A0A3Q0KGU4_SCHMA Loading...

Large ribosomal subunit protein eL36

AlphaFold DB (Q15ET2), UniProt , Accession A0A3Q0KGU4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 102 aa.

						>A0A3Q0KGU4_SCHMA|A0A3Q0KGU4
MSHIRKYPVCVGREKGLKRTNNIRPKKPSNRRGRLTKQAKFARSLIREVVGFAPFEKRMLELLKNDKEKRALKFAKRRIGGHRRAKKKREELTAIVKSMRMK
					

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	45.4	Very low	68.8	Low	230 Å²	230	138.9 Å²	138.9	100%	1.133	71%	0.706	S	S	*	*				0	108.7	0	-84.4	159.1	148.3	0	0	108.7	H3	M1-H3 PolarHBondContact O-N 3.47Å; M1-H3 PolarHBondContact O-ND1 3.45Å; M1-H3 VanDerWaalsContact O-ND1 3.11Å
2	S	40.8	Very low	70.3	Confident	100 Å²	100	131.8 Å²	131.8	70%	0.699	69%	0.694	S	S	*	*			trans	-54.9	116.3	-170.3	53.9	0	0	0	0	112.3	I4	S2-I4 PolarHBondContact O-N 3.48Å
3	H	56	Low	71.6	Confident	190 Å²	190	141.7 Å²	141.7	88%	0.88	72%	0.716	S	S	*	*			trans	-74.6	65.5	169.1	-71.8	40.5	0	0	0	109.3	M1 R5	M1-H3 PolarHBondContact O-N 3.47Å; M1-H3 PolarHBondContact O-ND1 3.45Å; M1-H3 VanDerWaalsContact O-ND1 3.11Å; H3-R5 PolarHBondContact O-N 3.29Å; H3-R5 VanDerWaalsContact O-N 3.15Å
4	I	63.1	Low	72.6	Confident	126 Å²	126	140.1 Å²	140.1	65%	0.646	71%	0.705	S	S	*	*			trans	-67.2	115.4	170.8	-64.4	166.9	0	0	0	106.1	S2 K6	S2-I4 PolarHBondContact O-N 3.48Å; I4-K6 VanDerWaalsContact C-N 3.3Å; I4-K6 PolarHBondContact O-N 3.08Å
5	R	57.5	Low	73.6	Confident	214 Å²	214	139.9 Å²	139.9	81%	0.808	70%	0.697	S	S	*	*			trans	-57.4	95.5	169.7	-80.1	-179.4	169.8	170.8	-2.7	107.9	H3 Y7	H3-R5 PolarHBondContact O-N 3.29Å; H3-R5 VanDerWaalsContact O-N 3.15Å; R5-Y7 WeakPolarHBondContact O-CD2 3.44Å; R5-Y7 PolarHBondContact O-N 2.99Å; R5-Y7 VanDerWaalsContact O-N 3.08Å
6	K	70.2	Confident	74.5	Confident	110 Å²	110	133.6 Å²	133.6	48%	0.478	68%	0.679	S	S	.	*			trans	-70.6	104.1	178	-68.5	-178.2	-179.4	167.7	0	108.7	I4 E14 K18	I4-K6 VanDerWaalsContact C-N 3.3Å; I4-K6 PolarHBondContact O-N 3.08Å; K6-E14 WeakPolarHBondContact CD-OE2 3.36Å; K6-E14 WeakPolarHBondContact CE-OE2 3.42Å; K6-E14 IonicContact NZ-OE1 2.74Å; K6-E14 PolarHBondContact NZ-OE1 3.45Å; K6-E14 IonicContact NZ-OE2 2.74Å; K6-E14 PolarHBondContact NZ-OE2 3.22Å; K6-K18 WeakPolarHBondContact O-CE 3.49Å; K6-K18 PolarHBondContact O-NZ 2.98Å
7	Y	77.6	Confident	75.2	Confident	175 Å²	175	132.8 Å²	132.8	69%	0.686	68%	0.676	S	S	*	*			trans	-62.6	148.7	167.9	-66.4	-84.3	0	0	0	110	R5 V9	R5-Y7 WeakPolarHBondContact O-CD2 3.44Å; R5-Y7 PolarHBondContact O-N 2.99Å; R5-Y7 VanDerWaalsContact O-N 3.08Å; Y7-V9 PolarHBondContact O-N 3.19Å
8	P	83	Confident	75.7	Confident	77 Å²	77	133.1 Å²	133.1	50%	0.5	67%	0.672	S	S	.	*			trans	-61.6	113.1	169.8	26.7	-32.1	0	0	0	108.4
9	V	86.1	Confident	76.3	Confident	72 Å²	72	136.4 Å²	136.4	44%	0.436	68%	0.675	S	S	.	*			trans	-107.9	151.4	178.6	-71.3	0	0	0	0	109.9	Y7 V11 K15 G16	Y7-V9 PolarHBondContact O-N 3.19Å; V9-V11 VanDerWaalsContact C-N 3.29Å; V9-V11 WeakPolarHBondContact CG2-O 3.33Å; V9-K15 CarbonylContact O-C 3.57Å; V9-K15 WeakPolarHBondContact O-CA 3.48Å; V9-K15 VanDerWaalsContact O-CB 3.3Å; V9-K15 WeakPolarHBondContact O-CB 3.36Å; V9-G16 PolarHBondContact O-N 3.14Å
10	C	87.4	Confident	77	Confident	121 Å²	121	137 Å²	137	82%	0.818	69%	0.687	S	S	*	*	S	Bend	trans	-81.1	-10.2	180	-59.6	0	0	0	0	113.2	K15	C10-K15 WeakPolarHBondContact O-CD 3.28Å
11	V	89.6	Confident	77.7	Confident	113 Å²	113	137.4 Å²	137.4	69%	0.685	69%	0.692	S	S	*	*	S	Bend	trans	-130.2	157.5	-174.7	-63.1	0	0	0	0	111.8	V9	V9-V11 VanDerWaalsContact C-N 3.29Å; V9-V11 WeakPolarHBondContact CG2-O 3.33Å
12	G	87	Confident	79.8	Confident	54 Å²	54	132.5 Å²	132.5	56%	0.557	67%	0.67	S	S	*	*	S	Bend	trans	95.8	-179.3	-179.1	0	0	0	0	0	114.8	K15	G12-K15 WeakPolarHBondContact O-CB 3.48Å; G12-K15 WeakPolarHBondContact O-CD 3.49Å; G12-K15 VanDerWaalsContact O-CG 3.27Å; G12-K15 WeakPolarHBondContact O-CG 3.31Å
13	R	87.4	Confident	82.2	Confident	260 Å²	260	135.4 Å²	135.4	98%	0.981	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-36.3	-175.1	-72.1	-178.8	170.1	175.5	-2.4	113.4
14	E	85	Confident	84	Confident	120 Å²	120	135.7 Å²	135.7	56%	0.561	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.6	33.9	-179.4	-65.9	178.7	-159.5	0	0	112.3	K6	K6-E14 WeakPolarHBondContact CD-OE2 3.36Å; K6-E14 WeakPolarHBondContact CE-OE2 3.42Å; K6-E14 IonicContact NZ-OE1 2.74Å; K6-E14 PolarHBondContact NZ-OE1 3.45Å; K6-E14 IonicContact NZ-OE2 2.74Å; K6-E14 PolarHBondContact NZ-OE2 3.22Å
15	K	87.3	Confident	85.4	Confident	136 Å²	136	135.5 Å²	135.5	59%	0.591	68%	0.676	S	S	*	*			trans	-71.1	161.6	179.8	66.7	-179	177.1	176	0	112.8	V9 C10 G12	V9-K15 CarbonylContact O-C 3.57Å; V9-K15 WeakPolarHBondContact O-CA 3.48Å; V9-K15 VanDerWaalsContact O-CB 3.3Å; V9-K15 WeakPolarHBondContact O-CB 3.36Å; C10-K15 WeakPolarHBondContact O-CD 3.28Å; G12-K15 WeakPolarHBondContact O-CB 3.48Å; G12-K15 WeakPolarHBondContact O-CD 3.49Å; G12-K15 VanDerWaalsContact O-CG 3.27Å; G12-K15 WeakPolarHBondContact O-CG 3.31Å
16	G	88	Confident	87.1	Confident	39 Å²	39	133.9 Å²	133.9	40%	0.402	68%	0.675	S	S	.	*	S	Bend	trans	97.8	173.8	174.5	0	0	0	0	0	113.4	V9 K18	V9-G16 PolarHBondContact O-N 3.14Å; G16-K18 PolarHBondContact O-N 3.34Å
17	L	87.6	Confident	88.3	Confident	121 Å²	121	135.6 Å²	135.6	63%	0.634	68%	0.682	S	S	*	*			trans	-72	125.9	179.7	-170.9	66.1	0	0	0	109.8	R19	L17-R19 HydrophobicContact CB-CG 4.46Å; L17-R19 HydrophobicContact CD2-CG 4.16Å; L17-R19 HydrophobicContact CG-CG 4.22Å; L17-R19 PolarHBondContact O-N 3.08Å
