X6RLR1_HUMAN Loading...

Dynactin subunit 3

AlphaFold DB , UniProt , Accession X6RLR1, Species HUMAN (Homo sapiens, Human), Gene DCTN3, Length 176 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	54.4	Low	78.7	Confident	206 Å²	206	113.3 Å²	113.3	100%	1.015	60%	0.6	S	S	*	*				0	-49.1	0	-65.6	-60.5	-89	0	0	112.4	G3 L4	M1-G3 PolarHBondContact O-N 3.18Å; M1-L4 PolarHBondContact O-N 3.17Å
2	A	62.1	Low	79.4	Confident	69 Å²	69	107.8 Å²	107.8	57%	0.57	58%	0.583	S	S	*	*	H	α-helix	trans	-62.4	-38.4	178.1	0	0	0	0	0	115.2	L4 T5 D6	A2-L4 PolarHBondContact O-N 2.94Å; A2-T5 PolarHBondContact O-N 3.28Å; A2-T5 PolarHBondContact O-OG1 2.83Å; A2-D6 PolarHBondContact O-N 2.84Å; A2-D6 VanDerWaalsContact O-N 3.14Å
3	G	70.4	Confident	80.1	Confident	49 Å²	49	110.8 Å²	110.8	51%	0.505	58%	0.581	S	S	.	*	H	α-helix	trans	-65.5	-25.3	177.5	0	0	0	0	0	114.4	M1 L7	M1-G3 PolarHBondContact O-N 3.18Å; G3-L7 WeakPolarHBondContact O-CG 3.32Å; G3-L7 PolarHBondContact O-N 3.14Å
4	L	76.1	Confident	80.5	Confident	109 Å²	109	107.7 Å²	107.7	57%	0.571	57%	0.568	S	S	*	*	H	α-helix	trans	-76.7	-37.2	178	-150.2	96	0	0	0	111.1	M1 A2 Q8	M1-L4 PolarHBondContact O-N 3.17Å; A2-L4 PolarHBondContact O-N 2.94Å; L4-Q8 VanDerWaalsContact O-CG 3.28Å; L4-Q8 WeakPolarHBondContact O-CG 3.42Å; L4-Q8 PolarHBondContact O-N 3.33Å
5	T	79	Confident	80.8	Confident	79 Å²	79	107.6 Å²	107.6	49%	0.485	56%	0.564	S	S	.	*	H	α-helix	trans	-70	-36	177.5	51.3	0	0	0	0	111.9	A2 Q8 R9	A2-T5 PolarHBondContact O-N 3.28Å; A2-T5 PolarHBondContact O-OG1 2.83Å; T5-Q8 PolarHBondContact O-N 2.97Å; T5-R9 WeakPolarHBondContact O-CB 3.38Å; T5-R9 PolarHBondContact O-N 3.47Å
6	D	84.2	Confident	81	Confident	100 Å²	100	108.4 Å²	108.4	54%	0.535	56%	0.564	S	S	.	*	H	α-helix	trans	-69.2	-39.4	176.7	-67.8	-26.1	0	0	0	111.9	A2 R9 L10	A2-D6 PolarHBondContact O-N 2.84Å; A2-D6 VanDerWaalsContact O-N 3.14Å; D6-R9 PolarHBondContact O-N 3Å; D6-L10 WeakPolarHBondContact O-CB 3.48Å; D6-L10 PolarHBondContact O-N 3.38Å
7	L	87.2	Confident	81.1	Confident	114 Å²	114	108.4 Å²	108.4	60%	0.597	56%	0.563	S	S	*	*	H	α-helix	trans	-64.2	-43.3	173.9	-78.2	170.7	0	0	0	112.2	G3 R9 L10 Q11	G3-L7 WeakPolarHBondContact O-CG 3.32Å; G3-L7 PolarHBondContact O-N 3.14Å; L7-R9 VanDerWaalsContact C-N 3.35Å; L7-R9 PolarHBondContact O-N 3.31Å; L7-L10 PolarHBondContact O-N 3.49Å; L7-Q11 WeakPolarHBondContact O-CB 3.33Å; L7-Q11 PolarHBondContact O-N 3.07Å
8	Q	86.3	Confident	81.1	Confident	118 Å²	118	106.4 Å²	106.4	55%	0.551	55%	0.551	S	S	*	*	H	α-helix	trans	-62.5	-41.7	176	-75	172	-16.4	0	0	111.9	L4 T5 Q11 A12	L4-Q8 VanDerWaalsContact O-CG 3.28Å; L4-Q8 WeakPolarHBondContact O-CG 3.42Å; L4-Q8 PolarHBondContact O-N 3.33Å; T5-Q8 PolarHBondContact O-N 2.97Å; Q8-Q11 PolarHBondContact O-N 2.81Å; Q8-A12 PolarHBondContact O-N 2.9Å
9	R	88.8	Confident	81.1	Confident	181 Å²	181	110.5 Å²	110.5	68%	0.683	56%	0.559	S	S	*	*	H	α-helix	trans	-64.8	-40.9	175.7	-173.5	179.2	-173.6	178.5	2.9	112	T5 D6 L7 Q11 R13	T5-R9 WeakPolarHBondContact O-CB 3.38Å; T5-R9 PolarHBondContact O-N 3.47Å; D6-R9 PolarHBondContact O-N 3Å; L7-R9 VanDerWaalsContact C-N 3.35Å; L7-R9 PolarHBondContact O-N 3.31Å; R9-Q11 VanDerWaalsContact C-N 3.34Å; R9-R13 WeakPolarHBondContact O-CG 3.28Å; R9-R13 PolarHBondContact O-N 3.42Å
10	L	88.6	Confident	80.8	Confident	100 Å²	100	116 Å²	116	52%	0.524	57%	0.573	S	S	.	*	H	α-helix	trans	-65.9	-41.9	177.5	-156.7	78.3	0	0	0	110.5	D6 L7 R13 V14	D6-L10 WeakPolarHBondContact O-CB 3.48Å; D6-L10 PolarHBondContact O-N 3.38Å; L7-L10 PolarHBondContact O-N 3.49Å; L10-R13 PolarHBondContact O-N 3.44Å; L10-V14 VanDerWaalsContact O-CG2 3.3Å; L10-V14 WeakPolarHBondContact O-CG2 3.14Å; L10-V14 PolarHBondContact O-N 2.81Å
11	Q	88.6	Confident	80.5	Confident	121 Å²	121	113.7 Å²	113.7	57%	0.565	57%	0.565	S	S	*	*	H	α-helix	trans	-64.4	-44.8	179.3	-174.9	158.2	-19.9	0	0	112.3	L7 Q8 R9 R13 V14 E15	L7-Q11 WeakPolarHBondContact O-CB 3.33Å; L7-Q11 PolarHBondContact O-N 3.07Å; Q8-Q11 PolarHBondContact O-N 2.81Å; R9-Q11 VanDerWaalsContact C-N 3.34Å; Q11-R13 VanDerWaalsContact C-N 3.3Å; Q11-R13 PolarHBondContact O-N 3.43Å; Q11-V14 PolarHBondContact O-N 3.3Å; Q11-V14 VanDerWaalsContact O-N 3.13Å; Q11-E15 WeakPolarHBondContact CG-OE1 3.45Å; Q11-E15 PolarHBondContact NE2-OE1 3.29Å; Q11-E15 WeakPolarHBondContact O-CG 3.45Å; Q11-E15 PolarHBondContact O-N 3.32Å
12	A	87	Confident	81.5	Confident	48 Å²	48	108 Å²	108	40%	0.397	53%	0.533	S	S	.	.	H	α-helix	trans	-58.3	-42	174.8	0	0	0	0	0	112.2	Q8 E15 E16	Q8-A12 PolarHBondContact O-N 2.9Å; A12-E15 PolarHBondContact O-N 3.17Å; A12-E16 WeakPolarHBondContact O-CG 3.3Å; A12-E16 PolarHBondContact O-N 2.94Å
13	R	88.3	Confident	82	Confident	147 Å²	147	106.1 Å²	106.1	56%	0.555	52%	0.52	S	S	*	.	H	α-helix	trans	-65.9	-38.2	176.2	-71.8	176.7	67	-167.8	1	112.5	R9 L10 Q11 L17	R9-R13 WeakPolarHBondContact O-CG 3.28Å; R9-R13 PolarHBondContact O-N 3.42Å; L10-R13 PolarHBondContact O-N 3.44Å; Q11-R13 VanDerWaalsContact C-N 3.3Å; Q11-R13 PolarHBondContact O-N 3.43Å; R13-L17 WeakPolarHBondContact O-CB 3.37Å; R13-L17 VanDerWaalsContact O-CG 3.26Å; R13-L17 WeakPolarHBondContact O-CG 3.48Å; R13-L17 PolarHBondContact O-N 3.05Å
14	V	86.1	Confident	81.6	Confident	67 Å²	67	109.9 Å²	109.9	41%	0.406	54%	0.536	S	S	.	.	H	α-helix	trans	-67.7	-42.7	177.2	171.2	0	0	0	0	110.3	L10 Q11 E16 L17 E18	L10-V14 VanDerWaalsContact O-CG2 3.3Å; L10-V14 WeakPolarHBondContact O-CG2 3.14Å; L10-V14 PolarHBondContact O-N 2.81Å; Q11-V14 PolarHBondContact O-N 3.3Å; Q11-V14 VanDerWaalsContact O-N 3.13Å; V14-E16 VanDerWaalsContact C-N 3.34Å; V14-E16 PolarHBondContact O-N 3.47Å; V14-L17 PolarHBondContact O-N 2.91Å; V14-E18 HydrophobicContact CG1-CG 4.27Å; V14-E18 WeakPolarHBondContact O-CB 3.49Å; V14-E18 WeakPolarHBondContact O-CG 3.27Å; V14-E18 PolarHBondContact O-N 3.44Å
15	E	85.1	Confident	81	Confident	106 Å²	106	107.9 Å²	107.9	50%	0.495	54%	0.541	S	S	.	.	H	α-helix	trans	-62.6	-40.2	176.8	-72.7	172.4	-169.9	0	0	112	Q11 A12 R19	Q11-E15 WeakPolarHBondContact CG-OE1 3.45Å; Q11-E15 PolarHBondContact NE2-OE1 3.29Å; Q11-E15 WeakPolarHBondContact O-CG 3.45Å; Q11-E15 PolarHBondContact O-N 3.32Å; A12-E15 PolarHBondContact O-N 3.17Å; E15-R19 VanDerWaalsContact O-CB 3.31Å; E15-R19 WeakPolarHBondContact O-CB 3.42Å; E15-R19 PolarHBondContact O-N 3.44Å
16	E	84.3	Confident	80.1	Confident	121 Å²	121	106.9 Å²	106.9	57%	0.565	55%	0.547	S	S	*	.	H	α-helix	trans	-60.1	-51.1	170.7	-76.7	177.6	179.5	0	0	111	A12 V14 E18 R19 W20	A12-E16 WeakPolarHBondContact O-CG 3.3Å; A12-E16 PolarHBondContact O-N 2.94Å; V14-E16 VanDerWaalsContact C-N 3.34Å; V14-E16 PolarHBondContact O-N 3.47Å; E16-E18 VanDerWaalsContact C-N 3.34Å; E16-E18 PolarHBondContact O-N 3.47Å; E16-R19 CarbonylContact O-C 3.56Å; E16-R19 WeakPolarHBondContact O-CA 3.18Å; E16-R19 WeakPolarHBondContact O-CB 3.49Å; E16-R19 PolarHBondContact O-N 3.14Å; E16-W20 PolarHBondContact O-N 3.33Å
17	L	82.2	Confident	78.8	Confident	107 Å²	107	106 Å²	106	56%	0.56	55%	0.553	S	S	*	*	H	α-helix	trans	-59.8	-42.5	179.2	-73.7	171.5	0	0	0	112.5	R13 V14 R19 W20 V21	R13-L17 WeakPolarHBondContact O-CB 3.37Å; R13-L17 VanDerWaalsContact O-CG 3.26Å; R13-L17 WeakPolarHBondContact O-CG 3.48Å; R13-L17 PolarHBondContact O-N 3.05Å; V14-L17 PolarHBondContact O-N 2.91Å; L17-R19 VanDerWaalsContact C-N 3.28Å; L17-R19 PolarHBondContact O-N 2.86Å; L17-W20 PolarHBondContact O-N 2.97Å; L17-V21 WeakPolarHBondContact O-CB 3.26Å; L17-V21 VanDerWaalsContact O-CG2 3.3Å; L17-V21 WeakPolarHBondContact O-CG2 3.47Å; L17-V21 PolarHBondContact O-N 2.88Å
18	E	81.8	Confident	77.6	Confident	74 Å²	74	109.3 Å²	109.3	35%	0.346	56%	0.558	S	S	.	*	H	α-helix	trans	-62	-38.6	174.9	-74.3	-170.2	141.2	0	0	111	V14 E16 V21 Y22 R28	V14-E18 HydrophobicContact CG1-CG 4.27Å; V14-E18 WeakPolarHBondContact O-CB 3.49Å; V14-E18 WeakPolarHBondContact O-CG 3.27Å; V14-E18 PolarHBondContact O-N 3.44Å; E16-E18 VanDerWaalsContact C-N 3.34Å; E16-E18 PolarHBondContact O-N 3.47Å; E18-V21 PolarHBondContact O-N 3.5Å; E18-Y22 HydrophobicContact CB-CD2 4.41Å; E18-Y22 WeakPolarHBondContact O-CB 3.49Å; E18-Y22 WeakPolarHBondContact O-CD2 3.27Å; E18-Y22 PolarHBondContact O-N 2.85Å; E18-R28 IonicContact OE1-CZ 3.87Å; E18-R28 IonicContact OE1-NH2 2.83Å; E18-R28 PolarHBondContact OE1-NH2 3.29Å
19	R	80.7	Confident	76.4	Confident	183 Å²	183	105.9 Å²	105.9	69%	0.691	55%	0.554	S	S	*	*	H	α-helix	trans	-67.7	-38.9	175.6	-169.3	169.3	-177.7	153.6	-0.9	112.6	E15 E16 L17 G23	E15-R19 VanDerWaalsContact O-CB 3.31Å; E15-R19 WeakPolarHBondContact O-CB 3.42Å; E15-R19 PolarHBondContact O-N 3.44Å; E16-R19 CarbonylContact O-C 3.56Å; E16-R19 WeakPolarHBondContact O-CA 3.18Å; E16-R19 WeakPolarHBondContact O-CB 3.49Å; E16-R19 PolarHBondContact O-N 3.14Å; L17-R19 VanDerWaalsContact C-N 3.28Å; L17-R19 PolarHBondContact O-N 2.86Å; R19-G23 VanDerWaalsContact O-CA 3.24Å; R19-G23 WeakPolarHBondContact O-CA 3.43Å; R19-G23 PolarHBondContact O-N 2.91Å
20	W	75.8	Confident	75	Confident	221 Å²	221	102.7 Å²	102.7	84%	0.837	56%	0.559	S	S	*	*	H	α-helix	trans	-65.2	-38.2	174.7	-81.1	100.5	0	0	0	112.3	E16 L17	E16-W20 PolarHBondContact O-N 3.33Å; L17-W20 PolarHBondContact O-N 2.97Å
21	V	74.6	Confident	73.6	Confident	68 Å²	68	106.1 Å²	106.1	41%	0.412	57%	0.565	S	S	.	*	H	α-helix	trans	-86.1	-43.8	-175.2	175.4	0	0	0	0	112.7	L17 E18 V33	L17-V21 WeakPolarHBondContact O-CB 3.26Å; L17-V21 VanDerWaalsContact O-CG2 3.3Å; L17-V21 WeakPolarHBondContact O-CG2 3.47Å; L17-V21 PolarHBondContact O-N 2.88Å; E18-V21 PolarHBondContact O-N 3.5Å; V21-V33 HydrophobicContact CG1-CG2 4.45Å
22	Y	74.5	Confident	72.6	Confident	87 Å²	87	106.6 Å²	106.6	34%	0.341	57%	0.565	S	S	.	*	H	α-helix	trans	-101.8	-14.9	-173	-62.2	-77.3	0	0	0	113.9	E18 R28	E18-Y22 HydrophobicContact CB-CD2 4.41Å; E18-Y22 WeakPolarHBondContact O-CB 3.49Å; E18-Y22 WeakPolarHBondContact O-CD2 3.27Å; E18-Y22 PolarHBondContact O-N 2.85Å; Y22-R28 HydrophobicContact CE1-CG 4.45Å
23	G	71.9	Confident	71.8	Confident	29 Å²	29	108.2 Å²	108.2	30%	0.299	57%	0.57	S	S	.	*			trans	71.8	179.8	-178.2	0	0	0	0	0	113.8	R19 G25	R19-G23 VanDerWaalsContact O-CA 3.24Å; R19-G23 WeakPolarHBondContact O-CA 3.43Å; R19-G23 PolarHBondContact O-N 2.91Å; G23-G25 VanDerWaalsContact C-N 3.27Å; G23-G25 PolarHBondContact O-N 3.26Å
24	P	62.9	Low	71.1	Confident	128 Å²	128	104.3 Å²	104.3	83%	0.831	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	77.9	-178.6	32.2	-33.3	0	0	0	109.8
25	G	63.8	Low	70.7	Confident	66 Å²	66	104.4 Å²	104.4	68%	0.68	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	172.4	0.9	-177.9	0	0	0	0	0	117.2	G23 A27	G23-G25 VanDerWaalsContact C-N 3.27Å; G23-G25 PolarHBondContact O-N 3.26Å; G25-A27 PolarHBondContact O-N 3.5Å
26	G	58.8	Low	70.4	Confident	59 Å²	59	100.9 Å²	100.9	61%	0.608	56%	0.56	S	S	*	*			trans	57.3	11.1	162.2	0	0	0	0	0	117.1	R28	G26-R28 VanDerWaalsContact C-N 3.3Å; G26-R28 PolarHBondContact O-N 2.79Å
27	A	57.9	Low	70.2	Confident	81 Å²	81	100.8 Å²	100.8	67%	0.669	56%	0.562	S	S	*	*			trans	-73.6	89.6	177.6	0	0	0	0	0	108.4	G25 G29	G25-A27 PolarHBondContact O-N 3.5Å; A27-G29 PolarHBondContact O-N 2.8Å
