBondContact O-N 2.94Å; A101-T105 PolarHBondContact O-OG1 3.26Å; A101-T105 VanDerWaalsContact O-OG1 3.06Å
102	M	80.3	Confident	80.4	Confident	93 Å²	93	79 Å²	79	46%	0.458	46%	0.457	S	S	.	.	H	α-helix	trans	-61.1	-35.1	175.2	-73.8	176.6	116	0	0	112.2	M98 T104 T105 A106 F128	M98-M102 HydrophobicContact CE-SD 4.4Å; M98-M102 HydrophobicContact CG-CG 4.26Å; M98-M102 HydrophobicContact CG-SD 4.01Å; M98-M102 VanDerWaalsContact O-CB 3.26Å; M98-M102 WeakPolarHBondContact O-CB 3.45Å; M98-M102 WeakPolarHBondContact O-CG 3.43Å; M98-M102 PolarHBondContact O-N 3.41Å; M102-T104 VanDerWaalsContact C-N 3.32Å; M102-T105 CarbonylContact O-C 3.59Å; M102-A106 WeakPolarHBondContact O-CA 3.49Å; M102-A106 WeakPolarHBondContact O-CB 3.19Å; M102-A106 PolarHBondContact O-N 3.32Å; M102-F128 HydrophobicContact CE-CE2 4.37Å
103	S	81.3	Confident	79.3	Confident	58 Å²	58	78.5 Å²	78.5	41%	0.406	46%	0.456	S	S	.	.	H	α-helix	trans	-64.3	-40.5	173.4	-179.9	0	0	0	0	111	A99 G100 A101 A106 K107	A99-S103 WeakPolarHBondContact O-CB 3.24Å; A99-S103 PolarHBondContact O-N 2.9Å; G100-S103 PolarHBondContact O-N 3.08Å; A101-S103 VanDerWaalsContact C-N 3.3Å; A101-S103 PolarHBondContact O-N 3.33Å; S103-A106 PolarHBondContact O-N 3Å; S103-K107 VanDerWaalsContact O-CG 3.31Å; S103-K107 WeakPolarHBondContact O-CG 3.49Å; S103-K107 PolarHBondContact O-N 3.11Å
104	T	84.9	Confident	78.2	Confident	89 Å²	89	86.6 Å²	86.6	55%	0.546	49%	0.49	S	S	.	.	H	α-helix	trans	-69.1	-48.3	176.7	-51.6	0	0	0	0	110.4	G100 A101 M102 A106 K107 T108	G100-T104 PolarHBondContact O-N 3.44Å; G100-T104 VanDerWaalsContact O-N 3.08Å; G100-T104 PolarHBondContact O-OG1 3.47Å; A101-T104 CarbonylContact O-C 3.53Å; A101-T104 WeakPolarHBondContact O-CA 3.49Å; A101-T104 WeakPolarHBondContact O-CB 3.32Å; A101-T104 PolarHBondContact O-N 2.84Å; M102-T104 VanDerWaalsContact C-N 3.32Å; T104-A106 VanDerWaalsContact C-N 3.31Å; T104-A106 PolarHBondContact O-N 3.17Å; T104-K107 WeakPolarHBondContact O-CB 3.43Å; T104-K107 PolarHBondContact O-N 2.88Å; T104-T108 PolarHBondContact O-N 3.32Å; T104-T108 PolarHBondContact O-OG1 3.1Å; T104-T108 VanDerWaalsContact O-OG1 3.1Å
105	T	78.6	Confident	77	Confident	83 Å²	83	92.4 Å²	92.4	51%	0.509	51%	0.506	S	S	.	.	H	α-helix	trans	-60.5	-38.7	173.9	-56.5	0	0	0	0	111.4	A101 M102 T108 M109	A101-T105 WeakPolarHBondContact O-CB 3.46Å; A101-T105 PolarHBondContact O-N 2.94Å; A101-T105 PolarHBondContact O-OG1 3.26Å; A101-T105 VanDerWaalsContact O-OG1 3.06Å; M102-T105 CarbonylContact O-C 3.59Å; T105-T108 CarbonylContact O-C 3.59Å; T105-T108 PolarHBondContact O-N 2.87Å; T105-M109 WeakPolarHBondContact O-CA 3.46Å; T105-M109 WeakPolarHBondContact O-CB 3.35Å; T105-M109 PolarHBondContact O-N 3.25Å
106	A	78	Confident	75.8	Confident	53 Å²	53	94.5 Å²	94.5	44%	0.438	52%	0.517	S	S	.	.	H	α-helix	trans	-68.3	-37.3	177.3	0	0	0	0	0	111	M102 S103 T104 M109 Q110	M102-A106 WeakPolarHBondContact O-CA 3.49Å; M102-A106 WeakPolarHBondContact O-CB 3.19Å; M102-A106 PolarHBondContact O-N 3.32Å; S103-A106 PolarHBondContact O-N 3Å; T104-A106 VanDerWaalsContact C-N 3.31Å; T104-A106 PolarHBondContact O-N 3.17Å; A106-M109 CarbonylContact O-C 3.57Å; A106-M109 PolarHBondContact O-N 3.18Å; A106-Q110 WeakPolarHBondContact O-CB 3.42Å; A106-Q110 PolarHBondContact O-N 2.58Å
107	K	83.5	Confident	74.7	Confident	141 Å²	141	96.3 Å²	96.3	61%	0.613	53%	0.528	S	S	*	.	H	α-helix	trans	-62.8	-45.2	170.8	-73.8	172.4	-176.6	177.4	0	111.4	S103 T104 Q110 A111	S103-K107 VanDerWaalsContact O-CG 3.31Å; S103-K107 WeakPolarHBondContact O-CG 3.49Å; S103-K107 PolarHBondContact O-N 3.11Å; T104-K107 WeakPolarHBondContact O-CB 3.43Å; T104-K107 PolarHBondContact O-N 2.88Å; K107-Q110 PolarHBondContact O-N 3.21Å; K107-A111 PolarHBondContact O-N 3.14Å; K107-A111 VanDerWaalsContact O-N 3.12Å
108	T	79.6	Confident	73.8	Confident	86 Å²	86	94.5 Å²	94.5	53%	0.528	53%	0.53	S	S	.	.	H	α-helix	trans	-64.9	-42.6	175.2	-52.2	0	0	0	0	111.3	T104 T105 Q110 A111 V112	T104-T108 PolarHBondContact O-N 3.32Å; T104-T108 PolarHBondContact O-OG1 3.1Å; T104-T108 VanDerWaalsContact O-OG1 3.1Å; T105-T108 CarbonylContact O-C 3.59Å; T105-T108 PolarHBondContact O-N 2.87Å; T108-Q110 VanDerWaalsContact C-N 3.34Å; T108-Q110 PolarHBondContact O-N 3.44Å; T108-A111 CarbonylContact O-C 3.59Å; T108-A111 WeakPolarHBondContact O-CA 3.35Å; T108-A111 WeakPolarHBondContact O-CB 3.42Å; T108-A111 PolarHBondContact O-N 2.76Å; T108-V112 VanDerWaalsContact O-CG2 3.29Å; T108-V112 WeakPolarHBondContact O-CG2 3.46Å; T108-V112 PolarHBondContact O-N 3.07Å
109	M	72.6	Confident	73.1	Confident	77 Å²	77	98.1 Å²	98.1	38%	0.379	55%	0.546	S	S	.	.	H	α-helix	trans	-70	-32.3	179.9	-169.9	173.1	165.4	0	0	110.2	T105 A106 A111 V112 N113 T121	T105-M109 WeakPolarHBondContact O-CA 3.46Å; T105-M109 WeakPolarHBondContact O-CB 3.35Å; T105-M109 PolarHBondContact O-N 3.25Å; A106-M109 CarbonylContact O-C 3.57Å; A106-M109 PolarHBondContact O-N 3.18Å; M109-A111 VanDerWaalsContact C-N 3.34Å; M109-V112 CarbonylContact O-C 3.57Å; M109-V112 PolarHBondContact O-N 3.03Å; M109-N113 WeakPolarHBondContact O-CA 3.43Å; M109-N113 WeakPolarHBondContact O-CB 3.48Å; M109-N113 PolarHBondContact O-N 2.86Å; M109-T121 HydrophobicContact CE-CG2 3.91Å
110	Q	75.3	Confident	72.5	Confident	146 Å²	146	103.4 Å²	103.4	68%	0.682	56%	0.56	S	S	*	*	H	α-helix	trans	-67.7	-36.9	172	-164.1	177.1	30.5	0	0	111	A106 K107 T108 V112 K114	A106-Q110 WeakPolarHBondContact O-CB 3.42Å; A106-Q110 PolarHBondContact O-N 2.58Å; K107-Q110 PolarHBondContact O-N 3.21Å; T108-Q110 VanDerWaalsContact C-N 3.34Å; T108-Q110 PolarHBondContact O-N 3.44Å; Q110-V112 VanDerWaalsContact C-N 3.32Å; Q110-K114 PolarHBondContact O-N 3.39Å
