G4M0Z5_SCHMA Loading...

Zinc finger protein, putative

AlphaFold DB , UniProt , Accession G4M0Z5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 193 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	38.5	Very low	64.5	Low	243 Å²	243	143 Å²	143	100%	1.197	78%	0.775	S	S	*	*				0	79.3	0	-64.7	-73	-167.8	0	0	108.2	G3	M1-G3 PolarHBondContact O-N 2.83Å
2	A	48.9	Very low	66	Low	104 Å²	104	142.4 Å²	142.4	86%	0.86	76%	0.759	S	S	*	*			trans	-80.7	96.5	177.4	0	0	0	0	0	107.9	T4	A2-T4 PolarHBondContact O-N 3.29Å
3	G	52.2	Low	67.4	Low	64 Å²	64	143.2 Å²	143.2	66%	0.66	75%	0.745	S	S	*	*			trans	-60.5	119.2	176.9	0	0	0	0	0	110	M1 N5	M1-G3 PolarHBondContact O-N 2.83Å; G3-N5 PolarHBondContact O-N 2.82Å
4	T	58	Low	68.7	Low	136 Å²	136	141 Å²	141	83%	0.834	74%	0.735	S	S	*	*			trans	-61.1	97.5	170.7	50.3	0	0	0	0	108	A2	A2-T4 PolarHBondContact O-N 3.29Å
5	N	63.6	Low	70	Confident	157 Å²	157	143.7 Å²	143.7	84%	0.84	74%	0.738	S	S	*	*			trans	-56.8	126.3	177.4	-82.1	-37.2	0	0	0	108.9	G3 V7	G3-N5 PolarHBondContact O-N 2.82Å; N5-V7 PolarHBondContact O-N 3.22Å
6	P	66.9	Low	71.3	Confident	113 Å²	113	138.4 Å²	138.4	73%	0.734	72%	0.723	S	S	*	*			trans	-58.4	139.4	-177.2	23.7	-32.8	0	0	0	109.8	D8	P6-D8 PolarHBondContact O-N 3.45Å
7	V	69.8	Low	72.5	Confident	112 Å²	112	136.9 Å²	136.9	68%	0.679	71%	0.711	S	S	*	*			trans	-49.1	100.5	-176.2	-178.2	0	0	0	0	109.5	N5 H9	N5-V7 PolarHBondContact O-N 3.22Å; V7-H9 PolarHBondContact O-CD2 3.44Å; V7-H9 PolarHBondContact O-N 3.04Å
8	D	70.3	Confident	73.6	Confident	88 Å²	88	133.7 Å²	133.7	47%	0.471	69%	0.691	S	S	.	*			trans	-74.7	94.5	-178.2	-168.2	6.6	0	0	0	107.6	P6 R10 K12	P6-D8 PolarHBondContact O-N 3.45Å; D8-R10 PolarHBondContact O-N 3.28Å; D8-R10 WeakPolarHBondContact OD1-CB 3.42Å; D8-K12 WeakPolarHBondContact OD2-CE 3.24Å; D8-K12 IonicContact OD2-NZ 2.82Å; D8-K12 PolarHBondContact OD2-NZ 3.26Å
9	H	79.2	Confident	74.6	Confident	174 Å²	174	133.9 Å²	133.9	81%	0.806	69%	0.689	S	S	*	*			trans	-65.4	4.9	175.9	-62.7	-67.9	0	0	0	113.4	V7 R11	V7-H9 PolarHBondContact O-CD2 3.44Å; V7-H9 PolarHBondContact O-N 3.04Å; H9-R11 PolarHBondContact O-N 2.91Å
10	R	80.9	Confident	75.6	Confident	185 Å²	185	135.2 Å²	135.2	70%	0.698	69%	0.689	S	S	*	*	S	Bend	trans	-68.3	115.2	172	-174.1	174.6	-63.6	-85.2	-2	109.4	D8 K12	D8-R10 PolarHBondContact O-N 3.28Å; D8-R10 WeakPolarHBondContact OD1-CB 3.42Å; R10-K12 PolarHBondContact O-N 3.33Å
11	R	80.9	Confident	76.5	Confident	197 Å²	197	133.2 Å²	133.2	74%	0.743	68%	0.68	S	S	*	*			trans	-60.4	97.2	173.4	-165.4	165.7	104.6	173.6	6.2	110	H9	H9-R11 PolarHBondContact O-N 2.91Å
12	K	83.1	Confident	79.1	Confident	136 Å²	136	124.5 Å²	124.5	59%	0.591	65%	0.646	S	S	*	*			trans	-78.4	125.4	174.7	-69.8	169.8	-171.2	173.4	0	107.3	D8 R10 D14	D8-K12 WeakPolarHBondContact OD2-CE 3.24Å; D8-K12 IonicContact OD2-NZ 2.82Å; D8-K12 PolarHBondContact OD2-NZ 3.26Å; R10-K12 PolarHBondContact O-N 3.33Å; K12-D14 PolarHBondContact O-N 3.43Å
13	W	84.1	Confident	81.2	Confident	153 Å²	153	123.1 Å²	123.1	58%	0.58	63%	0.63	S	S	*	*			trans	-79.8	115.6	173.4	-73.4	69.2	0	0	0	107.7	K15 F18	W13-K15 PolarHBondContact O-N 2.92Å; W13-F18 HydrophobicContact CB-CD2 4.26Å; W13-F18 HydrophobicContact CB-CE2 4.14Å; W13-F18 HydrophobicContact CD2-CD2 4.37Å; W13-F18 AromaticContact CD2-CE2 3.85Å; W13-F18 HydrophobicContact CD2-CE2 3.85Å; W13-F18 HydrophobicContact CD2-CZ 4.07Å; W13-F18 AromaticContact CE3-CD1 3.89Å; W13-F18 HydrophobicContact CE3-CD1 3.89Å; W13-F18 AromaticContact CE3-CD2 3.49Å; W13-F18 HydrophobicContact CE3-CD2 3.49Å; W13-F18 VanDerWaalsContact CE3-CD2 3.49Å; W13-F18 AromaticContact CE3-CE1 3.56Å; W13-F18 HydrophobicContact CE3-CE1 3.56Å; W13-F18 AromaticContact CE3-CE2 3.13Å; W13-F18 HydrophobicContact CE3-CE2 3.13Å; W13-F18 AromaticContact CE3-CG 3.87Å; W13-F18 HydrophobicContact CE3-CG 3.87Å; W13-F18 AromaticContact CE3-CZ 3.16Å; W13-F18 HydrophobicContact CE3-CZ 3.16Å; W13-F18 HydrophobicContact CG-CE2 4.3Å; W13-F18 HydrophobicContact CH2-CE1 4.3Å; W13-F18 HydrophobicContact CH2-CZ 4.2Å; W13-F18 AromaticContact CZ3-CD1 3.77Å; W13-F18 HydrophobicContact CZ3-CD1 3.77Å; W13-F18 HydrophobicContact CZ3-CD2 4.22Å; W13-F18 AromaticContact CZ3-CE1 3.24Å; W13-F18 HydrophobicContact CZ3-CE1 3.24Å; W13-F18 AromaticContact CZ3-CE2 3.76Å; W13-F18 HydrophobicContact CZ3-CE2 3.76Å; W13-F18 HydrophobicContact CZ3-CG 4.23Å; W13-F18 AromaticContact CZ3-CZ 3.24Å; W13-F18 HydrophobicContact CZ3-CZ 3.24Å
14	D	84.9	Confident	83.3	Confident	112 Å²	112	124.3 Å²	124.3	60%	0.599	62%	0.621	S	S	*	*			trans	-69.6	99	175.4	-68.7	-34.4	0	0	0	109.5	K12 A16 H17 F18	K12-D14 PolarHBondContact O-N 3.43Å; D14-A16 PolarHBondContact O-N 2.77Å; D14-A16 VanDerWaalsContact O-N 3.14Å; D14-H17 HydrophobicContact CB-CB 4.02Å; D14-H17 PolarHBondContact O-N 3.1Å; D14-F18 VanDerWaalsContact O-CD2 3.31Å; D14-F18 WeakPolarHBondContact O-CD2 3.23Å; D14-F18 PolarHBondContact O-N 3.42Å
15	K	88	Confident	85	Confident	181 Å²	181	125 Å²	125	79%	0.787	61%	0.613	S	S	*	*	H	α-helix	trans	-49.8	-43.1	-176	-64.7	-177	179.8	-169.8	0	112.1	W13 H17 F18 E19	W13-K15 PolarHBondContact O-N 2.92Å; K15-H17 PolarHBondContact O-N 3.06Å; K15-F18 PolarHBondContact O-N 3.45Å; K15-E19 WeakPolarHBondContact O-CB 2.99Å; K15-E19 PolarHBondContact O-N 2.91Å
16	A	91.9	Very high	86.5	Confident	60 Å²	60	122.4 Å²	122.4	50%	0.496	60%	0.598	S	S	.	*	H	α-helix	trans	-66.9	-34.9	-179.4	0	0	0	0	0	113.9	D14 K20	D14-A16 PolarHBondContact O-N 2.77Å; D14-A16 VanDerWaalsContact O-N 3.14Å; A16-K20 WeakPolarHBondContact O-CB 3.49Å; A16-K20 WeakPolarHBondContact O-CG 3.24Å; A16-K20 PolarHBondContact O-N 2.84Å
17	H	90.6	Very high	87.8	Confident	112 Å²	112	120.1 Å²	120.1	52%	0.519	59%	0.585	S	S	.	*	H	α-helix	trans	-68.8	-46.6	177.1	172.2	-94.5	0	0	0	110.6	D14 K15 K20 L21	D14-H17 HydrophobicContact CB-CB 4.02Å; D14-H17 PolarHBondContact O-N 3.1Å; K15-H17 PolarHBondContact O-N 3.06Å; H17-K20 PolarHBondContact O-N 3.43Å; H17-L21 WeakPolarHBondContact O-CB 3.5Å; H17-L21 PolarHBondContact O-N 2.84Å
18	F	92.3	Very high	88.9	Confident	80 Å²	80	118.6 Å²	118.6	35%	0.351	57%	0.573	S	S	.	*	H	α-helix	trans	-70.1	-33.1	178.1	-70.9	-74.5	0	0	0	112.7	W13 D14 K15 L21 A22	W13-F18 HydrophobicContact CB-CD2 4.26Å; W13-F18 HydrophobicContact CB-CE2 4.14Å; W13-F18 HydrophobicContact CD2-CD2 4.37Å; W13-F18 AromaticContact CD2-CE2 3.85Å; W13-F18 HydrophobicContact CD2-CE2 3.85Å; W13-F18 HydrophobicContact CD2-CZ 4.07Å; W13-F18 AromaticContact CE3-CD1 3.89Å; W13-F18 HydrophobicContact CE3-CD1 3.89Å; W13-F18 AromaticContact CE3-CD2 3.49Å; W13-F18 HydrophobicContact CE3-CD2 3.49Å; W13-F18 VanDerWaalsContact CE3-CD2 3.49Å; W13-F18 AromaticContact CE3-CE1 3.56Å; W13-F18 HydrophobicContact CE3-CE1 3.56Å; W13-F18 AromaticContact CE3-CE2 3.13Å; W13-F18 HydrophobicContact CE3-CE2 3.13Å; W13-F18 AromaticContact CE3-CG 3.87Å; W13-F18 HydrophobicContact CE3-CG 3.87Å; W13-F18 AromaticContact CE3-CZ 3.16Å; W13-F18 HydrophobicContact CE3-CZ 3.16Å; W13-F18 HydrophobicContact CG-CE2 4.3Å; W13-F18 HydrophobicContact CH2-CE1 4.3Å; W13-F18 HydrophobicContact CH2-CZ 4.2Å; W13-F18 AromaticContact CZ3-CD1 3.77Å; W13-F18 HydrophobicContact CZ3-CD1 3.77Å; W13-F18 HydrophobicContact CZ3-CD2 4.22Å; W13-F18 AromaticContact CZ3-CE1 3.24Å; W13-F18 HydrophobicContact CZ3-CE1 3.24Å; W13-F18 AromaticContact CZ3-CE2 3.76Å; W13-F18 HydrophobicContact CZ3-CE2 3.76Å; W13-F18 HydrophobicContact CZ3-CG 4.23Å; W13-F18 AromaticContact CZ3-CZ 3.24Å; W13-F18 HydrophobicContact CZ3-CZ 3.24Å; D14-F18 VanDerWaalsContact O-CD2 3.31Å; D14-F18 WeakPolarHBondContact O-CD2 3.23Å; D14-F18 PolarHBondContact O-N 3.42Å; K15-F18 PolarHBondContact O-N 3.45Å; F18-L21 PolarHBondContact O-N 3.02Å; F18-A22 WeakPolarHBondContact O-CB 3.19Å; F18-A22 PolarHBondContact O-N 3.4Å
19	E	93	Very high	90.1	Very high	137 Å²	137	119.9 Å²	119.9	64%	0.64	58%	0.576	S	S	*	*	H	α-helix	trans	-63.9	-45.3	172.5	-178.2	175.9	-163.4	0	0	111.6	K15 A22 S23	K15-E19 WeakPolarHBondContact O-CB 2.99Å; K15-E19 PolarHBondContact O-N 2.91Å; E19-A22 PolarHBondContact O-N 3.43Å; E19-S23 VanDerWaalsContact O-CB 3.32Å; E19-S23 WeakPolarHBondContact O-CB 3.43Å; E19-S23 PolarHBondContact O-N 3.32Å
20	K	94.1	Very high	90.7	Very high	159 Å²	159	116.5 Å²	116.5	69%	0.691	56%	0.564	S	S	*	*	H	α-helix	trans	-62.1	-45.7	173.8	-76.2	-179.8	-178.8	-176.7	0	112.2	A16 H17 A22 S23 D24	A16-K20 WeakPolarHBondContact O-CB 3.49Å; A16-K20 WeakPolarHBondContact O-CG 3.24Å; A16-K20 PolarHBondContact O-N 2.84Å; H17-K20 PolarHBondContact O-N 3.43Å; K20-A22 VanDerWaalsContact C-N 3.34Å; K20-A22 PolarHBondContact O-N 3.21Å; K20-S23 PolarHBondContact O-N 3.1Å; K20-D24 WeakPolarHBondContact O-CB 3.47Å; K20-D24 PolarHBondContact O-N 2.9Å
21	L	94.4	Very high	91.2	Very high	95 Å²	95	112.6 Å²	112.6	50%	0.497	55%	0.553	S	S	.	*	H	α-helix	trans	-63.6	-39.9	177.9	-176.4	64.7	0	0	0	112	H17 F18 K25	H17-L21 WeakPolarHBondContact O-CB 3.5Å; H17-L21 PolarHBondContact O-N 2.84Å; F18-L21 PolarHBondContact O-N 3.02Å; L21-K25 WeakPolarHBondContact O-CB 3.26Å; L21-K25 PolarHBondContact O-N 3.12Å
22	A	94	Very high	91.7	Very high	60 Å²	60	106.1 Å²	106.1	50%	0.496	54%	0.542	S	S	.	.	H	α-helix	trans	-66	-42.7	175.2	0	0	0	0	0	111.6	F18 E19 K20 K25 L26	F18-A22 WeakPolarHBondContact O-CB 3.19Å; F18-A22 PolarHBondContact O-N 3.4Å; E19-A22 PolarHBondContact O-N 3.43Å; K20-A22 VanDerWaalsContact C-N 3.34Å; K20-A22 PolarHBondContact O-N 3.21Å; A22-K25 PolarHBondContact O-N 3.21Å; A22-L26 WeakPolarHBondContact O-CB 3.39Å; A22-L26 PolarHBondContact O-N 3.08Å
23	S	94	Very high	91.9	Very high	75 Å²	75	105 Å²	105	52%	0.524	54%	0.54	S	S	.	.	H	α-helix	trans	-64.6	-41.1	176.2	-173.7	0	0	0	0	112.2	E19 K20 L26 S27	E19-S23 VanDerWaalsContact O-CB 3.32Å; E19-S23 WeakPolarHBondContact O-CB 3.43Å; E19-S23 PolarHBondContact O-N 3.32Å; K20-S23 PolarHBondContact O-N 3.1Å; S23-L26 PolarHBondContact O-N 2.82Å; S23-S27 WeakPolarHBondContact O-CB 3.32Å; S23-S27 PolarHBondContact O-N 3.24Å
24	D	95.3	Very high	92	Very high	88 Å²	88	106.7 Å²	106.7	47%	0.471	55%	0.546	S	S	.	.	H	α-helix	trans	-64.8	-46	177	-177.4	74	0	0	0	111.1	K20 L26 S27 N28	K20-D24 WeakPolarHBondContact O-CB 3.47Å; K20-D24 PolarHBondContact O-N 2.9Å; D24-L26 VanDerWaalsContact C-N 3.33Å; D24-L26 PolarHBondContact O-N 3.36Å; D24-S27 WeakPolarHBondContact O-CB 3.37Å; D24-S27 PolarHBondContact O-N 2.81Å; D24-N28 WeakPolarHBondContact O-CB 3.38Å; D24-N28 VanDerWaalsContact O-CG 3.28Å; D24-N28 PolarHBondContact O-N 3.26Å; D24-N28 PolarHBondContact O-ND2 2.87Å; D24-N28 PolarHBondContact OD2-ND2 3.13Å
25	K	94.5	Very high	92	Very high	150 Å²	150	105.1 Å²	105.1	65%	0.652	54%	0.538	S	S	*	.	H	α-helix	trans	-59.9	-43.7	175.3	-167.2	178.1	-177	-178.9	0	112	L21 A22 N28 E29	L21-K25 WeakPolarHBondContact O-CB 3.26Å; L21-K25 PolarHBondContact O-N 3.12Å; A22-K25 PolarHBondContact O-N 3.21Å; K25-N28 PolarHBondContact O-N 2.96Å; K25-E29 WeakPolarHBondContact O-CB 3.33Å; K25-E29 PolarHBondContact O-N 3.32Å