28	R	62.4	Low	70.2	Confident	184 Å²	184	99.9 Å²	99.9	69%	0.694	56%	0.561	S	S	*	*			trans	-69.5	47.6	172	-70.3	-179	169.4	173.2	-3	111.4	E18 Y22 G26	E18-R28 IonicContact OE1-CZ 3.87Å; E18-R28 IonicContact OE1-NH2 2.83Å; E18-R28 PolarHBondContact OE1-NH2 3.29Å; Y22-R28 HydrophobicContact CE1-CG 4.45Å; G26-R28 VanDerWaalsContact C-N 3.3Å; G26-R28 PolarHBondContact O-N 2.79Å
29	G	60.2	Low	70.4	Confident	46 Å²	46	103.9 Å²	103.9	47%	0.474	58%	0.578	S	S	.	*			trans	-62.3	151.7	166	0	0	0	0	0	109.5	A27 R31	A27-G29 PolarHBondContact O-N 2.8Å; G29-R31 PolarHBondContact O-N 2.9Å
30	S	59	Low	70.5	Confident	113 Å²	113	99 Å²	99	79%	0.79	57%	0.568	S	S	*	*			trans	-63.1	68.1	171	167.1	0	0	0	0	110.5	K32	S30-K32 PolarHBondContact O-N 3.2Å
31	R	59.8	Low	70.8	Confident	172 Å²	172	94.6 Å²	94.6	65%	0.649	56%	0.557	S	S	*	*			trans	-79.7	103.6	177.1	-166.1	176.4	-91.4	170.7	-5.8	106.5	G29 V33	G29-R31 PolarHBondContact O-N 2.9Å; R31-V33 HydrophobicContact CB-CG2 4.49Å; R31-V33 HydrophobicContact CG-CG2 4.11Å; R31-V33 PolarHBondContact O-N 3.48Å
32	K	68.1	Low	71.3	Confident	132 Å²	132	95.4 Å²	95.4	57%	0.574	56%	0.561	S	S	*	*			trans	-71.1	71.6	173.4	-67.1	149.9	148.9	-110.4	0	109.1	S30 A34 D35 G36	S30-K32 PolarHBondContact O-N 3.2Å; K32-A34 PolarHBondContact O-N 3.1Å; K32-D35 HydrophobicContact CB-CB 3.59Å; K32-D35 WeakPolarHBondContact CB-OD2 3.26Å; K32-D35 WeakPolarHBondContact CD-OD2 2.96Å; K32-D35 WeakPolarHBondContact CE-OD2 3.29Å; K32-D35 WeakPolarHBondContact CG-OD2 3.29Å; K32-D35 IonicContact NZ-OD2 2.72Å; K32-D35 PolarHBondContact NZ-OD2 3.41Å; K32-D35 PolarHBondContact O-N 2.86Å; K32-G36 PolarHBondContact O-N 3.3Å
33	V	70.1	Confident	71.7	Confident	82 Å²	82	93.4 Å²	93.4	50%	0.497	56%	0.563	S	S	.	*	H	α-helix	trans	-57.1	-37	178.3	179.4	0	0	0	0	110	V21 R31 G36 L37	V21-V33 HydrophobicContact CG1-CG2 4.45Å; R31-V33 HydrophobicContact CB-CG2 4.49Å; R31-V33 HydrophobicContact CG-CG2 4.11Å; R31-V33 PolarHBondContact O-N 3.48Å; V33-G36 PolarHBondContact O-N 3.3Å; V33-L37 VanDerWaalsContact O-CB 3.26Å; V33-L37 WeakPolarHBondContact O-CB 3.33Å; V33-L37 PolarHBondContact O-N 2.72Å
34	A	73.3	Confident	71.9	Confident	65 Å²	65	94.4 Å²	94.4	54%	0.537	56%	0.561	S	S	.	*	H	α-helix	trans	-58.9	-50.5	170.8	0	0	0	0	0	112.2	K32 G36 L37 V38	K32-A34 PolarHBondContact O-N 3.1Å; A34-G36 VanDerWaalsContact C-N 3.3Å; A34-G36 PolarHBondContact O-N 3.23Å; A34-L37 PolarHBondContact O-N 3.03Å; A34-V38 WeakPolarHBondContact O-CB 3.31Å; A34-V38 VanDerWaalsContact O-CG2 3.26Å; A34-V38 WeakPolarHBondContact O-CG2 3.41Å; A34-V38 PolarHBondContact O-N 3.29Å
35	D	77.6	Confident	72.6	Confident	68 Å²	68	90.1 Å²	90.1	36%	0.364	54%	0.54	S	S	.	.	H	α-helix	trans	-65.9	-34.7	178.4	-62	-8.3	0	0	0	112	K32 K39	K32-D35 HydrophobicContact CB-CB 3.59Å; K32-D35 WeakPolarHBondContact CB-OD2 3.26Å; K32-D35 WeakPolarHBondContact CD-OD2 2.96Å; K32-D35 WeakPolarHBondContact CE-OD2 3.29Å; K32-D35 WeakPolarHBondContact CG-OD2 3.29Å; K32-D35 IonicContact NZ-OD2 2.72Å; K32-D35 PolarHBondContact NZ-OD2 3.41Å; K32-D35 PolarHBondContact O-N 2.86Å; D35-K39 WeakPolarHBondContact O-CB 3.12Å; D35-K39 VanDerWaalsContact O-CG 3.27Å; D35-K39 WeakPolarHBondContact O-CG 3.39Å; D35-K39 PolarHBondContact O-N 3.37Å
36	G	78.6	Confident	73.4	Confident	32 Å²	32	91 Å²	91	33%	0.33	53%	0.529	S	S	.	.	H	α-helix	trans	-64.4	-45.3	173.7	0	0	0	0	0	111.8	K32 V33 A34 K39 V40	K32-G36 PolarHBondContact O-N 3.3Å; V33-G36 PolarHBondContact O-N 3.3Å; A34-G36 VanDerWaalsContact C-N 3.3Å; A34-G36 PolarHBondContact O-N 3.23Å; G36-K39 PolarHBondContact O-N 2.89Å; G36-V40 VanDerWaalsContact O-CG2 3.3Å; G36-V40 WeakPolarHBondContact O-CG2 3.41Å; G36-V40 PolarHBondContact O-N 2.77Å
37	L	79.6	Confident	74.2	Confident	119 Å²	119	91.9 Å²	91.9	62%	0.623	52%	0.519	S	S	*	.	H	α-helix	trans	-63.6	-42.5	176	-173.2	66.4	0	0	0	111.1	V33 A34 K39 V40 Q41	V33-L37 VanDerWaalsContact O-CB 3.26Å; V33-L37 WeakPolarHBondContact O-CB 3.33Å; V33-L37 PolarHBondContact O-N 2.72Å; A34-L37 PolarHBondContact O-N 3.03Å; L37-K39 PolarHBondContact O-N 3.41Å; L37-V40 PolarHBondContact O-N 2.84Å; L37-Q41 VanDerWaalsContact O-CB 3.29Å; L37-Q41 WeakPolarHBondContact O-CB 3.35Å; L37-Q41 PolarHBondContact O-N 3.29Å
38	V	83.9	Confident	74.7	Confident	89 Å²	89	89.4 Å²	89.4	54%	0.539	50%	0.497	S	S	.	.	H	α-helix	trans	-62.4	-42.7	174.6	171.4	0	0	0	0	110.8	A34 V40 Q41 V42	A34-V38 WeakPolarHBondContact O-CB 3.31Å; A34-V38 VanDerWaalsContact O-CG2 3.26Å; A34-V38 WeakPolarHBondContact O-CG2 3.41Å; A34-V38 PolarHBondContact O-N 3.29Å; V38-V40 PolarHBondContact O-N 3.25Å; V38-Q41 PolarHBondContact O-N 2.8Å; V38-V42 HydrophobicContact CG1-CG2 4.44Å; V38-V42 WeakPolarHBondContact O-CB 3.21Å; V38-V42 VanDerWaalsContact O-CG2 3.28Å; V38-V42 WeakPolarHBondContact O-CG2 3.26Å; V38-V42 PolarHBondContact O-N 3.39Å
39	K	85.6	Confident	75	Confident	158 Å²	158	84.5 Å²	84.5	69%	0.687	49%	0.491	S	S	*	.	H	α-helix	trans	-62.3	-43	175	-77.4	175.1	-177.4	-176.5	0	112.3	D35 G36 L37 V42 A43	D35-K39 WeakPolarHBondContact O-CB 3.12Å; D35-K39 VanDerWaalsContact O-CG 3.27Å; D35-K39 WeakPolarHBondContact O-CG 3.39Å; D35-K39 PolarHBondContact O-N 3.37Å; G36-K39 PolarHBondContact O-N 2.89Å; L37-K39 PolarHBondContact O-N 3.41Å; K39-V42 PolarHBondContact O-N 3.44Å; K39-A43 WeakPolarHBondContact O-CB 3.3Å; K39-A43 PolarHBondContact O-N 3.16Å
40	V	82.7	Confident	75.6	Confident	80 Å²	80	90.6 Å²	90.6	49%	0.485	51%	0.505	S	S	.	.	H	α-helix	trans	-65.3	-42.2	176.7	171.8	0	0	0	0	110.5	G36 L37 V38 V42 A43 L44	G36-V40 VanDerWaalsContact O-CG2 3.3Å; G36-V40 WeakPolarHBondContact O-CG2 3.41Å; G36-V40 PolarHBondContact O-N 2.77Å; L37-V40 PolarHBondContact O-N 2.84Å; V38-V40 PolarHBondContact O-N 3.25Å; V40-V42 PolarHBondContact O-N 3.46Å; V40-A43 PolarHBondContact O-N 3Å; V40-L44 HydrophobicContact CG1-CD1 3.69Å; V40-L44 HydrophobicContact CG1-CG 4.26Å; V40-L44 VanDerWaalsContact O-CB 3.29Å; V40-L44 WeakPolarHBondContact O-CB 3.08Å; V40-L44 VanDerWaalsContact O-CG 3.26Å; V40-L44 WeakPolarHBondContact O-CG 3.36Å; V40-L44 PolarHBondContact O-N 3.13Å
41	Q	82.2	Confident	76.3	Confident	129 Å²	129	93.3 Å²	93.3	60%	0.603	50%	0.498	S	S	*	.	H	α-helix	trans	-61.7	-44	176.1	-175	65.2	7.1	0	0	112	L37 V38 L44 G45	L37-Q41 VanDerWaalsContact O-CB 3.29Å; L37-Q41 WeakPolarHBondContact O-CB 3.35Å; L37-Q41 PolarHBondContact O-N 3.29Å; V38-Q41 PolarHBondContact O-N 2.8Å; Q41-L44 PolarHBondContact O-N 3.45Å; Q41-G45 PolarHBondContact O-N 2.88Å
42	V	85.2	Confident	77	Confident	84 Å²	84	90.2 Å²	90.2	51%	0.509	49%	0.49	S	S	.	.	H	α-helix	trans	-66.2	-41.6	176.2	171	0	0	0	0	111	V38 K39 V40 G45 N46	V38-V42 HydrophobicContact CG1-CG2 4.44Å; V38-V42 WeakPolarHBondContact O-CB 3.21Å; V38-V42 VanDerWaalsContact O-CG2 3.28Å; V38-V42 WeakPolarHBondContact O-CG2 3.26Å; V38-V42 PolarHBondContact O-N 3.39Å; K39-V42 PolarHBondContact O-N 3.44Å; V40-V42 PolarHBondContact O-N 3.46Å; V42-G45 PolarHBondContact O-N 3.42Å; V42-N46 WeakPolarHBondContact O-CB 3.37Å; V42-N46 VanDerWaalsContact O-CG 3.25Å; V42-N46 PolarHBondContact O-N 3.29Å; V42-N46 PolarHBondContact O-ND2 2.82Å
43	A	81.8	Confident	77.2	Confident	46 Å²	46	93.9 Å²	93.9	38%	0.38	50%	0.501	S	S	.	.	H	α-helix	trans	-62.7	-44	175.4	0	0	0	0	0	111.6	K39 V40 N46 I47	K39-A43 WeakPolarHBondContact O-CB 3.3Å; K39-A43 PolarHBondContact O-N 3.16Å; V40-A43 PolarHBondContact O-N 3Å; A43-N46 PolarHBondContact O-N 3.42Å; A43-I47 WeakPolarHBondContact O-CB 2.97Å; A43-I47 WeakPolarHBondContact O-CD1 3.48Å; A43-I47 WeakPolarHBondContact O-CG1 3.41Å; A43-I47 PolarHBondContact O-N 3.38Å
44	L	76.8	Confident	77.4	Confident	49 Å²	49	91.6 Å²	91.6	26%	0.257	49%	0.487	S	S	.	.	H	α-helix	trans	-65.5	-41.5	176.2	-76.1	171.9	0	0	0	112.4	V40 Q41 N46 I47 S48 Y58	V40-L44 HydrophobicContact CG1-CD1 3.69Å; V40-L44 HydrophobicContact CG1-CG 4.26Å; V40-L44 VanDerWaalsContact O-CB 3.29Å; V40-L44 WeakPolarHBondContact O-CB 3.08Å; V40-L44 VanDerWaalsContact O-CG 3.26Å; V40-L44 WeakPolarHBondContact O-CG 3.36Å; V40-L44 PolarHBondContact O-N 3.13Å; Q41-L44 PolarHBondContact O-N 3.45Å; L44-N46 VanDerWaalsContact C-N 3.33Å; L44-N46 PolarHBondContact O-N 3.18Å; L44-I47 PolarHBondContact O-N 2.82Å; L44-S48 WeakPolarHBondContact O-CB 3.45Å; L44-S48 PolarHBondContact O-N 2.67Å; L44-Y58 HydrophobicContact CD2-CE2 3.94Å; L44-Y58 WeakPolarHBondContact CD2-OH 3.26Å
45	G	78.3	Confident	77.4	Confident	38 Å²	38	92 Å²	92	39%	0.392	48%	0.477	S	S	.	.	H	α-helix	trans	-59.5	-43.2	172.8	0	0	0	0	0	112.1	Q41 V42 S49	Q41-G45 PolarHBondContact O-N 2.88Å; V42-G45 PolarHBondContact O-N 3.42Å; G45-S49 WeakPolarHBondContact O-CB 3.09Å; G45-S49 PolarHBondContact O-N 3.44Å; G45-S49 PolarHBondContact O-OG 3.43Å; G45-S49 VanDerWaalsContact O-OG 3.14Å
46	N	79.5	Confident	77.5	Confident	85 Å²	85	92.8 Å²	92.8	46%	0.455	48%	0.48	S	S	.	.	H	α-helix	trans	-68.1	-36.2	176.7	-75	-30.6	0	0	0	113.3	V42 A43 L44 S49 K50	V42-N46 WeakPolarHBondContact O-CB 3.37Å; V42-N46 VanDerWaalsContact O-CG 3.25Å; V42-N46 PolarHBondContact O-N 3.29Å; V42-N46 PolarHBondContact O-ND2 2.82Å; A43-N46 PolarHBondContact O-N 3.42Å; L44-N46 VanDerWaalsContact C-N 3.33Å; L44-N46 PolarHBondContact O-N 3.18Å; N46-S49 PolarHBondContact O-OG 2.77Å; N46-K50 WeakPolarHBondContact O-CB 3.39Å; N46-K50 VanDerWaalsContact O-CG 3.32Å; N46-K50 WeakPolarHBondContact O-CG 3.12Å; N46-K50 PolarHBondContact O-N 3.4Å
47	I	76.6	Confident	77.3	Confident	77 Å²	77	96.1 Å²	96.1	40%	0.395	49%	0.489	S	S	.	.	H	α-helix	trans	-73.4	-41.9	177.1	-67.5	163.4	0	0	0	110.4	A43 L44 K50 R51 V54	A43-I47 WeakPolarHBondContact O-CB 2.97Å; A43-I47 WeakPolarHBondContact O-CD1 3.48Å; A43-I47 WeakPolarHBondContact O-CG1 3.41Å; A43-I47 PolarHBondContact O-N 3.38Å; L44-I47 PolarHBondContact O-N 2.82Å; I47-K50 PolarHBondContact O-N 2.8Å; I47-R51 WeakPolarHBondContact O-CB 3.31Å; I47-R51 PolarHBondContact O-N 3.32Å; I47-V54 HydrophobicContact CG2-CB 4.25Å; I47-V54 HydrophobicContact CG2-CG1 3.91Å; I47-V54 HydrophobicContact CG2-CG2 4.06Å
48	S	68.2	Low	77	Confident	30 Å²	30	95.3 Å²	95.3	21%	0.21	48%	0.479	C	S	.	.	H	α-helix	trans	-65.5	-37.5	178	-175.2	0	0	0	0	112	L44	L44-S48 WeakPolarHBondContact O-CB 3.45Å; L44-S48 PolarHBondContact O-N 2.67Å
49	S	68.6	Low	76.8	Confident	81 Å²	81	97.3 Å²	97.3	57%	0.566	48%	0.48	S	S	*	.	H	α-helix	trans	-74.6	-31.4	178	68	0	0	0	0	113.8	G45 N46	G45-S49 WeakPolarHBondContact O-CB 3.09Å; G45-S49 PolarHBondContact O-N 3.44Å; G45-S49 PolarHBondContact O-OG 3.43Å; G45-S49 VanDerWaalsContact O-OG 3.14Å; N46-S49 PolarHBondContact O-OG 2.77Å
50	K	72.1	Confident	76.5	Confident	174 Å²	174	95.6 Å²	95.6	76%	0.757	47%	0.473	S	S	*	.	H	α-helix	trans	-91.2	-19.5	-179.3	-67	-179	-177.8	-176.2	0	114.3	N46 I47	N46-K50 WeakPolarHBondContact O-CB 3.39Å; N46-K50 VanDerWaalsContact O-CG 3.32Å; N46-K50 WeakPolarHBondContact O-CG 3.12Å; N46-K50 PolarHBondContact O-N 3.4Å; I47-K50 PolarHBondContact O-N 2.8Å
51	R	74.8	Confident	76.4	Confident	170 Å²	170	95.9 Å²	95.9	64%	0.642	47%	0.471	S	S	*	.			trans	-127.9	96.3	-179.2	-63.2	-173.2	-171.2	-98.9	4.1	110.4	I47 R53 V54 K55	I47-R51 WeakPolarHBondContact O-CB 3.31Å; I47-R51 PolarHBondContact O-N 3.32Å; R51-R53 PolarHBondContact O-N 2.98Å; R51-R53 VanDerWaalsContact O-N 3.07Å; R51-V54 HydrophobicContact CB-CB 4.18Å; R51-V54 HydrophobicContact CB-CG2 3.76Å; R51-V54 WeakPolarHBondContact O-CB 3.3Å; R51-V54 PolarHBondContact O-N 3.32Å; R51-K55 PolarHBondContact O-N 3.17Å