111	A	74.2	Confident	71.6	Confident	71 Å²	71	104.4 Å²	104.4	59%	0.587	56%	0.558	S	S	*	*	H	α-helix	trans	-66.3	-33.2	170.1	0	0	0	0	0	112.4	K107 T108 M109	K107-A111 PolarHBondContact O-N 3.14Å; K107-A111 VanDerWaalsContact O-N 3.12Å; T108-A111 CarbonylContact O-C 3.59Å; T108-A111 WeakPolarHBondContact O-CA 3.35Å; T108-A111 WeakPolarHBondContact O-CB 3.42Å; T108-A111 PolarHBondContact O-N 2.76Å; M109-A111 VanDerWaalsContact C-N 3.34Å
112	V	65.8	Low	70.9	Confident	71 Å²	71	108.1 Å²	108.1	43%	0.43	57%	0.57	S	S	.	*	H	α-helix	trans	-83.2	-29.7	176.3	173	0	0	0	0	112.9	T108 M109 Q110 K114 K115 M116	T108-V112 VanDerWaalsContact O-CG2 3.29Å; T108-V112 WeakPolarHBondContact O-CG2 3.46Å; T108-V112 PolarHBondContact O-N 3.07Å; M109-V112 CarbonylContact O-C 3.57Å; M109-V112 PolarHBondContact O-N 3.03Å; Q110-V112 VanDerWaalsContact C-N 3.32Å; V112-K114 VanDerWaalsContact C-N 3.28Å; V112-K114 PolarHBondContact O-N 3.32Å; V112-K115 CarbonylContact O-C 3.6Å; V112-K115 WeakPolarHBondContact O-CA 3.45Å; V112-K115 WeakPolarHBondContact O-CB 3.46Å; V112-K115 PolarHBondContact O-N 2.89Å; V112-M116 HydrophobicContact CG1-CB 4.26Å; V112-M116 HydrophobicContact CG1-SD 4.12Å; V112-M116 PolarHBondContact O-N 2.95Å; V112-M116 VanDerWaalsContact O-N 3.11Å
113	N	59.3	Low	70.6	Confident	77 Å²	77	110.5 Å²	110.5	41%	0.412	58%	0.578	S	S	.	*	H	α-helix	trans	-77.9	-16.3	-177.8	-162	59.8	0	0	0	111.2	M109 K115 M116	M109-N113 WeakPolarHBondContact O-CA 3.43Å; M109-N113 WeakPolarHBondContact O-CB 3.48Å; M109-N113 PolarHBondContact O-N 2.86Å; N113-K115 PolarHBondContact O-N 2.65Å; N113-K115 VanDerWaalsContact O-N 3.14Å; N113-M116 PolarHBondContact O-N 3.34Å
114	K	63.3	Low	70.1	Confident	194 Å²	194	112.4 Å²	112.4	84%	0.843	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.4	-11.7	155.4	-99.9	-174.8	175	-177.2	0	113.2	Q110 V112	Q110-K114 PolarHBondContact O-N 3.39Å; V112-K114 VanDerWaalsContact C-N 3.28Å; V112-K114 PolarHBondContact O-N 3.32Å
115	K	59.6	Low	69.5	Low	198 Å²	198	114 Å²	114	86%	0.861	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.7	11.9	-180	-64.3	-166.2	175.1	-171.5	0	114	V112 N113	V112-K115 CarbonylContact O-C 3.6Å; V112-K115 WeakPolarHBondContact O-CA 3.45Å; V112-K115 WeakPolarHBondContact O-CB 3.46Å; V112-K115 PolarHBondContact O-N 2.89Å; N113-K115 PolarHBondContact O-N 2.65Å; N113-K115 VanDerWaalsContact O-N 3.14Å
116	M	58.6	Low	69.4	Low	111 Å²	111	116.3 Å²	116.3	55%	0.547	60%	0.595	S	S	.	*	S	Bend	trans	-136.3	157.1	-172.9	-151.5	178.2	164.7	0	0	113.8	V112 N113	V112-M116 HydrophobicContact CG1-CB 4.26Å; V112-M116 HydrophobicContact CG1-SD 4.12Å; V112-M116 PolarHBondContact O-N 2.95Å; V112-M116 VanDerWaalsContact O-N 3.11Å; N113-M116 PolarHBondContact O-N 3.34Å
117	D	59.2	Low	69.4	Low	110 Å²	110	117.9 Å²	117.9	59%	0.588	60%	0.596	S	S	*	*			trans	-86.2	124.3	-161.4	-157.6	-30	0	0	0	114	Q119	D117-Q119 PolarHBondContact O-N 2.73Å
118	P	66.2	Low	68.9	Low	94 Å²	94	115.8 Å²	115.8	61%	0.61	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-20.1	-169	21.3	-33.4	0	0	0	116.8	K120 T121	P118-K120 PolarHBondContact O-N 3.36Å; P118-T121 PolarHBondContact O-N 3.28Å
119	Q	68.8	Low	68.5	Low	168 Å²	168	117.5 Å²	117.5	79%	0.785	59%	0.589	S	S	*	*	H	α-helix	trans	-70	-28.7	-172.9	-71	-152.4	-60.2	0	0	114.7	D117	D117-Q119 PolarHBondContact O-N 2.73Å
120	K	65.8	Low	68.7	Low	160 Å²	160	121.4 Å²	121.4	70%	0.696	60%	0.604	S	S	*	*	H	α-helix	trans	-76.2	-29.8	-179.5	-73.8	-178.5	178.5	178.1	0	112.8	P118 K123 T124	P118-K120 PolarHBondContact O-N 3.36Å; K120-K123 PolarHBondContact O-N 3.39Å; K120-T124 PolarHBondContact O-N 3.39Å; K120-T124 PolarHBondContact O-OG1 2.91Å
121	T	65.8	Low	68.2	Low	58 Å²	58	121 Å²	121	36%	0.356	60%	0.602	S	S	.	*	H	α-helix	trans	-69.3	-34.2	-178.6	-44.2	0	0	0	0	112.1	M109 P118 K123 M125	M109-T121 HydrophobicContact CE-CG2 3.91Å; P118-T121 PolarHBondContact O-N 3.28Å; T121-K123 PolarHBondContact O-N 2.89Å; T121-M125 PolarHBondContact O-N 3.34Å
122	L	69.1	Low	68	Low	132 Å²	132	121.7 Å²	121.7	69%	0.691	60%	0.596	S	S	*	*	H	α-helix	trans	-64.4	-40.1	179.4	-155.8	84.5	0	0	0	112	M125 Q126	L122-M125 PolarHBondContact O-N 2.86Å; L122-Q126 PolarHBondContact O-N 3.28Å
123	K	74.1	Confident	68.3	Low	143 Å²	143	125.4 Å²	125.4	62%	0.622	61%	0.61	S	S	*	*	H	α-helix	trans	-67.3	-44.5	-179.9	-166.9	171.3	-177.7	175.4	0	111.9	K120 T121 M125 Q126 D127	K120-K123 PolarHBondContact O-N 3.39Å; T121-K123 PolarHBondContact O-N 2.89Å; K123-M125 VanDerWaalsContact C-N 3.28Å; K123-M125 PolarHBondContact O-N 3.3Å; K123-Q126 WeakPolarHBondContact O-CB 3.4Å; K123-Q126 PolarHBondContact O-N 3.2Å; K123-Q126 VanDerWaalsContact O-N 3.15Å; K123-D127 PolarHBondContact O-N 3.19Å
124	T	70.3	Confident	68.7	Low	98 Å²	98	128.8 Å²	128.8	60%	0.601	62%	0.621	S	S	*	*	H	α-helix	trans	-61.8	-35.4	176.3	-51.7	0	0	0	0	112.5	K120 Q126 F128	K120-T124 PolarHBondContact O-N 3.39Å; K120-T124 PolarHBondContact O-OG1 2.91Å; T124-Q126 VanDerWaalsContact C-N 3.35Å; T124-F128 WeakPolarHBondContact O-CB 3.4Å; T124-F128 PolarHBondContact O-N 3.48Å