18	K	84	Confident	89.1	Confident	138 Å²	138	132.2 Å²	132.2	60%	0.6	68%	0.682	S	S	*	*			trans	-64.8	104.5	171.9	-67.1	178.7	174.1	178.6	0	108.9	K6 G16	K6-K18 WeakPolarHBondContact O-CE 3.49Å; K6-K18 PolarHBondContact O-NZ 2.98Å; G16-K18 PolarHBondContact O-N 3.34Å
19	R	86.5	Confident	89.7	Confident	196 Å²	196	132.6 Å²	132.6	74%	0.74	69%	0.686	S	S	*	*			trans	-117.2	145.3	174.9	-65.8	-176	179.5	-167.8	-3.8	109.3	L17 N21	L17-R19 HydrophobicContact CB-CG 4.46Å; L17-R19 HydrophobicContact CD2-CG 4.16Å; L17-R19 HydrophobicContact CG-CG 4.22Å; L17-R19 PolarHBondContact O-N 3.08Å; R19-N21 PolarHBondContact O-N 2.91Å
20	T	91	Very high	90.1	Very high	147 Å²	147	134.9 Å²	134.9	90%	0.902	70%	0.696	S	S	*	*			trans	-69.4	120.6	168.7	-51.4	0	0	0	0	108.8	N22	T20-N22 PolarHBondContact O-N 3.34Å
21	N	90.1	Very high	90.3	Very high	147 Å²	147	137.1 Å²	137.1	79%	0.786	69%	0.687	S	S	*	*			trans	-72	127.6	-179.2	-73.2	-33	0	0	0	111.1	R19	R19-N21 PolarHBondContact O-N 2.91Å
22	N	91	Very high	90.5	Very high	126 Å²	126	143 Å²	143	67%	0.674	70%	0.697	S	S	*	*			trans	-85.3	114.1	170.4	-177.8	-1.7	0	0	0	110.2	T20 R24	T20-N22 PolarHBondContact O-N 3.34Å; N22-R24 PolarHBondContact O-N 3.4Å; N22-R24 VanDerWaalsContact O-N 3.15Å
23	I	91.6	Very high	90.7	Very high	161 Å²	161	144.3 Å²	144.3	83%	0.826	71%	0.711	S	S	*	*			trans	-80.2	96	178.6	-51.9	176.6	0	0	0	109.2
24	R	92.7	Very high	91	Very high	197 Å²	197	141.6 Å²	141.6	74%	0.743	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-79.3	147.6	176.8	-61.8	-178.6	-176.9	-175.4	0.1	111.6	N22	N22-R24 PolarHBondContact O-N 3.4Å; N22-R24 VanDerWaalsContact O-N 3.15Å
25	P	92.5	Very high	91.5	Very high	121 Å²	121	140.3 Å²	140.3	79%	0.786	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-60.6	144.3	171.7	26.4	-34.1	0	0	0	110.8	K27	P25-K27 PolarHBondContact O-N 3.43Å
26	K	93.4	Very high	91.9	Very high	181 Å²	181	137.6 Å²	137.6	79%	0.787	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-65.1	125.7	178.6	-67.7	-179	-178.4	176.3	0	110
27	K	95.2	Very high	92.3	Very high	145 Å²	145	145.1 Å²	145.1	63%	0.63	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-55.5	138.6	177.8	-65.6	-174.5	177.1	-175.5	0	111.3	P25 S29 N30	P25-K27 PolarHBondContact O-N 3.43Å; K27-S29 PolarHBondContact O-N 2.96Å; K27-N30 WeakPolarHBondContact O-CB 3.39Å; K27-N30 PolarHBondContact O-N 3.4Å
28	P	94.4	Very high	92.8	Very high	104 Å²	104	147.2 Å²	147.2	68%	0.675	72%	0.72	S	S	*	*	G	3₁₀ helix	trans	-56.1	-33.5	175.7	-27.2	35.2	0	0	0	113.8	N30 R31	P28-N30 PolarHBondContact O-N 2.85Å; P28-N30 VanDerWaalsContact O-N 3.16Å; P28-R31 VanDerWaalsContact O-CB 3.31Å; P28-R31 WeakPolarHBondContact O-CB 3.44Å; P28-R31 PolarHBondContact O-N 3.22Å
29	S	95.8	Very high	93.3	Very high	85 Å²	85	142 Å²	142	59%	0.594	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-56.3	-30.2	176.4	56	0	0	0	0	113.4	K27 R31 R32	K27-S29 PolarHBondContact O-N 2.96Å; S29-R31 PolarHBondContact O-N 3.01Å; S29-R32 WeakPolarHBondContact O-CB 3.44Å; S29-R32 PolarHBondContact O-N 3.23Å
30	N	94.3	Very high	93.8	Very high	120 Å²	120	139.2 Å²	139.2	64%	0.642	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-71.3	-11.9	177.3	-63	-13.1	0	0	0	113	K27 P28 R32	K27-N30 WeakPolarHBondContact O-CB 3.39Å; K27-N30 PolarHBondContact O-N 3.4Å; P28-N30 PolarHBondContact O-N 2.85Å; P28-N30 VanDerWaalsContact O-N 3.16Å; N30-R32 VanDerWaalsContact C-N 3.33Å
31	R	92.1	Very high	94.1	Very high	169 Å²	169	138.6 Å²	138.6	64%	0.638	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-84.2	-5.9	176.8	-57.5	-175.7	-172	-175.7	3.2	113	P28 S29 G33 R34	P28-R31 VanDerWaalsContact O-CB 3.31Å; P28-R31 WeakPolarHBondContact O-CB 3.44Å; P28-R31 PolarHBondContact O-N 3.22Å; S29-R31 PolarHBondContact O-N 3.01Å; R31-G33 PolarHBondContact O-N 3.48Å; R31-R34 WeakPolarHBondContact O-CB 3.48Å; R31-R34 PolarHBondContact O-N 2.93Å
32	R	93.8	Very high	94.4	Very high	237 Å²	237	133.8 Å²	133.8	89%	0.894	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.5	129.4	-180	-172.6	179.1	-178.7	-171.7	1.4	110.4	S29 N30	S29-R32 WeakPolarHBondContact O-CB 3.44Å; S29-R32 PolarHBondContact O-N 3.23Å; N30-R32 VanDerWaalsContact C-N 3.33Å
33	G	91.5	Very high	94.7	Very high	81 Å²	81	135.7 Å²	135.7	84%	0.835	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	93.8	-3.6	179.4	0	0	0	0	0	115.4	R31	R31-G33 PolarHBondContact O-N 3.48Å
34	R	93.8	Very high	94.8	Very high	203 Å²	203	131 Å²	131	77%	0.766	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-65.6	138	170.1	-170.3	177.6	-178.6	-172.5	2	110.4	R31 T36	R31-R34 WeakPolarHBondContact O-CB 3.48Å; R31-R34 PolarHBondContact O-N 2.93Å; R34-T36 PolarHBondContact O-N 2.95Å
35	L	94.3	Very high	95	Very high	92 Å²	92	125.2 Å²	125.2	48%	0.482	62%	0.624	S	S	.	*	P	Polyproline II helix	trans	-72.6	121.3	176.2	-173.5	67	0	0	0	110.4	A39 K40	L35-A39 HydrophobicContact CD1-CB 4.44Å; L35-K40 HydrophobicContact CD1-CB 4.14Å; L35-K40 HydrophobicContact CD2-CB 4Å; L35-K40 HydrophobicContact CD2-CD 4.16Å; L35-K40 HydrophobicContact CD2-CG 4.08Å; L35-K40 HydrophobicContact CG-CB 4.04Å