26	L	94.4	Very high	91.7	Very high	103 Å²	103	98.5 Å²	98.5	54%	0.539	52%	0.517	S	S	.	.	H	α-helix	trans	-63.7	-41.4	176.3	-178	65.7	0	0	0	111.7	A22 S23 D24 E29 L30	A22-L26 WeakPolarHBondContact O-CB 3.39Å; A22-L26 PolarHBondContact O-N 3.08Å; S23-L26 PolarHBondContact O-N 2.82Å; D24-L26 VanDerWaalsContact C-N 3.33Å; D24-L26 PolarHBondContact O-N 3.36Å; L26-E29 PolarHBondContact O-N 3.16Å; L26-L30 HydrophobicContact CG-CD1 4.34Å; L26-L30 WeakPolarHBondContact O-CB 3.47Å; L26-L30 PolarHBondContact O-N 3.1Å
27	S	93.8	Very high	91	Very high	65 Å²	65	104.4 Å²	104.4	46%	0.455	53%	0.526	S	S	.	.	H	α-helix	trans	-62.8	-46.4	176.6	-175.2	0	0	0	0	111.5	S23 D24 E29 L30 E31	S23-S27 WeakPolarHBondContact O-CB 3.32Å; S23-S27 PolarHBondContact O-N 3.24Å; D24-S27 WeakPolarHBondContact O-CB 3.37Å; D24-S27 PolarHBondContact O-N 2.81Å; S27-E29 VanDerWaalsContact C-N 3.34Å; S27-E29 PolarHBondContact O-N 3.05Å; S27-L30 PolarHBondContact O-N 3.12Å; S27-E31 WeakPolarHBondContact O-CB 3.24Å; S27-E31 PolarHBondContact O-N 3.31Å
28	N	94.1	Very high	90.3	Very high	80 Å²	80	105.4 Å²	105.4	43%	0.428	53%	0.529	S	S	.	.	H	α-helix	trans	-63.2	-39.5	177.8	-70.6	-30.1	0	0	0	112	D24 K25 E31 A32	D24-N28 WeakPolarHBondContact O-CB 3.38Å; D24-N28 VanDerWaalsContact O-CG 3.28Å; D24-N28 PolarHBondContact O-N 3.26Å; D24-N28 PolarHBondContact O-ND2 2.87Å; D24-N28 PolarHBondContact OD2-ND2 3.13Å; K25-N28 PolarHBondContact O-N 2.96Å; N28-E31 PolarHBondContact O-N 2.87Å; N28-A32 WeakPolarHBondContact O-CB 3.49Å; N28-A32 PolarHBondContact O-N 3.1Å
29	E	94.1	Very high	89.1	Confident	115 Å²	115	108 Å²	108	54%	0.537	54%	0.542	S	S	.	.	H	α-helix	trans	-65.6	-43.1	174.7	-173.2	176.8	172.8	0	0	112	K25 L26 S27 A32 M33	K25-E29 WeakPolarHBondContact O-CB 3.33Å; K25-E29 PolarHBondContact O-N 3.32Å; L26-E29 PolarHBondContact O-N 3.16Å; S27-E29 VanDerWaalsContact C-N 3.34Å; S27-E29 PolarHBondContact O-N 3.05Å; E29-A32 PolarHBondContact O-N 2.77Å; E29-M33 WeakPolarHBondContact O-CG 3.24Å; E29-M33 PolarHBondContact O-N 3.35Å
30	L	93.2	Very high	87.7	Confident	104 Å²	104	109 Å²	109	55%	0.545	55%	0.545	S	S	.	.	H	α-helix	trans	-61.9	-41.8	174	-96.3	161.8	0	0	0	112.2	L26 S27 M33 R34	L26-L30 HydrophobicContact CG-CD1 4.34Å; L26-L30 WeakPolarHBondContact O-CB 3.47Å; L26-L30 PolarHBondContact O-N 3.1Å; S27-L30 PolarHBondContact O-N 3.12Å; L30-M33 HydrophobicContact CD2-CE 4.44Å; L30-M33 PolarHBondContact O-N 2.86Å; L30-R34 WeakPolarHBondContact O-CB 3.37Å; L30-R34 PolarHBondContact O-N 3.22Å
31	E	91.4	Very high	86.2	Confident	103 Å²	103	108.4 Å²	108.4	48%	0.481	54%	0.544	S	S	.	.	H	α-helix	trans	-67.8	-42.1	177.8	-169.6	175.6	174.1	0	0	111.4	S27 N28 M33 R34 N35	S27-E31 WeakPolarHBondContact O-CB 3.24Å; S27-E31 PolarHBondContact O-N 3.31Å; N28-E31 PolarHBondContact O-N 2.87Å; E31-M33 PolarHBondContact O-N 2.7Å; E31-R34 PolarHBondContact O-N 2.85Å; E31-N35 WeakPolarHBondContact O-CB 3.37Å; E31-N35 VanDerWaalsContact O-CG 3.28Å; E31-N35 PolarHBondContact O-N 3.24Å
32	A	90.8	Very high	84.4	Confident	60 Å²	60	108 Å²	108	50%	0.496	55%	0.545	S	S	.	.	H	α-helix	trans	-60.1	-43.8	173.8	0	0	0	0	0	111.8	N28 E29 R34 N35 A36	N28-A32 WeakPolarHBondContact O-CB 3.49Å; N28-A32 PolarHBondContact O-N 3.1Å; E29-A32 PolarHBondContact O-N 2.77Å; A32-R34 PolarHBondContact O-N 2.94Å; A32-N35 PolarHBondContact O-N 3.41Å; A32-A36 WeakPolarHBondContact O-CB 3.33Å; A32-A36 PolarHBondContact O-N 3.06Å
33	M	87.1	Confident	82.7	Confident	114 Å²	114	111.7 Å²	111.7	56%	0.562	55%	0.554	S	S	*	*	H	α-helix	trans	-63.6	-39.5	174.2	-75.3	-158.6	-73.4	0	0	112.5	E29 L30 E31 R37	E29-M33 WeakPolarHBondContact O-CG 3.24Å; E29-M33 PolarHBondContact O-N 3.35Å; L30-M33 HydrophobicContact CD2-CE 4.44Å; L30-M33 PolarHBondContact O-N 2.86Å; E31-M33 PolarHBondContact O-N 2.7Å; M33-R37 WeakPolarHBondContact O-CB 3.43Å; M33-R37 PolarHBondContact O-N 2.83Å
34	R	86.8	Confident	80.9	Confident	188 Å²	188	117.4 Å²	117.4	71%	0.709	57%	0.57	S	S	*	*	H	α-helix	trans	-66.3	-43.1	177.2	-173.9	-179.5	-176.6	174.6	1	111.6	L30 E31 A32 R37 K38	L30-R34 WeakPolarHBondContact O-CB 3.37Å; L30-R34 PolarHBondContact O-N 3.22Å; E31-R34 PolarHBondContact O-N 2.85Å; A32-R34 PolarHBondContact O-N 2.94Å; R34-R37 PolarHBondContact O-N 2.88Å; R34-K38 WeakPolarHBondContact O-CB 3.47Å; R34-K38 PolarHBondContact O-N 2.77Å
35	N	84.6	Confident	79.3	Confident	79 Å²	79	117.9 Å²	117.9	42%	0.422	57%	0.568	S	S	.	*	H	α-helix	trans	-67.1	-43.9	178.7	-72.1	-15.7	0	0	0	111	E31 A32 R37 K38 E39	E31-N35 WeakPolarHBondContact O-CB 3.37Å; E31-N35 VanDerWaalsContact O-CG 3.28Å; E31-N35 PolarHBondContact O-N 3.24Å; A32-N35 PolarHBondContact O-N 3.41Å; N35-R37 VanDerWaalsContact C-N 3.27Å; N35-R37 PolarHBondContact O-N 3.47Å; N35-K38 PolarHBondContact O-N 2.81Å; N35-K38 VanDerWaalsContact O-N 3.12Å; N35-E39 WeakPolarHBondContact O-CB 3.03Å; N35-E39 PolarHBondContact O-N 2.86Å
36	A	81.6	Confident	77.8	Confident	41 Å²	41	115.6 Å²	115.6	34%	0.339	56%	0.559	S	S	.	*	H	α-helix	trans	-60.7	-35	173.7	0	0	0	0	0	112.7	A32 K40	A32-A36 WeakPolarHBondContact O-CB 3.33Å; A32-A36 PolarHBondContact O-N 3.06Å; A36-K40 WeakPolarHBondContact O-CD 3.29Å; A36-K40 VanDerWaalsContact O-CG 3.23Å; A36-K40 WeakPolarHBondContact O-CG 3.3Å; A36-K40 PolarHBondContact O-N 3.4Å
37	R	77.9	Confident	76.5	Confident	185 Å²	185	117 Å²	117	70%	0.698	56%	0.558	S	S	*	*	H	α-helix	trans	-70	-43.4	173.2	-178.3	178.1	173.2	176.7	-0.6	111.7	M33 R34 N35 K40 E41	M33-R37 WeakPolarHBondContact O-CB 3.43Å; M33-R37 PolarHBondContact O-N 2.83Å; R34-R37 PolarHBondContact O-N 2.88Å; N35-R37 VanDerWaalsContact C-N 3.27Å; N35-R37 PolarHBondContact O-N 3.47Å; R37-K40 PolarHBondContact O-N 2.95Å; R37-E41 PolarHBondContact O-N 2.87Å; R37-E41 VanDerWaalsContact O-N 3.1Å
38	K	74.5	Confident	75.1	Confident	133 Å²	133	117.3 Å²	117.3	58%	0.578	55%	0.554	S	S	*	*	H	α-helix	trans	-65.9	-43.3	-179.5	-169.2	179.2	179.3	-172.7	0	111.3	R34 N35 K40 E41 T42	R34-K38 WeakPolarHBondContact O-CB 3.47Å; R34-K38 PolarHBondContact O-N 2.77Å; N35-K38 PolarHBondContact O-N 2.81Å; N35-K38 VanDerWaalsContact O-N 3.12Å; K38-K40 VanDerWaalsContact C-N 3.33Å; K38-K40 PolarHBondContact O-N 3.49Å; K38-E41 CarbonylContact O-C 3.56Å; K38-E41 WeakPolarHBondContact O-CA 3.4Å; K38-E41 PolarHBondContact O-N 3.44Å; K38-T42 HydrophobicContact CG-CG2 4.2Å; K38-T42 WeakPolarHBondContact O-CG2 3.34Å; K38-T42 PolarHBondContact O-N 2.87Å; K38-T42 PolarHBondContact O-OG1 2.92Å; K38-T42 VanDerWaalsContact O-OG1 3.09Å
39	E	66.8	Low	73.8	Confident	133 Å²	133	120.4 Å²	120.4	62%	0.621	56%	0.564	S	S	*	*	H	α-helix	trans	-57.8	-45.6	176	-170.5	-179.2	176.1	0	0	111.4	N35 E41 T42 M43	N35-E39 WeakPolarHBondContact O-CB 3.03Å; N35-E39 PolarHBondContact O-N 2.86Å; E39-E41 VanDerWaalsContact C-N 3.25Å; E39-E41 PolarHBondContact O-N 3.42Å; E39-T42 WeakPolarHBondContact CA-OG1 3.34Å; E39-T42 PolarHBondContact O-N 2.87Å; E39-T42 PolarHBondContact O-OG1 3.46Å; E39-M43 PolarHBondContact O-N 3.3Å
40	K	64.9	Low	72.5	Confident	160 Å²	160	119.2 Å²	119.2	70%	0.696	57%	0.574	S	S	*	*	H	α-helix	trans	-62.4	-28.3	173.9	-72.2	173.8	-175.3	-179.5	0	113.7	A36 R37 K38	A36-K40 WeakPolarHBondContact O-CD 3.29Å; A36-K40 VanDerWaalsContact O-CG 3.23Å; A36-K40 WeakPolarHBondContact O-CG 3.3Å; A36-K40 PolarHBondContact O-N 3.4Å; R37-K40 PolarHBondContact O-N 2.95Å; K38-K40 VanDerWaalsContact C-N 3.33Å; K38-K40 PolarHBondContact O-N 3.49Å
41	E	62.2	Low	71.3	Confident	145 Å²	145	118.9 Å²	118.9	68%	0.678	57%	0.565	S	S	*	*	H	α-helix	trans	-85.6	-33.9	178.3	-171.2	168.3	-171.9	0	0	112.4	R37 K38 E39 M43	R37-E41 PolarHBondContact O-N 2.87Å; R37-E41 VanDerWaalsContact O-N 3.1Å; K38-E41 CarbonylContact O-C 3.56Å; K38-E41 WeakPolarHBondContact O-CA 3.4Å; K38-E41 PolarHBondContact O-N 3.44Å; E39-E41 VanDerWaalsContact C-N 3.25Å; E39-E41 PolarHBondContact O-N 3.42Å; E41-M43 VanDerWaalsContact C-N 3.3Å; E41-M43 PolarHBondContact O-N 2.89Å
42	T	56.3	Low	70.2	Confident	86 Å²	86	121.8 Å²	121.8	53%	0.528	58%	0.584	S	S	.	*	H	α-helix	trans	-75.9	-12.7	-178.7	50.8	0	0	0	0	114.5	K38 E39 K44	K38-T42 HydrophobicContact CG-CG2 4.2Å; K38-T42 WeakPolarHBondContact O-CG2 3.34Å; K38-T42 PolarHBondContact O-N 2.87Å; K38-T42 PolarHBondContact O-OG1 2.92Å; K38-T42 VanDerWaalsContact O-OG1 3.09Å; E39-T42 WeakPolarHBondContact CA-OG1 3.34Å; E39-T42 PolarHBondContact O-N 2.87Å; E39-T42 PolarHBondContact O-OG1 3.46Å; T42-K44 PolarHBondContact O-N 3.5Å
43	M	58.7	Low	69.3	Low	138 Å²	138	126.1 Å²	126.1	68%	0.68	59%	0.589	S	S	*	*	S	Bend	trans	-66.1	87.2	163.2	-67	-143.4	-118.6	0	0	108.2	E39 E41 K45	E39-M43 PolarHBondContact O-N 3.3Å; E41-M43 VanDerWaalsContact C-N 3.3Å; E41-M43 PolarHBondContact O-N 2.89Å; M43-K45 PolarHBondContact O-N 3.4Å
44	K	56.6	Low	68.5	Low	195 Å²	195	126.9 Å²	126.9	85%	0.848	60%	0.6	S	S	*	*			trans	-54.4	101.4	176.2	-69.8	175.2	-178.1	174.7	0	107.5	T42 E46	T42-K44 PolarHBondContact O-N 3.5Å; K44-E46 PolarHBondContact O-N 3.44Å
45	K	60	Low	67.7	Low	98 Å²	98	119.5 Å²	119.5	43%	0.426	57%	0.574	S	S	.	*	P	Polyproline II helix	trans	-62.1	126.1	-179.3	-65.8	-179.4	-171.7	179.1	0	108.8	M43 G108	M43-K45 PolarHBondContact O-N 3.4Å; K45-G108 CarbonylContact C-O 3.58Å; K45-G108 WeakPolarHBondContact CA-O 3.38Å; K45-G108 VanDerWaalsContact CB-O 3.26Å; K45-G108 WeakPolarHBondContact CB-O 3.41Å
46	E	63.3	Low	67	Low	102 Å²	102	119.9 Å²	119.9	48%	0.477	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-60.3	151.6	178.5	-65	-163.8	170.8	0	0	110.3	K44 K49 G108 M109 S110	K44-E46 PolarHBondContact O-N 3.44Å; E46-K49 IonicContact OE2-NZ 2.79Å; E46-K49 PolarHBondContact OE2-NZ 2.85Å; E46-G108 PolarHBondContact N-O 3.2Å; E46-M109 HydrophobicContact CB-CG 4.44Å; E46-M109 CarbonylContact O-C 3.56Å; E46-M109 WeakPolarHBondContact O-CA 3.3Å; E46-S110 PolarHBondContact O-N 3.23Å; E46-S110 PolarHBondContact O-OG 3.46Å
47	Y	67.2	Low	66.3	Low	132 Å²	132	119.2 Å²	119.2	52%	0.518	57%	0.567	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-63.7	150.1	173.8	-65.4	-75.8	0	0	0	110.2	K49 R112 K114	Y47-K49 PolarHBondContact O-N 2.91Å; Y47-R112 WeakPolarHBondContact CD1-O 3.27Å; Y47-K114 HydrophobicContact CD1-CB 4.15Å; Y47-K114 HydrophobicContact CE1-CB 4.43Å; Y47-K114 HydrophobicContact CG-CB 4.3Å
48	L	65	Low	66	Low	72 Å²	72	117.8 Å²	117.8	38%	0.377	57%	0.568	S	S	.	*			trans	-56.6	110.2	176.1	-175.2	63.6	0	0	0	110.4	Q104 S110 I113	L48-Q104 HydrophobicContact CD1-CG 4.49Å; L48-S110 PolarHBondContact N-O 3.04Å; L48-I113 HydrophobicContact CB-CG1 4.43Å; L48-I113 HydrophobicContact CD2-CD1 4.32Å; L48-I113 HydrophobicContact CD2-CG1 4.01Å
49	K	66.3	Low	65.7	Low	146 Å²	146	114.1 Å²	114.1	64%	0.635	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-93	147	170.4	-69.6	171.1	-179.4	159.4	0	109.2	E46 Y47	E46-K49 IonicContact OE2-NZ 2.79Å; E46-K49 PolarHBondContact OE2-NZ 2.85Å; Y47-K49 PolarHBondContact O-N 2.91Å
50	A	68.3	Low	65.8	Low	89 Å²	89	112 Å²	112	74%	0.736	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-67.2	145.4	167.4	0	0	0	0	0	108.9
51	R	66.2	Low	66	Low	97 Å²	97	109.5 Å²	109.5	37%	0.366	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-74.1	134.8	177.2	-173.8	177	68.9	-146.9	1	110.1	Y53 I55	R51-Y53 HydrophobicContact CG-CD1 3.89Å; R51-Y53 HydrophobicContact CG-CD2 4.37Å; R51-Y53 HydrophobicContact CG-CE1 3.79Å; R51-Y53 HydrophobicContact CG-CE2 4.29Å; R51-Y53 HydrophobicContact CG-CG 4.18Å; R51-Y53 PolarHBondContact NE-O 3.4Å; R51-I55 VanDerWaalsContact CZ-CG1 3.43Å