125	M	72.1	Confident	68.9	Low	124 Å²	124	123.1 Å²	123.1	61%	0.611	60%	0.598	S	S	*	*	H	α-helix	trans	-69.1	-35.9	177.3	-161.7	-178.2	176.8	0	0	111.9	T121 L122 K123 Q129	T121-M125 PolarHBondContact O-N 3.34Å; L122-M125 PolarHBondContact O-N 2.86Å; K123-M125 VanDerWaalsContact C-N 3.28Å; K123-M125 PolarHBondContact O-N 3.3Å; M125-Q129 PolarHBondContact O-N 3.22Å; M125-Q129 VanDerWaalsContact O-N 3.1Å
126	Q	77.3	Confident	69.1	Low	131 Å²	131	114.9 Å²	114.9	61%	0.612	57%	0.57	S	S	*	*	H	α-helix	trans	-69.7	-40.7	177.7	-143.2	176.2	19.8	0	0	111.9	L122 K123 T124 Q129 K130	L122-Q126 PolarHBondContact O-N 3.28Å; K123-Q126 WeakPolarHBondContact O-CB 3.4Å; K123-Q126 PolarHBondContact O-N 3.2Å; K123-Q126 VanDerWaalsContact O-N 3.15Å; T124-Q126 VanDerWaalsContact C-N 3.35Å; Q126-Q129 PolarHBondContact O-N 2.92Å; Q126-K130 PolarHBondContact O-N 3.37Å; Q126-K130 VanDerWaalsContact O-N 3.17Å
127	D	76.1	Confident	69.4	Low	85 Å²	85	116.3 Å²	116.3	46%	0.455	58%	0.577	S	S	.	*	H	α-helix	trans	-66.7	-40.5	176	-68.2	-26.1	0	0	0	111.3	K123 Q129 K130 E131	K123-D127 PolarHBondContact O-N 3.19Å; D127-Q129 PolarHBondContact O-N 2.92Å; D127-K130 WeakPolarHBondContact O-CB 3.12Å; D127-K130 PolarHBondContact O-N 2.9Å; D127-E131 PolarHBondContact O-N 2.84Å
128	F	73.8	Confident	69.5	Low	98 Å²	98	115 Å²	115	43%	0.43	57%	0.573	S	S	.	*	H	α-helix	trans	-61.6	-42.4	174.7	-176.4	-94.9	0	0	0	112.7	M98 M102 T124 K130 E131 N132	M98-F128 HydrophobicContact CE-CE2 4.23Å; M102-F128 HydrophobicContact CE-CE2 4.37Å; T124-F128 WeakPolarHBondContact O-CB 3.4Å; T124-F128 PolarHBondContact O-N 3.48Å; F128-K130 VanDerWaalsContact C-N 3.31Å; F128-K130 PolarHBondContact O-N 3.19Å; F128-E131 PolarHBondContact O-N 3.36Å; F128-N132 WeakPolarHBondContact O-CB 3.5Å; F128-N132 PolarHBondContact O-N 3.46Å
129	Q	70.6	Confident	69.3	Low	122 Å²	122	113.8 Å²	113.8	57%	0.57	56%	0.559	S	S	*	*	H	α-helix	trans	-61.2	-40.6	175.8	-81.8	-177.7	-19.3	0	0	111.9	M125 Q126 D127 N132 M133	M125-Q129 PolarHBondContact O-N 3.22Å; M125-Q129 VanDerWaalsContact O-N 3.1Å; Q126-Q129 PolarHBondContact O-N 2.92Å; D127-Q129 PolarHBondContact O-N 2.92Å; Q129-N132 PolarHBondContact O-N 2.84Å; Q129-M133 WeakPolarHBondContact O-CB 3.4Å; Q129-M133 PolarHBondContact O-N 3.21Å
130	K	76.9	Confident	69.1	Low	159 Å²	159	110.4 Å²	110.4	69%	0.691	55%	0.547	S	S	*	.	H	α-helix	trans	-64.1	-45.1	177.6	-119.7	179.9	-179.4	179	0	112.5	Q126 D127 F128 N132 M133 K134	Q126-K130 PolarHBondContact O-N 3.37Å; Q126-K130 VanDerWaalsContact O-N 3.17Å; D127-K130 WeakPolarHBondContact O-CB 3.12Å; D127-K130 PolarHBondContact O-N 2.9Å; F128-K130 VanDerWaalsContact C-N 3.31Å; F128-K130 PolarHBondContact O-N 3.19Å; K130-N132 VanDerWaalsContact C-N 3.34Å; K130-M133 PolarHBondContact O-N 2.88Å; K130-K134 PolarHBondContact O-N 3.17Å; K130-K134 VanDerWaalsContact O-N 3.13Å
131	E	65.7	Low	68.9	Low	138 Å²	138	109.2 Å²	109.2	65%	0.645	55%	0.545	S	S	*	.	H	α-helix	trans	-63.6	-41.9	178.1	-146.3	88.2	-164.4	0	0	111.1	D127 F128 M133 K134 M135	D127-E131 PolarHBondContact O-N 2.84Å; F128-E131 PolarHBondContact O-N 3.36Å; E131-M133 PolarHBondContact O-N 2.78Å; E131-K134 WeakPolarHBondContact O-CB 3.49Å; E131-K134 PolarHBondContact O-N 2.99Å; E131-M135 PolarHBondContact O-N 3.16Å; E131-M135 VanDerWaalsContact O-N 3.16Å
132	N	70.6	Confident	68.9	Low	85 Å²	85	110.2 Å²	110.2	46%	0.455	55%	0.548	S	S	.	.	H	α-helix	trans	-67.8	-36.2	179.8	-154.5	48.8	0	0	0	112.1	F128 Q129 K130 M135 G136	F128-N132 WeakPolarHBondContact O-CB 3.5Å; F128-N132 PolarHBondContact O-N 3.46Å; Q129-N132 PolarHBondContact O-N 2.84Å; K130-N132 VanDerWaalsContact C-N 3.34Å; N132-M135 PolarHBondContact O-N 3.47Å; N132-G136 PolarHBondContact O-N 2.78Å
133	M	70.6	Confident	68.8	Low	149 Å²	149	107 Å²	107	73%	0.734	53%	0.531	S	S	*	.	H	α-helix	trans	-65.5	-38.7	174.7	-138.1	172.9	-168.8	0	0	111.9	Q129 K130 E131 M135 G136 M137	Q129-M133 WeakPolarHBondContact O-CB 3.4Å; Q129-M133 PolarHBondContact O-N 3.21Å; K130-M133 PolarHBondContact O-N 2.88Å; E131-M133 PolarHBondContact O-N 2.78Å; M133-M135 VanDerWaalsContact C-N 3.29Å; M133-M135 PolarHBondContact O-N 3.22Å; M133-G136 PolarHBondContact O-N 3.22Å; M133-M137 PolarHBondContact O-N 2.97Å
134	K	67.6	Low	68.5	Low	148 Å²	148	105 Å²	105	64%	0.643	53%	0.527	S	S	*	.	H	α-helix	trans	-65.1	-34.3	176.5	-163.2	179	-178.1	-175.6	0	112.1	K130 E131 T138	K130-K134 PolarHBondContact O-N 3.17Å; K130-K134 VanDerWaalsContact O-N 3.13Å; E131-K134 WeakPolarHBondContact O-CB 3.49Å; E131-K134 PolarHBondContact O-N 2.99Å; K134-T138 PolarHBondContact O-OG1 3.24Å
135	M	68.3	Low	68.1	Low	74 Å²	74	104 Å²	104	37%	0.365	52%	0.521	S	S	.	.	H	α-helix	trans	-66.9	-42.5	175.4	-158.3	-173.3	81.7	0	0	111.6	V91 E131 N132 M133 M137 T138 E139	V91-M135 HydrophobicContact CG1-SD 4.46Å; E131-M135 PolarHBondContact O-N 3.16Å; E131-M135 VanDerWaalsContact O-N 3.16Å; N132-M135 PolarHBondContact O-N 3.47Å; M133-M135 VanDerWaalsContact C-N 3.29Å; M133-M135 PolarHBondContact O-N 3.22Å; M135-M137 PolarHBondContact O-N 3.34Å; M135-T138 PolarHBondContact O-N 2.9Å; M135-E139 PolarHBondContact O-N 2.82Å
136	G	64.3	Low	67.5	Low	26 Å²	26	99.2 Å²	99.2	27%	0.268	50%	0.498	S	S	.	.	H	α-helix	trans	-59.9	-45.5	177.9	0	0	0	0	0	113.5	N132 M133 T138 E139 D140	N132-G136 PolarHBondContact O-N 2.78Å; M133-G136 PolarHBondContact O-N 3.22Å; G136-T138 PolarHBondContact O-N 2.6Å; G136-E139 WeakPolarHBondContact O-CB 3.33Å; G136-E139 PolarHBondContact O-N 3.23Å; G136-E139 VanDerWaalsContact O-N 3.09Å; G136-D140 PolarHBondContact O-N 3.21Å; G136-D140 VanDerWaalsContact O-N 3.11Å