36	T	96.3	Very high	95.2	Very high	79 Å²	79	124.5 Å²	124.5	49%	0.485	61%	0.613	S	S	.	*	P	Polyproline II helix	trans	-90.6	160.2	172.3	63.4	0	0	0	0	110.9	R34 Q38 A39 K40	R34-T36 PolarHBondContact O-N 2.95Å; T36-Q38 PolarHBondContact O-N 2.93Å; T36-A39 PolarHBondContact O-N 3.27Å; T36-A39 WeakPolarHBondContact OG1-CB 3.5Å; T36-A39 PolarHBondContact OG1-N 3.22Å; T36-K40 WeakPolarHBondContact O-CB 3.41Å; T36-K40 PolarHBondContact O-N 3.33Å
37	K	96.8	Very high	95.2	Very high	197 Å²	197	119 Å²	119	86%	0.857	59%	0.587	S	S	*	*	H	α-helix	trans	-58.6	-48.1	179	-68.5	-175.9	179	-178.4	0	111.7	K40 F41	K37-K40 WeakPolarHBondContact O-CB 3.49Å; K37-K40 PolarHBondContact O-N 3.31Å; K37-F41 PolarHBondContact O-N 3.25Å; K37-F41 VanDerWaalsContact O-N 3.08Å
38	Q	96.8	Very high	95.2	Very high	165 Å²	165	119.8 Å²	119.8	77%	0.771	59%	0.593	S	S	*	*	H	α-helix	trans	-61	-46.4	177.4	-70.9	171.9	-25.5	0	0	112.2	T36 K40 F41 A42	T36-Q38 PolarHBondContact O-N 2.93Å; Q38-K40 VanDerWaalsContact C-N 3.3Å; Q38-K40 PolarHBondContact O-N 3.43Å; Q38-F41 PolarHBondContact O-N 3.14Å; Q38-A42 PolarHBondContact O-N 3.06Å
39	A	96.3	Very high	95.3	Very high	29 Å²	29	121 Å²	121	24%	0.24	60%	0.598	C	S	.	*	H	α-helix	trans	-65.9	-33.1	178.9	0	0	0	0	0	112.5	L35 T36 R43	L35-A39 HydrophobicContact CD1-CB 4.44Å; T36-A39 PolarHBondContact O-N 3.27Å; T36-A39 WeakPolarHBondContact OG1-CB 3.5Å; T36-A39 PolarHBondContact OG1-N 3.22Å; A39-R43 WeakPolarHBondContact O-CB 3.32Å; A39-R43 WeakPolarHBondContact O-CD 3.42Å; A39-R43 WeakPolarHBondContact O-CG 3.39Å; A39-R43 PolarHBondContact O-N 2.91Å; A39-R43 VanDerWaalsContact O-N 3.1Å
40	K	96.2	Very high	95.3	Very high	138 Å²	138	122.3 Å²	122.3	60%	0.6	60%	0.602	S	S	*	*	H	α-helix	trans	-63	-48.5	173.5	-176.5	178.8	177.3	-174	0	110.8	L35 T36 K37 Q38 R43 S44	L35-K40 HydrophobicContact CD1-CB 4.14Å; L35-K40 HydrophobicContact CD2-CB 4Å; L35-K40 HydrophobicContact CD2-CD 4.16Å; L35-K40 HydrophobicContact CD2-CG 4.08Å; L35-K40 HydrophobicContact CG-CB 4.04Å; T36-K40 WeakPolarHBondContact O-CB 3.41Å; T36-K40 PolarHBondContact O-N 3.33Å; K37-K40 WeakPolarHBondContact O-CB 3.49Å; K37-K40 PolarHBondContact O-N 3.31Å; Q38-K40 VanDerWaalsContact C-N 3.3Å; Q38-K40 PolarHBondContact O-N 3.43Å; K40-R43 PolarHBondContact O-N 3.41Å; K40-S44 PolarHBondContact O-N 2.9Å; K40-S44 PolarHBondContact O-OG 3.41Å
41	F	97	Very high	95.3	Very high	134 Å²	134	117.9 Å²	117.9	59%	0.588	58%	0.584	S	S	*	*	H	α-helix	trans	-61.6	-49.1	179.7	178.7	-109.2	0	0	0	112.3	K37 Q38 R43 S44 L45	K37-F41 PolarHBondContact O-N 3.25Å; K37-F41 VanDerWaalsContact O-N 3.08Å; Q38-F41 PolarHBondContact O-N 3.14Å; F41-R43 VanDerWaalsContact C-N 3.31Å; F41-R43 PolarHBondContact O-N 2.91Å; F41-S44 PolarHBondContact O-N 2.95Å; F41-S44 PolarHBondContact O-OG 2.95Å; F41-L45 HydrophobicContact CD1-CD1 3.98Å; F41-L45 HydrophobicContact CE1-CD1 3.42Å; F41-L45 VanDerWaalsContact CE1-CD1 3.42Å; F41-L45 HydrophobicContact CE1-CG 4.34Å; F41-L45 HydrophobicContact CE2-CD1 4.09Å; F41-L45 HydrophobicContact CE2-CD2 4.39Å; F41-L45 HydrophobicContact CE2-CG 4.22Å; F41-L45 HydrophobicContact CZ-CD1 3.5Å; F41-L45 VanDerWaalsContact CZ-CD1 3.5Å; F41-L45 HydrophobicContact CZ-CD2 4.39Å; F41-L45 HydrophobicContact CZ-CG 4.12Å; F41-L45 WeakPolarHBondContact O-CG 3.42Å; F41-L45 PolarHBondContact O-N 3.22Å
42	A	97.1	Very high	95.4	Very high	46 Å²	46	112.2 Å²	112.2	38%	0.38	57%	0.565	S	S	.	*	H	α-helix	trans	-59.3	-42	177	0	0	0	0	0	112.2	Q38 L45 I46	Q38-A42 PolarHBondContact O-N 3.06Å; A42-L45 PolarHBondContact O-N 3.26Å; A42-I46 WeakPolarHBondContact O-CD1 3.3Å; A42-I46 VanDerWaalsContact O-CG1 3.27Å; A42-I46 WeakPolarHBondContact O-CG1 3.5Å; A42-I46 PolarHBondContact O-N 2.87Å
43	R	96	Very high	95.5	Very high	166 Å²	166	102.6 Å²	102.6	63%	0.626	54%	0.536	S	S	*	.	H	α-helix	trans	-67.3	-36.8	178.4	-73.1	173.2	-170.8	-175.1	4.4	113.2	A39 K40 F41 R47	A39-R43 WeakPolarHBondContact O-CB 3.32Å; A39-R43 WeakPolarHBondContact O-CD 3.42Å; A39-R43 WeakPolarHBondContact O-CG 3.39Å; A39-R43 PolarHBondContact O-N 2.91Å; A39-R43 VanDerWaalsContact O-N 3.1Å; K40-R43 PolarHBondContact O-N 3.41Å; F41-R43 VanDerWaalsContact C-N 3.31Å; F41-R43 PolarHBondContact O-N 2.91Å; R43-R47 WeakPolarHBondContact O-CB 3.4Å; R43-R47 PolarHBondContact O-N 3.23Å; R43-R47 VanDerWaalsContact O-N 3.13Å
44	S	94.5	Very high	95.7	Very high	62 Å²	62	104 Å²	104	43%	0.434	53%	0.53	S	S	.	.	H	α-helix	trans	-67.7	-43.5	176.5	50.8	0	0	0	0	111.5	K40 F41 R47 E48	K40-S44 PolarHBondContact O-N 2.9Å; K40-S44 PolarHBondContact O-OG 3.41Å; F41-S44 PolarHBondContact O-N 2.95Å; F41-S44 PolarHBondContact O-OG 2.95Å; S44-R47 PolarHBondContact O-N 3.36Å; S44-E48 PolarHBondContact O-N 3.33Å; S44-E48 VanDerWaalsContact O-N 3.09Å
45	L	96.6	Very high	95.8	Very high	75 Å²	75	96.8 Å²	96.8	39%	0.393	50%	0.504	S	S	.	.	H	α-helix	trans	-60.3	-48.2	176.7	-71.3	179.3	0	0	0	111.9	F41 A42 R47 E48 V49	F41-L45 HydrophobicContact CD1-CD1 3.98Å; F41-L45 HydrophobicContact CE1-CD1 3.42Å; F41-L45 VanDerWaalsContact CE1-CD1 3.42Å; F41-L45 HydrophobicContact CE1-CG 4.34Å; F41-L45 HydrophobicContact CE2-CD1 4.09Å; F41-L45 HydrophobicContact CE2-CD2 4.39Å; F41-L45 HydrophobicContact CE2-CG 4.22Å; F41-L45 HydrophobicContact CZ-CD1 3.5Å; F41-L45 VanDerWaalsContact CZ-CD1 3.5Å; F41-L45 HydrophobicContact CZ-CD2 4.39Å; F41-L45 HydrophobicContact CZ-CG 4.12Å; F41-L45 WeakPolarHBondContact O-CG 3.42Å; F41-L45 PolarHBondContact O-N 3.22Å; A42-L45 PolarHBondContact O-N 3.26Å; L45-R47 VanDerWaalsContact C-N 3.26Å; L45-R47 PolarHBondContact O-N 2.66Å; L45-E48 WeakPolarHBondContact O-CB 3.3Å; L45-E48 PolarHBondContact O-N 3.49Å; L45-E48 VanDerWaalsContact O-N 3.14Å; L45-V49 WeakPolarHBondContact O-CG2 3.45Å; L45-V49 PolarHBondContact O-N 3.35Å