52	D	68.8	Low	66.3	Low	165 Å²	165	111 Å²	111	88%	0.882	56%	0.559	S	S	*	*	S	Bend	trans	-83.9	-22.8	-176.9	-58.8	-43.1	0	0	0	113.8
53	Y	71.9	Confident	67.2	Low	151 Å²	151	113.7 Å²	113.7	59%	0.592	56%	0.563	S	S	*	*	S	Bend	trans	-106.7	141.2	-179.7	59.8	-88.1	0	0	0	112.6	R51 I55	R51-Y53 HydrophobicContact CG-CD1 3.89Å; R51-Y53 HydrophobicContact CG-CD2 4.37Å; R51-Y53 HydrophobicContact CG-CE1 3.79Å; R51-Y53 HydrophobicContact CG-CE2 4.29Å; R51-Y53 HydrophobicContact CG-CG 4.18Å; R51-Y53 PolarHBondContact NE-O 3.4Å; Y53-I55 HydrophobicContact CD2-CG1 4.26Å; Y53-I55 HydrophobicContact CE2-CG1 4.01Å
54	T	70.2	Confident	67.8	Low	129 Å²	129	113.3 Å²	113.3	79%	0.791	57%	0.574	S	S	*	*			trans	-73.4	131	167.1	47.7	0	0	0	0	108.5	D56	T54-D56 PolarHBondContact O-N 2.85Å
55	I	70.4	Confident	68.5	Low	34 Å²	34	110.6 Å²	110.6	17%	0.174	56%	0.564	C	S	.	*			trans	-80.6	108.6	170.8	-66.9	179.7	0	0	0	105.9	R51 Y53 L57 Y94 L95 I98	R51-I55 VanDerWaalsContact CZ-CG1 3.43Å; Y53-I55 HydrophobicContact CD2-CG1 4.26Å; Y53-I55 HydrophobicContact CE2-CG1 4.01Å; I55-L57 HydrophobicContact CG2-CD1 4.32Å; I55-L57 HydrophobicContact CG2-CD2 4.01Å; I55-L57 HydrophobicContact CG2-CG 3.84Å; I55-L57 PolarHBondContact O-N 2.87Å; I55-Y94 HydrophobicContact CD1-CD1 4.44Å; I55-Y94 HydrophobicContact CD1-CE1 3.91Å; I55-Y94 HydrophobicContact CG2-CD1 4.21Å; I55-Y94 HydrophobicContact CG2-CE1 3.79Å; I55-L95 HydrophobicContact CB-CD2 4.36Å; I55-L95 HydrophobicContact CD1-CD2 4.08Å; I55-I98 HydrophobicContact CD1-CD1 3.23Å
56	D	69.6	Low	69.2	Low	86 Å²	86	113 Å²	113	46%	0.46	59%	0.586	S	S	.	*			trans	-75.3	91.1	176.8	178.5	21.8	0	0	0	110	T54 E58 S59	T54-D56 PolarHBondContact O-N 2.85Å; D56-E58 VanDerWaalsContact C-N 3.28Å; D56-E58 WeakPolarHBondContact OD1-CB 3.31Å; D56-E58 PolarHBondContact OD1-N 3.44Å; D56-S59 PolarHBondContact OD1-N 3.44Å; D56-S59 VanDerWaalsContact OD1-N 3.14Å; D56-S59 WeakPolarHBondContact OD2-CB 3.33Å; D56-S59 PolarHBondContact OD2-OG 2.97Å
57	L	68	Low	69.4	Low	27 Å²	27	111.7 Å²	111.7	14%	0.141	58%	0.582	C	S	.	*			trans	-85.4	-8	172.1	-60.9	149	0	0	0	110.9	I55 Y79 Y94 L95	I55-L57 HydrophobicContact CG2-CD1 4.32Å; I55-L57 HydrophobicContact CG2-CD2 4.01Å; I55-L57 HydrophobicContact CG2-CG 3.84Å; I55-L57 PolarHBondContact O-N 2.87Å; L57-Y79 HydrophobicContact CD2-CD1 3.67Å; L57-Y79 HydrophobicContact CD2-CD2 4.33Å; L57-Y79 HydrophobicContact CD2-CE1 3.18Å; L57-Y79 HydrophobicContact CD2-CE2 3.93Å; L57-Y79 HydrophobicContact CD2-CG 4.22Å; L57-Y79 HydrophobicContact CG-CE1 4.4Å; L57-Y94 HydrophobicContact CD2-CD1 4.09Å; L57-L95 HydrophobicContact CD1-CD1 4Å; L57-L95 HydrophobicContact CD1-CD2 4.29Å; L57-L95 HydrophobicContact CD1-CG 4.1Å
58	E	70.7	Confident	69.7	Low	155 Å²	155	108.3 Å²	108.3	72%	0.724	58%	0.582	S	S	*	*	S	Bend	trans	-84.1	-36.3	-171.7	-62.7	-174.5	163.9	0	0	111.8	D56 N60 L61	D56-E58 VanDerWaalsContact C-N 3.28Å; D56-E58 WeakPolarHBondContact OD1-CB 3.31Å; D56-E58 PolarHBondContact OD1-N 3.44Å; E58-N60 PolarHBondContact O-N 2.85Å; E58-N60 VanDerWaalsContact O-N 3.1Å; E58-L61 HydrophobicContact CB-CD1 4.41Å; E58-L61 VanDerWaalsContact O-CB 3.27Å; E58-L61 WeakPolarHBondContact O-CB 3.06Å; E58-L61 WeakPolarHBondContact O-CG 3.46Å; E58-L61 PolarHBondContact O-N 3.49Å
59	S	68.9	Low	70	Confident	56 Å²	56	114.6 Å²	114.6	39%	0.392	61%	0.606	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.4	-12.7	-179.9	59.7	0	0	0	0	115.1	D56 K63	D56-S59 PolarHBondContact OD1-N 3.44Å; D56-S59 VanDerWaalsContact OD1-N 3.14Å; D56-S59 WeakPolarHBondContact OD2-CB 3.33Å; D56-S59 PolarHBondContact OD2-OG 2.97Å; S59-K63 WeakPolarHBondContact O-CE 3.38Å; S59-K63 PolarHBondContact O-NZ 3.41Å
60	N	69.1	Low	70.3	Confident	90 Å²	90	114.3 Å²	114.3	48%	0.481	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.3	-5.2	173.3	-67.9	-60.1	0	0	0	113.3	E58	E58-N60 PolarHBondContact O-N 2.85Å; E58-N60 VanDerWaalsContact O-N 3.1Å
61	L	68.1	Low	70.4	Confident	107 Å²	107	111.5 Å²	111.5	56%	0.56	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	138.9	171.5	-56.4	175.7	0	0	0	109	E58 K63	E58-L61 HydrophobicContact CB-CD1 4.41Å; E58-L61 VanDerWaalsContact O-CB 3.27Å; E58-L61 WeakPolarHBondContact O-CB 3.06Å; E58-L61 WeakPolarHBondContact O-CG 3.46Å; E58-L61 PolarHBondContact O-N 3.49Å; L61-K63 PolarHBondContact O-N 3.45Å
62	N	69.6	Low	70.8	Confident	176 Å²	176	111.7 Å²	111.7	94%	0.941	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	72	10.2	-178.9	-49.3	-45.1	0	0	0	117.5
63	K	73.6	Confident	70.8	Confident	143 Å²	143	105.2 Å²	105.2	62%	0.622	58%	0.582	S	S	*	*			trans	-98.1	121.7	170.1	-65.5	174.1	-177.8	160.2	0	110.2	S59 L61	S59-K63 WeakPolarHBondContact O-CE 3.38Å; S59-K63 PolarHBondContact O-NZ 3.41Å; L61-K63 PolarHBondContact O-N 3.45Å
64	S	71.5	Confident	70.6	Confident	129 Å²	129	101.8 Å²	101.8	90%	0.902	58%	0.58	S	S	*	*			trans	-89.5	115.5	170.2	52	0	0	0	0	109.7
65	Q	71.2	Confident	70.5	Confident	139 Å²	139	98.3 Å²	98.3	65%	0.65	56%	0.561	S	S	*	*			trans	-109.5	132.1	176	-168.6	172.9	35.4	0	0	109.9	I67	Q65-I67 VanDerWaalsContact O-CD1 3.27Å; Q65-I67 WeakPolarHBondContact O-CD1 3.24Å; Q65-I67 PolarHBondContact O-N 3.19Å
66	V	75.8	Confident	70.7	Confident	147 Å²	147	100.4 Å²	100.4	89%	0.891	57%	0.57	S	S	*	*			trans	-76.6	108.1	173.8	-179.8	0	0	0	0	108.6
67	I	68.1	Low	71.1	Confident	76 Å²	76	98.6 Å²	98.6	39%	0.39	57%	0.567	S	S	.	*			trans	-88	117.6	-178.8	-59.3	113.9	0	0	0	110.3	Q65 A77	Q65-I67 VanDerWaalsContact O-CD1 3.27Å; Q65-I67 WeakPolarHBondContact O-CD1 3.24Å; Q65-I67 PolarHBondContact O-N 3.19Å; I67-A77 HydrophobicContact CD1-CB 3.64Å; I67-A77 HydrophobicContact CG1-CB 3.82Å; I67-A77 HydrophobicContact CG2-CB 4.27Å
68	A	73.5	Confident	71.8	Confident	61 Å²	61	99.1 Å²	99.1	50%	0.504	58%	0.579	S	S	.	*			trans	-80.2	124.2	166.1	0	0	0	0	0	109.7	T70 G71	A68-T70 PolarHBondContact O-N 3.26Å; A68-G71 PolarHBondContact O-N 2.81Å
69	K	69.6	Low	72.4	Confident	203 Å²	203	94 Å²	94	88%	0.883	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	-17.1	-176.5	-65.9	-176.4	-179.7	179.8	0	114.5
70	T	73.6	Confident	73.1	Confident	140 Å²	140	94.9 Å²	94.9	86%	0.859	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.7	8.7	-171.8	48.1	0	0	0	0	113.7	A68	A68-T70 PolarHBondContact O-N 3.26Å
71	G	69.6	Low	73.9	Confident	30 Å²	30	90.7 Å²	90.7	31%	0.309	53%	0.526	S	S	.	.	S	Bend	trans	-75.6	167.8	175.8	0	0	0	0	0	113.1	A68 G73	A68-G71 PolarHBondContact O-N 2.81Å; G71-G73 PolarHBondContact O-N 3.48Å
72	P	74.4	Confident	74.6	Confident	102 Å²	102	93.3 Å²	93.3	66%	0.662	54%	0.536	S	S	*	.			trans	-49	140.6	171.2	-23.1	32.4	0	0	0	110.3	S74 S75	P72-S74 PolarHBondContact O-N 3.12Å; P72-S75 PolarHBondContact O-N 2.61Å
73	G	68.6	Low	75.2	Confident	29 Å²	29	87.1 Å²	87.1	30%	0.299	51%	0.505	S	S	.	.	G	3₁₀ helix	trans	-53.1	-23.2	-173.4	0	0	0	0	0	114.7	G71 S75 Q76 V87	G71-G73 PolarHBondContact O-N 3.48Å; G73-S75 VanDerWaalsContact C-N 3.27Å; G73-S75 PolarHBondContact O-N 2.82Å; G73-Q76 WeakPolarHBondContact O-CB 3.21Å; G73-Q76 PolarHBondContact O-N 3.39Å; G73-V87 WeakPolarHBondContact O-CG2 3.23Å
74	S	68.3	Low	75.7	Confident	78 Å²	78	80.7 Å²	80.7	55%	0.545	48%	0.478	S	S	.	.	G	3₁₀ helix	trans	-60.3	-30.7	172.3	174.8	0	0	0	0	114.1	P72	P72-S74 PolarHBondContact O-N 3.12Å
75	S	68.2	Low	76.2	Confident	56 Å²	56	80.2 Å²	80.2	39%	0.392	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-95.8	2.9	178.9	-49.9	0	0	0	0	113.4	P72 G73	P72-S75 PolarHBondContact O-N 2.61Å; G73-S75 VanDerWaalsContact C-N 3.27Å; G73-S75 PolarHBondContact O-N 2.82Å
76	Q	75.5	Confident	76.8	Confident	79 Å²	79	75.3 Å²	75.3	37%	0.369	45%	0.445	S	S	.	.	S	Bend	trans	-76.7	150.3	174.8	-170.1	178.5	-53.2	0	0	110	G73 G78 V87	G73-Q76 WeakPolarHBondContact O-CB 3.21Å; G73-Q76 PolarHBondContact O-N 3.39Å; Q76-G78 PolarHBondContact O-N 2.87Å; Q76-V87 HydrophobicContact CB-CG1 4.08Å; Q76-V87 HydrophobicContact CB-CG2 4.12Å; Q76-V87 HydrophobicContact CG-CG1 4.23Å
77	A	77.2	Confident	77.2	Confident	47 Å²	47	70.1 Å²	70.1	39%	0.388	41%	0.414	S	S	.	.	S	Bend	trans	-54.4	109.7	176.5	0	0	0	0	0	111.5	I67	I67-A77 HydrophobicContact CD1-CB 3.64Å; I67-A77 HydrophobicContact CG1-CB 3.82Å; I67-A77 HydrophobicContact CG2-CB 4.27Å
78	G	81.8	Confident	78	Confident	39 Å²	39	67 Å²	67	40%	0.402	40%	0.398	S	S	.	.	S	Bend	trans	140.4	-171.9	176.5	0	0	0	0	0	113.7	Q76 V88	Q76-G78 PolarHBondContact O-N 2.87Å; G78-V88 CarbonylContact C-O 3.6Å; G78-V88 VanDerWaalsContact CA-O 3.29Å; G78-V88 WeakPolarHBondContact CA-O 3.37Å
79	Y	83.4	Confident	78.5	Confident	48 Å²	48	71.6 Å²	71.6	19%	0.188	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	126	171.8	-57	-76.8	0	0	0	110.2	L57 V88 S91 Y94	L57-Y79 HydrophobicContact CD2-CD1 3.67Å; L57-Y79 HydrophobicContact CD2-CD2 4.33Å; L57-Y79 HydrophobicContact CD2-CE1 3.18Å; L57-Y79 HydrophobicContact CD2-CE2 3.93Å; L57-Y79 HydrophobicContact CD2-CG 4.22Å; L57-Y79 HydrophobicContact CG-CE1 4.4Å; Y79-V88 PolarHBondContact N-O 2.93Å; Y79-V88 PolarHBondContact O-N 2.79Å; Y79-S91 VanDerWaalsContact CE2-CA 3.44Å; Y79-Y94 HydrophobicContact CD2-CG 4.37Å; Y79-Y94 HydrophobicContact CG-CD1 4.25Å; Y79-Y94 HydrophobicContact CG-CD2 4.25Å; Y79-Y94 AromaticContact CG-CG 3.95Å; Y79-Y94 HydrophobicContact CG-CG 3.95Å
80	Y	85	Confident	79.2	Confident	73 Å²	73	67.1 Å²	67.1	29%	0.286	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	134.8	175	-175.7	-105.2	0	0	0	110.8	E82 D85 V87 Y94	Y80-E82 HydrophobicContact CD1-CG 3.99Å; Y80-E82 HydrophobicContact CE1-CB 4.34Å; Y80-E82 HydrophobicContact CE1-CG 3.9Å; Y80-D85 PolarHBondContact OH-OD1 3.07Å; Y80-V87 HydrophobicContact CD2-CG2 4.21Å; Y80-Y94 PolarHBondContact O-OH 2.78Å
81	C	85.8	Confident	79.7	Confident	2 Å²	2	62.7 Å²	62.7	1%	0.014	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	112.9	171.6	-179.6	0	0	0	0	109.9	V83 C84 D85 C86 Y94 H97 H103	C81-V83 VanDerWaalsContact C-N 3.28Å; C81-V83 PolarHBondContact O-N 3.36Å; C81-C84 HydrophobicContact CB-CB 4.4Å; C81-C84 PolarHBondContact O-N 2.93Å; C81-D85 WeakPolarHBondContact O-CA 3.06Å; C81-D85 PolarHBondContact O-N 3.09Å; C81-C86 PolarHBondContact N-O 3.44Å; C81-Y94 HydrophobicContact CB-CE2 4.24Å; C81-H97 VanDerWaalsContact SG-CD2 3.57Å; C81-H97 PolarHBondContact SG-NE2 2.82Å; C81-H103 PolarHBondContact SG-ND1 3.09Å
82	E	83	Confident	80.5	Confident	163 Å²	163	67.8 Å²	67.8	76%	0.762	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-27	-178.7	-61	176.4	175.6	0	0	113.5	Y80	Y80-E82 HydrophobicContact CD1-CG 3.99Å; Y80-E82 HydrophobicContact CE1-CB 4.34Å; Y80-E82 HydrophobicContact CE1-CG 3.9Å
83	V	82.5	Confident	81	Confident	46 Å²	46	66.9 Å²	66.9	28%	0.279	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-29.5	-175.6	176.8	0	0	0	0	112.4	C81 N106 M107	C81-V83 VanDerWaalsContact C-N 3.28Å; C81-V83 PolarHBondContact O-N 3.36Å; V83-N106 HydrophobicContact CG1-CB 3.41Å; V83-N106 VanDerWaalsContact CG1-CB 3.41Å; V83-N106 PolarHBondContact O-ND2 3.11Å; V83-N106 VanDerWaalsContact O-ND2 3.08Å; V83-M107 HydrophobicContact CG1-CG 4.06Å; V83-M107 HydrophobicContact CG2-CG 4.31Å; V83-M107 HydrophobicContact CG2-SD 3.88Å