52	E	73.9	Confident	76.1	Confident	106 Å²	106	95.9 Å²	95.9	50%	0.495	47%	0.471	S	S	.	.	H	α-helix	trans	-55.3	-32.3	-179.8	-155.1	63.5	-156.8	0	0	112.6	V54 K55 I56	E52-V54 VanDerWaalsContact C-N 3.32Å; E52-V54 PolarHBondContact O-N 3.31Å; E52-K55 PolarHBondContact O-N 3.28Å; E52-K55 WeakPolarHBondContact OE1-CD 3.42Å; E52-K55 IonicContact OE1-NZ 2.83Å; E52-K55 PolarHBondContact OE1-NZ 3.17Å; E52-K55 IonicContact OE2-NZ 3.68Å; E52-I56 VanDerWaalsContact O-CG1 3.3Å; E52-I56 WeakPolarHBondContact O-CG1 3.05Å; E52-I56 PolarHBondContact O-N 3.04Å
53	R	72.1	Confident	75.6	Confident	210 Å²	210	95 Å²	95	79%	0.792	46%	0.463	S	S	*	.	H	α-helix	trans	-60.1	-37.5	173.3	-70.5	178.6	69.2	174.3	1.5	113.2	R51 L57	R51-R53 PolarHBondContact O-N 2.98Å; R51-R53 VanDerWaalsContact O-N 3.07Å; R53-L57 VanDerWaalsContact O-CG 3.27Å; R53-L57 WeakPolarHBondContact O-CG 3.49Å; R53-L57 PolarHBondContact O-N 3.28Å
54	V	73.7	Confident	75.3	Confident	34 Å²	34	97.3 Å²	97.3	21%	0.206	47%	0.469	C	S	.	.	H	α-helix	trans	-72.6	-39.6	179.4	178.4	0	0	0	0	110.3	I47 R51 E52 I56 L57 Y58	I47-V54 HydrophobicContact CG2-CB 4.25Å; I47-V54 HydrophobicContact CG2-CG1 3.91Å; I47-V54 HydrophobicContact CG2-CG2 4.06Å; R51-V54 HydrophobicContact CB-CB 4.18Å; R51-V54 HydrophobicContact CB-CG2 3.76Å; R51-V54 WeakPolarHBondContact O-CB 3.3Å; R51-V54 PolarHBondContact O-N 3.32Å; E52-V54 VanDerWaalsContact C-N 3.32Å; E52-V54 PolarHBondContact O-N 3.31Å; V54-I56 VanDerWaalsContact C-N 3.34Å; V54-I56 PolarHBondContact O-N 3.12Å; V54-L57 WeakPolarHBondContact O-CB 3.22Å; V54-L57 PolarHBondContact O-N 3.44Å; V54-Y58 HydrophobicContact CG1-CD2 3.72Å; V54-Y58 HydrophobicContact CG1-CE2 3.83Å; V54-Y58 WeakPolarHBondContact O-CD2 3.38Å; V54-Y58 PolarHBondContact O-N 2.85Å
55	K	74.3	Confident	75.3	Confident	74 Å²	74	100.4 Å²	100.4	32%	0.322	48%	0.484	S	S	.	.	H	α-helix	trans	-61.7	-40.6	174.1	-175.1	178.8	166.2	-156.3	0	112.6	R51 E52 Y58 K59	R51-K55 PolarHBondContact O-N 3.17Å; E52-K55 PolarHBondContact O-N 3.28Å; E52-K55 WeakPolarHBondContact OE1-CD 3.42Å; E52-K55 IonicContact OE1-NZ 2.83Å; E52-K55 PolarHBondContact OE1-NZ 3.17Å; E52-K55 IonicContact OE2-NZ 3.68Å; K55-Y58 PolarHBondContact O-N 3.17Å; K55-K59 PolarHBondContact O-N 2.88Å; K55-K59 VanDerWaalsContact O-N 3.14Å
56	I	78.8	Confident	75.1	Confident	84 Å²	84	104.4 Å²	104.4	43%	0.431	49%	0.491	S	S	.	.	H	α-helix	trans	-64	-42.8	173	-66	162.9	0	0	0	110.7	E52 V54 K59 K60	E52-I56 VanDerWaalsContact O-CG1 3.3Å; E52-I56 WeakPolarHBondContact O-CG1 3.05Å; E52-I56 PolarHBondContact O-N 3.04Å; V54-I56 VanDerWaalsContact C-N 3.34Å; V54-I56 PolarHBondContact O-N 3.12Å; I56-K59 PolarHBondContact O-N 3.09Å; I56-K60 HydrophobicContact CG2-CD 4.32Å; I56-K60 WeakPolarHBondContact O-CB 3.25Å; I56-K60 WeakPolarHBondContact O-CG 3.45Å; I56-K60 PolarHBondContact O-N 3.46Å
57	L	75.6	Confident	74.4	Confident	102 Å²	102	106.9 Å²	106.9	53%	0.534	50%	0.495	S	S	.	.	H	α-helix	trans	-63.6	-41	176.8	-73.1	166.3	0	0	0	112.2	R53 V54 K60 I61	R53-L57 VanDerWaalsContact O-CG 3.27Å; R53-L57 WeakPolarHBondContact O-CG 3.49Å; R53-L57 PolarHBondContact O-N 3.28Å; V54-L57 WeakPolarHBondContact O-CB 3.22Å; V54-L57 PolarHBondContact O-N 3.44Å; L57-K60 CarbonylContact O-C 3.58Å; L57-K60 PolarHBondContact O-N 3.43Å; L57-I61 VanDerWaalsContact O-CG1 3.31Å; L57-I61 WeakPolarHBondContact O-CG1 3.26Å; L57-I61 PolarHBondContact O-N 2.79Å
58	Y	73.3	Confident	73.9	Confident	101 Å²	101	109.2 Å²	109.2	40%	0.396	51%	0.507	S	S	.	.	H	α-helix	trans	-61.1	-44.6	176.1	-97.7	-79.1	0	0	0	112.7	L44 V54 K55 K60 I61 E62	L44-Y58 HydrophobicContact CD2-CE2 3.94Å; L44-Y58 WeakPolarHBondContact CD2-OH 3.26Å; V54-Y58 HydrophobicContact CG1-CD2 3.72Å; V54-Y58 HydrophobicContact CG1-CE2 3.83Å; V54-Y58 WeakPolarHBondContact O-CD2 3.38Å; V54-Y58 PolarHBondContact O-N 2.85Å; K55-Y58 PolarHBondContact O-N 3.17Å; Y58-K60 VanDerWaalsContact C-N 3.33Å; Y58-K60 PolarHBondContact O-N 2.96Å; Y58-I61 PolarHBondContact O-N 3.13Å; Y58-E62 PolarHBondContact O-N 2.85Å
59	K	79.8	Confident	74.1	Confident	131 Å²	131	111.6 Å²	111.6	57%	0.57	52%	0.518	S	S	*	.	H	α-helix	trans	-62.3	-41.5	173.5	-71.6	-175.3	174.9	-170.3	0	112	K55 I56 I61 E62 D63	K55-K59 PolarHBondContact O-N 2.88Å; K55-K59 VanDerWaalsContact O-N 3.14Å; I56-K59 PolarHBondContact O-N 3.09Å; K59-I61 VanDerWaalsContact C-N 3.3Å; K59-I61 PolarHBondContact O-N 2.77Å; K59-E62 PolarHBondContact O-N 2.98Å; K59-D63 PolarHBondContact O-N 3.42Å; K59-D63 VanDerWaalsContact O-N 3.1Å
60	K	79.4	Confident	73.9	Confident	123 Å²	123	111.9 Å²	111.9	54%	0.535	52%	0.517	S	S	.	.	H	α-helix	trans	-65	-31.3	175.9	-76.3	-173.9	176.5	-166.5	0	112.8	I56 L57 Y58 D63 L64	I56-K60 HydrophobicContact CG2-CD 4.32Å; I56-K60 WeakPolarHBondContact O-CB 3.25Å; I56-K60 WeakPolarHBondContact O-CG 3.45Å; I56-K60 PolarHBondContact O-N 3.46Å; L57-K60 CarbonylContact O-C 3.58Å; L57-K60 PolarHBondContact O-N 3.43Å; Y58-K60 VanDerWaalsContact C-N 3.33Å; Y58-K60 PolarHBondContact O-N 2.96Å; K60-D63 PolarHBondContact O-N 3.27Å; K60-L64 WeakPolarHBondContact O-CB 2.92Å; K60-L64 WeakPolarHBondContact O-CD1 3.47Å; K60-L64 WeakPolarHBondContact O-CG 3.45Å; K60-L64 PolarHBondContact O-N 3.06Å
61	I	79.1	Confident	73.5	Confident	85 Å²	85	109.6 Å²	109.6	44%	0.436	51%	0.51	S	S	.	.	H	α-helix	trans	-64.9	-44.8	175.3	-71.7	163.3	0	0	0	110.2	L57 Y58 K59 D63 L64 I65	L57-I61 VanDerWaalsContact O-CG1 3.31Å; L57-I61 WeakPolarHBondContact O-CG1 3.26Å; L57-I61 PolarHBondContact O-N 2.79Å; Y58-I61 PolarHBondContact O-N 3.13Å; K59-I61 VanDerWaalsContact C-N 3.3Å; K59-I61 PolarHBondContact O-N 2.77Å; I61-D63 VanDerWaalsContact C-N 3.33Å; I61-D63 PolarHBondContact O-N 2.99Å; I61-L64 PolarHBondContact O-N 3.4Å; I61-I65 HydrophobicContact CG2-CD1 3.92Å; I61-I65 HydrophobicContact CG2-CG1 4.49Å; I61-I65 VanDerWaalsContact O-CG1 3.26Å; I61-I65 WeakPolarHBondContact O-CG1 3.38Å; I61-I65 PolarHBondContact O-N 2.83Å
62	E	76.4	Confident	72.8	Confident	129 Å²	129	106.8 Å²	106.8	60%	0.603	50%	0.5	S	S	*	.	H	α-helix	trans	-61.2	-41.8	175	-72.7	-179.2	179.4	0	0	111.9	Y58 K59 I65 K66	Y58-E62 PolarHBondContact O-N 2.85Å; K59-E62 PolarHBondContact O-N 2.98Å; E62-I65 PolarHBondContact O-N 2.85Å; E62-K66 WeakPolarHBondContact O-CG 3.48Å; E62-K66 PolarHBondContact O-N 3.46Å
63	D	75.2	Confident	72.2	Confident	67 Å²	67	105.8 Å²	105.8	36%	0.358	50%	0.497	S	S	.	.	H	α-helix	trans	-68.5	-40	176.3	-67.8	-26.3	0	0	0	111.8	K59 K60 I61 I65 K66 Y67	K59-D63 PolarHBondContact O-N 3.42Å; K59-D63 VanDerWaalsContact O-N 3.1Å; K60-D63 PolarHBondContact O-N 3.27Å; I61-D63 VanDerWaalsContact C-N 3.33Å; I61-D63 PolarHBondContact O-N 2.99Å; D63-I65 VanDerWaalsContact C-N 3.33Å; D63-I65 PolarHBondContact O-N 2.86Å; D63-K66 WeakPolarHBondContact O-CB 3.44Å; D63-K66 PolarHBondContact O-N 3.02Å; D63-K66 VanDerWaalsContact O-N 3.13Å; D63-K66 IonicContact OD1-NZ 2.9Å; D63-K66 PolarHBondContact OD1-NZ 3.44Å; D63-Y67 HydrophobicContact CB-CE2 4.26Å; D63-Y67 WeakPolarHBondContact O-CD2 3.26Å; D63-Y67 PolarHBondContact O-N 3.35Å
64	L	75.4	Confident	71.6	Confident	94 Å²	94	101.2 Å²	101.2	49%	0.492	49%	0.488	S	S	.	.	H	α-helix	trans	-62.9	-38.2	175.1	-77.6	165.6	0	0	0	111.9	K60 I61 K66 Y67 L68	K60-L64 WeakPolarHBondContact O-CB 2.92Å; K60-L64 WeakPolarHBondContact O-CD1 3.47Å; K60-L64 WeakPolarHBondContact O-CG 3.45Å; K60-L64 PolarHBondContact O-N 3.06Å; I61-L64 PolarHBondContact O-N 3.4Å; L64-K66 VanDerWaalsContact C-N 3.27Å; L64-K66 PolarHBondContact O-N 2.9Å; L64-Y67 CarbonylContact O-C 3.53Å; L64-Y67 PolarHBondContact O-N 2.95Å; L64-Y67 VanDerWaalsContact O-N 3.16Å; L64-L68 HydrophobicContact CB-CD1 4.32Å; L64-L68 WeakPolarHBondContact O-CB 3.37Å; L64-L68 WeakPolarHBondContact O-CD1 3.47Å; L64-L68 PolarHBondContact O-N 3.29Å
65	I	77.3	Confident	71	Confident	114 Å²	114	109.1 Å²	109.1	59%	0.585	51%	0.514	S	S	*	.	H	α-helix	trans	-60.9	-38.8	174.2	-70.4	164	0	0	0	110.7	I61 E62 D63 L68 D69	I61-I65 HydrophobicContact CG2-CD1 3.92Å; I61-I65 HydrophobicContact CG2-CG1 4.49Å; I61-I65 VanDerWaalsContact O-CG1 3.26Å; I61-I65 WeakPolarHBondContact O-CG1 3.38Å; I61-I65 PolarHBondContact O-N 2.83Å; E62-I65 PolarHBondContact O-N 2.85Å; D63-I65 VanDerWaalsContact C-N 3.33Å; D63-I65 PolarHBondContact O-N 2.86Å; I65-L68 PolarHBondContact O-N 2.99Å; I65-D69 PolarHBondContact O-N 3.43Å
66	K	72.8	Confident	70.3	Confident	121 Å²	121	110.8 Å²	110.8	53%	0.526	53%	0.526	S	S	.	.	H	α-helix	trans	-66	-39.9	174.2	-61.4	167.8	-164.6	157.7	0	112	E62 D63 L64 L68	E62-K66 WeakPolarHBondContact O-CG 3.48Å; E62-K66 PolarHBondContact O-N 3.46Å; D63-K66 WeakPolarHBondContact O-CB 3.44Å; D63-K66 PolarHBondContact O-N 3.02Å; D63-K66 VanDerWaalsContact O-N 3.13Å; D63-K66 IonicContact OD1-NZ 2.9Å; D63-K66 PolarHBondContact OD1-NZ 3.44Å; L64-K66 VanDerWaalsContact C-N 3.27Å; L64-K66 PolarHBondContact O-N 2.9Å; K66-L68 VanDerWaalsContact C-N 3.34Å
67	Y	65.1	Low	69.7	Low	138 Å²	138	109.6 Å²	109.6	54%	0.541	53%	0.528	S	S	.	.	H	α-helix	trans	-75.4	-21.2	178.2	-69.6	-64.7	0	0	0	113.5	D63 L64 D69 Y72 I73	D63-Y67 HydrophobicContact CB-CE2 4.26Å; D63-Y67 WeakPolarHBondContact O-CD2 3.26Å; D63-Y67 PolarHBondContact O-N 3.35Å; L64-Y67 CarbonylContact O-C 3.53Å; L64-Y67 PolarHBondContact O-N 2.95Å; L64-Y67 VanDerWaalsContact O-N 3.16Å; Y67-D69 VanDerWaalsContact C-N 3.34Å; Y67-Y72 HydrophobicContact CD1-CD1 4.22Å; Y67-Y72 AromaticContact CD1-CE1 3.72Å; Y67-Y72 HydrophobicContact CD1-CE1 3.72Å; Y67-Y72 AromaticContact CE1-CE1 3.83Å; Y67-Y72 HydrophobicContact CE1-CE1 3.83Å; Y67-I73 WeakPolarHBondContact O-CD1 3.36Å; Y67-I73 VanDerWaalsContact O-CG1 3.31Å; Y67-I73 WeakPolarHBondContact O-CG1 3.39Å
68	L	66.5	Low	69.2	Low	125 Å²	125	109.1 Å²	109.1	65%	0.654	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-4.4	175.5	-95.9	99.7	0	0	0	113.5	L64 I65 K66 P70	L64-L68 HydrophobicContact CB-CD1 4.32Å; L64-L68 WeakPolarHBondContact O-CB 3.37Å; L64-L68 WeakPolarHBondContact O-CD1 3.47Å; L64-L68 PolarHBondContact O-N 3.29Å; I65-L68 PolarHBondContact O-N 2.99Å; K66-L68 VanDerWaalsContact C-N 3.34Å; L68-P70 VanDerWaalsContact O-CD 3.22Å; L68-P70 WeakPolarHBondContact O-CD 3.24Å
69	D	71.8	Confident	69.5	Low	81 Å²	81	107.8 Å²	107.8	43%	0.433	53%	0.529	S	S	.	.			trans	-68	114.6	173.2	-164.2	-17.9	0	0	0	109.4	I65 Y67 E71 Y72 I73	I65-D69 PolarHBondContact O-N 3.43Å; Y67-D69 VanDerWaalsContact C-N 3.34Å; D69-E71 PolarHBondContact O-N 3.44Å; D69-E71 PolarHBondContact OD1-N 3.34Å; D69-Y72 WeakPolarHBondContact O-CB 3.2Å; D69-Y72 PolarHBondContact O-N 2.89Å; D69-I73 PolarHBondContact O-N 2.87Å
70	P	64.6	Low	69.3	Low	86 Å²	86	107.3 Å²	107.3	56%	0.558	53%	0.533	S	S	*	.	H	α-helix	trans	-57.1	-32.1	-178	-23.3	34.2	0	0	0	112.5	L68 Y72 I73 D74	L68-P70 VanDerWaalsContact O-CD 3.22Å; L68-P70 WeakPolarHBondContact O-CD 3.24Å; P70-Y72 VanDerWaalsContact C-N 3.25Å; P70-Y72 PolarHBondContact O-N 2.86Å; P70-I73 PolarHBondContact O-N 2.83Å; P70-D74 WeakPolarHBondContact O-CB 3.3Å; P70-D74 PolarHBondContact O-N 3.3Å