46	I	96.5	Very high	95.8	Very high	107 Å²	107	92.9 Å²	92.9	55%	0.549	48%	0.484	S	S	.	.	H	α-helix	trans	-61.2	-37.7	178.7	-67.2	166	0	0	0	111.1	A42 E48 V49 V50	A42-I46 WeakPolarHBondContact O-CD1 3.3Å; A42-I46 VanDerWaalsContact O-CG1 3.27Å; A42-I46 WeakPolarHBondContact O-CG1 3.5Å; A42-I46 PolarHBondContact O-N 2.87Å; I46-E48 VanDerWaalsContact C-N 3.3Å; I46-E48 PolarHBondContact O-N 3.33Å; I46-V49 PolarHBondContact O-N 2.84Å; I46-V50 HydrophobicContact CG2-CG2 4.01Å; I46-V50 WeakPolarHBondContact O-CB 3.34Å; I46-V50 WeakPolarHBondContact O-CG2 3.37Å; I46-V50 PolarHBondContact O-N 3.09Å
47	R	94.5	Very high	95.8	Very high	66 Å²	66	94.8 Å²	94.8	25%	0.249	49%	0.485	C	S	.	.	H	α-helix	trans	-66.1	-34.1	178.6	-176	55.2	147.1	-172	-12.9	112.3	R43 S44 L45 G51 F52 E56 E91	R43-R47 WeakPolarHBondContact O-CB 3.4Å; R43-R47 PolarHBondContact O-N 3.23Å; R43-R47 VanDerWaalsContact O-N 3.13Å; S44-R47 PolarHBondContact O-N 3.36Å; L45-R47 VanDerWaalsContact C-N 3.26Å; L45-R47 PolarHBondContact O-N 2.66Å; R47-G51 WeakPolarHBondContact CD-O 3.49Å; R47-G51 PolarHBondContact NH1-O 3.49Å; R47-G51 WeakPolarHBondContact O-CA 3.38Å; R47-G51 PolarHBondContact O-N 3.1Å; R47-F52 VanDerWaalsContact NH2-CD1 3.31Å; R47-F52 VanDerWaalsContact NH2-CE1 3.31Å; R47-E56 IonicContact CZ-OE1 3.8Å; R47-E56 IonicContact CZ-OE2 3.86Å; R47-E56 IonicContact NH1-OE1 2.78Å; R47-E56 IonicContact NH1-OE2 3.01Å; R47-E56 PolarHBondContact NH1-OE2 3.37Å; R47-E56 IonicContact NH2-OE1 3.77Å; R47-E56 PolarHBondContact NH2-OE1 3.17Å; R47-E56 IonicContact NH2-OE2 2.75Å; R47-E56 PolarHBondContact NH2-OE2 2.87Å; R47-E91 IonicContact NH2-OE1 2.93Å; R47-E91 PolarHBondContact NH2-OE1 2.83Å
48	E	93.8	Very high	95.7	Very high	160 Å²	160	90.1 Å²	90.1	75%	0.748	46%	0.463	S	S	*	.	H	α-helix	trans	-69.8	-45.2	175	-174.3	173.4	179.5	0	0	111.6	S44 L45 I46	S44-E48 PolarHBondContact O-N 3.33Å; S44-E48 VanDerWaalsContact O-N 3.09Å; L45-E48 WeakPolarHBondContact O-CB 3.3Å; L45-E48 PolarHBondContact O-N 3.49Å; L45-E48 VanDerWaalsContact O-N 3.14Å; I46-E48 VanDerWaalsContact C-N 3.3Å; I46-E48 PolarHBondContact O-N 3.33Å
49	V	97.4	Very high	95.7	Very high	129 Å²	129	82.3 Å²	82.3	78%	0.782	43%	0.426	S	S	*	.	H	α-helix	trans	-69.9	-46.6	-178.9	176	0	0	0	0	112.6	L45 I46	L45-V49 WeakPolarHBondContact O-CG2 3.45Å; L45-V49 PolarHBondContact O-N 3.35Å; I46-V49 PolarHBondContact O-N 2.84Å
50	V	96.6	Very high	95.6	Very high	114 Å²	114	81.7 Å²	81.7	69%	0.691	42%	0.418	S	S	*	.	H	α-helix	trans	-88.9	-29.7	-172.7	-178.5	0	0	0	0	112.5	I46	I46-V50 HydrophobicContact CG2-CG2 4.01Å; I46-V50 WeakPolarHBondContact O-CB 3.34Å; I46-V50 WeakPolarHBondContact O-CG2 3.37Å; I46-V50 PolarHBondContact O-N 3.09Å
51	G	93.6	Very high	95.5	Very high	26 Å²	26	80.5 Å²	80.5	27%	0.268	42%	0.415	S	S	.	.			trans	77.1	-146.3	-178	0	0	0	0	0	115.2	R47	R47-G51 WeakPolarHBondContact CD-O 3.49Å; R47-G51 PolarHBondContact NH1-O 3.49Å; R47-G51 WeakPolarHBondContact O-CA 3.38Å; R47-G51 PolarHBondContact O-N 3.1Å
52	F	94.8	Very high	95.5	Very high	50 Å²	50	74.9 Å²	74.9	22%	0.219	39%	0.391	C	S	.	.			trans	-106.2	139.6	-173.7	-65.5	-78	0	0	0	112.8	R47 E56 K57 L60 L92 I95 M99	R47-F52 VanDerWaalsContact NH2-CD1 3.31Å; R47-F52 VanDerWaalsContact NH2-CE1 3.31Å; F52-E56 HydrophobicContact CB-CB 4.17Å; F52-E56 HydrophobicContact CD1-CB 4.21Å; F52-K57 HydrophobicContact CB-CG 3.85Å; F52-K57 VanDerWaalsContact O-CE 3.3Å; F52-K57 WeakPolarHBondContact O-CE 3.44Å; F52-L60 HydrophobicContact CD1-CD1 3.92Å; F52-L60 HydrophobicContact CD2-CD1 3.94Å; F52-L60 HydrophobicContact CE1-CD1 4.07Å; F52-L60 HydrophobicContact CE2-CD1 4.09Å; F52-L60 HydrophobicContact CG-CD1 3.88Å; F52-L60 HydrophobicContact CZ-CD1 4.18Å; F52-L92 HydrophobicContact CD1-CD2 4.13Å; F52-L92 HydrophobicContact CE1-CD2 3.91Å; F52-I95 HydrophobicContact CE1-CD1 3.61Å; F52-I95 HydrophobicContact CE1-CG2 4.44Å; F52-I95 HydrophobicContact CZ-CD1 3.79Å; F52-I95 HydrophobicContact CZ-CG2 3.76Å; F52-M99 HydrophobicContact CE2-CE 4.31Å
53	A	94.8	Very high	95.3	Very high	36 Å²	36	73.2 Å²	73.2	30%	0.298	38%	0.376	S	S	.	.			trans	-67.4	156.7	172.1	0	0	0	0	0	111.5	F55 E56 K57	A53-F55 VanDerWaalsContact C-N 3.29Å; A53-F55 HydrophobicContact CB-CD1 3.8Å; A53-F55 HydrophobicContact CB-CE1 3.61Å; A53-F55 PolarHBondContact O-N 3.3Å; A53-F55 VanDerWaalsContact O-N 3.16Å; A53-E56 HydrophobicContact CB-CG 4.18Å; A53-E56 PolarHBondContact N-OE2 3.37Å; A53-E56 WeakPolarHBondContact O-CA 3.34Å; A53-E56 WeakPolarHBondContact O-CB 3.43Å; A53-E56 PolarHBondContact O-N 2.97Å; A53-K57 PolarHBondContact O-N 2.86Å
54	P	96.4	Very high	95.2	Very high	109 Å²	109	71 Å²	71	71%	0.708	37%	0.37	S	S	*	.	H	α-helix	trans	-56.3	-37.3	-176.4	-28.1	35.1	0	0	0	114.5	K57 R58	P54-K57 PolarHBondContact O-N 3.11Å; P54-R58 PolarHBondContact O-N 3.44Å