84	C	82.2	Confident	81.8	Confident	8 Å²	8	67.4 Å²	67.4	5%	0.054	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	-6	-173.8	-75.8	0	0	0	0	113.6	C81 C86 H97 K102 H103	C81-C84 HydrophobicContact CB-CB 4.4Å; C81-C84 PolarHBondContact O-N 2.93Å; C84-C86 VanDerWaalsContact C-N 3.28Å; C84-C86 PolarHBondContact O-N 2.9Å; C84-H97 WeakPolarHBondContact CB-NE2 3.4Å; C84-H97 VanDerWaalsContact SG-CE1 3.52Å; C84-H97 PolarHBondContact SG-NE2 3.28Å; C84-K102 PolarHBondContact O-NZ 2.82Å; C84-H103 VanDerWaalsContact SG-CA 3.54Å
85	D	82.6	Confident	82.6	Confident	119 Å²	119	66.4 Å²	66.4	64%	0.636	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.1	47.8	-172.7	-61.3	-44.8	0	0	0	112.8	Y80 C81	Y80-D85 PolarHBondContact OH-OD1 3.07Å; C81-D85 WeakPolarHBondContact O-CA 3.06Å; C81-D85 PolarHBondContact O-N 3.09Å
86	C	83.3	Confident	83.4	Confident	35 Å²	35	68.8 Å²	68.8	24%	0.236	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	146.7	179	66.7	0	0	0	0	112.2	C81 C84 H97	C81-C86 PolarHBondContact N-O 3.44Å; C84-C86 VanDerWaalsContact C-N 3.28Å; C84-C86 PolarHBondContact O-N 2.9Å; C86-H97 PolarHBondContact SG-CE1 2.95Å; C86-H97 PolarHBondContact SG-NE2 2.89Å
87	V	86	Confident	83.9	Confident	39 Å²	39	66.6 Å²	66.6	24%	0.236	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	120	174	-174.1	0	0	0	0	108.5	G73 Q76 Y80	G73-V87 WeakPolarHBondContact O-CG2 3.23Å; Q76-V87 HydrophobicContact CB-CG1 4.08Å; Q76-V87 HydrophobicContact CB-CG2 4.12Å; Q76-V87 HydrophobicContact CG-CG1 4.23Å; Y80-V87 HydrophobicContact CD2-CG2 4.21Å
88	V	84.8	Confident	84.3	Confident	9 Å²	9	65 Å²	65	6%	0.055	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	126.6	177.9	173.6	0	0	0	0	109.2	G78 Y79 D90 N93 Y94 H97	G78-V88 CarbonylContact C-O 3.6Å; G78-V88 VanDerWaalsContact CA-O 3.29Å; G78-V88 WeakPolarHBondContact CA-O 3.37Å; Y79-V88 PolarHBondContact N-O 2.93Å; Y79-V88 PolarHBondContact O-N 2.79Å; V88-D90 WeakPolarHBondContact CG1-O 3.33Å; V88-N93 HydrophobicContact CG1-CB 3.62Å; V88-N93 WeakPolarHBondContact CG1-ND2 3.38Å; V88-Y94 HydrophobicContact CB-CD2 4.42Å; V88-H97 HydrophobicContact CG2-CB 4.15Å
89	K	82.9	Confident	84.2	Confident	158 Å²	158	68.2 Å²	68.2	69%	0.687	35%	0.348	S	S	*	.			trans	-77.6	-33.8	-173.5	-58.2	-171	-179.1	-164.4	0	113.8
90	D	85.2	Confident	84.2	Confident	109 Å²	109	66.9 Å²	66.9	58%	0.583	35%	0.349	S	S	*	.	S	Bend	trans	-104.1	145.3	-173.8	-61.2	-37.6	0	0	0	112.5	V88 N93 Y94	V88-D90 WeakPolarHBondContact CG1-O 3.33Å; D90-N93 HydrophobicContact CB-CB 4.06Å; D90-N93 PolarHBondContact O-N 3.46Å; D90-Y94 PolarHBondContact O-N 2.73Å
91	S	82.5	Confident	84	Confident	47 Å²	47	70.2 Å²	70.2	33%	0.329	37%	0.365	S	S	.	.	H	α-helix	trans	-64.4	-40.8	178.2	53.5	0	0	0	0	112.5	Y79 Y94 L95	Y79-S91 VanDerWaalsContact CE2-CA 3.44Å; S91-Y94 PolarHBondContact O-N 3.1Å; S91-L95 WeakPolarHBondContact O-CG 3.46Å; S91-L95 PolarHBondContact O-N 3.14Å; S91-L95 VanDerWaalsContact O-N 3.13Å
92	I	86.4	Confident	83.8	Confident	138 Å²	138	75.5 Å²	75.5	71%	0.708	39%	0.388	S	S	*	.	H	α-helix	trans	-66.2	-44.2	177.5	-59.3	175.2	0	0	0	110.3	Y94 L95 D96	I92-Y94 VanDerWaalsContact C-N 3.25Å; I92-Y94 PolarHBondContact O-N 3.45Å; I92-L95 PolarHBondContact O-N 2.93Å; I92-D96 PolarHBondContact O-N 3.04Å
93	N	85.4	Confident	83.8	Confident	82 Å²	82	68.6 Å²	68.6	44%	0.439	36%	0.355	S	S	.	.	H	α-helix	trans	-67.3	-28.2	177.6	-167.5	83.3	0	0	0	111.6	V88 D90 H97	V88-N93 HydrophobicContact CG1-CB 3.62Å; V88-N93 WeakPolarHBondContact CG1-ND2 3.38Å; D90-N93 HydrophobicContact CB-CB 4.06Å; D90-N93 PolarHBondContact O-N 3.46Å; N93-H97 WeakPolarHBondContact O-CB 3.19Å; N93-H97 PolarHBondContact O-N 2.92Å
94	Y	86.5	Confident	83.7	Confident	41 Å²	41	67.4 Å²	67.4	16%	0.161	35%	0.347	C	S	.	.	H	α-helix	trans	-69.2	-41	175.1	-178.6	-110.6	0	0	0	111.2	I55 L57 Y79 Y80 C81 V88 D90 S91 I92 H97 I98	I55-Y94 HydrophobicContact CD1-CD1 4.44Å; I55-Y94 HydrophobicContact CD1-CE1 3.91Å; I55-Y94 HydrophobicContact CG2-CD1 4.21Å; I55-Y94 HydrophobicContact CG2-CE1 3.79Å; L57-Y94 HydrophobicContact CD2-CD1 4.09Å; Y79-Y94 HydrophobicContact CD2-CG 4.37Å; Y79-Y94 HydrophobicContact CG-CD1 4.25Å; Y79-Y94 HydrophobicContact CG-CD2 4.25Å; Y79-Y94 AromaticContact CG-CG 3.95Å; Y79-Y94 HydrophobicContact CG-CG 3.95Å; Y80-Y94 PolarHBondContact O-OH 2.78Å; C81-Y94 HydrophobicContact CB-CE2 4.24Å; V88-Y94 HydrophobicContact CB-CD2 4.42Å; D90-Y94 PolarHBondContact O-N 2.73Å; S91-Y94 PolarHBondContact O-N 3.1Å; I92-Y94 VanDerWaalsContact C-N 3.25Å; I92-Y94 PolarHBondContact O-N 3.45Å; Y94-H97 PolarHBondContact O-N 2.83Å; Y94-I98 HydrophobicContact CD1-CD1 3.83Å; Y94-I98 HydrophobicContact CD2-CD1 4.45Å; Y94-I98 HydrophobicContact CE1-CD1 3.39Å; Y94-I98 HydrophobicContact CE2-CD1 4.06Å; Y94-I98 HydrophobicContact CE2-CG1 4.46Å; Y94-I98 HydrophobicContact CG-CD1 4.36Å; Y94-I98 WeakPolarHBondContact O-CG1 3.31Å; Y94-I98 PolarHBondContact O-N 3.25Å
95	L	83.5	Confident	83.5	Confident	56 Å²	56	73.5 Å²	73.5	29%	0.293	37%	0.369	S	S	.	.	H	α-helix	trans	-64	-43	173.1	-67	174.3	0	0	0	112	I55 L57 S91 I92 N99	I55-L95 HydrophobicContact CB-CD2 4.36Å; I55-L95 HydrophobicContact CD1-CD2 4.08Å; L57-L95 HydrophobicContact CD1-CD1 4Å; L57-L95 HydrophobicContact CD1-CD2 4.29Å; L57-L95 HydrophobicContact CD1-CG 4.1Å; S91-L95 WeakPolarHBondContact O-CG 3.46Å; S91-L95 PolarHBondContact O-N 3.14Å; S91-L95 VanDerWaalsContact O-N 3.13Å; I92-L95 PolarHBondContact O-N 2.93Å; L95-N99 VanDerWaalsContact O-CG 3.3Å; L95-N99 PolarHBondContact O-N 3.27Å; L95-N99 VanDerWaalsContact O-N 3.14Å; L95-N99 PolarHBondContact O-ND2 3.16Å; L95-N99 VanDerWaalsContact O-ND2 3.1Å
96	D	84.9	Confident	83.4	Confident	107 Å²	107	72.3 Å²	72.3	57%	0.572	36%	0.362	S	S	*	.	H	α-helix	trans	-64.5	-40.5	173.7	-176	68.2	0	0	0	111.9	I92 I98 N99 G100	I92-D96 PolarHBondContact O-N 3.04Å; D96-I98 PolarHBondContact O-N 2.92Å; D96-N99 CarbonylContact O-C 3.59Å; D96-N99 PolarHBondContact O-N 3.05Å; D96-N99 VanDerWaalsContact O-N 3.16Å; D96-G100 WeakPolarHBondContact O-CA 3.25Å; D96-G100 PolarHBondContact O-N 2.86Å
97	H	87	Confident	82.9	Confident	32 Å²	32	74.8 Å²	74.8	15%	0.148	37%	0.371	C	S	.	.	H	α-helix	trans	-59.9	-45.1	178.6	177.2	75.7	0	0	0	112.2	C81 C84 C86 V88 N93 Y94 N99 G100 H103	C81-H97 VanDerWaalsContact SG-CD2 3.57Å; C81-H97 PolarHBondContact SG-NE2 2.82Å; C84-H97 WeakPolarHBondContact CB-NE2 3.4Å; C84-H97 VanDerWaalsContact SG-CE1 3.52Å; C84-H97 PolarHBondContact SG-NE2 3.28Å; C86-H97 PolarHBondContact SG-CE1 2.95Å; C86-H97 PolarHBondContact SG-NE2 2.89Å; V88-H97 HydrophobicContact CG2-CB 4.15Å; N93-H97 WeakPolarHBondContact O-CB 3.19Å; N93-H97 PolarHBondContact O-N 2.92Å; Y94-H97 PolarHBondContact O-N 2.83Å; H97-N99 VanDerWaalsContact C-N 3.33Å; H97-G100 PolarHBondContact O-N 3.42Å; H97-G100 VanDerWaalsContact O-N 3.08Å; H97-H103 VanDerWaalsContact O-CB 3.3Å; H97-H103 WeakPolarHBondContact O-CB 3.3Å
98	I	84.8	Confident	82.1	Confident	15 Å²	15	74.4 Å²	74.4	8%	0.077	38%	0.375	C	S	.	.	H	α-helix	trans	-64.4	-39.7	176.8	-70.3	172.8	0	0	0	110.9	I55 Y94 D96 G100 H103	I55-I98 HydrophobicContact CD1-CD1 3.23Å; Y94-I98 HydrophobicContact CD1-CD1 3.83Å; Y94-I98 HydrophobicContact CD2-CD1 4.45Å; Y94-I98 HydrophobicContact CE1-CD1 3.39Å; Y94-I98 HydrophobicContact CE2-CD1 4.06Å; Y94-I98 HydrophobicContact CE2-CG1 4.46Å; Y94-I98 HydrophobicContact CG-CD1 4.36Å; Y94-I98 WeakPolarHBondContact O-CG1 3.31Å; Y94-I98 PolarHBondContact O-N 3.25Å; D96-I98 PolarHBondContact O-N 2.92Å; I98-G100 PolarHBondContact O-N 2.97Å; I98-H103 PolarHBondContact O-CD2 3.35Å
99	N	80.3	Confident	81.3	Confident	106 Å²	106	76.3 Å²	76.3	57%	0.567	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-2	175.3	-64.4	-30.8	0	0	0	113.2	L95 D96 H97	L95-N99 VanDerWaalsContact O-CG 3.3Å; L95-N99 PolarHBondContact O-N 3.27Å; L95-N99 VanDerWaalsContact O-N 3.14Å; L95-N99 PolarHBondContact O-ND2 3.16Å; L95-N99 VanDerWaalsContact O-ND2 3.1Å; D96-N99 CarbonylContact O-C 3.59Å; D96-N99 PolarHBondContact O-N 3.05Å; D96-N99 VanDerWaalsContact O-N 3.16Å; H97-N99 VanDerWaalsContact C-N 3.33Å
100	G	84.4	Confident	80.2	Confident	20 Å²	20	70.3 Å²	70.3	21%	0.206	36%	0.362	C	S	.	.	S	Bend	trans	-77.3	155.7	-175.6	0	0	0	0	0	113.5	D96 H97 I98 K102 H103 Q104	D96-G100 WeakPolarHBondContact O-CA 3.25Å; D96-G100 PolarHBondContact O-N 2.86Å; H97-G100 PolarHBondContact O-N 3.42Å; H97-G100 VanDerWaalsContact O-N 3.08Å; I98-G100 PolarHBondContact O-N 2.97Å; G100-K102 PolarHBondContact O-N 3.26Å; G100-K102 VanDerWaalsContact O-N 3.14Å; G100-H103 PolarHBondContact O-N 2.95Å; G100-Q104 PolarHBondContact O-N 2.82Å
101	K	80.1	Confident	79.2	Confident	143 Å²	143	70 Å²	70	62%	0.622	36%	0.358	S	S	*	.	H	α-helix	trans	-59.8	-28.6	-178.4	-64.7	-177.6	-173.7	-178.8	0	114	R105 M111	K101-R105 WeakPolarHBondContact O-CB 3.21Å; K101-R105 PolarHBondContact O-N 3.46Å; K101-R105 VanDerWaalsContact O-N 3.13Å; K101-R105 PolarHBondContact O-NH1 2.72Å; K101-M111 HydrophobicContact CG-CE 4.48Å; K101-M111 HydrophobicContact CG-CG 4.49Å
102	K	81.6	Confident	78.4	Confident	113 Å²	113	77 Å²	77	49%	0.491	38%	0.377	S	S	.	.	H	α-helix	trans	-71	-52.7	179.4	-170.1	-170.3	177	-163.2	0	110.2	C84 G100 R105 N106	C84-K102 PolarHBondContact O-NZ 2.82Å; G100-K102 PolarHBondContact O-N 3.26Å; G100-K102 VanDerWaalsContact O-N 3.14Å; K102-R105 PolarHBondContact O-N 2.88Å; K102-N106 PolarHBondContact O-N 3.36Å; K102-N106 VanDerWaalsContact O-N 3.08Å; K102-N106 PolarHBondContact O-OD1 2.99Å
103	H	83.5	Confident	77.5	Confident	17 Å²	17	76 Å²	76	8%	0.079	37%	0.373	C	S	.	.	H	α-helix	trans	-59.5	-49.9	179.1	-172.9	88.5	0	0	0	111.2	C81 C84 H97 I98 G100 R105 N106 M107	C81-H103 PolarHBondContact SG-ND1 3.09Å; C84-H103 VanDerWaalsContact SG-CA 3.54Å; H97-H103 VanDerWaalsContact O-CB 3.3Å; H97-H103 WeakPolarHBondContact O-CB 3.3Å; I98-H103 PolarHBondContact O-CD2 3.35Å; G100-H103 PolarHBondContact O-N 2.95Å; H103-R105 VanDerWaalsContact C-N 3.31Å; H103-R105 PolarHBondContact O-N 3.03Å; H103-N106 PolarHBondContact O-N 3.15Å; H103-N106 VanDerWaalsContact O-N 3.16Å; H103-M107 WeakPolarHBondContact O-CG 3.35Å; H103-M107 PolarHBondContact O-N 3.27Å
104	Q	79	Confident	76.9	Confident	21 Å²	21	77.3 Å²	77.3	10%	0.098	37%	0.374	C	S	.	.	H	α-helix	trans	-65.3	-33.5	-179.3	-157.8	64.2	2.1	0	0	113.2	L48 G100 G108 M109	L48-Q104 HydrophobicContact CD1-CG 4.49Å; G100-Q104 PolarHBondContact O-N 2.82Å; Q104-G108 PolarHBondContact O-N 3.28Å; Q104-M109 VanDerWaalsContact CD-CB 3.44Å; Q104-M109 HydrophobicContact CG-CB 3.66Å; Q104-M109 PolarHBondContact NE2-SD 3.09Å; Q104-M109 VanDerWaalsContact NE2-SD 3.42Å; Q104-M109 PolarHBondContact O-N 2.99Å; Q104-M109 VanDerWaalsContact O-O 3.09Å
105	R	78.9	Confident	76.2	Confident	137 Å²	137	86.4 Å²	86.4	52%	0.517	41%	0.408	S	S	.	.	H	α-helix	trans	-67.7	-38.9	175.5	-176.2	-174.7	-60.5	107	-5.2	111.6	K101 K102 H103 G108	K101-R105 WeakPolarHBondContact O-CB 3.21Å; K101-R105 PolarHBondContact O-N 3.46Å; K101-R105 VanDerWaalsContact O-N 3.13Å; K101-R105 PolarHBondContact O-NH1 2.72Å; K102-R105 PolarHBondContact O-N 2.88Å; H103-R105 VanDerWaalsContact C-N 3.31Å; H103-R105 PolarHBondContact O-N 3.03Å; R105-G108 PolarHBondContact O-N 2.69Å