71	E	63.7	Low	69.3	Low	127 Å²	127	104.9 Å²	104.9	59%	0.593	54%	0.535	S	S	*	.	H	α-helix	trans	-67.5	-24.7	178.2	-67.9	-165.2	180	0	0	113.2	D69 R75	D69-E71 PolarHBondContact O-N 3.44Å; D69-E71 PolarHBondContact OD1-N 3.34Å; E71-R75 WeakPolarHBondContact O-CD 3.4Å; E71-R75 VanDerWaalsContact O-CG 3.25Å; E71-R75 WeakPolarHBondContact O-CG 3.4Å; E71-R75 IonicContact OE2-NH2 3.93Å
72	Y	61	Low	69.4	Low	110 Å²	110	103.6 Å²	103.6	43%	0.431	53%	0.534	S	S	.	.	H	α-helix	trans	-83.3	-41.1	177.8	-174	-101.4	0	0	0	111.8	Y67 D69 P70 I76	Y67-Y72 HydrophobicContact CD1-CD1 4.22Å; Y67-Y72 AromaticContact CD1-CE1 3.72Å; Y67-Y72 HydrophobicContact CD1-CE1 3.72Å; Y67-Y72 AromaticContact CE1-CE1 3.83Å; Y67-Y72 HydrophobicContact CE1-CE1 3.83Å; D69-Y72 WeakPolarHBondContact O-CB 3.2Å; D69-Y72 PolarHBondContact O-N 2.89Å; P70-Y72 VanDerWaalsContact C-N 3.25Å; P70-Y72 PolarHBondContact O-N 2.86Å; Y72-I76 HydrophobicContact CD1-CD1 3.89Å; Y72-I76 HydrophobicContact CD2-CD1 4.22Å; Y72-I76 HydrophobicContact CE1-CD1 3.31Å; Y72-I76 HydrophobicContact CE2-CD1 3.7Å; Y72-I76 HydrophobicContact CG-CD1 4.31Å; Y72-I76 PolarHBondContact O-N 3.43Å; Y72-I76 WeakPolarHBondContact OH-CD1 3.49Å
73	I	60.2	Low	69.8	Low	86 Å²	86	102.2 Å²	102.2	44%	0.441	53%	0.526	S	S	.	.	H	α-helix	trans	-64.8	-46.4	176.6	-66.9	169.4	0	0	0	110.1	Y67 D69 P70 R75 I76 A77	Y67-I73 WeakPolarHBondContact O-CD1 3.36Å; Y67-I73 VanDerWaalsContact O-CG1 3.31Å; Y67-I73 WeakPolarHBondContact O-CG1 3.39Å; D69-I73 PolarHBondContact O-N 2.87Å; P70-I73 PolarHBondContact O-N 2.83Å; I73-R75 VanDerWaalsContact C-N 3.28Å; I73-R75 PolarHBondContact O-N 2.88Å; I73-I76 PolarHBondContact O-N 2.95Å; I73-A77 HydrophobicContact CG2-CB 4.31Å; I73-A77 WeakPolarHBondContact O-CB 3.27Å; I73-A77 PolarHBondContact O-N 3.13Å
74	D	60.5	Low	70.4	Confident	114 Å²	114	103.8 Å²	103.8	61%	0.61	53%	0.534	S	S	*	.	H	α-helix	trans	-65.3	-30	-175.8	-77.4	-14.4	0	0	0	113.2	P70	P70-D74 WeakPolarHBondContact O-CB 3.3Å; P70-D74 PolarHBondContact O-N 3.3Å
75	R	59.8	Low	71	Confident	200 Å²	200	105.1 Å²	105.1	76%	0.755	54%	0.538	S	S	*	.	H	α-helix	trans	-77.5	-27.3	176.9	-69.3	179.3	-167.8	-159.8	8.3	113.5	E71 I73	E71-R75 WeakPolarHBondContact O-CD 3.4Å; E71-R75 VanDerWaalsContact O-CG 3.25Å; E71-R75 WeakPolarHBondContact O-CG 3.4Å; E71-R75 IonicContact OE2-NH2 3.93Å; I73-R75 VanDerWaalsContact C-N 3.28Å; I73-R75 PolarHBondContact O-N 2.88Å
76	I	59.5	Low	71.5	Confident	109 Å²	109	105.3 Å²	105.3	56%	0.559	54%	0.535	S	S	*	.	H	α-helix	trans	-92.7	-26	179.7	-67.3	174.3	0	0	0	111.5	Y72 I73 I78	Y72-I76 HydrophobicContact CD1-CD1 3.89Å; Y72-I76 HydrophobicContact CD2-CD1 4.22Å; Y72-I76 HydrophobicContact CE1-CD1 3.31Å; Y72-I76 HydrophobicContact CE2-CD1 3.7Å; Y72-I76 HydrophobicContact CG-CD1 4.31Å; Y72-I76 PolarHBondContact O-N 3.43Å; Y72-I76 WeakPolarHBondContact OH-CD1 3.49Å; I73-I76 PolarHBondContact O-N 2.95Å; I76-I78 PolarHBondContact O-N 3.41Å
77	A	65.9	Low	72.3	Confident	58 Å²	58	104.2 Å²	104.2	48%	0.479	53%	0.534	S	S	.	.			trans	-82.5	-6.4	-167.7	0	0	0	0	0	115.3	I73 P79	I73-A77 HydrophobicContact CG2-CB 4.31Å; I73-A77 WeakPolarHBondContact O-CB 3.27Å; I73-A77 PolarHBondContact O-N 3.13Å; A77-P79 WeakPolarHBondContact O-CD 3.3Å; A77-P79 WeakPolarHBondContact O-CG 3.37Å
78	I	66.3	Low	73.6	Confident	92 Å²	92	102.2 Å²	102.2	47%	0.472	53%	0.532	S	S	.	.			trans	-71.3	106.1	177.7	-52	179	0	0	0	108.5	I76 K83	I76-I78 PolarHBondContact O-N 3.41Å; I78-K83 HydrophobicContact CG2-CG 3.68Å; I78-K83 VanDerWaalsContact O-CE 3.26Å; I78-K83 WeakPolarHBondContact O-CE 3.38Å
79	P	79.9	Confident	74.8	Confident	74 Å²	74	100.4 Å²	100.4	48%	0.481	54%	0.535	S	S	.	.			trans	-66.7	148.3	-178.4	-15.9	33.3	0	0	0	109.6	A77 A81 S82 K83	A77-P79 WeakPolarHBondContact O-CD 3.3Å; A77-P79 WeakPolarHBondContact O-CG 3.37Å; P79-A81 PolarHBondContact O-N 3.46Å; P79-A81 VanDerWaalsContact O-N 3.17Å; P79-S82 WeakPolarHBondContact O-CA 3.21Å; P79-S82 WeakPolarHBondContact O-CB 3.31Å; P79-S82 PolarHBondContact O-N 3.18Å; P79-K83 PolarHBondContact O-N 3.23Å; P79-K83 VanDerWaalsContact O-N 3.12Å
80	D	75.1	Confident	75.8	Confident	120 Å²	120	99.7 Å²	99.7	64%	0.642	53%	0.529	S	S	*	.	H	α-helix	trans	-61	-30.7	-177.1	-67.8	-24.2	0	0	0	112.8	S82 K83 L84	D80-S82 VanDerWaalsContact C-N 3.31Å; D80-S82 PolarHBondContact O-N 3Å; D80-K83 PolarHBondContact O-N 3.36Å; D80-K83 IonicContact OD1-NZ 2.77Å; D80-K83 PolarHBondContact OD1-NZ 3.37Å; D80-L84 PolarHBondContact O-N 3.48Å; D80-L84 VanDerWaalsContact O-N 3.09Å
81	A	79.2	Confident	77.2	Confident	72 Å²	72	100.2 Å²	100.2	60%	0.595	52%	0.524	S	S	*	.	H	α-helix	trans	-61.4	-38.3	171.7	0	0	0	0	0	112.5	P79 L84 Q85	P79-A81 PolarHBondContact O-N 3.46Å; P79-A81 VanDerWaalsContact O-N 3.17Å; A81-L84 PolarHBondContact O-N 3.33Å; A81-Q85 WeakPolarHBondContact O-CG 3.47Å; A81-Q85 PolarHBondContact O-N 2.75Å; A81-Q85 VanDerWaalsContact O-N 3.13Å
82	S	80.9	Confident	78.7	Confident	59 Å²	59	100.9 Å²	100.9	41%	0.413	53%	0.527	S	S	.	.	H	α-helix	trans	-72.1	-34.1	176.7	-57.5	0	0	0	0	112	P79 D80 L84 Q85 F86	P79-S82 WeakPolarHBondContact O-CA 3.21Å; P79-S82 WeakPolarHBondContact O-CB 3.31Å; P79-S82 PolarHBondContact O-N 3.18Å; D80-S82 VanDerWaalsContact C-N 3.31Å; D80-S82 PolarHBondContact O-N 3Å; S82-L84 VanDerWaalsContact C-N 3.34Å; S82-Q85 PolarHBondContact O-N 2.85Å; S82-F86 VanDerWaalsContact O-CB 3.27Å; S82-F86 WeakPolarHBondContact O-CB 3.39Å; S82-F86 PolarHBondContact O-N 3.34Å
83	K	84.9	Confident	80.3	Confident	99 Å²	99	101 Å²	101	43%	0.43	53%	0.53	S	S	.	.	H	α-helix	trans	-62.4	-42.2	173	-61.8	177.4	-170.6	153.3	0	111.5	I78 P79 D80 F86 I87	I78-K83 HydrophobicContact CG2-CG 3.68Å; I78-K83 VanDerWaalsContact O-CE 3.26Å; I78-K83 WeakPolarHBondContact O-CE 3.38Å; P79-K83 PolarHBondContact O-N 3.23Å; P79-K83 VanDerWaalsContact O-N 3.12Å; D80-K83 PolarHBondContact O-N 3.36Å; D80-K83 IonicContact OD1-NZ 2.77Å; D80-K83 PolarHBondContact OD1-NZ 3.37Å; K83-F86 WeakPolarHBondContact O-CB 3.32Å; K83-F86 PolarHBondContact O-N 2.87Å; K83-I87 VanDerWaalsContact O-CG1 3.3Å; K83-I87 WeakPolarHBondContact O-CG1 3.36Å; K83-I87 PolarHBondContact O-N 3.36Å
84	L	87.8	Confident	82	Confident	100 Å²	100	100.3 Å²	100.3	52%	0.524	53%	0.526	S	S	.	.	H	α-helix	trans	-65.6	-44.4	178	-174.2	137.3	0	0	0	111.7	D80 A81 S82 F86 I87 L88	D80-L84 PolarHBondContact O-N 3.48Å; D80-L84 VanDerWaalsContact O-N 3.09Å; A81-L84 PolarHBondContact O-N 3.33Å; S82-L84 VanDerWaalsContact C-N 3.34Å; L84-F86 VanDerWaalsContact C-N 3.3Å; L84-F86 PolarHBondContact O-N 3.15Å; L84-I87 PolarHBondContact O-N 2.86Å; L84-L88 HydrophobicContact CD2-CD1 3.64Å; L84-L88 HydrophobicContact CD2-CG 4.46Å; L84-L88 HydrophobicContact CG-CD1 4.4Å; L84-L88 WeakPolarHBondContact O-CG 3.47Å; L84-L88 PolarHBondContact O-N 3.44Å
85	Q	87.7	Confident	83.7	Confident	122 Å²	122	99.4 Å²	99.4	57%	0.57	52%	0.521	S	S	*	.	H	α-helix	trans	-62.8	-37.9	174.9	-69.2	-63.7	-34.1	0	0	112.1	A81 S82 L88 A89	A81-Q85 WeakPolarHBondContact O-CG 3.47Å; A81-Q85 PolarHBondContact O-N 2.75Å; A81-Q85 VanDerWaalsContact O-N 3.13Å; S82-Q85 PolarHBondContact O-N 2.85Å; Q85-L88 PolarHBondContact O-N 3.02Å; Q85-A89 WeakPolarHBondContact O-CB 3.45Å; Q85-A89 PolarHBondContact O-N 2.94Å
86	F	88.2	Confident	85.4	Confident	118 Å²	118	92.4 Å²	92.4	52%	0.518	50%	0.503	S	S	.	.	H	α-helix	trans	-63.3	-47.1	175.6	-176.8	-95.3	0	0	0	111.8	S82 K83 L84 L88 A89 E90	S82-F86 VanDerWaalsContact O-CB 3.27Å; S82-F86 WeakPolarHBondContact O-CB 3.39Å; S82-F86 PolarHBondContact O-N 3.34Å; K83-F86 WeakPolarHBondContact O-CB 3.32Å; K83-F86 PolarHBondContact O-N 2.87Å; L84-F86 VanDerWaalsContact C-N 3.3Å; L84-F86 PolarHBondContact O-N 3.15Å; F86-L88 VanDerWaalsContact C-N 3.34Å; F86-L88 PolarHBondContact O-N 2.93Å; F86-A89 PolarHBondContact O-N 3.38Å; F86-E90 VanDerWaalsContact CE1-CD 3.49Å; F86-E90 HydrophobicContact CE1-CG 4.25Å; F86-E90 WeakPolarHBondContact CE1-OE2 3.44Å; F86-E90 HydrophobicContact CE2-CG 4.2Å; F86-E90 WeakPolarHBondContact CE2-OE1 2.98Å; F86-E90 HydrophobicContact CZ-CG 4.08Å; F86-E90 WeakPolarHBondContact CZ-OE1 3.17Å; F86-E90 WeakPolarHBondContact CZ-OE2 3.5Å; F86-E90 WeakPolarHBondContact O-CB 3.45Å; F86-E90 WeakPolarHBondContact O-CG 3.15Å; F86-E90 PolarHBondContact O-N 2.97Å
87	I	90.2	Very high	87.1	Confident	99 Å²	99	91.5 Å²	91.5	51%	0.508	50%	0.496	S	S	.	.	H	α-helix	trans	-61.3	-43	177.4	-67.9	164.6	0	0	0	111.2	K83 L84 E90 E91	K83-I87 VanDerWaalsContact O-CG1 3.3Å; K83-I87 WeakPolarHBondContact O-CG1 3.36Å; K83-I87 PolarHBondContact O-N 3.36Å; L84-I87 PolarHBondContact O-N 2.86Å; I87-E90 CarbonylContact O-C 3.55Å; I87-E90 PolarHBondContact O-N 3.39Å; I87-E91 WeakPolarHBondContact O-CA 3.23Å; I87-E91 PolarHBondContact O-N 3.24Å
88	L	91.7	Very high	88.6	Confident	95 Å²	95	92.1 Å²	92.1	50%	0.497	49%	0.494	S	S	.	.	H	α-helix	trans	-68	-39.6	178.1	-69.1	174.9	0	0	0	112.1	L84 Q85 F86 E90 E91	L84-L88 HydrophobicContact CD2-CD1 3.64Å; L84-L88 HydrophobicContact CD2-CG 4.46Å; L84-L88 HydrophobicContact CG-CD1 4.4Å; L84-L88 WeakPolarHBondContact O-CG 3.47Å; L84-L88 PolarHBondContact O-N 3.44Å; Q85-L88 PolarHBondContact O-N 3.02Å; F86-L88 VanDerWaalsContact C-N 3.34Å; F86-L88 PolarHBondContact O-N 2.93Å; L88-E90 VanDerWaalsContact C-N 3.32Å; L88-E91 WeakPolarHBondContact O-CB 3.45Å; L88-E91 PolarHBondContact O-N 2.83Å
89	A	91.8	Very high	90	Very high	87 Å²	87	89.9 Å²	89.9	72%	0.719	49%	0.489	S	S	*	.	H	α-helix	trans	-66.4	-36.1	176.5	0	0	0	0	0	112	Q85 F86	Q85-A89 WeakPolarHBondContact O-CB 3.45Å; Q85-A89 PolarHBondContact O-N 2.94Å; F86-A89 PolarHBondContact O-N 3.38Å
90	E	94	Very high	90.8	Very high	66 Å²	66	90.5 Å²	90.5	31%	0.308	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	4.6	179.2	-64.5	-159.3	165.4	0	0	113.9	F86 I87 L88 Q92 F93 I94	F86-E90 VanDerWaalsContact CE1-CD 3.49Å; F86-E90 HydrophobicContact CE1-CG 4.25Å; F86-E90 WeakPolarHBondContact CE1-OE2 3.44Å; F86-E90 HydrophobicContact CE2-CG 4.2Å; F86-E90 WeakPolarHBondContact CE2-OE1 2.98Å; F86-E90 HydrophobicContact CZ-CG 4.08Å; F86-E90 WeakPolarHBondContact CZ-OE1 3.17Å; F86-E90 WeakPolarHBondContact CZ-OE2 3.5Å; F86-E90 WeakPolarHBondContact O-CB 3.45Å; F86-E90 WeakPolarHBondContact O-CG 3.15Å; F86-E90 PolarHBondContact O-N 2.97Å; I87-E90 CarbonylContact O-C 3.55Å; I87-E90 PolarHBondContact O-N 3.39Å; L88-E90 VanDerWaalsContact C-N 3.32Å; E90-Q92 VanDerWaalsContact C-N 3.31Å; E90-Q92 PolarHBondContact O-N 3.41Å; E90-F93 HydrophobicContact CB-CB 4.49Å; E90-F93 CarbonylContact O-C 3.58Å; E90-F93 WeakPolarHBondContact O-CA 3.38Å; E90-F93 WeakPolarHBondContact O-CB 3.3Å; E90-F93 PolarHBondContact O-N 3.34Å; E90-I94 HydrophobicContact CB-CD1 4.2Å; E90-I94 HydrophobicContact CB-CG1 4.37Å; E90-I94 WeakPolarHBondContact O-CG1 3.42Å; E90-I94 PolarHBondContact O-N 3.29Å
91	E	93.7	Very high	91.7	Very high	97 Å²	97	90.4 Å²	90.4	45%	0.453	49%	0.486	S	S	.	.	H	α-helix	trans	-53.4	-48.7	-174.9	-178.9	-179.7	-170	0	0	111.8	I87 L88 F93 I94 L95	I87-E91 WeakPolarHBondContact O-CA 3.23Å; I87-E91 PolarHBondContact O-N 3.24Å; L88-E91 WeakPolarHBondContact O-CB 3.45Å; L88-E91 PolarHBondContact O-N 2.83Å; E91-F93 VanDerWaalsContact C-N 3.31Å; E91-F93 PolarHBondContact O-N 3.24Å; E91-I94 PolarHBondContact O-N 2.91Å; E91-L95 HydrophobicContact CG-CD1 4.07Å; E91-L95 WeakPolarHBondContact O-CB 3.44Å; E91-L95 VanDerWaalsContact O-CG 3.3Å; E91-L95 WeakPolarHBondContact O-CG 3.37Å; E91-L95 PolarHBondContact O-N 2.98Å