55	F	95.4	Very high	95.1	Very high	52 Å²	52	72.9 Å²	72.9	23%	0.228	38%	0.376	C	S	.	.	H	α-helix	trans	-71.9	-30.5	176.5	79.5	-86.8	0	0	0	112.4	A53 M59 F74 R78	A53-F55 VanDerWaalsContact C-N 3.29Å; A53-F55 HydrophobicContact CB-CD1 3.8Å; A53-F55 HydrophobicContact CB-CE1 3.61Å; A53-F55 PolarHBondContact O-N 3.3Å; A53-F55 VanDerWaalsContact O-N 3.16Å; F55-M59 HydrophobicContact CD2-SD 4.2Å; F55-M59 HydrophobicContact CE2-SD 4.41Å; F55-M59 WeakPolarHBondContact O-CG 3.4Å; F55-M59 PolarHBondContact O-N 3.13Å; F55-F74 HydrophobicContact CB-CE1 4.27Å; F55-F74 HydrophobicContact CB-CZ 4.3Å; F55-R78 HydrophobicContact CB-CG 4.45Å
56	E	95	Very high	94.8	Very high	11 Å²	11	75 Å²	75	5%	0.051	39%	0.387	C	S	.	.	H	α-helix	trans	-71	-39.6	175.6	-63.3	-176.5	129.3	0	0	110.4	R47 F52 A53 R58 M59 L60 K88 L92	R47-E56 IonicContact CZ-OE1 3.8Å; R47-E56 IonicContact CZ-OE2 3.86Å; R47-E56 IonicContact NH1-OE1 2.78Å; R47-E56 IonicContact NH1-OE2 3.01Å; R47-E56 PolarHBondContact NH1-OE2 3.37Å; R47-E56 IonicContact NH2-OE1 3.77Å; R47-E56 PolarHBondContact NH2-OE1 3.17Å; R47-E56 IonicContact NH2-OE2 2.75Å; R47-E56 PolarHBondContact NH2-OE2 2.87Å; F52-E56 HydrophobicContact CB-CB 4.17Å; F52-E56 HydrophobicContact CD1-CB 4.21Å; A53-E56 HydrophobicContact CB-CG 4.18Å; A53-E56 PolarHBondContact N-OE2 3.37Å; A53-E56 WeakPolarHBondContact O-CA 3.34Å; A53-E56 WeakPolarHBondContact O-CB 3.43Å; A53-E56 PolarHBondContact O-N 2.97Å; E56-R58 PolarHBondContact O-N 3.47Å; E56-M59 CarbonylContact O-C 3.59Å; E56-M59 WeakPolarHBondContact O-CA 3.42Å; E56-M59 WeakPolarHBondContact O-CB 3.47Å; E56-M59 PolarHBondContact O-N 3.02Å; E56-M59 VanDerWaalsContact O-N 3.1Å; E56-L60 WeakPolarHBondContact O-CG 3.43Å; E56-L60 PolarHBondContact O-N 2.89Å; E56-K88 WeakPolarHBondContact OE1-CE 3.38Å; E56-K88 IonicContact OE1-NZ 3.21Å; E56-K88 PolarHBondContact OE1-NZ 3.47Å; E56-L92 HydrophobicContact CB-CD1 4.22Å; E56-L92 HydrophobicContact CB-CD2 4.39Å
57	K	94.9	Very high	94.7	Very high	119 Å²	119	74.9 Å²	74.9	52%	0.517	38%	0.383	S	S	.	.	H	α-helix	trans	-56.7	-49.3	172.2	-66.6	-177	179.7	-178	0	111.4	F52 A53 P54 M59 L60 E61	F52-K57 HydrophobicContact CB-CG 3.85Å; F52-K57 VanDerWaalsContact O-CE 3.3Å; F52-K57 WeakPolarHBondContact O-CE 3.44Å; A53-K57 PolarHBondContact O-N 2.86Å; P54-K57 PolarHBondContact O-N 3.11Å; K57-M59 VanDerWaalsContact C-N 3.28Å; K57-M59 PolarHBondContact O-N 3.19Å; K57-L60 WeakPolarHBondContact O-CB 3.33Å; K57-L60 PolarHBondContact O-N 3.07Å; K57-L60 VanDerWaalsContact O-N 3.09Å; K57-E61 PolarHBondContact O-N 3.5Å
58	R	95.8	Very high	94.6	Very high	99 Å²	99	76 Å²	76	37%	0.374	39%	0.391	S	S	.	.	H	α-helix	trans	-60.6	-35.1	174.2	-172.4	172.5	-170.8	-127.6	9.8	113.1	P54 E56 L62 F74	P54-R58 PolarHBondContact O-N 3.44Å; E56-R58 PolarHBondContact O-N 3.47Å; R58-L62 WeakPolarHBondContact O-CG 3.4Å; R58-L62 PolarHBondContact O-N 3.05Å; R58-F74 HydrophobicContact CB-CE1 3.97Å; R58-F74 HydrophobicContact CB-CZ 4.39Å; R58-F74 HydrophobicContact CG-CD1 4.47Å; R58-F74 HydrophobicContact CG-CE1 3.97Å; R58-F74 HydrophobicContact CG-CZ 4.26Å
59	M	95.9	Very high	94.7	Very high	0 Å²	0	76.1 Å²	76.1	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-68.1	-41.2	174.1	-76.4	-178.3	67.1	0	0	111.9	F55 E56 K57 E61 L62 L63 F74 A75 K88 L92	F55-M59 HydrophobicContact CD2-SD 4.2Å; F55-M59 HydrophobicContact CE2-SD 4.41Å; F55-M59 WeakPolarHBondContact O-CG 3.4Å; F55-M59 PolarHBondContact O-N 3.13Å; E56-M59 CarbonylContact O-C 3.59Å; E56-M59 WeakPolarHBondContact O-CA 3.42Å; E56-M59 WeakPolarHBondContact O-CB 3.47Å; E56-M59 PolarHBondContact O-N 3.02Å; E56-M59 VanDerWaalsContact O-N 3.1Å; K57-M59 VanDerWaalsContact C-N 3.28Å; K57-M59 PolarHBondContact O-N 3.19Å; M59-E61 VanDerWaalsContact C-N 3.35Å; M59-L62 PolarHBondContact O-N 3.21Å; M59-L63 WeakPolarHBondContact O-CB 3.32Å; M59-L63 VanDerWaalsContact O-CG 3.28Å; M59-L63 WeakPolarHBondContact O-CG 3.38Å; M59-L63 PolarHBondContact O-N 2.75Å; M59-F74 HydrophobicContact CG-CD1 3.73Å; M59-F74 HydrophobicContact CG-CE1 4.06Å; M59-A75 HydrophobicContact CE-CB 3.42Å; M59-A75 VanDerWaalsContact CE-CB 3.42Å; M59-A75 HydrophobicContact SD-CB 3.61Å; M59-K88 HydrophobicContact CE-CG 4.04Å; M59-K88 HydrophobicContact SD-CG 4.15Å; M59-L92 HydrophobicContact CB-CD1 3.44Å; M59-L92 VanDerWaalsContact CB-CD1 3.44Å; M59-L92 HydrophobicContact CE-CD1 3.88Å; M59-L92 HydrophobicContact CG-CD1 4.31Å; M59-L92 HydrophobicContact SD-CD1 3.99Å
60	L	95.3	Very high	94.6	Very high	16 Å²	16	76.8 Å²	76.8	8%	0.084	38%	0.378	C	S	.	.	H	α-helix	trans	-60.8	-42.8	176.1	-72.5	167.6	0	0	0	111.3	F52 E56 K57 L62 L63 K64 L92 I95 V96	F52-L60 HydrophobicContact CD1-CD1 3.92Å; F52-L60 HydrophobicContact CD2-CD1 3.94Å; F52-L60 HydrophobicContact CE1-CD1 4.07Å; F52-L60 HydrophobicContact CE2-CD1 4.09Å; F52-L60 HydrophobicContact CG-CD1 3.88Å; F52-L60 HydrophobicContact CZ-CD1 4.18Å; E56-L60 WeakPolarHBondContact O-CG 3.43Å; E56-L60 PolarHBondContact O-N 2.89Å; K57-L60 WeakPolarHBondContact O-CB 3.33Å; K57-L60 PolarHBondContact O-N 3.07Å; K57-L60 VanDerWaalsContact O-N 3.09Å; L60-L62 PolarHBondContact O-N 3.03Å; L60-L63 PolarHBondContact O-N 3.44Å; L60-K64 WeakPolarHBondContact O-CG 3.43Å; L60-K64 PolarHBondContact O-N 3.01Å; L60-L92 HydrophobicContact CD2-CB 3.94Å; L60-L92 HydrophobicContact CD2-CD2 4.11Å; L60-L92 HydrophobicContact CD2-CG 4.44Å; L60-L92 HydrophobicContact CG-CD1 4.43Å; L60-L92 HydrophobicContact CG-CD2 4.25Å; L60-I95 HydrophobicContact CD2-CG2 4.45Å; L60-V96 HydrophobicContact CD2-CG2 3.6Å