106	N	79.4	Confident	75.8	Confident	94 Å²	94	87.1 Å²	87.1	50%	0.503	42%	0.418	S	S	.	.	H	α-helix	trans	-71.3	-38.4	176.9	-75.9	33.8	0	0	0	111.4	V83 K102 H103 G108	V83-N106 HydrophobicContact CG1-CB 3.41Å; V83-N106 VanDerWaalsContact CG1-CB 3.41Å; V83-N106 PolarHBondContact O-ND2 3.11Å; V83-N106 VanDerWaalsContact O-ND2 3.08Å; K102-N106 PolarHBondContact O-N 3.36Å; K102-N106 VanDerWaalsContact O-N 3.08Å; K102-N106 PolarHBondContact O-OD1 2.99Å; H103-N106 PolarHBondContact O-N 3.15Å; H103-N106 VanDerWaalsContact O-N 3.16Å; N106-G108 PolarHBondContact O-N 3.31Å; N106-G108 VanDerWaalsContact O-N 3.17Å
107	M	74.6	Confident	75.8	Confident	87 Å²	87	85.2 Å²	85.2	43%	0.429	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-1.2	172.9	-70.3	-75.5	-83.8	0	0	113.7	V83 H103 M109	V83-M107 HydrophobicContact CG1-CG 4.06Å; V83-M107 HydrophobicContact CG2-CG 4.31Å; V83-M107 HydrophobicContact CG2-SD 3.88Å; H103-M107 WeakPolarHBondContact O-CG 3.35Å; H103-M107 PolarHBondContact O-N 3.27Å; M107-M109 VanDerWaalsContact C-N 3.32Å; M107-M109 HydrophobicContact CB-CE 4.09Å; M107-M109 HydrophobicContact CB-SD 3.44Å; M107-M109 WeakPolarHBondContact CB-SD 3.41Å; M107-M109 HydrophobicContact CE-CE 4.27Å; M107-M109 WeakPolarHBondContact O-CE 3.2Å; M107-M109 PolarHBondContact O-N 3.13Å
108	G	68.1	Low	75.6	Confident	31 Å²	31	90.8 Å²	90.8	32%	0.32	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.6	20	175.9	0	0	0	0	0	114.2	K45 E46 Q104 R105 N106	K45-G108 CarbonylContact C-O 3.58Å; K45-G108 WeakPolarHBondContact CA-O 3.38Å; K45-G108 VanDerWaalsContact CB-O 3.26Å; K45-G108 WeakPolarHBondContact CB-O 3.41Å; E46-G108 PolarHBondContact N-O 3.2Å; Q104-G108 PolarHBondContact O-N 3.28Å; R105-G108 PolarHBondContact O-N 2.69Å; N106-G108 PolarHBondContact O-N 3.31Å; N106-G108 VanDerWaalsContact O-N 3.17Å
109	M	67.9	Low	75.6	Confident	49 Å²	49	97 Å²	97	24%	0.241	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	144.8	178	-66.2	120.5	-167	0	0	111.5	E46 Q104 M107	E46-M109 HydrophobicContact CB-CG 4.44Å; E46-M109 CarbonylContact O-C 3.56Å; E46-M109 WeakPolarHBondContact O-CA 3.3Å; Q104-M109 VanDerWaalsContact CD-CB 3.44Å; Q104-M109 HydrophobicContact CG-CB 3.66Å; Q104-M109 PolarHBondContact NE2-SD 3.09Å; Q104-M109 VanDerWaalsContact NE2-SD 3.42Å; Q104-M109 PolarHBondContact O-N 2.99Å; Q104-M109 VanDerWaalsContact O-O 3.09Å; M107-M109 VanDerWaalsContact C-N 3.32Å; M107-M109 HydrophobicContact CB-CE 4.09Å; M107-M109 HydrophobicContact CB-SD 3.44Å; M107-M109 WeakPolarHBondContact CB-SD 3.41Å; M107-M109 HydrophobicContact CE-CE 4.27Å; M107-M109 WeakPolarHBondContact O-CE 3.2Å; M107-M109 PolarHBondContact O-N 3.13Å
110	S	60.3	Low	75.8	Confident	31 Å²	31	95 Å²	95	22%	0.217	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	142.2	175.5	67.1	0	0	0	0	110.5	E46 L48 R112	E46-S110 PolarHBondContact O-N 3.23Å; E46-S110 PolarHBondContact O-OG 3.46Å; L48-S110 PolarHBondContact N-O 3.04Å; S110-R112 PolarHBondContact O-N 3.36Å
111	M	64.4	Low	75.7	Confident	104 Å²	104	96.8 Å²	96.8	51%	0.512	46%	0.463	S	S	.	.	S	Bend	trans	-64.4	1.2	174.9	-67.5	-73.4	-84.4	0	0	113.5	K101 I113	K101-M111 HydrophobicContact CG-CE 4.48Å; K101-M111 HydrophobicContact CG-CG 4.49Å; M111-I113 PolarHBondContact O-N 3.21Å
112	R	65.1	Low	76.1	Confident	193 Å²	193	96.6 Å²	96.6	73%	0.728	46%	0.462	S	S	*	.			trans	-84.5	112.2	-179.2	-169.1	177	-66.1	163.7	0.5	108	Y47 S110	Y47-R112 WeakPolarHBondContact CD1-O 3.27Å; S110-R112 PolarHBondContact O-N 3.36Å
113	I	68.8	Low	76.4	Confident	118 Å²	118	97 Å²	97	61%	0.605	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-71.2	133.6	167.5	-62.2	119.7	0	0	0	107.9	L48 M111 R115	L48-I113 HydrophobicContact CB-CG1 4.43Å; L48-I113 HydrophobicContact CD2-CD1 4.32Å; L48-I113 HydrophobicContact CD2-CG1 4.01Å; M111-I113 PolarHBondContact O-N 3.21Å; I113-R115 PolarHBondContact O-N 2.82Å
114	K	71.9	Confident	76.5	Confident	108 Å²	108	105 Å²	105	47%	0.47	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-62.3	132.1	170.3	-172.3	-173.1	177.9	-163.1	0	107.5	Y47 S116 E120	Y47-K114 HydrophobicContact CD1-CB 4.15Å; Y47-K114 HydrophobicContact CE1-CB 4.43Å; Y47-K114 HydrophobicContact CG-CB 4.3Å; K114-S116 PolarHBondContact O-N 2.88Å; K114-S116 VanDerWaalsContact O-N 3.13Å; K114-E120 IonicContact NZ-OE1 2.69Å; K114-E120 PolarHBondContact NZ-OE1 3.38Å
115	R	71.9	Confident	77	Confident	232 Å²	232	110.8 Å²	110.8	88%	0.875	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-63.3	118.5	173.9	-69.8	-176.5	178.5	-173.1	-1	107.8	I113 T117	I113-R115 PolarHBondContact O-N 2.82Å; R115-T117 PolarHBondContact O-N 3.01Å
116	S	75	Confident	77.6	Confident	71 Å²	71	109.8 Å²	109.8	50%	0.497	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-59.2	127.2	177.1	-43.8	0	0	0	0	109.5	K114 E120	K114-S116 PolarHBondContact O-N 2.88Å; K114-S116 VanDerWaalsContact O-N 3.13Å; S116-E120 WeakPolarHBondContact CA-OE2 3.47Å
117	T	84.1	Confident	78	Confident	67 Å²	67	110.9 Å²	110.9	41%	0.411	53%	0.527	S	S	.	.	P	Polyproline II helix	trans	-81.3	163.1	171.5	62.1	0	0	0	0	110.5	R115 E119 E120 V121	R115-T117 PolarHBondContact O-N 3.01Å; T117-E119 PolarHBondContact O-N 2.85Å; T117-E120 PolarHBondContact N-OE2 3.36Å; T117-E120 VanDerWaalsContact N-OE2 3.11Å; T117-E120 PolarHBondContact O-N 2.95Å; T117-E120 WeakPolarHBondContact OG1-CG 3.23Å; T117-V121 WeakPolarHBondContact O-CG2 3.49Å; T117-V121 PolarHBondContact O-N 3.27Å; T117-V121 VanDerWaalsContact O-N 3.09Å
118	L	84	Confident	78.6	Confident	150 Å²	150	113 Å²	113	79%	0.785	54%	0.535	S	S	*	.	H	α-helix	trans	-58.2	-33.3	179.9	-68.3	175.3	0	0	0	112.7	K122	L118-K122 WeakPolarHBondContact O-CG 3.14Å; L118-K122 PolarHBondContact O-N 3.49Å; L118-K122 VanDerWaalsContact O-N 3.15Å
119	E	85.2	Confident	79.8	Confident	146 Å²	146	117.7 Å²	117.7	68%	0.682	55%	0.547	S	S	*	.	H	α-helix	trans	-71.1	-49.4	178.7	-63.9	177.9	164	0	0	111.2	T117 V121 K122 E123	T117-E119 PolarHBondContact O-N 2.85Å; E119-V121 PolarHBondContact O-N 3.28Å; E119-K122 WeakPolarHBondContact O-CB 3.15Å; E119-K122 PolarHBondContact O-N 2.98Å; E119-E123 PolarHBondContact O-N 3.02Å
120	E	83.2	Confident	80.8	Confident	64 Å²	64	120.1 Å²	120.1	30%	0.299	56%	0.558	S	S	.	*	H	α-helix	trans	-57	-35.6	175.9	-70.9	172.5	172.5	0	0	111.8	K114 S116 T117 R124	K114-E120 IonicContact NZ-OE1 2.69Å; K114-E120 PolarHBondContact NZ-OE1 3.38Å; S116-E120 WeakPolarHBondContact CA-OE2 3.47Å; T117-E120 PolarHBondContact N-OE2 3.36Å; T117-E120 VanDerWaalsContact N-OE2 3.11Å; T117-E120 PolarHBondContact O-N 2.95Å; T117-E120 WeakPolarHBondContact OG1-CG 3.23Å; E120-R124 VanDerWaalsContact O-CB 3.27Å; E120-R124 WeakPolarHBondContact O-CB 3.3Å; E120-R124 PolarHBondContact O-N 3.33Å
121	V	83.3	Confident	82.1	Confident	56 Å²	56	124.2 Å²	124.2	34%	0.339	57%	0.572	S	S	.	*	H	α-helix	trans	-69.5	-43.3	176.4	172.3	0	0	0	0	111.4	T117 E119 R124 F125	T117-V121 WeakPolarHBondContact O-CG2 3.49Å; T117-V121 PolarHBondContact O-N 3.27Å; T117-V121 VanDerWaalsContact O-N 3.09Å; E119-V121 PolarHBondContact O-N 3.28Å; V121-R124 PolarHBondContact O-N 3.26Å; V121-F125 HydrophobicContact CG1-CD2 3.5Å; V121-F125 VanDerWaalsContact CG1-CD2 3.5Å; V121-F125 HydrophobicContact CG1-CE2 3.24Å; V121-F125 HydrophobicContact CG1-CZ 4.37Å; V121-F125 WeakPolarHBondContact O-CD2 3.31Å; V121-F125 PolarHBondContact O-N 3.37Å
122	K	88.6	Confident	82.9	Confident	140 Å²	140	122.3 Å²	122.3	61%	0.609	57%	0.569	S	S	*	*	H	α-helix	trans	-62.8	-45.1	176.1	-75.2	176	-178.5	-179.9	0	111.8	L118 E119 F125 Q126	L118-K122 WeakPolarHBondContact O-CG 3.14Å; L118-K122 PolarHBondContact O-N 3.49Å; L118-K122 VanDerWaalsContact O-N 3.15Å; E119-K122 WeakPolarHBondContact O-CB 3.15Å; E119-K122 PolarHBondContact O-N 2.98Å; K122-F125 PolarHBondContact O-N 2.8Å; K122-Q126 WeakPolarHBondContact O-CG 3.12Å; K122-Q126 PolarHBondContact O-N 3.09Å
123	E	87.2	Confident	83.9	Confident	122 Å²	122	117.3 Å²	117.3	57%	0.57	55%	0.554	S	S	*	*	H	α-helix	trans	-60.4	-45.3	175.6	-69.8	178	165.1	0	0	111.2	E119 F125 Q126 L127	E119-E123 PolarHBondContact O-N 3.02Å; E123-F125 VanDerWaalsContact C-N 3.34Å; E123-F125 PolarHBondContact O-N 2.96Å; E123-Q126 WeakPolarHBondContact O-CB 3.22Å; E123-Q126 PolarHBondContact O-N 3.16Å; E123-Q126 VanDerWaalsContact O-N 3.16Å; E123-L127 WeakPolarHBondContact O-CG 3.18Å; E123-L127 PolarHBondContact O-N 3.14Å
124	R	85	Confident	84.5	Confident	183 Å²	183	117.5 Å²	117.5	69%	0.691	55%	0.552	S	S	*	*	H	α-helix	trans	-63.3	-38.3	176.4	-175.3	171	-79.9	178	-4.4	112.4	E120 V121 H128	E120-R124 VanDerWaalsContact O-CB 3.27Å; E120-R124 WeakPolarHBondContact O-CB 3.3Å; E120-R124 PolarHBondContact O-N 3.33Å; V121-R124 PolarHBondContact O-N 3.26Å; R124-H128 VanDerWaalsContact O-CB 3.29Å; R124-H128 WeakPolarHBondContact O-CB 3.33Å; R124-H128 PolarHBondContact O-N 3.33Å
125	F	89.8	Confident	84.8	Confident	144 Å²	144	118.1 Å²	118.1	63%	0.632	56%	0.555	S	S	*	*	H	α-helix	trans	-66	-37.4	173.5	-82.2	-60.1	0	0	0	112.3	V121 K122 E123 K129	V121-F125 HydrophobicContact CG1-CD2 3.5Å; V121-F125 VanDerWaalsContact CG1-CD2 3.5Å; V121-F125 HydrophobicContact CG1-CE2 3.24Å; V121-F125 HydrophobicContact CG1-CZ 4.37Å; V121-F125 WeakPolarHBondContact O-CD2 3.31Å; V121-F125 PolarHBondContact O-N 3.37Å; K122-F125 PolarHBondContact O-N 2.8Å; E123-F125 VanDerWaalsContact C-N 3.34Å; E123-F125 PolarHBondContact O-N 2.96Å; F125-K129 WeakPolarHBondContact O-CB 3.18Å; F125-K129 PolarHBondContact O-N 3.1Å
126	Q	91.6	Very high	85.2	Confident	116 Å²	116	109.9 Å²	109.9	54%	0.542	54%	0.536	S	S	.	.	H	α-helix	trans	-65.1	-47.3	174.9	-71.6	172.5	16.2	0	0	111.5	K122 E123 H128 K129 Q130	K122-Q126 WeakPolarHBondContact O-CG 3.12Å; K122-Q126 PolarHBondContact O-N 3.09Å; E123-Q126 WeakPolarHBondContact O-CB 3.22Å; E123-Q126 PolarHBondContact O-N 3.16Å; E123-Q126 VanDerWaalsContact O-N 3.16Å; Q126-H128 VanDerWaalsContact C-N 3.34Å; Q126-H128 PolarHBondContact O-N 3.41Å; Q126-K129 PolarHBondContact O-N 3.43Å; Q126-Q130 WeakPolarHBondContact O-CG 3.14Å; Q126-Q130 PolarHBondContact O-N 3.42Å
127	L	88	Confident	85.3	Confident	117 Å²	117	112.3 Å²	112.3	61%	0.613	54%	0.54	S	S	*	.	H	α-helix	trans	-61.6	-41.4	176	-69.7	176.2	0	0	0	112.2	E123 K131	E123-L127 WeakPolarHBondContact O-CG 3.18Å; E123-L127 PolarHBondContact O-N 3.14Å; L127-K131 WeakPolarHBondContact O-CB 2.95Å; L127-K131 PolarHBondContact O-N 2.79Å
128	H	88.1	Confident	84.9	Confident	131 Å²	131	115.2 Å²	115.2	61%	0.606	55%	0.548	S	S	*	.	H	α-helix	trans	-69.6	-35.9	177.4	-170.4	-79	0	0	0	112.1	R124 Q126 S132	R124-H128 VanDerWaalsContact O-CB 3.29Å; R124-H128 WeakPolarHBondContact O-CB 3.33Å; R124-H128 PolarHBondContact O-N 3.33Å; Q126-H128 VanDerWaalsContact C-N 3.34Å; Q126-H128 PolarHBondContact O-N 3.41Å; H128-S132 VanDerWaalsContact O-CB 3.24Å; H128-S132 WeakPolarHBondContact O-CB 3.31Å; H128-S132 PolarHBondContact O-N 3.13Å
129	K	91.6	Very high	84.5	Confident	129 Å²	129	115.2 Å²	115.2	56%	0.561	54%	0.539	S	S	*	.	H	α-helix	trans	-63.9	-49.7	173.9	-178.5	179.3	168.8	-177.8	0	110.6	F125 Q126 K131 S132 E133	F125-K129 WeakPolarHBondContact O-CB 3.18Å; F125-K129 PolarHBondContact O-N 3.1Å; Q126-K129 PolarHBondContact O-N 3.43Å; K129-K131 PolarHBondContact O-N 3.02Å; K129-S132 CarbonylContact O-C 3.43Å; K129-S132 WeakPolarHBondContact O-CA 2.9Å; K129-S132 WeakPolarHBondContact O-CB 3.01Å; K129-S132 PolarHBondContact O-N 3.11Å; K129-S132 VanDerWaalsContact O-N 3.07Å; K129-E133 WeakPolarHBondContact CE-OE1 3.32Å; K129-E133 HydrophobicContact CG-CG 4.46Å; K129-E133 IonicContact NZ-OE1 3.77Å; K129-E133 WeakPolarHBondContact O-CG 3.41Å; K129-E133 PolarHBondContact O-N 3.35Å