92	Q	93.5	Very high	92.6	Very high	141 Å²	141	93.1 Å²	93.1	66%	0.659	49%	0.487	S	S	*	.	H	α-helix	trans	-64.2	-37	178.3	-64.9	-60.9	-32.6	0	0	112.1	E90 S96	E90-Q92 VanDerWaalsContact C-N 3.31Å; E90-Q92 PolarHBondContact O-N 3.41Å; Q92-S96 VanDerWaalsContact O-CB 3.29Å; Q92-S96 WeakPolarHBondContact O-CB 3.39Å; Q92-S96 PolarHBondContact O-N 2.87Å; Q92-S96 PolarHBondContact O-OG 3.35Å
93	F	95.5	Very high	93.2	Very high	112 Å²	112	96 Å²	96	49%	0.491	49%	0.494	S	S	.	.	H	α-helix	trans	-65.9	-49.2	176.4	176	-102.9	0	0	0	110.6	E90 E91 L95 S96 Q97	E90-F93 HydrophobicContact CB-CB 4.49Å; E90-F93 CarbonylContact O-C 3.58Å; E90-F93 WeakPolarHBondContact O-CA 3.38Å; E90-F93 WeakPolarHBondContact O-CB 3.3Å; E90-F93 PolarHBondContact O-N 3.34Å; E91-F93 VanDerWaalsContact C-N 3.31Å; E91-F93 PolarHBondContact O-N 3.24Å; F93-L95 PolarHBondContact O-N 3.43Å; F93-S96 PolarHBondContact O-N 2.95Å; F93-S96 PolarHBondContact O-OG 3.3Å; F93-Q97 HydrophobicContact CD1-CG 4.36Å; F93-Q97 HydrophobicContact CD2-CG 4.41Å; F93-Q97 HydrophobicContact CE1-CG 3.98Å; F93-Q97 HydrophobicContact CE2-CG 4.05Å; F93-Q97 VanDerWaalsContact CE2-NE2 3.28Å; F93-Q97 HydrophobicContact CZ-CG 3.82Å; F93-Q97 WeakPolarHBondContact O-CG 3.33Å; F93-Q97 PolarHBondContact O-N 3.37Å
94	I	95.9	Very high	93.6	Very high	72 Å²	72	95.7 Å²	95.7	37%	0.369	50%	0.5	S	S	.	.	H	α-helix	trans	-58.3	-48.2	178.1	-64.9	166	0	0	0	110.5	E90 E91 S96 Q97 V98	E90-I94 HydrophobicContact CB-CD1 4.2Å; E90-I94 HydrophobicContact CB-CG1 4.37Å; E90-I94 WeakPolarHBondContact O-CG1 3.42Å; E90-I94 PolarHBondContact O-N 3.29Å; E91-I94 PolarHBondContact O-N 2.91Å; I94-S96 VanDerWaalsContact C-N 3.34Å; I94-S96 PolarHBondContact O-N 3.48Å; I94-Q97 PolarHBondContact O-N 3.4Å; I94-V98 WeakPolarHBondContact O-CG2 3.42Å; I94-V98 PolarHBondContact O-N 3.19Å
95	L	96.1	Very high	93.8	Very high	96 Å²	96	96.2 Å²	96.2	50%	0.503	50%	0.503	S	S	.	.	H	α-helix	trans	-61.8	-41.6	178.2	-71.1	174.3	0	0	0	112.1	E91 F93 Q97 V98 A99	E91-L95 HydrophobicContact CG-CD1 4.07Å; E91-L95 WeakPolarHBondContact O-CB 3.44Å; E91-L95 VanDerWaalsContact O-CG 3.3Å; E91-L95 WeakPolarHBondContact O-CG 3.37Å; E91-L95 PolarHBondContact O-N 2.98Å; F93-L95 PolarHBondContact O-N 3.43Å; L95-Q97 VanDerWaalsContact C-N 3.34Å; L95-Q97 PolarHBondContact O-N 3.41Å; L95-V98 PolarHBondContact O-N 3.42Å; L95-A99 PolarHBondContact O-N 3.43Å
96	S	95.9	Very high	94	Very high	53 Å²	53	94 Å²	94	37%	0.371	51%	0.506	S	S	.	.	H	α-helix	trans	-63.3	-39.4	176.8	75.5	0	0	0	0	112.4	Q92 F93 I94 A99 L100	Q92-S96 VanDerWaalsContact O-CB 3.29Å; Q92-S96 WeakPolarHBondContact O-CB 3.39Å; Q92-S96 PolarHBondContact O-N 2.87Å; Q92-S96 PolarHBondContact O-OG 3.35Å; F93-S96 PolarHBondContact O-N 2.95Å; F93-S96 PolarHBondContact O-OG 3.3Å; I94-S96 VanDerWaalsContact C-N 3.34Å; I94-S96 PolarHBondContact O-N 3.48Å; S96-A99 PolarHBondContact O-N 3Å; S96-L100 WeakPolarHBondContact O-CG 3.38Å; S96-L100 PolarHBondContact O-N 2.94Å
97	Q	95.6	Very high	94.1	Very high	90 Å²	90	93.1 Å²	93.1	42%	0.421	51%	0.506	S	S	.	.	H	α-helix	trans	-68.4	-40	177.8	-69.2	-63.7	-16.1	0	0	111.7	F93 I94 L95 L100 L101	F93-Q97 HydrophobicContact CD1-CG 4.36Å; F93-Q97 HydrophobicContact CD2-CG 4.41Å; F93-Q97 HydrophobicContact CE1-CG 3.98Å; F93-Q97 HydrophobicContact CE2-CG 4.05Å; F93-Q97 VanDerWaalsContact CE2-NE2 3.28Å; F93-Q97 HydrophobicContact CZ-CG 3.82Å; F93-Q97 WeakPolarHBondContact O-CG 3.33Å; F93-Q97 PolarHBondContact O-N 3.37Å; I94-Q97 PolarHBondContact O-N 3.4Å; L95-Q97 VanDerWaalsContact C-N 3.34Å; L95-Q97 PolarHBondContact O-N 3.41Å; Q97-L100 PolarHBondContact O-N 3.23Å; Q97-L101 VanDerWaalsContact O-CB 3.23Å; Q97-L101 WeakPolarHBondContact O-CB 3.27Å; Q97-L101 PolarHBondContact O-N 3.16Å
98	V	96.2	Very high	94.2	Very high	71 Å²	71	91.8 Å²	91.8	43%	0.43	50%	0.503	S	S	.	.	H	α-helix	trans	-61.1	-47.1	174.6	171.6	0	0	0	0	110.6	I94 L95 L100 L101 E102	I94-V98 WeakPolarHBondContact O-CG2 3.42Å; I94-V98 PolarHBondContact O-N 3.19Å; L95-V98 PolarHBondContact O-N 3.42Å; V98-L100 VanDerWaalsContact C-N 3.33Å; V98-L100 PolarHBondContact O-N 3.19Å; V98-L101 PolarHBondContact O-N 3.34Å; V98-L101 VanDerWaalsContact O-N 3.15Å; V98-E102 WeakPolarHBondContact O-CG 3.34Å; V98-E102 PolarHBondContact O-N 3.48Å
99	A	96.1	Very high	94	Very high	44 Å²	44	91.7 Å²	91.7	36%	0.364	51%	0.508	S	S	.	.	H	α-helix	trans	-61.2	-40.5	178.8	0	0	0	0	0	112.6	L95 S96 Q103	L95-A99 PolarHBondContact O-N 3.43Å; S96-A99 PolarHBondContact O-N 3Å; A99-Q103 WeakPolarHBondContact O-CG 3.41Å; A99-Q103 PolarHBondContact O-N 3.16Å
100	L	95.9	Very high	93.7	Very high	88 Å²	88	93.2 Å²	93.2	46%	0.461	50%	0.501	S	S	.	.	H	α-helix	trans	-66.9	-41.1	174.7	-71.7	168.5	0	0	0	111.7	S96 Q97 V98 E102 Q103 V104	S96-L100 WeakPolarHBondContact O-CG 3.38Å; S96-L100 PolarHBondContact O-N 2.94Å; Q97-L100 PolarHBondContact O-N 3.23Å; V98-L100 VanDerWaalsContact C-N 3.33Å; V98-L100 PolarHBondContact O-N 3.19Å; L100-E102 VanDerWaalsContact C-N 3.34Å; L100-Q103 WeakPolarHBondContact O-CB 3.29Å; L100-Q103 PolarHBondContact O-N 3.14Å; L100-V104 WeakPolarHBondContact O-CG2 3.45Å; L100-V104 PolarHBondContact O-N 2.99Å
101	L	95.7	Very high	93.1	Very high	117 Å²	117	96.4 Å²	96.4	61%	0.613	52%	0.52	S	S	*	.	H	α-helix	trans	-66.9	-37.1	179.8	-169.8	141.4	0	0	0	111.7	Q97 V98 V104 N105	Q97-L101 VanDerWaalsContact O-CB 3.23Å; Q97-L101 WeakPolarHBondContact O-CB 3.27Å; Q97-L101 PolarHBondContact O-N 3.16Å; V98-L101 PolarHBondContact O-N 3.34Å; V98-L101 VanDerWaalsContact O-N 3.15Å; L101-V104 PolarHBondContact O-N 3.09Å; L101-N105 VanDerWaalsContact O-CB 3.32Å; L101-N105 WeakPolarHBondContact O-CB 3.38Å; L101-N105 PolarHBondContact O-N 3.18Å
102	E	96.4	Very high	92.6	Very high	129 Å²	129	97.2 Å²	97.2	60%	0.603	53%	0.527	S	S	*	.	H	α-helix	trans	-60.9	-43.2	171.9	-76.4	179.8	171	0	0	111.9	V98 L100 N105 A106	V98-E102 WeakPolarHBondContact O-CG 3.34Å; V98-E102 PolarHBondContact O-N 3.48Å; L100-E102 VanDerWaalsContact C-N 3.34Å; E102-N105 PolarHBondContact O-N 3.39Å; E102-A106 WeakPolarHBondContact O-CB 3.4Å; E102-A106 PolarHBondContact O-N 3.24Å
103	Q	93.9	Very high	92.3	Very high	119 Å²	119	91.9 Å²	91.9	56%	0.556	51%	0.506	S	S	*	.	H	α-helix	trans	-61.8	-45.6	175.2	-69	171.7	30.2	0	0	111.5	A99 L100 N105 A106 L107	A99-Q103 WeakPolarHBondContact O-CG 3.41Å; A99-Q103 PolarHBondContact O-N 3.16Å; L100-Q103 WeakPolarHBondContact O-CB 3.29Å; L100-Q103 PolarHBondContact O-N 3.14Å; Q103-N105 VanDerWaalsContact C-N 3.34Å; Q103-N105 PolarHBondContact O-N 2.98Å; Q103-A106 PolarHBondContact O-N 3.06Å; Q103-L107 WeakPolarHBondContact O-CD1 3.33Å; Q103-L107 VanDerWaalsContact O-CG 3.29Å; Q103-L107 WeakPolarHBondContact O-CG 3.34Å; Q103-L107 PolarHBondContact O-N 3.46Å
104	V	93.4	Very high	91.6	Very high	94 Å²	94	90 Å²	90	57%	0.57	51%	0.511	S	S	*	.	H	α-helix	trans	-61.1	-45.9	177	172.5	0	0	0	0	110.4	L100 L101 A106 L107 V108	L100-V104 WeakPolarHBondContact O-CG2 3.45Å; L100-V104 PolarHBondContact O-N 2.99Å; L101-V104 PolarHBondContact O-N 3.09Å; V104-A106 VanDerWaalsContact C-N 3.31Å; V104-A106 PolarHBondContact O-N 3.02Å; V104-L107 PolarHBondContact O-N 2.95Å; V104-V108 WeakPolarHBondContact O-CG2 3.36Å; V104-V108 PolarHBondContact O-N 3.43Å; V104-V108 VanDerWaalsContact O-N 3.09Å
105	N	92.8	Very high	91	Very high	110 Å²	110	94.2 Å²	94.2	59%	0.588	53%	0.528	S	S	*	.	H	α-helix	trans	-62.6	-38.1	-179.7	-163	25.5	0	0	0	112.1	L101 E102 Q103 L107 V108	L101-N105 VanDerWaalsContact O-CB 3.32Å; L101-N105 WeakPolarHBondContact O-CB 3.38Å; L101-N105 PolarHBondContact O-N 3.18Å; E102-N105 PolarHBondContact O-N 3.39Å; Q103-N105 VanDerWaalsContact C-N 3.34Å; Q103-N105 PolarHBondContact O-N 2.98Å; N105-L107 PolarHBondContact O-N 3.33Å; N105-V108 PolarHBondContact O-N 3.24Å
106	A	92.6	Very high	90.3	Very high	76 Å²	76	94.5 Å²	94.5	63%	0.628	53%	0.53	S	S	*	.	H	α-helix	trans	-64.2	-28.8	173.9	0	0	0	0	0	113.1	E102 Q103 V104 P109	E102-A106 WeakPolarHBondContact O-CB 3.4Å; E102-A106 PolarHBondContact O-N 3.24Å; Q103-A106 PolarHBondContact O-N 3.06Å; V104-A106 VanDerWaalsContact C-N 3.31Å; V104-A106 PolarHBondContact O-N 3.02Å; A106-P109 WeakPolarHBondContact O-CD 3.29Å
107	L	90.3	Very high	89.7	Confident	99 Å²	99	98.3 Å²	98.3	52%	0.518	54%	0.539	S	S	.	.	H	α-helix	trans	-87.3	-17.2	-179.7	-67.6	165.7	0	0	0	113.6	Q103 V104 N105 P109 M110	Q103-L107 WeakPolarHBondContact O-CD1 3.33Å; Q103-L107 VanDerWaalsContact O-CG 3.29Å; Q103-L107 WeakPolarHBondContact O-CG 3.34Å; Q103-L107 PolarHBondContact O-N 3.46Å; V104-L107 PolarHBondContact O-N 2.95Å; N105-L107 PolarHBondContact O-N 3.33Å; L107-P109 VanDerWaalsContact C-CD 3.44Å; L107-P109 VanDerWaalsContact C-N 3.34Å; L107-M110 HydrophobicContact CD2-SD 3.75Å; L107-M110 WeakPolarHBondContact O-CB 3.28Å; L107-M110 PolarHBondContact O-N 3.2Å
108	V	90.4	Very high	89.2	Confident	72 Å²	72	95.3 Å²	95.3	44%	0.436	53%	0.53	S	S	.	.	H	α-helix	trans	-50.1	-45.6	178.8	171.9	0	0	0	0	112.9	V104 N105 M110 L111	V104-V108 WeakPolarHBondContact O-CG2 3.36Å; V104-V108 PolarHBondContact O-N 3.43Å; V104-V108 VanDerWaalsContact O-N 3.09Å; N105-V108 PolarHBondContact O-N 3.24Å; V108-M110 PolarHBondContact O-N 2.69Å; V108-M110 VanDerWaalsContact O-N 3.14Å; V108-L111 WeakPolarHBondContact O-CB 3.39Å; V108-L111 PolarHBondContact O-N 3.35Å; V108-L111 VanDerWaalsContact O-N 3.16Å
109	P	88.1	Confident	88.7	Confident	92 Å²	92	95.9 Å²	95.9	60%	0.597	53%	0.534	S	S	*	.	H	α-helix	trans	-63.4	-20.4	179.9	-22.5	34.9	0	0	0	114.6	A106 L107 L111 D112	A106-P109 WeakPolarHBondContact O-CD 3.29Å; L107-P109 VanDerWaalsContact C-CD 3.44Å; L107-P109 VanDerWaalsContact C-N 3.34Å; P109-L111 VanDerWaalsContact C-N 3.29Å; P109-L111 PolarHBondContact O-N 3.43Å; P109-D112 PolarHBondContact O-N 3.28Å
110	M	85.4	Confident	88.3	Confident	120 Å²	120	98.1 Å²	98.1	59%	0.591	54%	0.544	S	S	*	.	H	α-helix	trans	-70.8	-26.8	178.1	-61.7	-166.9	72.9	0	0	112.6	L107 V108 D112 S113	L107-M110 HydrophobicContact CD2-SD 3.75Å; L107-M110 WeakPolarHBondContact O-CB 3.28Å; L107-M110 PolarHBondContact O-N 3.2Å; V108-M110 PolarHBondContact O-N 2.69Å; V108-M110 VanDerWaalsContact O-N 3.14Å; M110-D112 PolarHBondContact O-N 3.14Å; M110-S113 VanDerWaalsContact O-CB 3.27Å; M110-S113 WeakPolarHBondContact O-CB 3.3Å; M110-S113 PolarHBondContact O-N 3.28Å; M110-S113 PolarHBondContact O-OG 2.95Å
111	L	82.1	Confident	87.8	Confident	133 Å²	133	99.1 Å²	99.1	70%	0.696	55%	0.547	S	S	*	.	H	α-helix	trans	-62.9	-31.8	177.6	-61.3	176.5	0	0	0	111.8	V108 P109	V108-L111 WeakPolarHBondContact O-CB 3.39Å; V108-L111 PolarHBondContact O-N 3.35Å; V108-L111 VanDerWaalsContact O-N 3.16Å; P109-L111 VanDerWaalsContact C-N 3.29Å; P109-L111 PolarHBondContact O-N 3.43Å