137	M	63.6	Low	66.9	Low	141 Å²	141	96.8 Å²	96.8	70%	0.695	49%	0.489	S	S	*	.	H	α-helix	trans	-61.1	-29.4	177.7	-69.8	179.4	74.2	0	0	113.6	M133 M135 M141	M133-M137 PolarHBondContact O-N 2.97Å; M135-M137 PolarHBondContact O-N 3.34Å; M137-M141 PolarHBondContact O-N 3.37Å
138	T	61.4	Low	66.5	Low	81 Å²	81	98 Å²	98	50%	0.497	50%	0.495	S	S	.	.	H	α-helix	trans	-75.6	-31.8	179.6	-41.8	0	0	0	0	111	K134 M135 G136 I142	K134-T138 PolarHBondContact O-OG1 3.24Å; M135-T138 PolarHBondContact O-N 2.9Å; G136-T138 PolarHBondContact O-N 2.6Å; T138-I142 HydrophobicContact CG2-CD1 4.4Å; T138-I142 WeakPolarHBondContact O-CD1 3.46Å; T138-I142 VanDerWaalsContact O-CG1 3.25Å; T138-I142 WeakPolarHBondContact O-CG1 3.4Å; T138-I142 PolarHBondContact O-N 3.01Å
139	E	62.6	Low	66	Low	69 Å²	69	98.7 Å²	98.7	32%	0.322	50%	0.502	S	S	.	.	H	α-helix	trans	-71.2	-41.9	176.5	-130.7	168.8	-172.5	0	0	111.2	Q88 M135 G136 I142 N143	Q88-E139 VanDerWaalsContact CD-OE1 3.29Å; Q88-E139 WeakPolarHBondContact CG-OE1 3.17Å; Q88-E139 PolarHBondContact NE2-OE1 3.01Å; M135-E139 PolarHBondContact O-N 2.82Å; G136-E139 WeakPolarHBondContact O-CB 3.33Å; G136-E139 PolarHBondContact O-N 3.23Å; G136-E139 VanDerWaalsContact O-N 3.09Å; E139-I142 PolarHBondContact O-N 3.35Å; E139-N143 PolarHBondContact O-N 2.92Å; E139-N143 PolarHBondContact O-ND2 2.94Å
140	D	65.1	Low	65.4	Low	98 Å²	98	94.9 Å²	94.9	52%	0.524	48%	0.484	S	S	.	.	H	α-helix	trans	-63.8	-45.8	176.9	-66.5	-24.4	0	0	0	111.3	G136 I142 N143 D144	G136-D140 PolarHBondContact O-N 3.21Å; G136-D140 VanDerWaalsContact O-N 3.11Å; D140-I142 VanDerWaalsContact C-N 3.26Å; D140-I142 PolarHBondContact O-N 3.13Å; D140-N143 PolarHBondContact O-N 3.39Å; D140-D144 PolarHBondContact O-N 2.82Å
141	M	62.2	Low	64.6	Low	134 Å²	134	93.8 Å²	93.8	66%	0.66	49%	0.486	S	S	*	.	H	α-helix	trans	-63.5	-30.8	178.4	-154.8	-176.5	98.9	0	0	113.2	M137 T145	M137-M141 PolarHBondContact O-N 3.37Å; M141-T145 PolarHBondContact O-N 3.33Å; M141-T145 PolarHBondContact O-OG1 2.88Å
142	I	63.8	Low	64.1	Low	80 Å²	80	95.5 Å²	95.5	41%	0.41	49%	0.494	S	S	.	.	H	α-helix	trans	-74.5	-35.6	174.7	-72.7	169	0	0	0	111.2	T138 E139 D140 T145 L146	T138-I142 HydrophobicContact CG2-CD1 4.4Å; T138-I142 WeakPolarHBondContact O-CD1 3.46Å; T138-I142 VanDerWaalsContact O-CG1 3.25Å; T138-I142 WeakPolarHBondContact O-CG1 3.4Å; T138-I142 PolarHBondContact O-N 3.01Å; E139-I142 PolarHBondContact O-N 3.35Å; D140-I142 VanDerWaalsContact C-N 3.26Å; D140-I142 PolarHBondContact O-N 3.13Å; I142-T145 PolarHBondContact O-OG1 2.89Å; I142-L146 HydrophobicContact CG2-CD1 4.14Å; I142-L146 WeakPolarHBondContact O-CB 3.47Å; I142-L146 WeakPolarHBondContact O-CD1 3.46Å; I142-L146 VanDerWaalsContact O-CG 3.32Å; I142-L146 WeakPolarHBondContact O-CG 3.43Å; I142-L146 PolarHBondContact O-N 3.04Å
143	N	68	Low	63.1	Low	64 Å²	64	93.4 Å²	93.4	34%	0.342	49%	0.486	S	S	.	.	H	α-helix	trans	-71.8	-42.1	176.1	-75.9	-43.3	0	0	0	111.5	E139 D140 T145 L146 D147	E139-N143 PolarHBondContact O-N 2.92Å; E139-N143 PolarHBondContact O-ND2 2.94Å; D140-N143 PolarHBondContact O-N 3.39Å; N143-T145 PolarHBondContact O-N 3.19Å; N143-L146 CarbonylContact O-C 3.57Å; N143-L146 WeakPolarHBondContact O-CB 3.31Å; N143-L146 PolarHBondContact O-N 2.78Å; N143-L146 VanDerWaalsContact O-N 3.1Å; N143-D147 WeakPolarHBondContact O-CB 3.37Å; N143-D147 PolarHBondContact O-N 3.42Å
144	D	68.1	Low	61.9	Low	100 Å²	100	89.1 Å²	89.1	54%	0.535	48%	0.48	S	S	.	.	H	α-helix	trans	-61.6	-43.8	178.4	-68.7	-16.4	0	0	0	111.5	D140 L146 D147 D148	D140-D144 PolarHBondContact O-N 2.82Å; D144-L146 VanDerWaalsContact C-N 3.29Å; D144-L146 PolarHBondContact O-N 2.85Å; D144-D147 PolarHBondContact O-N 3.16Å; D144-D148 WeakPolarHBondContact O-CB 3.4Å; D144-D148 PolarHBondContact O-N 3.04Å
145	T	62.2	Low	61.2	Low	77 Å²	77	89.1 Å²	89.1	47%	0.472	49%	0.487	S	S	.	.	H	α-helix	trans	-67.3	-28.4	175	37.6	0	0	0	0	113.7	M141 I142 N143 I149	M141-T145 PolarHBondContact O-N 3.33Å; M141-T145 PolarHBondContact O-OG1 2.88Å; I142-T145 PolarHBondContact O-OG1 2.89Å; N143-T145 PolarHBondContact O-N 3.19Å; T145-I149 WeakPolarHBondContact O-CD1 3.37Å; T145-I149 VanDerWaalsContact O-CG1 3.3Å; T145-I149 WeakPolarHBondContact O-CG1 3.33Å
146	L	58.2	Low	60.3	Low	24 Å²	24	93.1 Å²	93.1	13%	0.126	51%	0.505	C	S	.	.	H	α-helix	trans	-75.3	-39.7	173.2	-79.5	168.6	0	0	0	111.3	I142 N143 D144 I149 F150	I142-L146 HydrophobicContact CG2-CD1 4.14Å; I142-L146 WeakPolarHBondContact O-CB 3.47Å; I142-L146 WeakPolarHBondContact O-CD1 3.46Å; I142-L146 VanDerWaalsContact O-CG 3.32Å; I142-L146 WeakPolarHBondContact O-CG 3.43Å; I142-L146 PolarHBondContact O-N 3.04Å; N143-L146 CarbonylContact O-C 3.57Å; N143-L146 WeakPolarHBondContact O-CB 3.31Å; N143-L146 PolarHBondContact O-N 2.78Å; N143-L146 VanDerWaalsContact O-N 3.1Å; D144-L146 VanDerWaalsContact C-N 3.29Å; D144-L146 PolarHBondContact O-N 2.85Å; L146-I149 PolarHBondContact O-N 3.31Å; L146-F150 WeakPolarHBondContact O-CD2 3.3Å; L146-F150 PolarHBondContact O-N 2.99Å
147	D	65.8	Low	59.7	Low	80 Å²	80	100.9 Å²	100.9	43%	0.428	53%	0.534	S	S	.	.	H	α-helix	trans	-72.6	-35.7	-178.6	-76.6	-12.1	0	0	0	111.7	K81 N143 D144 I149 F150 D151	K81-D147 IonicContact NZ-OD1 3.52Å; N143-D147 WeakPolarHBondContact O-CB 3.37Å; N143-D147 PolarHBondContact O-N 3.42Å; D144-D147 PolarHBondContact O-N 3.16Å; D147-I149 VanDerWaalsContact C-N 3.3Å; D147-I149 PolarHBondContact O-N 3.5Å; D147-F150 CarbonylContact O-C 3.58Å; D147-F150 WeakPolarHBondContact O-CA 3.39Å; D147-F150 PolarHBondContact O-N 3.04Å; D147-D151 PolarHBondContact O-N 3.11Å