61	E	94.2	Very high	94.6	Very high	114 Å²	114	71.3 Å²	71.3	53%	0.533	35%	0.345	S	S	.	.	H	α-helix	trans	-58.6	-45.6	174	-70	164.2	-166.3	0	0	112.4	K57 M59 L63 K64 N65	K57-E61 PolarHBondContact O-N 3.5Å; M59-E61 VanDerWaalsContact C-N 3.35Å; E61-L63 VanDerWaalsContact C-N 3.31Å; E61-L63 PolarHBondContact O-N 3.4Å; E61-K64 PolarHBondContact O-N 2.78Å; E61-N65 PolarHBondContact O-N 2.9Å; E61-N65 PolarHBondContact O-ND2 2.91Å
62	L	95.3	Very high	94.7	Very high	16 Å²	16	71.5 Å²	71.5	8%	0.084	34%	0.339	C	S	.	.	H	α-helix	trans	-65.2	-36.1	177.4	-70.8	173.1	0	0	0	112.2	R58 M59 L60 K67 R70 A71 F74	R58-L62 WeakPolarHBondContact O-CG 3.4Å; R58-L62 PolarHBondContact O-N 3.05Å; M59-L62 PolarHBondContact O-N 3.21Å; L60-L62 PolarHBondContact O-N 3.03Å; L62-K67 PolarHBondContact O-N 3.33Å; L62-R70 HydrophobicContact CD1-CG 4.4Å; L62-R70 HydrophobicContact CD2-CG 4.21Å; L62-A71 HydrophobicContact CB-CB 3.86Å; L62-A71 HydrophobicContact CD1-CB 4.35Å; L62-F74 HydrophobicContact CD1-CB 4.24Å; L62-F74 HydrophobicContact CD1-CD1 4.44Å
63	L	94.7	Very high	94.8	Very high	10 Å²	10	76.1 Å²	76.1	5%	0.052	36%	0.359	C	S	.	.	H	α-helix	trans	-74.3	-32.8	177.9	-71.1	171.2	0	0	0	112.5	M59 L60 E61 N65 D66 E68 A71 R89 L92 V96	M59-L63 WeakPolarHBondContact O-CB 3.32Å; M59-L63 VanDerWaalsContact O-CG 3.28Å; M59-L63 WeakPolarHBondContact O-CG 3.38Å; M59-L63 PolarHBondContact O-N 2.75Å; L60-L63 PolarHBondContact O-N 3.44Å; E61-L63 VanDerWaalsContact C-N 3.31Å; E61-L63 PolarHBondContact O-N 3.4Å; L63-N65 VanDerWaalsContact C-N 3.26Å; L63-N65 PolarHBondContact O-N 3.16Å; L63-D66 PolarHBondContact O-N 3.06Å; L63-E68 HydrophobicContact CD2-CG 4.3Å; L63-A71 HydrophobicContact CD2-CB 4Å; L63-A71 HydrophobicContact CG-CB 4.14Å; L63-R89 HydrophobicContact CD2-CG 4.08Å; L63-L92 HydrophobicContact CD1-CB 3.64Å; L63-V96 HydrophobicContact CB-CG2 4.34Å
64	K	92.7	Very high	94.9	Very high	119 Å²	119	75.1 Å²	75.1	52%	0.517	35%	0.348	S	S	.	.	H	α-helix	trans	-64.3	-32.8	173.5	-77.2	179.9	177.6	-171.4	0	112.5	L60 E61 D66 V96 R100	L60-K64 WeakPolarHBondContact O-CG 3.43Å; L60-K64 PolarHBondContact O-N 3.01Å; E61-K64 PolarHBondContact O-N 2.78Å; K64-D66 VanDerWaalsContact C-N 3.27Å; K64-D66 PolarHBondContact O-N 3.21Å; K64-V96 HydrophobicContact CG-CG1 4.36Å; K64-V96 HydrophobicContact CG-CG2 4.47Å; K64-R100 PolarHBondContact O-NH2 2.94Å
65	N	92.7	Very high	94.9	Very high	103 Å²	103	69.9 Å²	69.9	55%	0.551	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	14.6	176.8	-66.5	-33.7	0	0	0	113.3	E61 L63 K67	E61-N65 PolarHBondContact O-N 2.9Å; E61-N65 PolarHBondContact O-ND2 2.91Å; L63-N65 VanDerWaalsContact C-N 3.26Å; L63-N65 PolarHBondContact O-N 3.16Å; N65-K67 HydrophobicContact CB-CD 4.42Å; N65-K67 HydrophobicContact CB-CG 4.42Å; N65-K67 WeakPolarHBondContact O-CG 3.45Å; N65-K67 PolarHBondContact O-N 3.15Å
66	D	90.6	Very high	94.9	Very high	118 Å²	118	72.7 Å²	72.7	63%	0.631	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	21.3	-179.3	-55.9	-54	0	0	0	114.8	L63 K64 E68 R100	L63-D66 PolarHBondContact O-N 3.06Å; K64-D66 VanDerWaalsContact C-N 3.27Å; K64-D66 PolarHBondContact O-N 3.21Å; D66-E68 VanDerWaalsContact C-N 3.28Å; D66-E68 PolarHBondContact O-N 3.1Å; D66-E68 VanDerWaalsContact O-N 3.08Å; D66-R100 IonicContact OD1-NH2 3.44Å
67	K	94	Very high	95	Very high	105 Å²	105	81.3 Å²	81.3	46%	0.457	36%	0.358	S	S	.	.			trans	-87.8	54.8	179.1	-68.4	176.6	-174.4	172.8	0	111.8	L62 N65 K69 R70 A71	L62-K67 PolarHBondContact O-N 3.33Å; N65-K67 HydrophobicContact CB-CD 4.42Å; N65-K67 HydrophobicContact CB-CG 4.42Å; N65-K67 WeakPolarHBondContact O-CG 3.45Å; N65-K67 PolarHBondContact O-N 3.15Å; K67-K69 PolarHBondContact O-N 3.36Å; K67-R70 HydrophobicContact CB-CB 4.17Å; K67-R70 PolarHBondContact O-N 2.94Å; K67-R70 VanDerWaalsContact O-N 3.14Å; K67-A71 PolarHBondContact O-N 2.86Å
68	E	93.5	Very high	95	Very high	91 Å²	91	82.8 Å²	82.8	43%	0.425	36%	0.361	S	S	.	.	H	α-helix	trans	-57.8	-43.9	-172.6	-67.9	-162.7	179	0	0	114.4	L63 D66 R70 A71 L72 R89	L63-E68 HydrophobicContact CD2-CG 4.3Å; D66-E68 VanDerWaalsContact C-N 3.28Å; D66-E68 PolarHBondContact O-N 3.1Å; D66-E68 VanDerWaalsContact O-N 3.08Å; E68-R70 VanDerWaalsContact C-N 3.29Å; E68-R70 PolarHBondContact O-N 3.41Å; E68-A71 WeakPolarHBondContact O-CB 3.49Å; E68-A71 PolarHBondContact O-N 3.16Å; E68-L72 WeakPolarHBondContact O-CB 3.38Å; E68-L72 PolarHBondContact O-N 3.39Å; E68-R89 IonicContact OE2-CZ 3.87Å; E68-R89 IonicContact OE2-NH1 3.21Å; E68-R89 PolarHBondContact OE2-NH1 2.89Å
69	K	95.4	Very high	95	Very high	162 Å²	162	80.4 Å²	80.4	70%	0.704	36%	0.355	S	S	*	.	H	α-helix	trans	-63.9	-37.1	-179.4	-174	172	-176.9	177.5	0	111.2	K67 K73	K67-K69 PolarHBondContact O-N 3.36Å; K69-K73 WeakPolarHBondContact O-CG 3.42Å; K69-K73 PolarHBondContact O-N 2.93Å
70	R	95.8	Very high	94.9	Very high	142 Å²	142	83.3 Å²	83.3	54%	0.536	39%	0.385	S	S	.	.	H	α-helix	trans	-70.5	-42.5	175.1	-171.1	174.5	177.1	179	-2.1	110.9	L62 K67 E68 L72 K73 F74	L62-R70 HydrophobicContact CD1-CG 4.4Å; L62-R70 HydrophobicContact CD2-CG 4.21Å; K67-R70 HydrophobicContact CB-CB 4.17Å; K67-R70 PolarHBondContact O-N 2.94Å; K67-R70 VanDerWaalsContact O-N 3.14Å; E68-R70 VanDerWaalsContact C-N 3.29Å; E68-R70 PolarHBondContact O-N 3.41Å; R70-L72 VanDerWaalsContact C-N 3.31Å; R70-L72 PolarHBondContact O-N 3.28Å; R70-K73 PolarHBondContact O-N 2.89Å; R70-F74 WeakPolarHBondContact O-CB 3.36Å; R70-F74 PolarHBondContact O-N 3.47Å