112	D	83.5	Confident	87.4	Confident	113 Å²	113	98.8 Å²	98.8	60%	0.604	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	9.7	180	-95.2	-41.8	0	0	0	114.2	P109 M110 A114 K117	P109-D112 PolarHBondContact O-N 3.28Å; M110-D112 PolarHBondContact O-N 3.14Å; D112-A114 PolarHBondContact O-N 3.48Å; D112-K117 PolarHBondContact O-NZ 2.88Å; D112-K117 IonicContact OD1-NZ 2.75Å; D112-K117 PolarHBondContact OD1-NZ 2.74Å
113	S	86.5	Confident	87	Confident	30 Å²	30	95 Å²	95	21%	0.21	53%	0.532	C	S	.	.			trans	-60.2	134.6	-175.1	65.6	0	0	0	0	112.7	M110 H115 I116 K117	M110-S113 VanDerWaalsContact O-CB 3.27Å; M110-S113 WeakPolarHBondContact O-CB 3.3Å; M110-S113 PolarHBondContact O-N 3.28Å; M110-S113 PolarHBondContact O-OG 2.95Å; S113-H115 PolarHBondContact O-N 3.26Å; S113-I116 PolarHBondContact O-N 3.29Å; S113-I116 VanDerWaalsContact O-N 3.16Å; S113-I116 VanDerWaalsContact OG-CD1 3.28Å; S113-I116 WeakPolarHBondContact OG-CD1 3.28Å; S113-I116 VanDerWaalsContact OG-CG1 3.24Å; S113-I116 WeakPolarHBondContact OG-CG1 3.44Å; S113-K117 PolarHBondContact O-N 3.47Å
114	A	81.9	Confident	86.7	Confident	72 Å²	72	92.1 Å²	92.1	60%	0.595	53%	0.529	S	S	*	.	H	α-helix	trans	-58.6	-31	179.5	0	0	0	0	0	112.5	D112 K117 A118	D112-A114 PolarHBondContact O-N 3.48Å; A114-K117 PolarHBondContact O-N 3.06Å; A114-A118 VanDerWaalsContact O-CB 3.31Å; A114-A118 WeakPolarHBondContact O-CB 3.46Å; A114-A118 PolarHBondContact O-N 3.41Å
115	H	81.6	Confident	86.5	Confident	160 Å²	160	95.2 Å²	95.2	74%	0.741	53%	0.53	S	S	*	.	H	α-helix	trans	-65.6	-41	177.9	-54.5	98.7	0	0	0	112.6	S113 K117 A118 V119	S113-H115 PolarHBondContact O-N 3.26Å; H115-K117 VanDerWaalsContact C-N 3.35Å; H115-A118 PolarHBondContact O-N 3.42Å; H115-V119 WeakPolarHBondContact O-CG2 3.31Å; H115-V119 PolarHBondContact O-N 2.74Å
116	I	81.5	Confident	86.5	Confident	103 Å²	103	95.6 Å²	95.6	53%	0.528	53%	0.532	S	S	.	.	H	α-helix	trans	-67.1	-40.2	174.8	-65.7	174.3	0	0	0	109.9	S113 A118 V119	S113-I116 PolarHBondContact O-N 3.29Å; S113-I116 VanDerWaalsContact O-N 3.16Å; S113-I116 VanDerWaalsContact OG-CD1 3.28Å; S113-I116 WeakPolarHBondContact OG-CD1 3.28Å; S113-I116 VanDerWaalsContact OG-CG1 3.24Å; S113-I116 WeakPolarHBondContact OG-CG1 3.44Å; I116-A118 VanDerWaalsContact C-N 3.3Å; I116-A118 PolarHBondContact O-N 3.32Å; I116-V119 WeakPolarHBondContact O-CB 3.46Å; I116-V119 VanDerWaalsContact O-CG2 3.32Å; I116-V119 WeakPolarHBondContact O-CG2 3.32Å; I116-V119 PolarHBondContact O-N 3.36Å
117	K	83.4	Confident	86.4	Confident	132 Å²	132	98.9 Å²	98.9	57%	0.574	53%	0.534	S	S	*	.	H	α-helix	trans	-65.6	-30.8	176.2	-69.7	176.9	-179.7	162.8	0	113	D112 S113 A114 H115 V119 P120	D112-K117 PolarHBondContact O-NZ 2.88Å; D112-K117 IonicContact OD1-NZ 2.75Å; D112-K117 PolarHBondContact OD1-NZ 2.74Å; S113-K117 PolarHBondContact O-N 3.47Å; A114-K117 PolarHBondContact O-N 3.06Å; H115-K117 VanDerWaalsContact C-N 3.35Å; K117-V119 VanDerWaalsContact C-N 3.34Å; K117-P120 VanDerWaalsContact O-CD 3.3Å; K117-P120 WeakPolarHBondContact O-CD 3.24Å
118	A	85.2	Confident	86.4	Confident	27 Å²	27	102.9 Å²	102.9	22%	0.223	54%	0.542	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-6.2	179.6	0	0	0	0	0	114.3	A114 H115 I116 P120 E121 H122	A114-A118 VanDerWaalsContact O-CB 3.31Å; A114-A118 WeakPolarHBondContact O-CB 3.46Å; A114-A118 PolarHBondContact O-N 3.41Å; H115-A118 PolarHBondContact O-N 3.42Å; I116-A118 VanDerWaalsContact C-N 3.3Å; I116-A118 PolarHBondContact O-N 3.32Å; A118-P120 VanDerWaalsContact C-CD 3.48Å; A118-E121 WeakPolarHBondContact O-CB 3.41Å; A118-E121 PolarHBondContact O-N 3.48Å; A118-E121 VanDerWaalsContact O-N 3.1Å; A118-H122 PolarHBondContact O-CD2 3.23Å; A118-H122 VanDerWaalsContact O-CD2 3.23Å; A118-H122 PolarHBondContact O-N 3.2Å
119	V	87.1	Confident	86.5	Confident	84 Å²	84	104.8 Å²	104.8	51%	0.509	55%	0.549	S	S	.	.	H	α-helix	trans	-53.5	-44.4	-179.3	172.9	0	0	0	0	113.5	H115 I116 K117 E121 H122 A123	H115-V119 WeakPolarHBondContact O-CG2 3.31Å; H115-V119 PolarHBondContact O-N 2.74Å; I116-V119 WeakPolarHBondContact O-CB 3.46Å; I116-V119 VanDerWaalsContact O-CG2 3.32Å; I116-V119 WeakPolarHBondContact O-CG2 3.32Å; I116-V119 PolarHBondContact O-N 3.36Å; K117-V119 VanDerWaalsContact C-N 3.34Å; V119-E121 VanDerWaalsContact C-N 3.27Å; V119-E121 PolarHBondContact O-N 3.31Å; V119-H122 PolarHBondContact O-N 2.87Å; V119-A123 WeakPolarHBondContact O-CB 3.45Å; V119-A123 PolarHBondContact O-N 3.33Å
120	P	86.9	Confident	86.5	Confident	91 Å²	91	102.5 Å²	102.5	59%	0.591	54%	0.539	S	S	*	.	H	α-helix	trans	-61.4	-33.8	178.9	-23.6	35.5	0	0	0	113.4	K117 A118 A123 A124	K117-P120 VanDerWaalsContact O-CD 3.3Å; K117-P120 WeakPolarHBondContact O-CD 3.24Å; A118-P120 VanDerWaalsContact C-CD 3.48Å; P120-A123 PolarHBondContact O-N 3.29Å; P120-A124 PolarHBondContact O-N 3.24Å
121	E	85	Confident	86.7	Confident	109 Å²	109	102.4 Å²	102.4	51%	0.509	54%	0.536	S	S	.	.	H	α-helix	trans	-67.8	-42.4	178	-165	-171.9	158.3	0	0	111.2	A118 V119 R125	A118-E121 WeakPolarHBondContact O-CB 3.41Å; A118-E121 PolarHBondContact O-N 3.48Å; A118-E121 VanDerWaalsContact O-N 3.1Å; V119-E121 VanDerWaalsContact C-N 3.27Å; V119-E121 PolarHBondContact O-N 3.31Å; E121-R125 PolarHBondContact O-N 3.1Å; E121-R125 IonicContact OE1-CZ 3.69Å; E121-R125 IonicContact OE1-NH2 2.74Å; E121-R125 PolarHBondContact OE1-NH2 3.41Å
122	H	86.9	Confident	87	Confident	110 Å²	110	99.1 Å²	99.1	51%	0.509	52%	0.519	S	S	.	.	H	α-helix	trans	-69.6	-35	175.2	-63.5	-57.2	0	0	0	112.4	A118 V119 A124 R125 L126	A118-H122 PolarHBondContact O-CD2 3.23Å; A118-H122 VanDerWaalsContact O-CD2 3.23Å; A118-H122 PolarHBondContact O-N 3.2Å; V119-H122 PolarHBondContact O-N 2.87Å; H122-A124 VanDerWaalsContact C-N 3.34Å; H122-A124 PolarHBondContact O-N 3.48Å; H122-R125 PolarHBondContact O-N 2.97Å; H122-L126 WeakPolarHBondContact O-CB 3.35Å; H122-L126 PolarHBondContact O-N 3.44Å
123	A	88.5	Confident	87.1	Confident	48 Å²	48	98.6 Å²	98.6	40%	0.397	51%	0.513	S	S	.	.	H	α-helix	trans	-60.8	-41.3	176.9	0	0	0	0	0	112.1	V119 P120 R125 L126 Q127	V119-A123 WeakPolarHBondContact O-CB 3.45Å; V119-A123 PolarHBondContact O-N 3.33Å; P120-A123 PolarHBondContact O-N 3.29Å; A123-R125 PolarHBondContact O-N 3.26Å; A123-L126 PolarHBondContact O-N 2.82Å; A123-Q127 WeakPolarHBondContact O-CB 3.33Å; A123-Q127 PolarHBondContact O-N 3.12Å
124	A	87.9	Confident	87.1	Confident	59 Å²	59	102.7 Å²	102.7	49%	0.488	53%	0.531	S	S	.	.	H	α-helix	trans	-63.4	-42.4	176.4	0	0	0	0	0	112.3	P120 H122 Q127 R128	P120-A124 PolarHBondContact O-N 3.24Å; H122-A124 VanDerWaalsContact C-N 3.34Å; H122-A124 PolarHBondContact O-N 3.48Å; A124-Q127 PolarHBondContact O-N 2.86Å; A124-R128 PolarHBondContact O-N 3.33Å; A124-R128 VanDerWaalsContact O-N 3.12Å
125	R	89.6	Confident	87	Confident	159 Å²	159	104.8 Å²	104.8	60%	0.6	53%	0.528	S	S	*	.	H	α-helix	trans	-66.5	-41.3	175.9	-63.8	-175.8	-164.7	-177.4	5.9	111.5	E121 H122 A123 R128 L129	E121-R125 PolarHBondContact O-N 3.1Å; E121-R125 IonicContact OE1-CZ 3.69Å; E121-R125 IonicContact OE1-NH2 2.74Å; E121-R125 PolarHBondContact OE1-NH2 3.41Å; H122-R125 PolarHBondContact O-N 2.97Å; A123-R125 PolarHBondContact O-N 3.26Å; R125-R128 PolarHBondContact O-N 3.47Å; R125-L129 PolarHBondContact O-N 3.5Å
126	L	91.8	Very high	86.9	Confident	118 Å²	118	104.2 Å²	104.2	62%	0.618	53%	0.526	S	S	*	.	H	α-helix	trans	-64.5	-41.6	176.9	-174.3	68.3	0	0	0	111.6	H122 A123 R128 L129 A130	H122-L126 WeakPolarHBondContact O-CB 3.35Å; H122-L126 PolarHBondContact O-N 3.44Å; A123-L126 PolarHBondContact O-N 2.82Å; L126-R128 VanDerWaalsContact C-N 3.34Å; L126-R128 PolarHBondContact O-N 3.37Å; L126-L129 PolarHBondContact O-N 2.79Å; L126-A130 WeakPolarHBondContact O-CB 3.36Å; L126-A130 PolarHBondContact O-N 3.22Å
127	Q	90.9	Very high	86.4	Confident	146 Å²	146	105.6 Å²	105.6	68%	0.682	53%	0.53	S	S	*	.	H	α-helix	trans	-61.1	-43.5	176.4	-177.2	178.8	-4.1	0	0	111.3	A123 A124 A130 Q131	A123-Q127 WeakPolarHBondContact O-CB 3.33Å; A123-Q127 PolarHBondContact O-N 3.12Å; A124-Q127 PolarHBondContact O-N 2.86Å; Q127-A130 PolarHBondContact O-N 3.04Å; Q127-Q131 PolarHBondContact O-N 3.34Å
128	R	90.5	Very high	85.4	Confident	183 Å²	183	102.3 Å²	102.3	69%	0.691	52%	0.518	S	S	*	.	H	α-helix	trans	-62.5	-43.5	174.7	-173.8	177.2	-176.6	178.5	1.5	111.6	A124 R125 L126 Q131 I132	A124-R128 PolarHBondContact O-N 3.33Å; A124-R128 VanDerWaalsContact O-N 3.12Å; R125-R128 PolarHBondContact O-N 3.47Å; L126-R128 VanDerWaalsContact C-N 3.34Å; L126-R128 PolarHBondContact O-N 3.37Å; R128-Q131 PolarHBondContact O-N 2.95Å; R128-I132 HydrophobicContact CG-CD1 4.26Å; R128-I132 WeakPolarHBondContact O-CG1 3.36Å; R128-I132 PolarHBondContact O-N 3.35Å
129	L	91.4	Very high	84.3	Confident	111 Å²	111	104.7 Å²	104.7	58%	0.581	53%	0.532	S	S	*	.	H	α-helix	trans	-63.2	-43	176.8	-170.8	75.7	0	0	0	111.4	R125 L126 Q131 I132 H133	R125-L129 PolarHBondContact O-N 3.5Å; L126-L129 PolarHBondContact O-N 2.79Å; L129-Q131 VanDerWaalsContact C-N 3.32Å; L129-Q131 PolarHBondContact O-N 3.03Å; L129-I132 PolarHBondContact O-N 3.28Å; L129-H133 WeakPolarHBondContact O-CB 3.35Å; L129-H133 PolarHBondContact O-N 3.5Å
130	A	89.8	Confident	82.9	Confident	45 Å²	45	106 Å²	106	37%	0.372	53%	0.534	S	S	.	.	H	α-helix	trans	-61.4	-40.8	176.6	0	0	0	0	0	111.4	L126 Q127 H133 I134	L126-A130 WeakPolarHBondContact O-CB 3.36Å; L126-A130 PolarHBondContact O-N 3.22Å; Q127-A130 PolarHBondContact O-N 3.04Å; A130-H133 PolarHBondContact O-N 2.88Å; A130-I134 WeakPolarHBondContact O-CD1 3.48Å; A130-I134 VanDerWaalsContact O-CG1 3.24Å; A130-I134 WeakPolarHBondContact O-CG1 3.22Å; A130-I134 PolarHBondContact O-N 3.22Å
131	Q	88.9	Confident	81.6	Confident	117 Å²	117	107.2 Å²	107.2	55%	0.547	54%	0.536	S	S	.	.	H	α-helix	trans	-62.2	-44.1	174.4	-173.2	177.9	10.5	0	0	112.1	Q127 R128 L129 H133 I134 Q135	Q127-Q131 PolarHBondContact O-N 3.34Å; R128-Q131 PolarHBondContact O-N 2.95Å; L129-Q131 VanDerWaalsContact C-N 3.32Å; L129-Q131 PolarHBondContact O-N 3.03Å; Q131-H133 VanDerWaalsContact C-N 3.33Å; Q131-I134 PolarHBondContact O-N 3.42Å; Q131-Q135 WeakPolarHBondContact O-CG 3.38Å; Q131-Q135 PolarHBondContact O-N 3.45Å
132	I	89	Confident	80.4	Confident	64 Å²	64	106.2 Å²	106.2	33%	0.328	54%	0.537	S	S	.	.	H	α-helix	trans	-63.8	-41.8	175.5	-66.3	164.7	0	0	0	110.4	R128 L129 I134 Q135 Q136	R128-I132 HydrophobicContact CG-CD1 4.26Å; R128-I132 WeakPolarHBondContact O-CG1 3.36Å; R128-I132 PolarHBondContact O-N 3.35Å; L129-I132 PolarHBondContact O-N 3.28Å; I132-I134 PolarHBondContact O-N 2.81Å; I132-Q135 CarbonylContact O-C 3.6Å; I132-Q135 WeakPolarHBondContact O-CB 3.43Å; I132-Q135 PolarHBondContact O-N 3.15Å; I132-Q135 VanDerWaalsContact O-N 3.15Å; I132-Q136 HydrophobicContact CG2-CG 4.27Å; I132-Q136 WeakPolarHBondContact O-CG 3.5Å; I132-Q136 PolarHBondContact O-N 2.85Å
133	H	85.6	Confident	79.2	Confident	102 Å²	102	105.9 Å²	105.9	47%	0.472	54%	0.538	S	S	.	.	H	α-helix	trans	-61.8	-45.3	177.9	-174.2	70.1	0	0	0	111.5	L129 A130 Q131 Q135 Q136 Q137	L129-H133 WeakPolarHBondContact O-CB 3.35Å; L129-H133 PolarHBondContact O-N 3.5Å; A130-H133 PolarHBondContact O-N 2.88Å; Q131-H133 VanDerWaalsContact C-N 3.33Å; H133-Q135 VanDerWaalsContact C-N 3.26Å; H133-Q135 PolarHBondContact O-N 3.49Å; H133-Q136 PolarHBondContact O-N 2.83Å; H133-Q136 VanDerWaalsContact O-N 3.15Å; H133-Q137 PolarHBondContact NE2-OE1 3.39Å; H133-Q137 VanDerWaalsContact O-CB 3.3Å; H133-Q137 WeakPolarHBondContact O-CB 3.41Å; H133-Q137 PolarHBondContact O-N 3.15Å