148	D	67.2	Low	59.4	Low	111 Å²	111	97.2 Å²	97.2	59%	0.594	52%	0.515	S	S	*	.	H	α-helix	trans	-58.5	-39.8	170.2	-77	-15.4	0	0	0	112.1	D144 F150 D151 E152	D144-D148 WeakPolarHBondContact O-CB 3.4Å; D144-D148 PolarHBondContact O-N 3.04Å; D148-F150 PolarHBondContact O-N 3.02Å; D148-D151 PolarHBondContact O-N 3.36Å; D148-E152 PolarHBondContact O-N 3.44Å
149	I	62.3	Low	59.4	Low	112 Å²	112	95.5 Å²	95.5	57%	0.574	51%	0.507	S	S	*	.	H	α-helix	trans	-66.6	-27.6	174.8	-67.9	168.8	0	0	0	111.6	T145 L146 D147	T145-I149 WeakPolarHBondContact O-CD1 3.37Å; T145-I149 VanDerWaalsContact O-CG1 3.3Å; T145-I149 WeakPolarHBondContact O-CG1 3.33Å; L146-I149 PolarHBondContact O-N 3.31Å; D147-I149 VanDerWaalsContact C-N 3.3Å; D147-I149 PolarHBondContact O-N 3.5Å
150	F	58.9	Low	59.7	Low	42 Å²	42	97.4 Å²	97.4	18%	0.184	52%	0.516	C	S	.	.	H	α-helix	trans	-84.5	-33.6	177.1	-79.4	-68.9	0	0	0	112.6	R74 A77 K81 L146 D147 D148 S153	R74-F150 HydrophobicContact CG-CE1 4.48Å; A77-F150 HydrophobicContact CB-CE1 3.72Å; A77-F150 HydrophobicContact CB-CE2 4.25Å; A77-F150 HydrophobicContact CB-CZ 3.43Å; A77-F150 VanDerWaalsContact CB-CZ 3.43Å; K81-F150 HydrophobicContact CD-CE2 4.48Å; L146-F150 WeakPolarHBondContact O-CD2 3.3Å; L146-F150 PolarHBondContact O-N 2.99Å; D147-F150 CarbonylContact O-C 3.58Å; D147-F150 WeakPolarHBondContact O-CA 3.39Å; D147-F150 PolarHBondContact O-N 3.04Å; D148-F150 PolarHBondContact O-N 3.02Å; F150-S153 PolarHBondContact O-N 3.25Å; F150-S153 PolarHBondContact O-OG 3.2Å
151	D	59.3	Low	60.2	Low	137 Å²	137	98.1 Å²	98.1	73%	0.733	52%	0.519	S	S	*	.	H	α-helix	trans	-76.2	-32.3	-176.1	-146	29.8	0	0	0	112.1	D147 D148 S153 G154	D147-D151 PolarHBondContact O-N 3.11Å; D148-D151 PolarHBondContact O-N 3.36Å; D151-S153 PolarHBondContact O-N 2.89Å; D151-S153 VanDerWaalsContact O-N 3.07Å; D151-G154 PolarHBondContact O-N 3.31Å; D151-G154 VanDerWaalsContact O-N 3.14Å
152	E	55.3	Low	60.8	Low	173 Å²	173	94.6 Å²	94.6	81%	0.808	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-5.3	173	-161.9	161.3	-159.1	0	0	113.3	D148 G154	D148-E152 PolarHBondContact O-N 3.44Å; E152-G154 VanDerWaalsContact C-N 3.35Å
153	S	50.7	Low	61.5	Low	41 Å²	41	91.1 Å²	91.1	29%	0.287	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	3.2	174.2	78.5	0	0	0	0	114.1	K70 F150 D151	K70-S153 WeakPolarHBondContact CE-O 3.5Å; K70-S153 PolarHBondContact NZ-O 3.28Å; F150-S153 PolarHBondContact O-N 3.25Å; F150-S153 PolarHBondContact O-OG 3.2Å; D151-S153 PolarHBondContact O-N 2.89Å; D151-S153 VanDerWaalsContact O-N 3.07Å
154	G	45.4	Very low	61.9	Low	60 Å²	60	91.2 Å²	91.2	62%	0.619	49%	0.486	S	S	*	.	S	Bend	trans	-91.1	-27.5	-174.5	0	0	0	0	0	115.9	D151 E152	D151-G154 PolarHBondContact O-N 3.31Å; D151-G154 VanDerWaalsContact O-N 3.14Å; E152-G154 VanDerWaalsContact C-N 3.35Å
155	D	53.6	Low	62.6	Low	148 Å²	148	92.8 Å²	92.8	79%	0.791	49%	0.49	S	S	*	.			trans	-109.8	115.8	-177	-112.1	-12.3	0	0	0	111
156	E	48	Very low	63.4	Low	158 Å²	158	89.5 Å²	89.5	74%	0.738	47%	0.47	S	S	*	.			trans	169	122.1	130.7	-92.7	175	176.5	0	0	106.4	E158	E156-E158 PolarHBondContact O-N 2.89Å
157	E	52	Low	64.4	Low	188 Å²	188	89 Å²	89	88%	0.879	47%	0.467	S	S	*	.			trans	-35.3	118.1	155.6	-75	-179.4	130.3	0	0	107.4	S159	E157-S159 WeakPolarHBondContact O-CA 3.18Å; E157-S159 PolarHBondContact O-N 3.2Å
158	E	57.9	Low	65.2	Low	64 Å²	64	89.8 Å²	89.8	30%	0.299	47%	0.471	S	S	.	.			trans	-54.5	93.9	176.8	-72.6	173.4	179.9	0	0	107.3	K63 Q67 E156 Q160	K63-E158 WeakPolarHBondContact CD-OE2 2.72Å; K63-E158 WeakPolarHBondContact CE-OE2 3.48Å; K63-E158 WeakPolarHBondContact CG-OE2 3.5Å; K63-E158 IonicContact NZ-OE2 3.93Å; Q67-E158 WeakPolarHBondContact CG-OE1 3Å; Q67-E158 PolarHBondContact NE2-OE1 3.42Å; E156-E158 PolarHBondContact O-N 2.89Å; E158-Q160 PolarHBondContact O-N 2.9Å
159	S	61.9	Low	65.7	Low	45 Å²	45	90.7 Å²	90.7	32%	0.315	47%	0.472	S	S	.	.			trans	-62	138.7	-169.3	175.8	0	0	0	0	106.2	E157 D161 I162 V163	E157-S159 WeakPolarHBondContact O-CA 3.18Å; E157-S159 PolarHBondContact O-N 3.2Å; S159-D161 PolarHBondContact O-N 3.2Å; S159-D161 WeakPolarHBondContact OG-CB 3.39Å; S159-D161 PolarHBondContact OG-N 2.88Å; S159-D161 PolarHBondContact OG-OD2 3.43Å; S159-I162 PolarHBondContact O-N 3.2Å; S159-V163 PolarHBondContact O-N 3Å
160	Q	67.8	Low	66.2	Low	110 Å²	110	86.2 Å²	86.2	51%	0.514	45%	0.449	S	S	.	.	H	α-helix	trans	-50.8	-26.9	171.5	-111.5	101.4	63.9	0	0	111	E158 V163 N164	E158-Q160 PolarHBondContact O-N 2.9Å; Q160-V163 PolarHBondContact O-N 3.21Å; Q160-N164 WeakPolarHBondContact O-CB 3.44Å; Q160-N164 PolarHBondContact O-N 2.98Å; Q160-N164 PolarHBondContact O-ND2 2.84Å; Q160-N164 VanDerWaalsContact O-ND2 3.13Å
161	D	74.8	Confident	66.4	Low	112 Å²	112	87.1 Å²	87.1	60%	0.599	47%	0.47	S	S	*	.	H	α-helix	trans	-64.2	-39.8	175.9	-59.2	-30.4	0	0	0	113.1	S159 V163 N164 Q165	S159-D161 PolarHBondContact O-N 3.2Å; S159-D161 WeakPolarHBondContact OG-CB 3.39Å; S159-D161 PolarHBondContact OG-N 2.88Å; S159-D161 PolarHBondContact OG-OD2 3.43Å; D161-V163 VanDerWaalsContact C-N 3.34Å; D161-N164 PolarHBondContact O-N 3.07Å; D161-Q165 VanDerWaalsContact O-CB 3.32Å; D161-Q165 WeakPolarHBondContact O-CB 3.29Å; D161-Q165 PolarHBondContact O-N 3.43Å