71	A	96.1	Very high	95	Very high	0 Å²	0	83.6 Å²	83.6	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-58.2	-43.4	174	0	0	0	0	0	111.6	L62 L63 K67 E68 F74 A75	L62-A71 HydrophobicContact CB-CB 3.86Å; L62-A71 HydrophobicContact CD1-CB 4.35Å; L63-A71 HydrophobicContact CD2-CB 4Å; L63-A71 HydrophobicContact CG-CB 4.14Å; K67-A71 PolarHBondContact O-N 2.86Å; E68-A71 WeakPolarHBondContact O-CB 3.49Å; E68-A71 PolarHBondContact O-N 3.16Å; A71-F74 PolarHBondContact O-N 2.83Å; A71-A75 VanDerWaalsContact O-CB 3.3Å; A71-A75 WeakPolarHBondContact O-CB 3.48Å; A71-A75 PolarHBondContact O-N 3.42Å
72	L	96.3	Very high	95.1	Very high	29 Å²	29	82.4 Å²	82.4	15%	0.152	39%	0.386	C	S	.	.	H	α-helix	trans	-65	-45.1	177.4	-176.9	62.8	0	0	0	112.4	E68 R70 F74 A75 K76 A85 K86	E68-L72 WeakPolarHBondContact O-CB 3.38Å; E68-L72 PolarHBondContact O-N 3.39Å; R70-L72 VanDerWaalsContact C-N 3.31Å; R70-L72 PolarHBondContact O-N 3.28Å; L72-F74 VanDerWaalsContact C-N 3.32Å; L72-F74 PolarHBondContact O-N 3.48Å; L72-A75 PolarHBondContact O-N 2.89Å; L72-K76 WeakPolarHBondContact O-CB 3.47Å; L72-K76 PolarHBondContact O-N 3.45Å; L72-A85 HydrophobicContact CD1-CB 3.95Å; L72-K86 HydrophobicContact CD1-CG 3.95Å
73	K	96.6	Very high	95.2	Very high	147 Å²	147	92.2 Å²	92.2	64%	0.639	42%	0.422	S	S	*	.	H	α-helix	trans	-60.7	-42.6	175.4	-76	-175.3	176.5	-171.8	0	111.4	K69 R70 K76 R77	K69-K73 WeakPolarHBondContact O-CG 3.42Å; K69-K73 PolarHBondContact O-N 2.93Å; R70-K73 PolarHBondContact O-N 2.89Å; K73-K76 PolarHBondContact O-N 2.91Å; K73-R77 PolarHBondContact O-N 3.25Å; K73-R77 VanDerWaalsContact O-N 3.13Å
74	F	96.1	Very high	95.3	Very high	15 Å²	15	100.3 Å²	100.3	7%	0.066	45%	0.452	C	S	.	.	H	α-helix	trans	-63.4	-47.6	176.3	177.7	-115.6	0	0	0	112	F55 R58 M59 L62 R70 A71 L72 K76 R77 R78	F55-F74 HydrophobicContact CB-CE1 4.27Å; F55-F74 HydrophobicContact CB-CZ 4.3Å; R58-F74 HydrophobicContact CB-CE1 3.97Å; R58-F74 HydrophobicContact CB-CZ 4.39Å; R58-F74 HydrophobicContact CG-CD1 4.47Å; R58-F74 HydrophobicContact CG-CE1 3.97Å; R58-F74 HydrophobicContact CG-CZ 4.26Å; M59-F74 HydrophobicContact CG-CD1 3.73Å; M59-F74 HydrophobicContact CG-CE1 4.06Å; L62-F74 HydrophobicContact CD1-CB 4.24Å; L62-F74 HydrophobicContact CD1-CD1 4.44Å; R70-F74 WeakPolarHBondContact O-CB 3.36Å; R70-F74 PolarHBondContact O-N 3.47Å; A71-F74 PolarHBondContact O-N 2.83Å; L72-F74 VanDerWaalsContact C-N 3.32Å; L72-F74 PolarHBondContact O-N 3.48Å; F74-K76 VanDerWaalsContact C-N 3.35Å; F74-K76 PolarHBondContact O-N 3.07Å; F74-R77 PolarHBondContact O-N 3.09Å; F74-R78 HydrophobicContact CD2-CG 4.23Å; F74-R78 HydrophobicContact CE1-CG 4.16Å; F74-R78 HydrophobicContact CE2-CG 3.69Å; F74-R78 HydrophobicContact CZ-CG 3.67Å; F74-R78 WeakPolarHBondContact O-CG 3.44Å; F74-R78 PolarHBondContact O-N 3.24Å; F74-R78 VanDerWaalsContact O-N 3.11Å
75	A	96.2	Very high	95.5	Very high	0 Å²	0	94.7 Å²	94.7	0%	0	43%	0.427	C	S	.	.	H	α-helix	trans	-60.6	-42.5	177.5	0	0	0	0	0	112.3	M59 A71 L72 R77 R78 I79 A85	M59-A75 HydrophobicContact CE-CB 3.42Å; M59-A75 VanDerWaalsContact CE-CB 3.42Å; M59-A75 HydrophobicContact SD-CB 3.61Å; A71-A75 VanDerWaalsContact O-CB 3.3Å; A71-A75 WeakPolarHBondContact O-CB 3.48Å; A71-A75 PolarHBondContact O-N 3.42Å; L72-A75 PolarHBondContact O-N 2.89Å; A75-R77 VanDerWaalsContact C-N 3.31Å; A75-R77 PolarHBondContact O-N 3.24Å; A75-R78 PolarHBondContact O-N 3.01Å; A75-R78 VanDerWaalsContact O-N 3.16Å; A75-I79 HydrophobicContact CB-CD1 4.4Å; A75-I79 WeakPolarHBondContact O-CB 3.15Å; A75-I79 WeakPolarHBondContact O-CG1 3.34Å; A75-I79 PolarHBondContact O-N 3.13Å; A75-A85 HydrophobicContact CB-CB 3.93Å
76	K	96.7	Very high	95.7	Very high	110 Å²	110	93.9 Å²	93.9	48%	0.478	42%	0.419	S	S	.	.	H	α-helix	trans	-59.3	-42.5	176.1	-171.9	-177	175.5	-173.5	0	111	L72 K73 F74 R78 G80 A85	L72-K76 WeakPolarHBondContact O-CB 3.47Å; L72-K76 PolarHBondContact O-N 3.45Å; K73-K76 PolarHBondContact O-N 2.91Å; F74-K76 VanDerWaalsContact C-N 3.35Å; F74-K76 PolarHBondContact O-N 3.07Å; K76-R78 VanDerWaalsContact C-N 3.33Å; K76-R78 PolarHBondContact O-N 3.41Å; K76-G80 WeakPolarHBondContact O-CA 3.49Å; K76-G80 PolarHBondContact O-N 3.03Å; K76-A85 HydrophobicContact CB-CB 4.21Å
77	R	95.9	Very high	95.9	Very high	193 Å²	193	95.6 Å²	95.6	73%	0.728	42%	0.421	S	S	*	.	H	α-helix	trans	-65.7	-31.7	176.8	-168.5	170.5	72.2	173.7	7	113.2	K73 F74 A75	K73-R77 PolarHBondContact O-N 3.25Å; K73-R77 VanDerWaalsContact O-N 3.13Å; F74-R77 PolarHBondContact O-N 3.09Å; A75-R77 VanDerWaalsContact C-N 3.31Å; A75-R77 PolarHBondContact O-N 3.24Å
78	R	96	Very high	96	Very high	150 Å²	150	92.6 Å²	92.6	57%	0.566	41%	0.408	S	S	*	.	H	α-helix	trans	-86.1	-34.9	-179.6	-62.1	-65.1	-76.3	-137.8	-2.8	113.8	F55 F74 A75 K76	F55-R78 HydrophobicContact CB-CG 4.45Å; F74-R78 HydrophobicContact CD2-CG 4.23Å; F74-R78 HydrophobicContact CE1-CG 4.16Å; F74-R78 HydrophobicContact CE2-CG 3.69Å; F74-R78 HydrophobicContact CZ-CG 3.67Å; F74-R78 WeakPolarHBondContact O-CG 3.44Å; F74-R78 PolarHBondContact O-N 3.24Å; F74-R78 VanDerWaalsContact O-N 3.11Å; A75-R78 PolarHBondContact O-N 3.01Å; A75-R78 VanDerWaalsContact O-N 3.16Å; K76-R78 VanDerWaalsContact C-N 3.33Å; K76-R78 PolarHBondContact O-N 3.41Å