134	I	86.1	Confident	77.9	Confident	116 Å²	116	106.4 Å²	106.4	60%	0.595	54%	0.537	S	S	*	.	H	α-helix	trans	-58.4	-40.8	174.2	-69.2	162.8	0	0	0	110.6	A130 Q131 I132 Q137 I138	A130-I134 WeakPolarHBondContact O-CD1 3.48Å; A130-I134 VanDerWaalsContact O-CG1 3.24Å; A130-I134 WeakPolarHBondContact O-CG1 3.22Å; A130-I134 PolarHBondContact O-N 3.22Å; Q131-I134 PolarHBondContact O-N 3.42Å; I132-I134 PolarHBondContact O-N 2.81Å; I134-Q137 PolarHBondContact O-N 3.35Å; I134-I138 VanDerWaalsContact O-CG1 3.3Å; I134-I138 WeakPolarHBondContact O-CG1 3.44Å
135	Q	80.3	Confident	76.8	Confident	116 Å²	116	110.6 Å²	110.6	54%	0.542	54%	0.541	S	S	.	.	H	α-helix	trans	-67.5	-37	176.3	-73.5	178.7	-6.7	0	0	113.4	Q131 I132 H133 I138	Q131-Q135 WeakPolarHBondContact O-CG 3.38Å; Q131-Q135 PolarHBondContact O-N 3.45Å; I132-Q135 CarbonylContact O-C 3.6Å; I132-Q135 WeakPolarHBondContact O-CB 3.43Å; I132-Q135 PolarHBondContact O-N 3.15Å; I132-Q135 VanDerWaalsContact O-N 3.15Å; H133-Q135 VanDerWaalsContact C-N 3.26Å; H133-Q135 PolarHBondContact O-N 3.49Å; Q135-I138 WeakPolarHBondContact O-CB 3.24Å; Q135-I138 WeakPolarHBondContact O-CD1 3.3Å; Q135-I138 VanDerWaalsContact O-CG1 3.22Å; Q135-I138 WeakPolarHBondContact O-CG1 3.3Å
136	Q	78.2	Confident	75.7	Confident	149 Å²	149	107.6 Å²	107.6	70%	0.696	54%	0.537	S	S	*	.	H	α-helix	trans	-73.5	-33.4	177.2	-73.1	176.2	-11.7	0	0	111.9	I132 H133 I138	I132-Q136 HydrophobicContact CG2-CG 4.27Å; I132-Q136 WeakPolarHBondContact O-CG 3.5Å; I132-Q136 PolarHBondContact O-N 2.85Å; H133-Q136 PolarHBondContact O-N 2.83Å; H133-Q136 VanDerWaalsContact O-N 3.15Å; Q136-I138 PolarHBondContact O-N 3.23Å
137	Q	72	Confident	74.6	Confident	131 Å²	131	108.3 Å²	108.3	61%	0.612	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	26.6	176.6	-155.2	176.5	7	0	0	112.1	H133 I134 P139	H133-Q137 PolarHBondContact NE2-OE1 3.39Å; H133-Q137 VanDerWaalsContact O-CB 3.3Å; H133-Q137 WeakPolarHBondContact O-CB 3.41Å; H133-Q137 PolarHBondContact O-N 3.15Å; I134-Q137 PolarHBondContact O-N 3.35Å; Q137-P139 WeakPolarHBondContact O-CD 3.34Å
138	I	62.7	Low	73.6	Confident	63 Å²	63	105.1 Å²	105.1	32%	0.323	53%	0.527	S	S	.	.			trans	-95	84.2	171.7	-56.4	177.7	0	0	0	109.2	I134 Q135 Q136 I140 L141	I134-I138 VanDerWaalsContact O-CG1 3.3Å; I134-I138 WeakPolarHBondContact O-CG1 3.44Å; Q135-I138 WeakPolarHBondContact O-CB 3.24Å; Q135-I138 WeakPolarHBondContact O-CD1 3.3Å; Q135-I138 VanDerWaalsContact O-CG1 3.22Å; Q135-I138 WeakPolarHBondContact O-CG1 3.3Å; Q136-I138 PolarHBondContact O-N 3.23Å; I138-I140 HydrophobicContact CG2-CB 3.63Å; I138-I140 HydrophobicContact CG2-CG1 4.24Å; I138-I140 PolarHBondContact O-N 3.05Å; I138-L141 HydrophobicContact CG2-CB 4.23Å; I138-L141 HydrophobicContact CG2-CD1 4.18Å; I138-L141 HydrophobicContact CG2-CG 4.01Å
139	P	61.3	Low	72.7	Confident	77 Å²	77	101.7 Å²	101.7	50%	0.5	52%	0.521	S	S	.	.	H	α-helix	trans	-68.9	-1.7	159.1	31.2	-33.3	0	0	0	111.9	Q137 T142 L143	Q137-P139 WeakPolarHBondContact O-CD 3.34Å; P139-T142 WeakPolarHBondContact CA-OG1 3.42Å; P139-T142 PolarHBondContact O-OG1 2.9Å; P139-L143 WeakPolarHBondContact O-CB 2.78Å; P139-L143 WeakPolarHBondContact O-CG 3.29Å; P139-L143 PolarHBondContact O-N 3Å
140	I	58.6	Low	72	Confident	111 Å²	111	101.3 Å²	101.3	57%	0.569	52%	0.519	S	S	*	.	H	α-helix	trans	-72.6	-32.6	179.4	-51.7	173.3	0	0	0	111.2	I138 L143 T144	I138-I140 HydrophobicContact CG2-CB 3.63Å; I138-I140 HydrophobicContact CG2-CG1 4.24Å; I138-I140 PolarHBondContact O-N 3.05Å; I140-L143 PolarHBondContact O-N 3.07Å; I140-T144 HydrophobicContact CG2-CG2 4.29Å; I140-T144 WeakPolarHBondContact O-CB 3.41Å; I140-T144 VanDerWaalsContact O-CG2 3.31Å; I140-T144 WeakPolarHBondContact O-CG2 3.26Å; I140-T144 PolarHBondContact O-N 2.8Å; I140-T144 PolarHBondContact O-OG1 3.02Å
141	L	58.6	Low	71.5	Confident	118 Å²	118	103.6 Å²	103.6	62%	0.618	52%	0.524	S	S	*	.	H	α-helix	trans	-70	-35.7	176.2	-83.4	164.9	0	0	0	111.6	I138 T144 Y145	I138-L141 HydrophobicContact CG2-CB 4.23Å; I138-L141 HydrophobicContact CG2-CD1 4.18Å; I138-L141 HydrophobicContact CG2-CG 4.01Å; L141-T144 WeakPolarHBondContact CA-OG1 3.46Å; L141-T144 PolarHBondContact O-OG1 2.87Å; L141-T144 VanDerWaalsContact O-OG1 3.07Å; L141-Y145 VanDerWaalsContact O-CB 3.29Å; L141-Y145 WeakPolarHBondContact O-CB 3.31Å; L141-Y145 PolarHBondContact O-N 3.41Å
142	T	59.8	Low	71.3	Confident	87 Å²	87	101 Å²	101	53%	0.534	52%	0.519	S	S	.	.	H	α-helix	trans	-72.6	-37.2	172.7	43.3	0	0	0	0	112.1	P139 N146	P139-T142 WeakPolarHBondContact CA-OG1 3.42Å; P139-T142 PolarHBondContact O-OG1 2.9Å; T142-N146 WeakPolarHBondContact O-CB 3.46Å; T142-N146 PolarHBondContact O-N 3.12Å; T142-N146 PolarHBondContact O-ND2 3.44Å; T142-N146 VanDerWaalsContact O-ND2 3.14Å
143	L	61.2	Low	71	Confident	103 Å²	103	104.3 Å²	104.3	54%	0.539	53%	0.531	S	S	.	.	H	α-helix	trans	-64	-44.3	173	-81.9	163.9	0	0	0	112.9	P139 I140 N146 Q147	P139-L143 WeakPolarHBondContact O-CB 2.78Å; P139-L143 WeakPolarHBondContact O-CG 3.29Å; P139-L143 PolarHBondContact O-N 3Å; I140-L143 PolarHBondContact O-N 3.07Å; L143-N146 PolarHBondContact O-N 3.21Å; L143-Q147 WeakPolarHBondContact O-CG 3.5Å; L143-Q147 PolarHBondContact O-N 3.16Å
144	T	62.2	Low	71	Confident	60 Å²	60	103.3 Å²	103.3	37%	0.368	53%	0.526	S	S	.	.	H	α-helix	trans	-68.1	-38.7	177.7	48.4	0	0	0	0	111.8	I140 L141 N146 Q147 T148	I140-T144 HydrophobicContact CG2-CG2 4.29Å; I140-T144 WeakPolarHBondContact O-CB 3.41Å; I140-T144 VanDerWaalsContact O-CG2 3.31Å; I140-T144 WeakPolarHBondContact O-CG2 3.26Å; I140-T144 PolarHBondContact O-N 2.8Å; I140-T144 PolarHBondContact O-OG1 3.02Å; L141-T144 WeakPolarHBondContact CA-OG1 3.46Å; L141-T144 PolarHBondContact O-OG1 2.87Å; L141-T144 VanDerWaalsContact O-OG1 3.07Å; T144-N146 VanDerWaalsContact C-N 3.33Å; T144-N146 PolarHBondContact O-N 2.93Å; T144-Q147 WeakPolarHBondContact O-CB 3.46Å; T144-Q147 PolarHBondContact O-N 2.98Å; T144-Q147 VanDerWaalsContact O-N 3.16Å; T144-T148 PolarHBondContact O-N 3.02Å; T144-T148 PolarHBondContact O-OG1 3.14Å; T144-T148 VanDerWaalsContact O-OG1 3.12Å
145	Y	64.1	Low	71.1	Confident	147 Å²	147	103.6 Å²	103.6	58%	0.576	52%	0.524	S	S	*	.	H	α-helix	trans	-59.4	-43.2	171.5	-176.1	-99	0	0	0	112.2	L141 Q147 T148 M149	L141-Y145 VanDerWaalsContact O-CB 3.29Å; L141-Y145 WeakPolarHBondContact O-CB 3.31Å; L141-Y145 PolarHBondContact O-N 3.41Å; Y145-Q147 VanDerWaalsContact C-N 3.32Å; Y145-Q147 PolarHBondContact O-N 3.45Å; Y145-T148 VanDerWaalsContact C-OG1 3.29Å; Y145-T148 VanDerWaalsContact CA-OG1 3.26Å; Y145-T148 WeakPolarHBondContact CA-OG1 3.43Å; Y145-T148 PolarHBondContact O-N 3.31Å; Y145-T148 PolarHBondContact O-OG1 3.06Å; Y145-M149 HydrophobicContact CE1-CG 4.41Å; Y145-M149 PolarHBondContact O-N 2.71Å
146	N	66.3	Low	71.5	Confident	95 Å²	95	102.5 Å²	102.5	51%	0.508	53%	0.525	S	S	.	.	H	α-helix	trans	-65.7	-32.5	175.7	-71.1	-25.4	0	0	0	112.6	T142 L143 T144 M149 L150	T142-N146 WeakPolarHBondContact O-CB 3.46Å; T142-N146 PolarHBondContact O-N 3.12Å; T142-N146 PolarHBondContact O-ND2 3.44Å; T142-N146 VanDerWaalsContact O-ND2 3.14Å; L143-N146 PolarHBondContact O-N 3.21Å; T144-N146 VanDerWaalsContact C-N 3.33Å; T144-N146 PolarHBondContact O-N 2.93Å; N146-M149 WeakPolarHBondContact O-CB 3.28Å; N146-M149 PolarHBondContact O-N 3.33Å; N146-L150 PolarHBondContact O-N 3.38Å
147	Q	69.8	Low	72	Confident	134 Å²	134	100.5 Å²	100.5	63%	0.626	52%	0.516	S	S	*	.	H	α-helix	trans	-69.3	-38	171.6	-74.4	174.3	-21.6	0	0	112.2	L143 T144 Y145 M149 L150	L143-Q147 WeakPolarHBondContact O-CG 3.5Å; L143-Q147 PolarHBondContact O-N 3.16Å; T144-Q147 WeakPolarHBondContact O-CB 3.46Å; T144-Q147 PolarHBondContact O-N 2.98Å; T144-Q147 VanDerWaalsContact O-N 3.16Å; Y145-Q147 VanDerWaalsContact C-N 3.32Å; Y145-Q147 PolarHBondContact O-N 3.45Å; Q147-M149 VanDerWaalsContact C-N 3.28Å; Q147-M149 PolarHBondContact O-N 3.25Å; Q147-L150 WeakPolarHBondContact O-CB 3.43Å; Q147-L150 PolarHBondContact O-N 2.62Å
148	T	69	Low	73	Confident	78 Å²	78	101.4 Å²	101.4	48%	0.479	51%	0.513	S	S	.	.	H	α-helix	trans	-65	-31.4	170.3	33.1	0	0	0	0	112.5	T144 Y145 L150 L151	T144-T148 PolarHBondContact O-N 3.02Å; T144-T148 PolarHBondContact O-OG1 3.14Å; T144-T148 VanDerWaalsContact O-OG1 3.12Å; Y145-T148 VanDerWaalsContact C-OG1 3.29Å; Y145-T148 VanDerWaalsContact CA-OG1 3.26Å; Y145-T148 WeakPolarHBondContact CA-OG1 3.43Å; Y145-T148 PolarHBondContact O-N 3.31Å; Y145-T148 PolarHBondContact O-OG1 3.06Å; T148-L150 PolarHBondContact O-N 2.97Å; T148-L151 HydrophobicContact CG2-CD1 4.17Å; T148-L151 VanDerWaalsContact O-CB 3.28Å; T148-L151 WeakPolarHBondContact O-CB 3.14Å; T148-L151 PolarHBondContact O-N 3.33Å
149	M	71.1	Confident	74.4	Confident	111 Å²	111	103.3 Å²	103.3	55%	0.547	52%	0.524	S	S	.	.	H	α-helix	trans	-62.3	-23.6	170.3	-92.4	-119.5	165.1	0	0	113	Y145 N146 Q147 L151 S152	Y145-M149 HydrophobicContact CE1-CG 4.41Å; Y145-M149 PolarHBondContact O-N 2.71Å; N146-M149 WeakPolarHBondContact O-CB 3.28Å; N146-M149 PolarHBondContact O-N 3.33Å; Q147-M149 VanDerWaalsContact C-N 3.28Å; Q147-M149 PolarHBondContact O-N 3.25Å; M149-L151 PolarHBondContact O-N 3.35Å; M149-S152 WeakPolarHBondContact O-CB 3.16Å; M149-S152 PolarHBondContact O-N 3.15Å; M149-S152 VanDerWaalsContact O-N 3.15Å; M149-S152 PolarHBondContact O-OG 3.03Å
150	L	77	Confident	75.8	Confident	103 Å²	103	105.1 Å²	105.1	54%	0.539	53%	0.526	S	S	.	.	H	α-helix	trans	-66.2	-23	173.2	-121.8	80.7	0	0	0	113	N146 Q147 T148 S152 K153 Q154	N146-L150 PolarHBondContact O-N 3.38Å; Q147-L150 WeakPolarHBondContact O-CB 3.43Å; Q147-L150 PolarHBondContact O-N 2.62Å; T148-L150 PolarHBondContact O-N 2.97Å; L150-S152 PolarHBondContact O-N 3.37Å; L150-K153 WeakPolarHBondContact O-CB 3.38Å; L150-K153 PolarHBondContact O-N 3.43Å; L150-Q154 PolarHBondContact O-N 3.12Å
151	L	80.3	Confident	77.3	Confident	93 Å²	93	104.4 Å²	104.4	49%	0.487	52%	0.523	S	S	.	.	H	α-helix	trans	-62.3	-31.6	172.3	-78.1	146.1	0	0	0	111.8	T148 M149 K153 Q154 F155	T148-L151 HydrophobicContact CG2-CD1 4.17Å; T148-L151 VanDerWaalsContact O-CB 3.28Å; T148-L151 WeakPolarHBondContact O-CB 3.14Å; T148-L151 PolarHBondContact O-N 3.33Å; M149-L151 PolarHBondContact O-N 3.35Å; L151-K153 VanDerWaalsContact C-N 3.28Å; L151-K153 PolarHBondContact O-N 3Å; L151-Q154 WeakPolarHBondContact O-CB 3.44Å; L151-Q154 PolarHBondContact O-N 3.13Å; L151-Q154 VanDerWaalsContact O-N 3.12Å; L151-F155 HydrophobicContact CB-CE2 4.37Å; L151-F155 WeakPolarHBondContact O-CD2 3.41Å; L151-F155 PolarHBondContact O-N 3.3Å
152	S	84.1	Confident	78.8	Confident	63 Å²	63	103.2 Å²	103.2	44%	0.441	52%	0.517	S	S	.	.	H	α-helix	trans	-62.3	-37.5	176	70.4	0	0	0	0	112	M149 L150 Q154 F155 V156	M149-S152 WeakPolarHBondContact O-CB 3.16Å; M149-S152 PolarHBondContact O-N 3.15Å; M149-S152 VanDerWaalsContact O-N 3.15Å; M149-S152 PolarHBondContact O-OG 3.03Å; L150-S152 PolarHBondContact O-N 3.37Å; S152-Q154 VanDerWaalsContact C-N 3.35Å; S152-F155 PolarHBondContact O-N 3.19Å; S152-V156 WeakPolarHBondContact O-CG2 3.43Å; S152-V156 PolarHBondContact O-N 3.38Å; S152-V156 VanDerWaalsContact O-N 3.13Å