162	I	75.8	Confident	66.6	Low	60 Å²	60	81.7 Å²	81.7	31%	0.308	44%	0.441	S	S	.	.	H	α-helix	trans	-66.2	-41.7	176.4	-60.9	173.9	0	0	0	109.8	V66 S159 Q165 V166	V66-I162 HydrophobicContact CG1-CG2 4.15Å; V66-I162 HydrophobicContact CG2-CG2 4.06Å; S159-I162 PolarHBondContact O-N 3.2Å; I162-Q165 PolarHBondContact O-N 3.08Å; I162-V166 WeakPolarHBondContact O-CG2 3.49Å; I162-V166 PolarHBondContact O-N 3.35Å
163	V	77.4	Confident	66.6	Low	8 Å²	8	79.6 Å²	79.6	5%	0.048	43%	0.431	C	S	.	.	H	α-helix	trans	-64.2	-43.3	176.7	179.7	0	0	0	0	110.6	K59 A62 S159 Q160 D161 V166 L167	K59-V163 HydrophobicContact CG-CG1 4.46Å; A62-V163 HydrophobicContact CB-CG1 3.61Å; S159-V163 PolarHBondContact O-N 3Å; Q160-V163 PolarHBondContact O-N 3.21Å; D161-V163 VanDerWaalsContact C-N 3.34Å; V163-V166 PolarHBondContact O-N 3.29Å; V163-L167 HydrophobicContact CG1-CD1 4.34Å; V163-L167 WeakPolarHBondContact O-CG 3.44Å; V163-L167 PolarHBondContact O-N 3Å
164	N	78.4	Confident	66.7	Low	65 Å²	65	81.6 Å²	81.6	35%	0.348	44%	0.438	S	S	.	.	H	α-helix	trans	-64.1	-42.7	176.8	-69	-25.6	0	0	0	111.5	Q160 D161 V166 L167 D168	Q160-N164 WeakPolarHBondContact O-CB 3.44Å; Q160-N164 PolarHBondContact O-N 2.98Å; Q160-N164 PolarHBondContact O-ND2 2.84Å; Q160-N164 VanDerWaalsContact O-ND2 3.13Å; D161-N164 PolarHBondContact O-N 3.07Å; N164-V166 VanDerWaalsContact C-N 3.32Å; N164-V166 PolarHBondContact O-N 3.04Å; N164-L167 WeakPolarHBondContact O-CB 3.37Å; N164-L167 PolarHBondContact O-N 2.62Å; N164-L167 VanDerWaalsContact O-N 3.16Å; N164-D168 PolarHBondContact O-N 3.22Å
165	Q	80.8	Confident	66.9	Low	133 Å²	133	84.1 Å²	84.1	62%	0.621	45%	0.446	S	S	*	.	H	α-helix	trans	-59.7	-40.7	176	-177.7	-178.9	-6.4	0	0	112.1	D161 I162 D168 E169	D161-Q165 VanDerWaalsContact O-CB 3.32Å; D161-Q165 WeakPolarHBondContact O-CB 3.29Å; D161-Q165 PolarHBondContact O-N 3.43Å; I162-Q165 PolarHBondContact O-N 3.08Å; Q165-D168 PolarHBondContact O-N 3.25Å; Q165-E169 WeakPolarHBondContact O-CB 3.43Å; Q165-E169 PolarHBondContact O-N 3.36Å
166	V	80.1	Confident	66.9	Low	9 Å²	9	80.2 Å²	80.2	6%	0.055	44%	0.441	C	S	.	.	H	α-helix	trans	-68.5	-38.5	176.2	171	0	0	0	0	111.5	L65 V66 I162 V163 N164 D168 E169 I170	L65-V166 HydrophobicContact CD2-CG1 3.61Å; L65-V166 HydrophobicContact CG-CG1 4.33Å; V66-V166 HydrophobicContact CG2-CG2 3.89Å; I162-V166 WeakPolarHBondContact O-CG2 3.49Å; I162-V166 PolarHBondContact O-N 3.35Å; V163-V166 PolarHBondContact O-N 3.29Å; N164-V166 VanDerWaalsContact C-N 3.32Å; N164-V166 PolarHBondContact O-N 3.04Å; V166-D168 VanDerWaalsContact C-N 3.32Å; V166-E169 PolarHBondContact O-N 3.15Å; V166-I170 HydrophobicContact CG1-CD1 3.81Å; V166-I170 WeakPolarHBondContact O-CB 3.49Å; V166-I170 WeakPolarHBondContact O-CD1 3.19Å; V166-I170 WeakPolarHBondContact O-CG1 3.43Å; V166-I170 PolarHBondContact O-N 3.49Å
167	L	79.6	Confident	66.9	Low	12 Å²	12	82 Å²	82	6%	0.063	45%	0.446	C	S	.	.	H	α-helix	trans	-63.1	-40.3	174.2	-70	171.4	0	0	0	111.6	I46 C58 A62 V163 N164 I170 I172	I46-L167 HydrophobicContact CG2-CD2 3.87Å; C58-L167 HydrophobicContact CB-CD2 4.4Å; A62-L167 HydrophobicContact CB-CD1 4.47Å; A62-L167 HydrophobicContact CB-CD2 3.82Å; A62-L167 HydrophobicContact CB-CG 3.99Å; V163-L167 HydrophobicContact CG1-CD1 4.34Å; V163-L167 WeakPolarHBondContact O-CG 3.44Å; V163-L167 PolarHBondContact O-N 3Å; N164-L167 WeakPolarHBondContact O-CB 3.37Å; N164-L167 PolarHBondContact O-N 2.62Å; N164-L167 VanDerWaalsContact O-N 3.16Å; L167-I170 PolarHBondContact O-N 3.38Å; L167-I172 HydrophobicContact CD2-CD1 3.9Å; L167-I172 WeakPolarHBondContact O-CB 3.47Å; L167-I172 PolarHBondContact O-N 2.89Å
168	D	81.1	Confident	66.3	Low	97 Å²	97	80.4 Å²	80.4	52%	0.519	44%	0.44	S	S	.	.	H	α-helix	trans	-65.8	-43.6	175.1	-70.2	-20.2	0	0	0	111.6	N164 Q165 V166 I170 G171	N164-D168 PolarHBondContact O-N 3.22Å; Q165-D168 PolarHBondContact O-N 3.25Å; V166-D168 VanDerWaalsContact C-N 3.32Å; D168-I170 VanDerWaalsContact C-N 3.28Å; D168-I170 PolarHBondContact O-N 3.5Å; D168-G171 WeakPolarHBondContact O-CA 3.35Å; D168-G171 PolarHBondContact O-N 3.29Å
169	E	78	Confident	65.6	Low	130 Å²	130	83.6 Å²	83.6	61%	0.607	46%	0.464	S	S	*	.	H	α-helix	trans	-60.1	-36.7	176.3	-171.2	-173	-169.1	0	0	112.2	R69 Q165 V166 G171	R69-E169 IonicContact CZ-OE2 3.85Å; R69-E169 IonicContact NH1-OE2 2.92Å; R69-E169 PolarHBondContact NH1-OE2 3.43Å; R69-E169 IonicContact NH2-OE2 3.19Å; Q165-E169 WeakPolarHBondContact O-CB 3.43Å; Q165-E169 PolarHBondContact O-N 3.36Å; V166-E169 PolarHBondContact O-N 3.15Å; E169-G171 PolarHBondContact O-N 3.09Å
170	I	73.8	Confident	64.6	Low	18 Å²	18	92.6 Å²	92.6	9%	0.092	49%	0.491	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-8.9	177.1	-68.9	169.2	0	0	0	111.7	E43 I46 K47 L65 V166 L167 D168 I172	E43-I170 HydrophobicContact CG-CD1 4.4Å; I46-I170 HydrophobicContact CD1-CD1 4.12Å; I46-I170 HydrophobicContact CG2-CD1 3.96Å; I46-I170 HydrophobicContact CG2-CG2 4.29Å; K47-I170 HydrophobicContact CD-CG2 4.16Å; K47-I170 VanDerWaalsContact CE-CG2 3.44Å; K47-I170 VanDerWaalsContact CE-O 3.31Å; K47-I170 WeakPolarHBondContact CE-O 3.48Å; K47-I170 HydrophobicContact CG-CG2 3.52Å; L65-I170 HydrophobicContact CD2-CD1 3.58Å; V166-I170 HydrophobicContact CG1-CD1 3.81Å; V166-I170 WeakPolarHBondContact O-CB 3.49Å; V166-I170 WeakPolarHBondContact O-CD1 3.19Å; V166-I170 WeakPolarHBondContact O-CG1 3.43Å; V166-I170 PolarHBondContact O-N 3.49Å; L167-I170 PolarHBondContact O-N 3.38Å; D168-I170 VanDerWaalsContact C-N 3.28Å; D168-I170 PolarHBondContact O-N 3.5Å; I170-I172 HydrophobicContact CB-CD1 4.46Å; I170-I172 HydrophobicContact CG2-CD1 3.86Å; I170-I172 HydrophobicContact CG2-CG1 4.08Å