130	Q	88.9	Confident	84.4	Confident	100 Å²	100	110.7 Å²	110.7	47%	0.467	52%	0.524	S	S	.	.	H	α-helix	trans	-57.3	-48.4	175.7	-71.5	174.2	28.6	0	0	111.4	Q126 S132 E133 E134	Q126-Q130 WeakPolarHBondContact O-CG 3.14Å; Q126-Q130 PolarHBondContact O-N 3.42Å; Q130-S132 VanDerWaalsContact C-N 3.26Å; Q130-S132 PolarHBondContact O-N 3.35Å; Q130-E133 PolarHBondContact O-N 3.08Å; Q130-E133 VanDerWaalsContact O-N 3.11Å; Q130-E134 WeakPolarHBondContact O-CG 3.14Å; Q130-E134 PolarHBondContact O-N 3.27Å
131	K	88.4	Confident	84.2	Confident	117 Å²	117	112.9 Å²	112.9	51%	0.509	54%	0.537	S	S	.	.	H	α-helix	trans	-62.7	-32.2	176.3	-173	171.3	-173.4	169.6	0	113.1	L127 K129 K135	L127-K131 WeakPolarHBondContact O-CB 2.95Å; L127-K131 PolarHBondContact O-N 2.79Å; K129-K131 PolarHBondContact O-N 3.02Å; K131-K135 HydrophobicContact CG-CD 4.41Å; K131-K135 VanDerWaalsContact O-CB 3.32Å; K131-K135 WeakPolarHBondContact O-CB 3.2Å; K131-K135 WeakPolarHBondContact O-CG 3.32Å; K131-K135 PolarHBondContact O-N 3.24Å; K131-K135 VanDerWaalsContact O-N 3.09Å
132	S	81.7	Confident	84.2	Confident	65 Å²	65	113.8 Å²	113.8	46%	0.455	54%	0.54	S	S	.	.	H	α-helix	trans	-74	-34.9	175.4	-172.5	0	0	0	0	111.9	H128 K129 Q130 A136	H128-S132 VanDerWaalsContact O-CB 3.24Å; H128-S132 WeakPolarHBondContact O-CB 3.31Å; H128-S132 PolarHBondContact O-N 3.13Å; K129-S132 CarbonylContact O-C 3.43Å; K129-S132 WeakPolarHBondContact O-CA 2.9Å; K129-S132 WeakPolarHBondContact O-CB 3.01Å; K129-S132 PolarHBondContact O-N 3.11Å; K129-S132 VanDerWaalsContact O-N 3.07Å; Q130-S132 VanDerWaalsContact C-N 3.26Å; Q130-S132 PolarHBondContact O-N 3.35Å; S132-A136 WeakPolarHBondContact O-CB 3.35Å; S132-A136 PolarHBondContact O-N 2.91Å
133	E	84.8	Confident	83.9	Confident	88 Å²	88	110.2 Å²	110.2	41%	0.411	53%	0.525	S	S	.	.	H	α-helix	trans	-68.6	-49.2	174.4	-72.5	168.6	163.2	0	0	109.9	K129 Q130 K135 A136 E137	K129-E133 WeakPolarHBondContact CE-OE1 3.32Å; K129-E133 HydrophobicContact CG-CG 4.46Å; K129-E133 IonicContact NZ-OE1 3.77Å; K129-E133 WeakPolarHBondContact O-CG 3.41Å; K129-E133 PolarHBondContact O-N 3.35Å; Q130-E133 PolarHBondContact O-N 3.08Å; Q130-E133 VanDerWaalsContact O-N 3.11Å; E133-K135 VanDerWaalsContact C-N 3.34Å; E133-K135 PolarHBondContact O-N 3.33Å; E133-A136 CarbonylContact O-C 3.37Å; E133-A136 PolarHBondContact O-N 3.16Å; E133-A136 VanDerWaalsContact O-N 3.09Å; E133-E137 WeakPolarHBondContact O-CB 3.35Å; E133-E137 WeakPolarHBondContact O-CG 3.34Å; E133-E137 PolarHBondContact O-N 3.31Å
134	E	81.5	Confident	83.6	Confident	121 Å²	121	112.4 Å²	112.4	57%	0.565	53%	0.528	S	S	*	.	H	α-helix	trans	-55.4	-46.5	174.3	-71.7	172.8	166.9	0	0	112	Q130 E137 E138	Q130-E134 WeakPolarHBondContact O-CG 3.14Å; Q130-E134 PolarHBondContact O-N 3.27Å; E134-E137 PolarHBondContact O-N 3.13Å; E134-E138 VanDerWaalsContact O-CB 3.31Å; E134-E138 WeakPolarHBondContact O-CB 3.5Å; E134-E138 PolarHBondContact O-N 3.26Å
135	K	79.4	Confident	83.4	Confident	122 Å²	122	109.8 Å²	109.8	53%	0.53	53%	0.525	S	S	.	.	H	α-helix	trans	-67.5	-36.3	176.5	-76.5	178.5	174.4	-163.6	0	113	K131 E133 E137 Y139	K131-K135 HydrophobicContact CG-CD 4.41Å; K131-K135 VanDerWaalsContact O-CB 3.32Å; K131-K135 WeakPolarHBondContact O-CB 3.2Å; K131-K135 WeakPolarHBondContact O-CG 3.32Å; K131-K135 PolarHBondContact O-N 3.24Å; K131-K135 VanDerWaalsContact O-N 3.09Å; E133-K135 VanDerWaalsContact C-N 3.34Å; E133-K135 PolarHBondContact O-N 3.33Å; K135-E137 VanDerWaalsContact C-N 3.35Å; K135-Y139 WeakPolarHBondContact O-CB 3.42Å; K135-Y139 PolarHBondContact O-N 2.84Å
136	A	80.7	Confident	83.2	Confident	58 Å²	58	110.6 Å²	110.6	48%	0.479	52%	0.524	S	S	.	.	H	α-helix	trans	-70.2	-36.1	177	0	0	0	0	0	111.1	S132 E133 S140	S132-A136 WeakPolarHBondContact O-CB 3.35Å; S132-A136 PolarHBondContact O-N 2.91Å; E133-A136 CarbonylContact O-C 3.37Å; E133-A136 PolarHBondContact O-N 3.16Å; E133-A136 VanDerWaalsContact O-N 3.09Å; A136-S140 WeakPolarHBondContact O-CB 2.84Å; A136-S140 PolarHBondContact O-N 3.34Å
137	E	76.8	Confident	82.7	Confident	123 Å²	123	110.1 Å²	110.1	58%	0.575	52%	0.522	S	S	*	.	H	α-helix	trans	-68.1	-48.9	173.4	-73.2	178.9	-178.1	0	0	111.3	E133 E134 K135 Y139 S140 L141	E133-E137 WeakPolarHBondContact O-CB 3.35Å; E133-E137 WeakPolarHBondContact O-CG 3.34Å; E133-E137 PolarHBondContact O-N 3.31Å; E134-E137 PolarHBondContact O-N 3.13Å; K135-E137 VanDerWaalsContact C-N 3.35Å; E137-Y139 PolarHBondContact O-N 3.31Å; E137-S140 PolarHBondContact O-N 3.19Å; E137-L141 WeakPolarHBondContact O-CB 3.19Å; E137-L141 PolarHBondContact O-N 3.23Å
138	E	75.1	Confident	82.7	Confident	127 Å²	127	108.8 Å²	108.8	59%	0.593	52%	0.515	S	S	*	.	H	α-helix	trans	-56	-51.9	175.2	-175.8	-177.9	-167.4	0	0	110.2	E134 S140 L141 D142	E134-E138 VanDerWaalsContact O-CB 3.31Å; E134-E138 WeakPolarHBondContact O-CB 3.5Å; E134-E138 PolarHBondContact O-N 3.26Å; E138-S140 PolarHBondContact O-N 3.08Å; E138-L141 PolarHBondContact O-N 3.08Å; E138-D142 VanDerWaalsContact O-CB 3.3Å; E138-D142 WeakPolarHBondContact O-CB 3.1Å; E138-D142 PolarHBondContact O-N 3.06Å
139	Y	74.9	Confident	82.7	Confident	150 Å²	150	105.3 Å²	105.3	59%	0.588	51%	0.508	S	S	*	.	H	α-helix	trans	-61.1	-45.5	177.7	-168.1	-106.2	0	0	0	111.9	K135 E137 L141 E143	K135-Y139 WeakPolarHBondContact O-CB 3.42Å; K135-Y139 PolarHBondContact O-N 2.84Å; E137-Y139 PolarHBondContact O-N 3.31Å; Y139-L141 PolarHBondContact O-N 3.17Å; Y139-E143 HydrophobicContact CD2-CG 4.03Å; Y139-E143 VanDerWaalsContact CE1-CD 3.4Å; Y139-E143 HydrophobicContact CE1-CG 4.44Å; Y139-E143 WeakPolarHBondContact CE1-OE2 3.47Å; Y139-E143 HydrophobicContact CE2-CG 3.94Å; Y139-E143 WeakPolarHBondContact CE2-OE1 3.27Å; Y139-E143 HydrophobicContact CG-CG 4.32Å; Y139-E143 WeakPolarHBondContact O-CB 3.24Å; Y139-E143 VanDerWaalsContact O-CG 3.22Å; Y139-E143 WeakPolarHBondContact O-CG 3.37Å; Y139-E143 PolarHBondContact O-N 3.01Å; Y139-E143 PolarHBondContact OH-OE1 3.42Å; Y139-E143 PolarHBondContact OH-OE2 2.94Å; Y139-E143 VanDerWaalsContact OH-OE2 3.12Å
140	S	83.4	Confident	82.6	Confident	52 Å²	52	103.9 Å²	103.9	36%	0.364	50%	0.504	S	S	.	.	H	α-helix	trans	-65.1	-40.4	-180	-178.6	0	0	0	0	112.9	A136 E137 E138 R144	A136-S140 WeakPolarHBondContact O-CB 2.84Å; A136-S140 PolarHBondContact O-N 3.34Å; E137-S140 PolarHBondContact O-N 3.19Å; E138-S140 PolarHBondContact O-N 3.08Å; S140-R144 WeakPolarHBondContact O-CB 3.48Å; S140-R144 WeakPolarHBondContact O-CD 3.49Å; S140-R144 WeakPolarHBondContact O-CG 3.35Å; S140-R144 PolarHBondContact O-N 2.87Å
141	L	80	Confident	82.5	Confident	110 Å²	110	105.7 Å²	105.7	58%	0.576	51%	0.512	S	S	*	.	H	α-helix	trans	-76.1	-51.6	179.8	-92.7	134.4	0	0	0	111.9	E137 E138 Y139 R144 M145	E137-L141 WeakPolarHBondContact O-CB 3.19Å; E137-L141 PolarHBondContact O-N 3.23Å; E138-L141 PolarHBondContact O-N 3.08Å; Y139-L141 PolarHBondContact O-N 3.17Å; L141-R144 PolarHBondContact O-N 3.13Å; L141-M145 VanDerWaalsContact O-CB 3.23Å; L141-M145 WeakPolarHBondContact O-CB 3.18Å; L141-M145 WeakPolarHBondContact O-CG 3.27Å; L141-M145 PolarHBondContact O-N 2.94Å
142	D	83.3	Confident	82.6	Confident	74 Å²	74	104.7 Å²	104.7	40%	0.396	51%	0.509	S	S	.	.	H	α-helix	trans	-63.5	-44.5	-179.5	-92.5	-90.7	0	0	0	111.4	E138 M145 R146	E138-D142 VanDerWaalsContact O-CB 3.3Å; E138-D142 WeakPolarHBondContact O-CB 3.1Å; E138-D142 PolarHBondContact O-N 3.06Å; D142-M145 PolarHBondContact O-N 3.39Å; D142-R146 VanDerWaalsContact O-CB 3.3Å; D142-R146 WeakPolarHBondContact O-CB 3.08Å; D142-R146 WeakPolarHBondContact O-CG 3.27Å; D142-R146 PolarHBondContact O-N 2.77Å; D142-R146 IonicContact OD1-NE 3.96Å; D142-R146 IonicContact OD1-NH2 3.57Å
143	E	81.6	Confident	83	Confident	65 Å²	65	108.2 Å²	108.2	30%	0.304	52%	0.518	S	S	.	.	H	α-helix	trans	-68.5	-40.4	179.1	-68.6	-161	144.4	0	0	112.3	Y139 R146 Q147	Y139-E143 HydrophobicContact CD2-CG 4.03Å; Y139-E143 VanDerWaalsContact CE1-CD 3.4Å; Y139-E143 HydrophobicContact CE1-CG 4.44Å; Y139-E143 WeakPolarHBondContact CE1-OE2 3.47Å; Y139-E143 HydrophobicContact CE2-CG 3.94Å; Y139-E143 WeakPolarHBondContact CE2-OE1 3.27Å; Y139-E143 HydrophobicContact CG-CG 4.32Å; Y139-E143 WeakPolarHBondContact O-CB 3.24Å; Y139-E143 VanDerWaalsContact O-CG 3.22Å; Y139-E143 WeakPolarHBondContact O-CG 3.37Å; Y139-E143 PolarHBondContact O-N 3.01Å; Y139-E143 PolarHBondContact OH-OE1 3.42Å; Y139-E143 PolarHBondContact OH-OE2 2.94Å; Y139-E143 VanDerWaalsContact OH-OE2 3.12Å; E143-R146 PolarHBondContact O-N 3.26Å; E143-Q147 VanDerWaalsContact O-CB 3.31Å; E143-Q147 WeakPolarHBondContact O-CB 3.49Å; E143-Q147 WeakPolarHBondContact O-CG 3.36Å; E143-Q147 PolarHBondContact O-N 3.44Å
144	R	80.4	Confident	83.2	Confident	169 Å²	169	110.4 Å²	110.4	64%	0.638	53%	0.527	S	S	*	.	H	α-helix	trans	-64.8	-42.8	174.9	-80.9	-179.9	166.4	174.9	-1.2	111.9	S140 L141 R146 Q147 I148	S140-R144 WeakPolarHBondContact O-CB 3.48Å; S140-R144 WeakPolarHBondContact O-CD 3.49Å; S140-R144 WeakPolarHBondContact O-CG 3.35Å; S140-R144 PolarHBondContact O-N 2.87Å; L141-R144 PolarHBondContact O-N 3.13Å; R144-R146 VanDerWaalsContact C-N 3.35Å; R144-Q147 PolarHBondContact O-N 3.27Å; R144-I148 WeakPolarHBondContact O-CB 3.34Å; R144-I148 WeakPolarHBondContact O-CD1 3.29Å; R144-I148 WeakPolarHBondContact O-CG1 3.34Å; R144-I148 PolarHBondContact O-N 3.14Å
145	M	81.3	Confident	83.4	Confident	128 Å²	128	111 Å²	111	63%	0.631	53%	0.528	S	S	*	.	H	α-helix	trans	-64.9	-40.5	178.7	-73.9	-69.6	-74.5	0	0	111.4	L141 D142 A149	L141-M145 VanDerWaalsContact O-CB 3.23Å; L141-M145 WeakPolarHBondContact O-CB 3.18Å; L141-M145 WeakPolarHBondContact O-CG 3.27Å; L141-M145 PolarHBondContact O-N 2.94Å; D142-M145 PolarHBondContact O-N 3.39Å; M145-A149 VanDerWaalsContact O-CB 3.25Å; M145-A149 WeakPolarHBondContact O-CB 3.5Å; M145-A149 PolarHBondContact O-N 3.43Å
146	R	85.7	Confident	83.9	Confident	161 Å²	161	113 Å²	113	61%	0.608	53%	0.532	S	S	*	.	H	α-helix	trans	-65.7	-45.4	174.4	-73.6	176.6	-164.9	-174.4	7.5	112	D142 E143 R144 I148 A149 E150	D142-R146 VanDerWaalsContact O-CB 3.3Å; D142-R146 WeakPolarHBondContact O-CB 3.08Å; D142-R146 WeakPolarHBondContact O-CG 3.27Å; D142-R146 PolarHBondContact O-N 2.77Å; D142-R146 IonicContact OD1-NE 3.96Å; D142-R146 IonicContact OD1-NH2 3.57Å; E143-R146 PolarHBondContact O-N 3.26Å; R144-R146 VanDerWaalsContact C-N 3.35Å; R146-I148 PolarHBondContact O-N 3.44Å; R146-A149 PolarHBondContact O-N 3.42Å; R146-E150 WeakPolarHBondContact O-CB 3.39Å; R146-E150 WeakPolarHBondContact O-CG 3.08Å; R146-E150 PolarHBondContact O-N 3.32Å
147	Q	81.9	Confident	84.4	Confident	105 Å²	105	112.6 Å²	112.6	49%	0.491	53%	0.529	S	S	.	.	H	α-helix	trans	-62.1	-44.8	178	-73.7	171	23.6	0	0	111.6	E143 R144 E150 E151	E143-Q147 VanDerWaalsContact O-CB 3.31Å; E143-Q147 WeakPolarHBondContact O-CB 3.49Å; E143-Q147 WeakPolarHBondContact O-CG 3.36Å; E143-Q147 PolarHBondContact O-N 3.44Å; R144-Q147 PolarHBondContact O-N 3.27Å; Q147-E150 PolarHBondContact O-N 3.38Å; Q147-E151 WeakPolarHBondContact O-CB 3.41Å; Q147-E151 VanDerWaalsContact O-CG 3.3Å; Q147-E151 WeakPolarHBondContact O-CG 3.29Å; Q147-E151 PolarHBondContact O-N 2.85Å