153	K	82.5	Confident	80.2	Confident	134 Å²	134	102.2 Å²	102.2	58%	0.583	51%	0.513	S	S	*	.	H	α-helix	trans	-66.4	-36.6	173.9	-67.1	-175.8	175.9	-178.6	0	112.2	L150 L151 V156 Q157	L150-K153 WeakPolarHBondContact O-CB 3.38Å; L150-K153 PolarHBondContact O-N 3.43Å; L151-K153 VanDerWaalsContact C-N 3.28Å; L151-K153 PolarHBondContact O-N 3Å; K153-V156 PolarHBondContact O-N 3.31Å; K153-Q157 WeakPolarHBondContact O-CG 3.47Å; K153-Q157 PolarHBondContact O-N 3.43Å
154	Q	86.4	Confident	81.4	Confident	80 Å²	80	103 Å²	103	37%	0.374	51%	0.513	S	S	.	.	H	α-helix	trans	-64.7	-41.5	175.4	-67	-61.6	-50.2	0	0	111.4	L150 L151 S152 V156 Q157 W158	L150-Q154 PolarHBondContact O-N 3.12Å; L151-Q154 WeakPolarHBondContact O-CB 3.44Å; L151-Q154 PolarHBondContact O-N 3.13Å; L151-Q154 VanDerWaalsContact O-N 3.12Å; S152-Q154 VanDerWaalsContact C-N 3.35Å; Q154-V156 PolarHBondContact O-N 2.92Å; Q154-Q157 PolarHBondContact O-N 3.47Å; Q154-W158 PolarHBondContact O-N 3.33Å
155	F	88.1	Confident	82.5	Confident	123 Å²	123	105 Å²	105	54%	0.539	52%	0.522	S	S	.	.	H	α-helix	trans	-62.7	-41.4	175.4	-72.1	-58.3	0	0	0	112.7	L151 S152 W158 D159	L151-F155 HydrophobicContact CB-CE2 4.37Å; L151-F155 WeakPolarHBondContact O-CD2 3.41Å; L151-F155 PolarHBondContact O-N 3.3Å; S152-F155 PolarHBondContact O-N 3.19Å; F155-W158 AromaticContact CD1-CE3 3.95Å; F155-W158 HydrophobicContact CD1-CE3 3.95Å; F155-W158 HydrophobicContact CD1-CZ3 4.18Å; F155-W158 HydrophobicContact CE1-CE3 4.19Å; F155-W158 AromaticContact CE1-CZ3 3.97Å; F155-W158 HydrophobicContact CE1-CZ3 3.97Å; F155-W158 PolarHBondContact O-N 2.95Å; F155-D159 WeakPolarHBondContact O-CB 3.35Å; F155-D159 PolarHBondContact O-N 3.48Å
156	V	88.9	Confident	83.6	Confident	93 Å²	93	103.9 Å²	103.9	56%	0.564	52%	0.521	S	S	*	.	H	α-helix	trans	-63.7	-41.9	175.7	174.1	0	0	0	0	111.4	S152 K153 Q154 W158 D159 E160	S152-V156 WeakPolarHBondContact O-CG2 3.43Å; S152-V156 PolarHBondContact O-N 3.38Å; S152-V156 VanDerWaalsContact O-N 3.13Å; K153-V156 PolarHBondContact O-N 3.31Å; Q154-V156 PolarHBondContact O-N 2.92Å; V156-W158 VanDerWaalsContact C-N 3.33Å; V156-W158 PolarHBondContact O-N 3.29Å; V156-D159 PolarHBondContact O-N 3.41Å; V156-E160 WeakPolarHBondContact O-CB 3.4Å; V156-E160 PolarHBondContact O-N 2.88Å
157	Q	88.5	Confident	84.3	Confident	107 Å²	107	101.8 Å²	101.8	50%	0.5	52%	0.517	S	S	.	.	H	α-helix	trans	-63.4	-39.3	176.5	-74.9	178.4	-19.1	0	0	112.4	K153 Q154 L161	K153-Q157 WeakPolarHBondContact O-CG 3.47Å; K153-Q157 PolarHBondContact O-N 3.43Å; Q154-Q157 PolarHBondContact O-N 3.47Å; Q157-L161 WeakPolarHBondContact O-CB 3.34Å; Q157-L161 PolarHBondContact O-N 3.39Å
158	W	91.9	Very high	84.7	Confident	149 Å²	149	98.4 Å²	98.4	56%	0.564	51%	0.512	S	S	*	.	H	α-helix	trans	-68.3	-38.5	175.4	-70.3	-13.8	0	0	0	112.5	Q154 F155 V156 L161 L162	Q154-W158 PolarHBondContact O-N 3.33Å; F155-W158 AromaticContact CD1-CE3 3.95Å; F155-W158 HydrophobicContact CD1-CE3 3.95Å; F155-W158 HydrophobicContact CD1-CZ3 4.18Å; F155-W158 HydrophobicContact CE1-CE3 4.19Å; F155-W158 AromaticContact CE1-CZ3 3.97Å; F155-W158 HydrophobicContact CE1-CZ3 3.97Å; F155-W158 PolarHBondContact O-N 2.95Å; V156-W158 VanDerWaalsContact C-N 3.33Å; V156-W158 PolarHBondContact O-N 3.29Å; W158-L161 PolarHBondContact O-N 3.02Å; W158-L162 WeakPolarHBondContact O-CB 3.44Å; W158-L162 WeakPolarHBondContact O-CG 3.35Å; W158-L162 PolarHBondContact O-N 2.94Å
159	D	92.1	Very high	84.7	Confident	104 Å²	104	99.5 Å²	99.5	56%	0.556	52%	0.519	S	S	*	.	H	α-helix	trans	-64.6	-44.1	176.3	-167.1	49.4	0	0	0	111.6	F155 V156 L161 L162 C163	F155-D159 WeakPolarHBondContact O-CB 3.35Å; F155-D159 PolarHBondContact O-N 3.48Å; V156-D159 PolarHBondContact O-N 3.41Å; D159-L161 PolarHBondContact O-N 3.26Å; D159-L162 PolarHBondContact O-N 2.89Å; D159-C163 PolarHBondContact O-N 3.36Å; D159-C163 PolarHBondContact O-SG 3.01Å
160	E	91.1	Very high	84.2	Confident	114 Å²	114	102.2 Å²	102.2	53%	0.533	53%	0.53	S	S	.	.	H	α-helix	trans	-63.8	-41.1	176.1	-168.1	173.8	-166.6	0	0	112	V156 C163 Q164	V156-E160 WeakPolarHBondContact O-CB 3.4Å; V156-E160 PolarHBondContact O-N 2.88Å; E160-C163 PolarHBondContact O-N 3.03Å; E160-Q164 VanDerWaalsContact O-CG 3.3Å; E160-Q164 WeakPolarHBondContact O-CG 3.36Å; E160-Q164 PolarHBondContact O-N 3.42Å
161	L	90.9	Very high	83.2	Confident	96 Å²	96	102.8 Å²	102.8	50%	0.503	54%	0.538	S	S	.	.	H	α-helix	trans	-64.6	-42.2	174.3	-174.4	117.4	0	0	0	111.9	Q157 W158 D159 Q164 L165	Q157-L161 WeakPolarHBondContact O-CB 3.34Å; Q157-L161 PolarHBondContact O-N 3.39Å; W158-L161 PolarHBondContact O-N 3.02Å; D159-L161 PolarHBondContact O-N 3.26Å; L161-Q164 PolarHBondContact O-N 3.23Å; L161-L165 HydrophobicContact CD2-CD1 3.82Å; L161-L165 HydrophobicContact CG-CD1 4.26Å; L161-L165 WeakPolarHBondContact O-CG 3.27Å; L161-L165 PolarHBondContact O-N 3.27Å
162	L	89.6	Confident	81.5	Confident	94 Å²	94	106.8 Å²	106.8	49%	0.492	55%	0.551	S	S	.	*	H	α-helix	trans	-61.1	-46.3	175	-80.4	166.9	0	0	0	111.2	W158 D159 Q164 L165 E166	W158-L162 WeakPolarHBondContact O-CB 3.44Å; W158-L162 WeakPolarHBondContact O-CG 3.35Å; W158-L162 PolarHBondContact O-N 2.94Å; D159-L162 PolarHBondContact O-N 2.89Å; L162-Q164 VanDerWaalsContact C-N 3.33Å; L162-Q164 PolarHBondContact O-N 3.47Å; L162-L165 PolarHBondContact O-N 2.96Å; L162-E166 WeakPolarHBondContact O-CB 3.31Å; L162-E166 WeakPolarHBondContact O-CG 3.33Å; L162-E166 PolarHBondContact O-N 2.93Å
163	C	88.9	Confident	79.7	Confident	66 Å²	66	108 Å²	108	45%	0.446	56%	0.557	S	S	.	*	H	α-helix	trans	-60	-41	176.8	-71.4	0	0	0	0	112.4	D159 E160 A167	D159-C163 PolarHBondContact O-N 3.36Å; D159-C163 PolarHBondContact O-SG 3.01Å; E160-C163 PolarHBondContact O-N 3.03Å; C163-A167 VanDerWaalsContact O-CB 3.28Å; C163-A167 WeakPolarHBondContact O-CB 3.3Å; C163-A167 PolarHBondContact O-N 3.45Å
164	Q	86.5	Confident	77.9	Confident	119 Å²	119	106.5 Å²	106.5	56%	0.556	57%	0.571	S	S	*	*	H	α-helix	trans	-66.1	-42.4	176.5	-73.1	174.9	13.9	0	0	112.2	E160 L161 L162 A167 A168	E160-Q164 VanDerWaalsContact O-CG 3.3Å; E160-Q164 WeakPolarHBondContact O-CG 3.36Å; E160-Q164 PolarHBondContact O-N 3.42Å; L161-Q164 PolarHBondContact O-N 3.23Å; L162-Q164 VanDerWaalsContact C-N 3.33Å; L162-Q164 PolarHBondContact O-N 3.47Å; Q164-A167 PolarHBondContact O-N 2.83Å; Q164-A168 WeakPolarHBondContact O-CB 3.16Å; Q164-A168 PolarHBondContact O-N 2.93Å
165	L	86.3	Confident	75.7	Confident	103 Å²	103	111 Å²	111	54%	0.539	59%	0.592	S	S	.	*	H	α-helix	trans	-65.2	-44.4	176.3	-71.8	173	0	0	0	111.1	L161 L162 A168 T169	L161-L165 HydrophobicContact CD2-CD1 3.82Å; L161-L165 HydrophobicContact CG-CD1 4.26Å; L161-L165 WeakPolarHBondContact O-CG 3.27Å; L161-L165 PolarHBondContact O-N 3.27Å; L162-L165 PolarHBondContact O-N 2.96Å; L165-A168 PolarHBondContact O-N 2.83Å; L165-T169 PolarHBondContact O-N 2.85Å; L165-T169 PolarHBondContact O-OG1 3.42Å
166	E	85.5	Confident	73.2	Confident	122 Å²	122	118 Å²	118	57%	0.57	63%	0.626	S	S	*	*	H	α-helix	trans	-58.9	-47.2	175.5	-77	-178.1	178.8	0	0	111.6	L162 A168 T169 Q170	L162-E166 WeakPolarHBondContact O-CB 3.31Å; L162-E166 WeakPolarHBondContact O-CG 3.33Å; L162-E166 PolarHBondContact O-N 2.93Å; E166-A168 VanDerWaalsContact C-N 3.34Å; E166-A168 PolarHBondContact O-N 3.5Å; E166-T169 VanDerWaalsContact CA-OG1 3.27Å; E166-T169 WeakPolarHBondContact CA-OG1 3.39Å; E166-T169 PolarHBondContact O-N 2.89Å; E166-T169 PolarHBondContact O-OG1 3.47Å; E166-Q170 VanDerWaalsContact O-CG 3.31Å; E166-Q170 WeakPolarHBondContact O-CG 3.42Å; E166-Q170 PolarHBondContact O-N 3.2Å
167	A	80.8	Confident	72.4	Confident	52 Å²	52	119.3 Å²	119.3	43%	0.43	63%	0.629	S	S	.	*	H	α-helix	trans	-60.3	-41.4	175.2	0	0	0	0	0	112	C163 Q164 T169 Q170 V171	C163-A167 VanDerWaalsContact O-CB 3.28Å; C163-A167 WeakPolarHBondContact O-CB 3.3Å; C163-A167 PolarHBondContact O-N 3.45Å; Q164-A167 PolarHBondContact O-N 2.83Å; A167-T169 PolarHBondContact O-N 3.2Å; A167-Q170 PolarHBondContact O-N 2.91Å; A167-V171 WeakPolarHBondContact O-CB 3.28Å; A167-V171 WeakPolarHBondContact O-CG2 3.37Å; A167-V171 PolarHBondContact O-N 3.49Å
168	A	78.6	Confident	71.5	Confident	62 Å²	62	119.9 Å²	119.9	51%	0.512	64%	0.636	S	S	.	*	H	α-helix	trans	-66.6	-34.3	176.2	0	0	0	0	0	112.9	Q164 L165 E166 V171	Q164-A168 WeakPolarHBondContact O-CB 3.16Å; Q164-A168 PolarHBondContact O-N 2.93Å; L165-A168 PolarHBondContact O-N 2.83Å; E166-A168 VanDerWaalsContact C-N 3.34Å; E166-A168 PolarHBondContact O-N 3.5Å; A168-V171 PolarHBondContact O-N 2.94Å
169	T	69.8	Low	70.4	Confident	102 Å²	102	118.3 Å²	118.3	63%	0.626	64%	0.64	S	S	*	*	H	α-helix	trans	-70.9	-34.7	171.2	25.2	0	0	0	0	113.3	L165 E166 A167 V171 K172	L165-T169 PolarHBondContact O-N 2.85Å; L165-T169 PolarHBondContact O-OG1 3.42Å; E166-T169 VanDerWaalsContact CA-OG1 3.27Å; E166-T169 WeakPolarHBondContact CA-OG1 3.39Å; E166-T169 PolarHBondContact O-N 2.89Å; E166-T169 PolarHBondContact O-OG1 3.47Å; A167-T169 PolarHBondContact O-N 3.2Å; T169-V171 VanDerWaalsContact C-N 3.3Å; T169-K172 PolarHBondContact O-N 3.41Å
170	Q	61	Low	69.1	Low	168 Å²	168	119.1 Å²	119.1	79%	0.785	65%	0.645	S	S	*	*	H	α-helix	trans	-70.6	-27.4	173.3	-70.3	-88.5	5.5	0	0	112.1	E166 A167 K172	E166-Q170 VanDerWaalsContact O-CG 3.31Å; E166-Q170 WeakPolarHBondContact O-CG 3.42Å; E166-Q170 PolarHBondContact O-N 3.2Å; A167-Q170 PolarHBondContact O-N 2.91Å; Q170-K172 VanDerWaalsContact C-N 3.26Å; Q170-K172 PolarHBondContact O-N 3.27Å
171	V	54.3	Low	67.8	Low	115 Å²	115	119.4 Å²	119.4	70%	0.697	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	7.5	177	174.2	0	0	0	0	112.8	A167 A168 T169 P173	A167-V171 WeakPolarHBondContact O-CB 3.28Å; A167-V171 WeakPolarHBondContact O-CG2 3.37Å; A167-V171 PolarHBondContact O-N 3.49Å; A168-V171 PolarHBondContact O-N 2.94Å; T169-V171 VanDerWaalsContact C-N 3.3Å; V171-P173 WeakPolarHBondContact O-CD 2.95Å
172	K	46.6	Very low	66.2	Low	176 Å²	176	121 Å²	121	77%	0.765	66%	0.662	S	S	*	*			trans	-92.8	91.2	158	-95.9	-177.9	172.1	179.2	0	110	T169 Q170 A174	T169-K172 PolarHBondContact O-N 3.41Å; Q170-K172 VanDerWaalsContact C-N 3.26Å; Q170-K172 PolarHBondContact O-N 3.27Å; K172-A174 PolarHBondContact O-N 2.99Å
173	P	45.5	Very low	64.5	Low	88 Å²	88	122.9 Å²	122.9	57%	0.571	67%	0.674	S	S	*	*			trans	-64.4	130.6	146.3	30.1	-26.9	0	0	0	106.7	V171 E175	V171-P173 WeakPolarHBondContact O-CD 2.95Å; P173-E175 HydrophobicContact CB-CG 4.42Å; P173-E175 HydrophobicContact CG-CG 4.33Å; P173-E175 PolarHBondContact O-N 3.47Å
174	A	45.6	Very low	62.7	Low	104 Å²	104	127.3 Å²	127.3	86%	0.86	69%	0.691	S	S	*	*			trans	-60.5	99.3	151.4	0	0	0	0	0	106	K172	K172-A174 PolarHBondContact O-N 2.99Å
175	E	38.9	Very low	60.7	Low	174 Å²	174	128 Å²	128	81%	0.813	70%	0.703	S	S	*	*			trans	-87.4	127.1	157.9	-74.6	-176.1	167.5	0	0	107.5	P173	P173-E175 HydrophobicContact CB-CG 4.42Å; P173-E175 HydrophobicContact CG-CG 4.33Å; P173-E175 PolarHBondContact O-N 3.47Å
176	E	35.4	Very low	58.4	Low	270 Å²	270	130.3 Å²	130.3	100%	1.262	72%	0.717	S	S	*	*			trans	-57	0	169.3	-64.4	175.1	139.5	0	0	112.9

Retrieved 176 of 176 residues in 38.6 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).