171	G	63.8	Low	63.2	Low	61 Å²	61	91.6 Å²	91.6	63%	0.629	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.3	21.8	-177	0	0	0	0	0	112.4	D168 E169 E173	D168-G171 WeakPolarHBondContact O-CA 3.35Å; D168-G171 PolarHBondContact O-N 3.29Å; E169-G171 PolarHBondContact O-N 3.09Å; G171-E173 PolarHBondContact O-N 2.96Å
172	I	62.8	Low	61.7	Low	23 Å²	23	92.3 Å²	92.3	12%	0.118	51%	0.512	C	S	.	.			trans	-87.2	75.4	165.7	-56.4	161.1	0	0	0	105.5	I46 A50 L167 I170 I174	I46-I172 HydrophobicContact CG2-CD1 3.32Å; A50-I172 HydrophobicContact CB-CB 4.28Å; A50-I172 HydrophobicContact CB-CD1 3.41Å; A50-I172 VanDerWaalsContact CB-CD1 3.41Å; A50-I172 HydrophobicContact CB-CG1 3.57Å; A50-I172 HydrophobicContact CB-CG2 3.65Å; L167-I172 HydrophobicContact CD2-CD1 3.9Å; L167-I172 WeakPolarHBondContact O-CB 3.47Å; L167-I172 PolarHBondContact O-N 2.89Å; I170-I172 HydrophobicContact CB-CD1 4.46Å; I170-I172 HydrophobicContact CG2-CD1 3.86Å; I170-I172 HydrophobicContact CG2-CG1 4.08Å; I172-I174 PolarHBondContact O-N 3.43Å
173	E	55.6	Low	60	Low	129 Å²	129	94.1 Å²	94.1	60%	0.603	54%	0.537	S	S	*	.			trans	-56.9	99.6	151.7	-70.1	-173.3	176.2	0	0	105	G171 S175	G171-E173 PolarHBondContact O-N 2.96Å; E173-S175 WeakPolarHBondContact O-CA 3.35Å; E173-S175 PolarHBondContact O-N 3.43Å
174	I	51.6	Low	58.8	Low	83 Å²	83	99.1 Å²	99.1	43%	0.426	58%	0.579	S	S	.	*			trans	-43.7	113.9	165.6	-70.4	169.2	0	0	0	103.9	I172 G176	I172-I174 PolarHBondContact O-N 3.43Å; I174-G176 PolarHBondContact O-N 2.83Å
175	S	50.6	Low	56.9	Low	114 Å²	114	99 Å²	99	80%	0.797	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	31.7	-163.9	-56.4	0	0	0	0	115.2	E173	E173-S175 WeakPolarHBondContact O-CA 3.35Å; E173-S175 PolarHBondContact O-N 3.43Å
176	G	53.7	Low	55.3	Low	66 Å²	66	101.8 Å²	101.8	68%	0.68	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-3.2	176	0	0	0	0	0	115.3	I174	I174-G176 PolarHBondContact O-N 2.83Å
177	K	47.1	Very low	53.2	Low	196 Å²	196	109.1 Å²	109.1	85%	0.852	64%	0.642	S	S	*	*	S	Bend	trans	-108.8	0.1	179.1	-73.3	-172.7	180	175	0	116.4
178	M	40.4	Very low	51.6	Low	153 Å²	153	114.7 Å²	114.7	75%	0.754	68%	0.676	S	S	*	*	S	Bend	trans	-107	9.6	177.6	-146	-179.5	-72.7	0	0	115.1
179	V	42.2	Very low	49.7	Very low	132 Å²	132	115.9 Å²	115.9	80%	0.8	69%	0.689	S	S	*	*	S	Bend	trans	-105	34.9	170.1	-174.1	0	0	0	0	111.2
180	R	41.6	Very low	47.7	Very low	233 Å²	233	113 Å²	113	88%	0.879	69%	0.694	S	S	*	*			trans	-144.1	61.3	165.6	-107.6	178.4	166.5	-114.2	-0.4	109.7
181	A	38.4	Very low	45.9	Very low	89 Å²	89	117 Å²	117	74%	0.736	73%	0.729	S	S	*	*			trans	-63.6	133	152.7	0	0	0	0	0	107.7	A183	A181-A183 PolarHBondContact O-N 2.85Å
182	P	42.1	Very low	44.4	Very low	127 Å²	127	118.8 Å²	118.8	83%	0.825	74%	0.739	S	S	*	*			trans	-62.6	123.9	176.8	25.3	-30.7	0	0	0	108.4	A184	P182-A184 PolarHBondContact O-N 3.26Å
183	A	41.5	Very low	43	Very low	99 Å²	99	122.3 Å²	122.3	82%	0.818	77%	0.771	S	S	*	*			trans	-59.3	110.7	173	0	0	0	0	0	108.6	A181 G185	A181-A183 PolarHBondContact O-N 2.85Å; A183-G185 VanDerWaalsContact C-N 3.31Å; A183-G185 PolarHBondContact O-N 2.98Å
184	A	51.1	Low	42.1	Very low	113 Å²	113	120.7 Å²	120.7	93%	0.934	78%	0.78	S	S	*	*			trans	-63.4	95.9	162	0	0	0	0	0	107.8	P182	P182-A184 PolarHBondContact O-N 3.26Å
185	G	39.7	Very low	41.1	Very low	62 Å²	62	122.2 Å²	122.2	64%	0.639	80%	0.798	S	S	*	*			trans	-136.5	84.1	-177.6	0	0	0	0	0	111	A183	A183-G185 VanDerWaalsContact C-N 3.31Å; A183-G185 PolarHBondContact O-N 2.98Å
186	K	46.8	Very low	40.3	Very low	191 Å²	191	121.9 Å²	121.9	83%	0.83	80%	0.796	S	S	*	*			trans	23.5	107	148.8	-70	174.1	175.2	177.2	0	117.3
187	N	36	Very low	39.4	Very low	163 Å²	163	128.4 Å²	128.4	87%	0.872	81%	0.805	S	S	*	*			trans	-132.8	108.5	141.4	-79.7	-13.7	0	0	0	108.1
188	V	45.8	Very low	39.4	Very low	130 Å²	130	122.7 Å²	122.7	79%	0.788	80%	0.802	S	S	*	*			trans	-85.8	138.5	170.8	-174.1	0	0	0	0	107.8
189	P	42	Very low	39.3	Very low	121 Å²	121	120 Å²	120	79%	0.786	81%	0.805	S	S	*	*				-131.2	133	125.7	19.8	-1.3	0	0	0	109.2
190	G	34.4	Very low	39.3	Very low	69 Å²	69	119.9 Å²	119.9	71%	0.711	80%	0.804	S	S	*	*				83.5	76.8	53.2	0	0	0	0	0	109.4
191	A	35.7	Very low	39.9	Very low	102 Å²	102	115.5 Å²	115.5	84%	0.843	80%	0.797	S	S	*	*			trans	0.7	126.9	169.5	0	0	0	0	0	120.3
192	A	33.8	Very low	40.9	Very low	100 Å²	100	114.1 Å²	114.1	83%	0.826	78%	0.782	S	S	*	*				159.7	142.8	107.7	0	0	0	0	0	113
193	A	31.8	Very low	42	Very low	97 Å²	97	114.2 Å²	114.2	80%	0.802	78%	0.775	S	S	*	*			trans	78.4	102.2	154.8	0	0	0	0	0	120.9
194	A	37	Very low	43.1	Very low	94 Å²	94	115.2 Å²	115.2	78%	0.777	77%	0.767	S	S	*	*				46.2	117.1	128.4	0	0	0	0	0	120.5
195	S	31.3	Very low	44	Very low	115 Å²	115	115.1 Å²	115.1	80%	0.804	75%	0.747	S	S	*	*				165.1	119.5	104.7	42.1	0	0	0	0	113.7
196	S	33.9	Very low	45.4	Very low	108 Å²	108	116 Å²	116	76%	0.755	74%	0.736	S	S	*	*			trans	24.7	139.1	145.2	63.5	0	0	0	0	124.7
197	K	35.5	Very low	46.5	Very low	202 Å²	202	112.4 Å²	112.4	88%	0.878	72%	0.722	S	S	*	*			trans	97	104.1	140.7	-82.2	176	178.6	-174.5	0	118.9
198	G	45.3	Very low	48.3	Very low	77 Å²	77	113.8 Å²	113.8	79%	0.794	72%	0.715	S	S	*	*			trans	-63.6	139.2	142.3	0	0	0	0	0	109.9
199	A	40.2	Very low	49.4	Very low	97 Å²	97	113.7 Å²	113.7	80%	0.802	71%	0.707	S	S	*	*			trans	-109	101.6	175.2	0	0	0	0	0	108.5