148	I	86.7	Confident	84.9	Confident	90 Å²	90	112 Å²	112	46%	0.462	52%	0.522	S	S	.	.	H	α-helix	trans	-63.3	-43.8	176.3	-67.6	165.3	0	0	0	110.9	R144 R146 E151 E152	R144-I148 WeakPolarHBondContact O-CB 3.34Å; R144-I148 WeakPolarHBondContact O-CD1 3.29Å; R144-I148 WeakPolarHBondContact O-CG1 3.34Å; R144-I148 PolarHBondContact O-N 3.14Å; R146-I148 PolarHBondContact O-N 3.44Å; I148-E151 PolarHBondContact O-N 3.41Å; I148-E152 HydrophobicContact CG2-CG 4.41Å; I148-E152 WeakPolarHBondContact O-CB 3.37Å; I148-E152 WeakPolarHBondContact O-CG 3.08Å; I148-E152 PolarHBondContact O-N 3.36Å
149	A	89.1	Confident	85.7	Confident	57 Å²	57	112.7 Å²	112.7	47%	0.471	52%	0.523	S	S	.	.	H	α-helix	trans	-64.2	-42.7	178.7	0	0	0	0	0	112.2	M145 R146 E152 E153	M145-A149 VanDerWaalsContact O-CB 3.25Å; M145-A149 WeakPolarHBondContact O-CB 3.5Å; M145-A149 PolarHBondContact O-N 3.43Å; R146-A149 PolarHBondContact O-N 3.42Å; A149-E152 PolarHBondContact O-N 3Å; A149-E153 WeakPolarHBondContact O-CB 3.34Å; A149-E153 PolarHBondContact O-N 3.31Å
150	E	89.9	Confident	86.5	Confident	100 Å²	100	112.8 Å²	112.8	47%	0.467	53%	0.529	S	S	.	.	H	α-helix	trans	-66.3	-40	176.2	-76.2	-173.3	-162	0	0	112.3	R146 Q147 E153 K154	R146-E150 WeakPolarHBondContact O-CB 3.39Å; R146-E150 WeakPolarHBondContact O-CG 3.08Å; R146-E150 PolarHBondContact O-N 3.32Å; Q147-E150 PolarHBondContact O-N 3.38Å; E150-E153 PolarHBondContact O-N 2.82Å; E150-K154 VanDerWaalsContact O-CB 3.31Å; E150-K154 WeakPolarHBondContact O-CB 3.12Å; E150-K154 WeakPolarHBondContact O-CD 3.44Å; E150-K154 WeakPolarHBondContact O-CG 3.42Å; E150-K154 PolarHBondContact O-N 3.02Å; E150-K154 IonicContact OE2-NZ 3.51Å
151	E	86.2	Confident	86.8	Confident	137 Å²	137	115.3 Å²	115.3	64%	0.64	54%	0.535	S	S	*	.	H	α-helix	trans	-66.3	-42.9	175.6	-76.1	-177	172.4	0	0	111.5	Q147 I148 F155	Q147-E151 WeakPolarHBondContact O-CB 3.41Å; Q147-E151 VanDerWaalsContact O-CG 3.3Å; Q147-E151 WeakPolarHBondContact O-CG 3.29Å; Q147-E151 PolarHBondContact O-N 2.85Å; I148-E151 PolarHBondContact O-N 3.41Å; E151-F155 VanDerWaalsContact O-CB 3.23Å; E151-F155 WeakPolarHBondContact O-CB 3.34Å; E151-F155 PolarHBondContact O-N 3.12Å
152	E	90.4	Very high	87.3	Confident	97 Å²	97	114.5 Å²	114.5	45%	0.453	53%	0.527	S	S	.	.	H	α-helix	trans	-65.3	-39.7	174.8	-75.8	-156	145.7	0	0	112.1	I148 A149 F155 R156	I148-E152 HydrophobicContact CG2-CG 4.41Å; I148-E152 WeakPolarHBondContact O-CB 3.37Å; I148-E152 WeakPolarHBondContact O-CG 3.08Å; I148-E152 PolarHBondContact O-N 3.36Å; A149-E152 PolarHBondContact O-N 3Å; E152-F155 PolarHBondContact O-N 2.87Å; E152-R156 VanDerWaalsContact O-CB 3.24Å; E152-R156 WeakPolarHBondContact O-CB 3.39Å; E152-R156 WeakPolarHBondContact O-CD 3.47Å; E152-R156 WeakPolarHBondContact O-CG 3.21Å; E152-R156 PolarHBondContact O-N 3.32Å; E152-R156 IonicContact OE2-CZ 3.64Å; E152-R156 IonicContact OE2-NE 3.99Å; E152-R156 IonicContact OE2-NH2 2.77Å; E152-R156 PolarHBondContact OE2-NH2 2.95Å
153	E	90.2	Very high	87.7	Confident	138 Å²	138	118.7 Å²	118.7	65%	0.645	54%	0.537	S	S	*	.	H	α-helix	trans	-65.5	-47.5	176.9	-174.5	177.5	-171.1	0	0	111.2	A149 E150 F155 R156 A157	A149-E153 WeakPolarHBondContact O-CB 3.34Å; A149-E153 PolarHBondContact O-N 3.31Å; E150-E153 PolarHBondContact O-N 2.82Å; E153-F155 VanDerWaalsContact C-N 3.31Å; E153-F155 PolarHBondContact O-N 3.09Å; E153-R156 PolarHBondContact O-N 2.81Å; E153-A157 WeakPolarHBondContact O-CB 3.3Å; E153-A157 PolarHBondContact O-N 3.45Å
154	K	89.2	Confident	88.1	Confident	135 Å²	135	122.2 Å²	122.2	59%	0.587	55%	0.551	S	S	*	*	H	α-helix	trans	-60.1	-41.3	175.2	-72.8	168.7	-173.8	163.2	0	111.2	E150 Y158	E150-K154 VanDerWaalsContact O-CB 3.31Å; E150-K154 WeakPolarHBondContact O-CB 3.12Å; E150-K154 WeakPolarHBondContact O-CD 3.44Å; E150-K154 WeakPolarHBondContact O-CG 3.42Å; E150-K154 PolarHBondContact O-N 3.02Å; E150-K154 IonicContact OE2-NZ 3.51Å; K154-Y158 WeakPolarHBondContact O-CB 3.49Å; K154-Y158 PolarHBondContact O-N 3.46Å
155	F	85.4	Confident	88.4	Confident	134 Å²	134	120.4 Å²	120.4	59%	0.588	55%	0.55	S	S	*	*	H	α-helix	trans	-69.3	-37.4	176.9	-171.3	-102.6	0	0	0	112.7	E151 E152 E153 Y158 K159	E151-F155 VanDerWaalsContact O-CB 3.23Å; E151-F155 WeakPolarHBondContact O-CB 3.34Å; E151-F155 PolarHBondContact O-N 3.12Å; E152-F155 PolarHBondContact O-N 2.87Å; E153-F155 VanDerWaalsContact C-N 3.31Å; E153-F155 PolarHBondContact O-N 3.09Å; F155-Y158 PolarHBondContact O-N 3.42Å; F155-K159 VanDerWaalsContact O-CB 3.27Å; F155-K159 WeakPolarHBondContact O-CB 3.04Å; F155-K159 PolarHBondContact O-N 3.49Å
156	R	90.8	Very high	88.6	Confident	162 Å²	162	121.9 Å²	121.9	61%	0.611	55%	0.553	S	S	*	*	H	α-helix	trans	-67.2	-43.2	175.6	-74.2	166.6	-168.2	-160.3	8.4	111.2	E152 E153 K159 Q160	E152-R156 VanDerWaalsContact O-CB 3.24Å; E152-R156 WeakPolarHBondContact O-CB 3.39Å; E152-R156 WeakPolarHBondContact O-CD 3.47Å; E152-R156 WeakPolarHBondContact O-CG 3.21Å; E152-R156 PolarHBondContact O-N 3.32Å; E152-R156 IonicContact OE2-CZ 3.64Å; E152-R156 IonicContact OE2-NE 3.99Å; E152-R156 IonicContact OE2-NH2 2.77Å; E152-R156 PolarHBondContact OE2-NH2 2.95Å; E153-R156 PolarHBondContact O-N 2.81Å; R156-K159 PolarHBondContact O-N 3.31Å; R156-Q160 WeakPolarHBondContact O-CB 3.36Å; R156-Q160 PolarHBondContact O-N 3.1Å
157	A	89.8	Confident	88.6	Confident	50 Å²	50	121.7 Å²	121.7	41%	0.413	55%	0.552	S	S	.	*	H	α-helix	trans	-61.1	-47.9	173.1	0	0	0	0	0	110.8	E153 K159 Q160 E161	E153-A157 WeakPolarHBondContact O-CB 3.3Å; E153-A157 PolarHBondContact O-N 3.45Å; A157-K159 VanDerWaalsContact C-N 3.33Å; A157-K159 PolarHBondContact O-N 2.92Å; A157-Q160 PolarHBondContact O-N 3.03Å; A157-E161 WeakPolarHBondContact O-CG 3.05Å; A157-E161 PolarHBondContact O-N 3.18Å
158	Y	88.8	Confident	88.6	Confident	110 Å²	110	124 Å²	124	43%	0.431	56%	0.556	S	S	.	*	H	α-helix	trans	-60	-39.3	176.6	-176	-101.3	0	0	0	113.8	K154 F155 E161 K162	K154-Y158 WeakPolarHBondContact O-CB 3.49Å; K154-Y158 PolarHBondContact O-N 3.46Å; F155-Y158 PolarHBondContact O-N 3.42Å; Y158-E161 VanDerWaalsContact CA-OE1 3.31Å; Y158-E161 WeakPolarHBondContact CA-OE1 3.38Å; Y158-E161 WeakPolarHBondContact CD2-OE1 3.44Å; Y158-E161 WeakPolarHBondContact O-CG 3.4Å; Y158-K162 HydrophobicContact CD1-CD 4.21Å; Y158-K162 HydrophobicContact CE1-CD 3.56Å; Y158-K162 HydrophobicContact CE1-CG 4.39Å; Y158-K162 HydrophobicContact CE2-CD 4.36Å; Y158-K162 WeakPolarHBondContact O-CB 3.26Å; Y158-K162 PolarHBondContact O-N 3.04Å; Y158-K162 VanDerWaalsContact O-N 3.12Å; Y158-K162 WeakPolarHBondContact OH-CE 3.23Å; Y158-K162 PolarHBondContact OH-NZ 3.21Å
159	K	91.6	Very high	88.1	Confident	142 Å²	142	127.6 Å²	127.6	62%	0.617	56%	0.564	S	S	*	*	H	α-helix	trans	-69.9	-35.7	175.3	-169.9	176.4	-178.9	178.7	0	111.5	F155 R156 A157 R163	F155-K159 VanDerWaalsContact O-CB 3.27Å; F155-K159 WeakPolarHBondContact O-CB 3.04Å; F155-K159 PolarHBondContact O-N 3.49Å; R156-K159 PolarHBondContact O-N 3.31Å; A157-K159 VanDerWaalsContact C-N 3.33Å; A157-K159 PolarHBondContact O-N 2.92Å; K159-R163 VanDerWaalsContact O-CB 3.3Å; K159-R163 WeakPolarHBondContact O-CB 3.34Å; K159-R163 PolarHBondContact O-N 2.98Å; K159-R163 VanDerWaalsContact O-N 3.1Å
160	Q	91.8	Very high	87.6	Confident	152 Å²	152	130.2 Å²	130.2	71%	0.71	57%	0.57	S	S	*	*	H	α-helix	trans	-73.3	-44	179.9	-167.8	178.9	89.7	0	0	111.9	R156 A157 R163 K164	R156-Q160 WeakPolarHBondContact O-CB 3.36Å; R156-Q160 PolarHBondContact O-N 3.1Å; A157-Q160 PolarHBondContact O-N 3.03Å; Q160-R163 PolarHBondContact O-N 2.8Å; Q160-K164 WeakPolarHBondContact O-CB 3.37Å; Q160-K164 PolarHBondContact O-N 3.46Å
161	E	89.4	Confident	86.9	Confident	105 Å²	105	130.4 Å²	130.4	49%	0.491	58%	0.575	S	S	.	*	H	α-helix	trans	-65.4	-43.8	176.5	71.6	-161.1	-172.7	0	0	111.4	A157 Y158 R163 K164 E165	A157-E161 WeakPolarHBondContact O-CG 3.05Å; A157-E161 PolarHBondContact O-N 3.18Å; Y158-E161 VanDerWaalsContact CA-OE1 3.31Å; Y158-E161 WeakPolarHBondContact CA-OE1 3.38Å; Y158-E161 WeakPolarHBondContact CD2-OE1 3.44Å; Y158-E161 WeakPolarHBondContact O-CG 3.4Å; E161-R163 VanDerWaalsContact C-N 3.27Å; E161-R163 PolarHBondContact O-N 2.91Å; E161-K164 CarbonylContact O-C 3.47Å; E161-K164 PolarHBondContact O-N 3.43Å; E161-K164 VanDerWaalsContact O-N 3.1Å; E161-E165 WeakPolarHBondContact O-CB 3.43Å; E161-E165 PolarHBondContact O-N 2.89Å
162	K	90.8	Very high	86.1	Confident	94 Å²	94	129 Å²	129	41%	0.409	57%	0.568	S	S	.	*	H	α-helix	trans	-61.2	-35.7	173.1	-84.3	-167.3	158.1	178.7	0	112.7	Y158 K166	Y158-K162 HydrophobicContact CD1-CD 4.21Å; Y158-K162 HydrophobicContact CE1-CD 3.56Å; Y158-K162 HydrophobicContact CE1-CG 4.39Å; Y158-K162 HydrophobicContact CE2-CD 4.36Å; Y158-K162 WeakPolarHBondContact O-CB 3.26Å; Y158-K162 PolarHBondContact O-N 3.04Å; Y158-K162 VanDerWaalsContact O-N 3.12Å; Y158-K162 WeakPolarHBondContact OH-CE 3.23Å; Y158-K162 PolarHBondContact OH-NZ 3.21Å; K162-K166 WeakPolarHBondContact O-CB 3.49Å; K162-K166 VanDerWaalsContact O-CG 3.29Å; K162-K166 WeakPolarHBondContact O-CG 3.34Å; K162-K166 PolarHBondContact O-N 3.43Å
163	R	90	Very high	84.8	Confident	161 Å²	161	129.6 Å²	129.6	61%	0.608	57%	0.571	S	S	*	*	H	α-helix	trans	-70.5	-37.4	175.7	-169.7	177.9	-175.9	-170.8	2.2	111.2	K159 Q160 E161 R167	K159-R163 VanDerWaalsContact O-CB 3.3Å; K159-R163 WeakPolarHBondContact O-CB 3.34Å; K159-R163 PolarHBondContact O-N 2.98Å; K159-R163 VanDerWaalsContact O-N 3.1Å; Q160-R163 PolarHBondContact O-N 2.8Å; E161-R163 VanDerWaalsContact C-N 3.27Å; E161-R163 PolarHBondContact O-N 2.91Å; R163-R167 WeakPolarHBondContact O-CB 3.44Å; R163-R167 VanDerWaalsContact O-CG 3.24Å; R163-R167 WeakPolarHBondContact O-CG 3.4Å; R163-R167 PolarHBondContact O-N 3.44Å; R163-R167 VanDerWaalsContact O-N 3.13Å
164	K	90.8	Very high	83.4	Confident	140 Å²	140	129.4 Å²	129.4	61%	0.609	57%	0.568	S	S	*	*	H	α-helix	trans	-70.2	-44.2	176.8	-169	178.9	180	-178.2	0	111.4	Q160 E161 R167 R168	Q160-K164 WeakPolarHBondContact O-CB 3.37Å; Q160-K164 PolarHBondContact O-N 3.46Å; E161-K164 CarbonylContact O-C 3.47Å; E161-K164 PolarHBondContact O-N 3.43Å; E161-K164 VanDerWaalsContact O-N 3.1Å; K164-R167 WeakPolarHBondContact O-CB 3.43Å; K164-R167 PolarHBondContact O-N 3.4Å; K164-R167 VanDerWaalsContact O-N 3.16Å; K164-R168 WeakPolarHBondContact O-CG 3.34Å; K164-R168 PolarHBondContact O-N 3.27Å
165	E	86.5	Confident	82.1	Confident	131 Å²	131	128.9 Å²	128.9	61%	0.612	57%	0.568	S	S	*	*	H	α-helix	trans	-62.7	-45.5	176.7	-170.8	-172.3	177.1	0	0	111.5	E161 R167 R168 R169	E161-E165 WeakPolarHBondContact O-CB 3.43Å; E161-E165 PolarHBondContact O-N 2.89Å; E165-R167 VanDerWaalsContact C-N 3.26Å; E165-R167 PolarHBondContact O-N 2.87Å; E165-R168 PolarHBondContact O-N 3.4Å; E165-R169 WeakPolarHBondContact O-CB 3.36Å; E165-R169 PolarHBondContact O-N 2.87Å
166	K	85.8	Confident	81	Confident	158 Å²	158	128.1 Å²	128.1	69%	0.687	57%	0.57	S	S	*	*	H	α-helix	trans	-59.7	-35.9	172.9	-76.8	-178.6	179.8	-173.6	0	112.7	K162 N170	K162-K166 WeakPolarHBondContact O-CB 3.49Å; K162-K166 VanDerWaalsContact O-CG 3.29Å; K162-K166 WeakPolarHBondContact O-CG 3.34Å; K162-K166 PolarHBondContact O-N 3.43Å; K166-N170 VanDerWaalsContact O-CB 3.24Å; K166-N170 WeakPolarHBondContact O-CB 3.46Å; K166-N170 PolarHBondContact O-N 3.19Å; K166-N170 VanDerWaalsContact O-N 3.08Å
167	R	84.5	Confident	80	Confident	157 Å²	157	123.9 Å²	123.9	59%	0.592	57%	0.565	S	S	*	*	H	α-helix	trans	-67.9	-47.5	175.1	-76.8	173.3	173.8	-157.1	-5.7	111.4	R163 K164 E165 N170 D171	R163-R167 WeakPolarHBondContact O-CB 3.44Å; R163-R167 VanDerWaalsContact O-CG 3.24Å; R163-R167 WeakPolarHBondContact O-CG 3.4Å; R163-R167 PolarHBondContact O-N 3.44Å; R163-R167 VanDerWaalsContact O-N 3.13Å; K164-R167 WeakPolarHBondContact O-CB 3.43Å; K164-R167 PolarHBondContact O-N 3.4Å; K164-R167 VanDerWaalsContact O-N 3.16Å; E165-R167 VanDerWaalsContact C-N 3.26Å; E165-R167 PolarHBondContact O-N 2.87Å; R167-N170 PolarHBondContact O-N 2.94Å; R167-D171 VanDerWaalsContact O-CB 3.32Å; R167-D171 WeakPolarHBondContact O-CB 3.44Å; R167-D171 PolarHBondContact O-N 3.44Å
168	R	82.2	Confident	79.1	Confident	153 Å²	153	126 Å²	126	58%	0.577	57%	0.569	S	S	*	*	H	α-helix	trans	-62.2	-45.2	177.4	-66.6	-178	82.8	-174.2	5.8	112.1	K164 E165 N170 D171 E172	K164-R168 WeakPolarHBondContact O-CG 3.34Å; K164-R168 PolarHBondContact O-N 3.27Å; E165-R168 PolarHBondContact O-N 3.4Å; R168-N170 VanDerWaalsContact C-N 3.28Å; R168-N170 PolarHBondContact O-N 2.84Å; R168-D171 WeakPolarHBondContact O-CB 3.47Å; R168-D171 PolarHBondContact O-N 3.48Å; R168-E172 WeakPolarHBondContact O-CB 3.42Å; R168-E172 WeakPolarHBondContact O-CG 3.44Å; R168-E172 PolarHBondContact O-N 3Å
169	R	77.3	Confident	78.2	Confident	166 Å²	166	124.2 Å²	124.2	63%	0.626	57%	0.57	S	S	*	*	H	α-helix	trans	-65.6	-30.5	177.1	-177.1	175.5	175.8	-174.5	1.6	113	E165 Q173	E165-R169 WeakPolarHBondContact O-CB 3.36Å; E165-R169 PolarHBondContact O-N 2.87Å; R169-Q173 WeakPolarHBondContact O-CB 3.33Å; R169-Q173 PolarHBondContact O-N 3.45Å; R169-Q173 PolarHBondContact O-NE2 2.94Å
170	N	77.2	Confident	77.2	Confident	112 Å²	112	119.3 Å²	119.3	60%	0.599	56%	0.556	S	S	*	*	H	α-helix	trans	-76.2	-36.6	174.8	-168.1	49.1	0	0	0	111.5	K166 R167 R168 F174	K166-N170 VanDerWaalsContact O-CB 3.24Å; K166-N170 WeakPolarHBondContact O-CB 3.46Å; K166-N170 PolarHBondContact O-N 3.19Å; K166-N170 VanDerWaalsContact O-N 3.08Å; R167-N170 PolarHBondContact O-N 2.94Å; R168-N170 VanDerWaalsContact C-N 3.28Å; R168-N170 PolarHBondContact O-N 2.84Å; N170-F174 WeakPolarHBondContact O-CB 3.31Å; N170-F174 PolarHBondContact O-N 2.96Å; N170-F174 VanDerWaalsContact O-N 3.12Å
171	D	75.6	Confident	76.4	Confident	105 Å²	105	115.2 Å²	115.2	56%	0.561	55%	0.548	S	S	*	.	H	α-helix	trans	-66.8	-49.5	175.6	-161.3	64.1	0	0	0	111.1	R167 R168 Q173 F174 E175	R167-D171 VanDerWaalsContact O-CB 3.32Å; R167-D171 WeakPolarHBondContact O-CB 3.44Å; R167-D171 PolarHBondContact O-N 3.44Å; R168-D171 WeakPolarHBondContact O-CB 3.47Å; R168-D171 PolarHBondContact O-N 3.48Å; D171-Q173 PolarHBondContact O-N 2.84Å; D171-F174 WeakPolarHBondContact O-CA 3.34Å; D171-F174 WeakPolarHBondContact O-CB 3.36Å; D171-F174 PolarHBondContact O-N 3.41Å; D171-E175 PolarHBondContact O-N 3.39Å
172	E	69.8	Low	75.6	Confident	108 Å²	108	114.5 Å²	114.5	51%	0.505	56%	0.56	S	S	.	*	H	α-helix	trans	-60.4	-40.5	175.2	-74.3	170.4	-180	0	0	112.2	R168 F174 E175 D176	R168-E172 WeakPolarHBondContact O-CB 3.42Å; R168-E172 WeakPolarHBondContact O-CG 3.44Å; R168-E172 PolarHBondContact O-N 3Å; E172-F174 VanDerWaalsContact C-N 3.28Å; E172-F174 PolarHBondContact O-N 3.2Å; E172-E175 PolarHBondContact O-N 2.83Å; E172-D176 WeakPolarHBondContact O-CB 3.36Å; E172-D176 PolarHBondContact O-N 3.3Å
173	Q	64.3	Low	74.6	Confident	109 Å²	109	116.3 Å²	116.3	51%	0.509	57%	0.572	S	S	.	*	H	α-helix	trans	-66.7	-29.8	174.1	-93.6	169.5	94.7	0	0	113	R169 D171 S177	R169-Q173 WeakPolarHBondContact O-CB 3.33Å; R169-Q173 PolarHBondContact O-N 3.45Å; R169-Q173 PolarHBondContact O-NE2 2.94Å; D171-Q173 PolarHBondContact O-N 2.84Å; Q173-S177 VanDerWaalsContact O-CB 3.26Å; Q173-S177 WeakPolarHBondContact O-CB 3.4Å; Q173-S177 PolarHBondContact O-N 3.03Å; Q173-S177 VanDerWaalsContact O-N 3.1Å
174	F	60.3	Low	73.4	Confident	133 Å²	133	111.3 Å²	111.3	58%	0.583	57%	0.57	S	S	*	*	H	α-helix	trans	-74.4	-44	177	-152	-89.7	0	0	0	110.4	N170 D171 E172 S177 D178	N170-F174 WeakPolarHBondContact O-CB 3.31Å; N170-F174 PolarHBondContact O-N 2.96Å; N170-F174 VanDerWaalsContact O-N 3.12Å; D171-F174 WeakPolarHBondContact O-CA 3.34Å; D171-F174 WeakPolarHBondContact O-CB 3.36Å; D171-F174 PolarHBondContact O-N 3.41Å; E172-F174 VanDerWaalsContact C-N 3.28Å; E172-F174 PolarHBondContact O-N 3.2Å; F174-S177 PolarHBondContact O-N 3.48Å; F174-D178 WeakPolarHBondContact CE1-OD2 3.32Å; F174-D178 PolarHBondContact O-N 2.85Å
175	E	60.5	Low	72.2	Confident	125 Å²	125	112.4 Å²	112.4	58%	0.584	58%	0.575	S	S	*	*	H	α-helix	trans	-66.6	-40.7	175.1	-65	-150.2	154.8	0	0	112.4	D171 E172 S177 D178 V179	D171-E175 PolarHBondContact O-N 3.39Å; E172-E175 PolarHBondContact O-N 2.83Å; E175-S177 VanDerWaalsContact C-N 3.3Å; E175-S177 PolarHBondContact O-N 3.47Å; E175-D178 PolarHBondContact O-N 2.84Å; E175-V179 VanDerWaalsContact O-CB 3.23Å; E175-V179 WeakPolarHBondContact O-CB 3.18Å; E175-V179 WeakPolarHBondContact O-CG2 3.45Å; E175-V179 PolarHBondContact O-N 3.45Å
176	D	63.4	Low	70.6	Confident	117 Å²	117	109.8 Å²	109.8	63%	0.626	58%	0.583	S	S	*	*	H	α-helix	trans	-64.3	-36.3	174.5	-84.9	-16	0	0	0	111.5	E172 A180	E172-D176 WeakPolarHBondContact O-CB 3.36Å; E172-D176 PolarHBondContact O-N 3.3Å; D176-A180 WeakPolarHBondContact O-CB 3.16Å; D176-A180 PolarHBondContact O-N 3Å
177	S	70.6	Confident	69.2	Low	73 Å²	73	105.4 Å²	105.4	51%	0.51	58%	0.583	S	S	.	*	H	α-helix	trans	-68.8	-43	175.4	-176.7	0	0	0	0	111.8	Q173 F174 E175 A181	Q173-S177 VanDerWaalsContact O-CB 3.26Å; Q173-S177 WeakPolarHBondContact O-CB 3.4Å; Q173-S177 PolarHBondContact O-N 3.03Å; Q173-S177 VanDerWaalsContact O-N 3.1Å; F174-S177 PolarHBondContact O-N 3.48Å; E175-S177 VanDerWaalsContact C-N 3.3Å; E175-S177 PolarHBondContact O-N 3.47Å; S177-A181 VanDerWaalsContact O-CB 3.24Å; S177-A181 WeakPolarHBondContact O-CB 3.15Å; S177-A181 PolarHBondContact O-N 3.49Å
178	D	70.9	Confident	67.9	Low	95 Å²	95	108.1 Å²	108.1	51%	0.508	60%	0.6	S	S	.	*	H	α-helix	trans	-71.9	-37.1	178.6	-89.6	-15.1	0	0	0	112	F174 E175 A181 A182	F174-D178 WeakPolarHBondContact CE1-OD2 3.32Å; F174-D178 PolarHBondContact O-N 2.85Å; E175-D178 PolarHBondContact O-N 2.84Å; D178-A181 PolarHBondContact O-N 3.14Å; D178-A182 VanDerWaalsContact O-CB 3.24Å; D178-A182 WeakPolarHBondContact O-CB 3.11Å; D178-A182 PolarHBondContact O-N 3.25Å
179	V	68.9	Low	66.4	Low	72 Å²	72	103.6 Å²	103.6	44%	0.436	60%	0.601	S	S	.	*	H	α-helix	trans	-70.5	-40.8	173.6	172.7	0	0	0	0	111	E175 A181 A182 M183	E175-V179 VanDerWaalsContact O-CB 3.23Å; E175-V179 WeakPolarHBondContact O-CB 3.18Å; E175-V179 WeakPolarHBondContact O-CG2 3.45Å; E175-V179 PolarHBondContact O-N 3.45Å; V179-A181 VanDerWaalsContact C-N 3.29Å; V179-A181 PolarHBondContact O-N 2.98Å; V179-A182 PolarHBondContact O-N 2.86Å; V179-M183 HydrophobicContact CG1-CE 4.02Å; V179-M183 HydrophobicContact CG1-CG 4.41Å; V179-M183 WeakPolarHBondContact O-CB 3.33Å; V179-M183 PolarHBondContact O-N 2.98Å
180	A	71.1	Confident	65.1	Low	39 Å²	39	106 Å²	106	32%	0.322	62%	0.616	S	S	.	*	H	α-helix	trans	-66.3	-31.5	174	0	0	0	0	0	112.5	D176 G184 F185	D176-A180 WeakPolarHBondContact O-CB 3.16Å; D176-A180 PolarHBondContact O-N 3Å; A180-G184 PolarHBondContact O-N 2.95Å; A180-F185 PolarHBondContact O-N 3.47Å
181	A	74	Confident	63.8	Low	67 Å²	67	111.1 Å²	111.1	55%	0.554	63%	0.627	S	S	*	*	H	α-helix	trans	-71.6	-43.8	171	0	0	0	0	0	111.8	S177 D178 V179 G184	S177-A181 VanDerWaalsContact O-CB 3.24Å; S177-A181 WeakPolarHBondContact O-CB 3.15Å; S177-A181 PolarHBondContact O-N 3.49Å; D178-A181 PolarHBondContact O-N 3.14Å; V179-A181 VanDerWaalsContact C-N 3.29Å; V179-A181 PolarHBondContact O-N 2.98Å; A181-G184 PolarHBondContact O-N 3.35Å
182	A	72.9	Confident	62	Low	90 Å²	90	111.7 Å²	111.7	74%	0.744	64%	0.639	S	S	*	*	H	α-helix	trans	-67.5	-34.7	178.8	0	0	0	0	0	113.2	D178 V179 G184	D178-A182 VanDerWaalsContact O-CB 3.24Å; D178-A182 WeakPolarHBondContact O-CB 3.11Å; D178-A182 PolarHBondContact O-N 3.25Å; V179-A182 PolarHBondContact O-N 2.86Å; A182-G184 VanDerWaalsContact C-N 3.34Å
183	M	70.6	Confident	60.7	Low	132 Å²	132	119.9 Å²	119.9	65%	0.65	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	3.6	174.1	-65.8	-156.4	-164.4	0	0	113.9	V179 F185	V179-M183 HydrophobicContact CG1-CE 4.02Å; V179-M183 HydrophobicContact CG1-CG 4.41Å; V179-M183 WeakPolarHBondContact O-CB 3.33Å; V179-M183 PolarHBondContact O-N 2.98Å; M183-F185 VanDerWaalsContact C-N 3.29Å; M183-F185 HydrophobicContact CB-CD2 3.71Å; M183-F185 HydrophobicContact CB-CE2 3.91Å; M183-F185 PolarHBondContact O-N 2.82Å; M183-F185 HydrophobicContact SD-CE2 4.43Å
184	G	64.8	Low	60.5	Low	56 Å²	56	120.4 Å²	120.4	58%	0.577	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	70.4	14.5	172.8	0	0	0	0	0	116	A180 A181 A182 G186	A180-G184 PolarHBondContact O-N 2.95Å; A181-G184 PolarHBondContact O-N 3.35Å; A182-G184 VanDerWaalsContact C-N 3.34Å; G184-G186 VanDerWaalsContact C-N 3.27Å; G184-G186 PolarHBondContact O-N 2.85Å
185	F	64.6	Low	60.5	Low	162 Å²	162	119.7 Å²	119.7	71%	0.711	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-76.7	-12.5	177.8	-74.9	-75.6	0	0	0	113.6	A180 M183 G187	A180-F185 PolarHBondContact O-N 3.47Å; M183-F185 VanDerWaalsContact C-N 3.29Å; M183-F185 HydrophobicContact CB-CD2 3.71Å; M183-F185 HydrophobicContact CB-CE2 3.91Å; M183-F185 PolarHBondContact O-N 2.82Å; M183-F185 HydrophobicContact SD-CE2 4.43Å; F185-G187 PolarHBondContact O-N 3.24Å
186	G	54.3	Low	60.5	Low	76 Å²	76	119.4 Å²	119.4	78%	0.784	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-66.4	-1.9	175.9	0	0	0	0	0	115.8	G184	G184-G186 VanDerWaalsContact C-N 3.27Å; G184-G186 PolarHBondContact O-N 2.85Å
187	G	55.5	Low	60.3	Low	67 Å²	67	119.6 Å²	119.6	69%	0.691	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-102.5	-7.4	-172.9	0	0	0	0	0	117.3	F185 G189	F185-G187 PolarHBondContact O-N 3.24Å; G187-G189 PolarHBondContact O-N 2.96Å; G187-G189 VanDerWaalsContact O-N 3.1Å
188	F	56.2	Low	59.7	Low	213 Å²	213	122.5 Å²	122.5	93%	0.934	71%	0.707	S	S	*	*	S	Bend	trans	-90.6	79	-174.6	-126.5	-97.6	0	0	0	113.1
189	G	52.5	Low	58.9	Low	59 Å²	59	124.3 Å²	124.3	61%	0.608	72%	0.721	S	S	*	*			trans	73.1	93.9	133.8	0	0	0	0	0	118.6	G187 R191	G187-G189 PolarHBondContact O-N 2.96Å; G187-G189 VanDerWaalsContact O-N 3.1Å; G189-R191 PolarHBondContact O-N 3.18Å
190	K	49.7	Very low	58.2	Low	216 Å²	216	128.1 Å²	128.1	94%	0.939	74%	0.741	S	S	*	*			trans	-54.8	127.3	137.7	-55.9	-173.8	-170.5	-164.7	0	108.9
191	R	48.6	Very low	57.2	Low	220 Å²	220	134.9 Å²	134.9	83%	0.83	77%	0.773	S	S	*	*			trans	-158.1	91	151.3	-169	149.7	63.3	-113.2	3.8	107.4	G189	G189-R191 PolarHBondContact O-N 3.18Å
192	S	37.8	Very low	55.8	Low	117 Å²	117	140.6 Å²	140.6	82%	0.818	79%	0.792	S	S	*	*				45.6	82	94.4	169	0	0	0	0	111.8
193	K	42.3	Very low	54.3	Low	279 Å²	279	145.2 Å²	145.2	100%	1.213	80%	0.796	S	S	*	*			trans	-157.6	0	136.7	-164	148.2	-176	156.7	0	109.9

Retrieved 193 of 193 residues in 34.3 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).