200	T	41.5	Very low	50.6	Low	128 Å²	128	112.7 Å²	112.7	79%	0.785	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-50.2	129.4	149.8	46.8	0	0	0	0	108.5	S202	T200-S202 PolarHBondContact O-N 3.49Å; T200-S202 VanDerWaalsContact O-N 3.11Å
201	I	54.9	Low	52.4	Low	141 Å²	141	118.9 Å²	118.9	72%	0.723	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-56.6	116.1	168.5	-61.9	163.9	0	0	0	106.5	I206	I201-I206 HydrophobicContact CG2-CG1 4.46Å
202	S	59.6	Low	54.1	Low	60 Å²	60	118.1 Å²	118.1	42%	0.42	69%	0.69	S	S	.	*	P	Polyproline II helix	trans	-81.2	141.9	-176.7	46.8	0	0	0	0	111.3	T200 D204 E205	T200-S202 PolarHBondContact O-N 3.49Å; T200-S202 VanDerWaalsContact O-N 3.11Å; S202-D204 PolarHBondContact O-N 3.24Å; S202-E205 WeakPolarHBondContact O-CB 3.43Å; S202-E205 PolarHBondContact O-N 3.08Å
203	D	63.5	Low	55.8	Low	129 Å²	129	120 Å²	120	69%	0.69	69%	0.685	S	S	*	*	H	α-helix	trans	-52.7	-26.5	-179.3	-66.8	-26.2	0	0	0	113.6	E205 I206 E207	D203-E205 VanDerWaalsContact C-N 3.3Å; D203-E205 PolarHBondContact O-N 3.49Å; D203-I206 PolarHBondContact O-N 3.03Å; D203-E207 PolarHBondContact O-N 3.09Å
204	D	66.1	Low	57.3	Low	121 Å²	121	118.6 Å²	118.6	65%	0.647	68%	0.68	S	S	*	*	H	α-helix	trans	-62.1	-30.9	174.6	-64.6	-36.2	0	0	0	113.9	S202 R208	S202-D204 PolarHBondContact O-N 3.24Å; D204-R208 WeakPolarHBondContact O-CB 3.48Å; D204-R208 PolarHBondContact O-N 2.96Å
205	E	68.8	Low	58.3	Low	110 Å²	110	119.3 Å²	119.3	51%	0.514	67%	0.674	S	S	.	*	H	α-helix	trans	-75.5	-34.6	178.4	-161.9	93.4	-152.7	0	0	110.6	S202 D203 Q209	S202-E205 WeakPolarHBondContact O-CB 3.43Å; S202-E205 PolarHBondContact O-N 3.08Å; D203-E205 VanDerWaalsContact C-N 3.3Å; D203-E205 PolarHBondContact O-N 3.49Å; E205-Q209 WeakPolarHBondContact O-CG 3.31Å; E205-Q209 PolarHBondContact O-N 2.99Å
206	I	68.7	Low	59.4	Low	80 Å²	80	124.7 Å²	124.7	41%	0.41	69%	0.694	S	S	.	*	H	α-helix	trans	-72	-42.7	177.3	-59.6	175.6	0	0	0	109.9	I201 D203 R208 Q209 L210	I201-I206 HydrophobicContact CG2-CG1 4.46Å; D203-I206 PolarHBondContact O-N 3.03Å; I206-R208 VanDerWaalsContact C-N 3.3Å; I206-R208 PolarHBondContact O-N 3.43Å; I206-Q209 PolarHBondContact O-N 3.38Å; I206-L210 HydrophobicContact CG2-CD1 4.1Å; I206-L210 PolarHBondContact O-N 3.43Å
207	E	70.6	Confident	60.6	Low	116 Å²	116	125.5 Å²	125.5	54%	0.542	69%	0.691	S	S	.	*	H	α-helix	trans	-66.5	-33.2	178.7	-147.2	178.7	-153.6	0	0	111.9	D203 L210 R211	D203-E207 PolarHBondContact O-N 3.09Å; E207-L210 PolarHBondContact O-N 3.31Å; E207-R211 PolarHBondContact O-N 3.27Å; E207-R211 VanDerWaalsContact O-N 3.14Å
208	R	73.9	Confident	62	Low	192 Å²	192	121.5 Å²	121.5	73%	0.725	68%	0.681	S	S	*	*	H	α-helix	trans	-68.9	-35.3	173.2	-165.9	177.2	-176.1	-164.6	1.4	112.9	D204 I206 A212	D204-R208 WeakPolarHBondContact O-CB 3.48Å; D204-R208 PolarHBondContact O-N 2.96Å; I206-R208 VanDerWaalsContact C-N 3.3Å; I206-R208 PolarHBondContact O-N 3.43Å; R208-A212 WeakPolarHBondContact O-CB 3.44Å; R208-A212 PolarHBondContact O-N 3.36Å
209	Q	68.9	Low	62.9	Low	129 Å²	129	123.9 Å²	123.9	60%	0.603	68%	0.675	S	S	*	*	H	α-helix	trans	-73.6	-33.3	176	-76.4	-175.3	-18.8	0	0	112.7	E205 I206 A212 L213	E205-Q209 WeakPolarHBondContact O-CG 3.31Å; E205-Q209 PolarHBondContact O-N 2.99Å; I206-Q209 PolarHBondContact O-N 3.38Å; Q209-A212 PolarHBondContact O-N 3.14Å; Q209-L213 PolarHBondContact O-N 3.17Å
210	L	68.2	Low	64.2	Low	99 Å²	99	125.5 Å²	125.5	52%	0.518	67%	0.668	S	S	.	*	H	α-helix	trans	-68.7	-41.6	175	-78.5	161.4	0	0	0	112.3	I206 E207 A212 L213	I206-L210 HydrophobicContact CG2-CD1 4.1Å; I206-L210 PolarHBondContact O-N 3.43Å; E207-L210 PolarHBondContact O-N 3.31Å; L210-A212 VanDerWaalsContact C-N 3.32Å; L210-A212 PolarHBondContact O-N 3.12Å; L210-L213 PolarHBondContact O-N 3.3Å
211	R	71.1	Confident	65.7	Low	199 Å²	199	125.4 Å²	125.4	75%	0.751	66%	0.66	S	S	*	*	H	α-helix	trans	-66.5	-30.5	173.7	-78.6	-175.3	167.3	168.3	1.3	113.7	E207 L213 G214	E207-R211 PolarHBondContact O-N 3.27Å; E207-R211 VanDerWaalsContact O-N 3.14Å; R211-L213 PolarHBondContact O-N 3.28Å; R211-G214 PolarHBondContact O-N 3.13Å
212	A	71.8	Confident	66.4	Low	87 Å²	87	124.3 Å²	124.3	72%	0.719	66%	0.656	S	S	*	*	H	α-helix	trans	-71.2	-17.8	176.7	0	0	0	0	0	113.4	R208 Q209 L210	R208-A212 WeakPolarHBondContact O-CB 3.44Å; R208-A212 PolarHBondContact O-N 3.36Å; Q209-A212 PolarHBondContact O-N 3.14Å; L210-A212 VanDerWaalsContact C-N 3.32Å; L210-A212 PolarHBondContact O-N 3.12Å
213	L	70.4	Confident	66.9	Low	139 Å²	139	128.9 Å²	128.9	73%	0.728	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	2.7	177.6	-70.9	167.8	0	0	0	113.4	Q209 L210 R211 V215	Q209-L213 PolarHBondContact O-N 3.17Å; L210-L213 PolarHBondContact O-N 3.3Å; R211-L213 PolarHBondContact O-N 3.28Å; L213-V215 VanDerWaalsContact C-N 3.33Å; L213-V215 PolarHBondContact O-N 3.21Å
214	G	61.5	Low	67.1	Low	68 Å²	68	128.9 Å²	128.9	70%	0.701	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	65.6	31	170.7	0	0	0	0	0	114.7	R211	R211-G214 PolarHBondContact O-N 3.13Å
215	V	59.7	Low	67.2	Low	108 Å²	108	129.6 Å²	129.6	66%	0.655	67%	0.674	S	S	*	*			trans	-104.6	98.4	169.7	-173.3	0	0	0	0	106.5	L213	L213-V215 VanDerWaalsContact C-N 3.33Å; L213-V215 PolarHBondContact O-N 3.21Å
216	D	53	Low	67.1	Low	228 Å²	228	131.4 Å²	131.4	100%	1.219	69%	0.688	S	S	*	*			trans	-66.7	0	166.4	-83	-43.9	0	0	0	111

Retrieved 216 of 216 residues in 312.3 ms (Link to these results)

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