79	I	95	Very high	96.1	Very high	48 Å²	48	90.7 Å²	90.7	25%	0.246	40%	0.397	C	S	.	.	H	α-helix	trans	-98.6	-25.2	-173.8	-59.4	167.9	0	0	0	112.3	A75 G81 R84 K88	A75-I79 HydrophobicContact CB-CD1 4.4Å; A75-I79 WeakPolarHBondContact O-CB 3.15Å; A75-I79 WeakPolarHBondContact O-CG1 3.34Å; A75-I79 PolarHBondContact O-N 3.13Å; I79-G81 PolarHBondContact O-N 3.46Å; I79-R84 HydrophobicContact CG2-CB 3.54Å; I79-R84 HydrophobicContact CG2-CG 4.43Å; I79-K88 HydrophobicContact CD1-CB 3.76Å; I79-K88 HydrophobicContact CD1-CG 3.95Å
80	G	94.8	Very high	96.1	Very high	61 Å²	61	88.2 Å²	88.2	63%	0.629	39%	0.388	S	S	*	.	S	Bend	trans	90.5	-33.9	179.7	0	0	0	0	0	115.1	K76	K76-G80 WeakPolarHBondContact O-CA 3.49Å; K76-G80 PolarHBondContact O-N 3.03Å
81	G	96.3	Very high	96	Very high	23 Å²	23	85.1 Å²	85.1	24%	0.237	38%	0.379	C	S	.	.			trans	-108.3	135.4	-175.3	0	0	0	0	0	115.1	I79 R84 A85	I79-G81 PolarHBondContact O-N 3.46Å; G81-R84 PolarHBondContact O-N 2.78Å; G81-A85 WeakPolarHBondContact O-CB 3.27Å; G81-A85 PolarHBondContact O-N 3.36Å
82	H	96.1	Very high	96	Very high	88 Å²	88	85.1 Å²	85.1	41%	0.407	38%	0.379	S	S	.	.	H	α-helix	trans	-62.3	-47.2	179	-172.3	57.9	0	0	0	113.3	R84 A85 K86	H82-R84 VanDerWaalsContact C-N 3.31Å; H82-R84 PolarHBondContact O-N 3.14Å; H82-A85 PolarHBondContact O-N 3.3Å; H82-K86 WeakPolarHBondContact NE2-CE 3.2Å; H82-K86 PolarHBondContact O-N 3.34Å
83	R	97.2	Very high	95.9	Very high	223 Å²	223	85.1 Å²	85.1	84%	0.842	38%	0.38	S	S	*	.	H	α-helix	trans	-61	-40.8	177.7	-67.7	-179.3	67.3	-171.6	2.6	111.8	K87	R83-K87 PolarHBondContact O-N 3.28Å; R83-K87 VanDerWaalsContact O-N 3.1Å
84	R	96.7	Very high	95.8	Very high	180 Å²	180	80.9 Å²	80.9	68%	0.679	37%	0.373	S	S	*	.	H	α-helix	trans	-68.1	-41.3	177.9	-60.3	-175.9	-171.3	172.3	2.2	111.3	I79 G81 H82 K87 K88	I79-R84 HydrophobicContact CG2-CB 3.54Å; I79-R84 HydrophobicContact CG2-CG 4.43Å; G81-R84 PolarHBondContact O-N 2.78Å; H82-R84 VanDerWaalsContact C-N 3.31Å; H82-R84 PolarHBondContact O-N 3.14Å; R84-K87 PolarHBondContact O-N 3.24Å; R84-K88 PolarHBondContact O-N 3.38Å
85	A	97.1	Very high	95.6	Very high	0 Å²	0	81.7 Å²	81.7	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-63.2	-43.1	176.5	0	0	0	0	0	112.4	L72 A75 K76 G81 H82 K88 R89	L72-A85 HydrophobicContact CD1-CB 3.95Å; A75-A85 HydrophobicContact CB-CB 3.93Å; K76-A85 HydrophobicContact CB-CB 4.21Å; G81-A85 WeakPolarHBondContact O-CB 3.27Å; G81-A85 PolarHBondContact O-N 3.36Å; H82-A85 PolarHBondContact O-N 3.3Å; A85-K88 PolarHBondContact O-N 2.95Å; A85-R89 WeakPolarHBondContact O-CB 3.43Å; A85-R89 PolarHBondContact O-N 3.1Å
86	K	97.1	Very high	95.4	Very high	87 Å²	87	82.2 Å²	82.2	38%	0.378	38%	0.381	S	S	.	.	H	α-helix	trans	-59.1	-48.3	172.8	-79	-170.9	170.8	-174.2	0	111.8	L72 H82 K88 R89 E90	L72-K86 HydrophobicContact CD1-CG 3.95Å; H82-K86 WeakPolarHBondContact NE2-CE 3.2Å; H82-K86 PolarHBondContact O-N 3.34Å; K86-K88 VanDerWaalsContact C-N 3.34Å; K86-K88 PolarHBondContact O-N 3.35Å; K86-R89 WeakPolarHBondContact O-CB 3.37Å; K86-R89 PolarHBondContact O-N 3.08Å; K86-R89 VanDerWaalsContact O-N 3.15Å; K86-E90 WeakPolarHBondContact O-CG 2.95Å; K86-E90 PolarHBondContact O-N 3.06Å
87	K	96.3	Very high	95.2	Very high	154 Å²	154	83.4 Å²	83.4	67%	0.67	39%	0.386	S	S	*	.	H	α-helix	trans	-58.3	-44	177.3	-174.7	176.6	-179.2	179.2	0	112.3	R83 R84 E90 E91	R83-K87 PolarHBondContact O-N 3.28Å; R83-K87 VanDerWaalsContact O-N 3.1Å; R84-K87 PolarHBondContact O-N 3.24Å; K87-E90 PolarHBondContact O-N 3.36Å; K87-E91 PolarHBondContact O-N 3.11Å
88	K	96.1	Very high	95	Very high	41 Å²	41	77.3 Å²	77.3	18%	0.178	37%	0.373	C	S	.	.	H	α-helix	trans	-67.1	-38.2	177.2	-178	58.5	66.8	177.9	0	111.9	E56 M59 I79 R84 A85 K86 E91 L92	E56-K88 WeakPolarHBondContact OE1-CE 3.38Å; E56-K88 IonicContact OE1-NZ 3.21Å; E56-K88 PolarHBondContact OE1-NZ 3.47Å; M59-K88 HydrophobicContact CE-CG 4.04Å; M59-K88 HydrophobicContact SD-CG 4.15Å; I79-K88 HydrophobicContact CD1-CB 3.76Å; I79-K88 HydrophobicContact CD1-CG 3.95Å; R84-K88 PolarHBondContact O-N 3.38Å; A85-K88 PolarHBondContact O-N 2.95Å; K86-K88 VanDerWaalsContact C-N 3.34Å; K86-K88 PolarHBondContact O-N 3.35Å; K88-E91 WeakPolarHBondContact CE-OE2 3.31Å; K88-E91 IonicContact NZ-OE1 3.36Å; K88-E91 PolarHBondContact NZ-OE1 3.5Å; K88-E91 IonicContact NZ-OE2 2.78Å; K88-E91 PolarHBondContact NZ-OE2 3.28Å; K88-E91 PolarHBondContact O-N 3.19Å; K88-L92 HydrophobicContact CD-CD1 4.39Å; K88-L92 HydrophobicContact CD-CG 4.23Å; K88-L92 HydrophobicContact CG-CD1 4.47Å; K88-L92 WeakPolarHBondContact O-CG 3.37Å; K88-L92 PolarHBondContact O-N 3.38Å
89	R	94.9	Very high	94.6	Very high	51 Å²	51	74.8 Å²	74.8	19%	0.192	37%	0.369	C	S	.	.	H	α-helix	trans	-60.6	-47	173.8	-175.5	-170.5	67.6	149.2	5.8	111.1	L63 E68 A85 K86 L92 T93	L63-R89 HydrophobicContact CD2-CG 4.08Å; E68-R89 IonicContact OE2-CZ 3.87Å; E68-R89 IonicContact OE2-NH1 3.21Å; E68-R89 PolarHBondContact OE2-NH1 2.89Å; A85-R89 WeakPolarHBondContact O-CB 3.43Å; A85-R89 PolarHBondContact O-N 3.1Å; K86-R89 WeakPolarHBondContact O-CB 3.37Å; K86-R89 PolarHBondContact O-N 3.08Å; K86-R89 VanDerWaalsContact O-N 3.15Å; R89-L92 PolarHBondContact O-N 3.34Å; R89-T93 VanDerWaalsContact O-CB 3.32Å; R89-T93 WeakPolarHBondContact O-CB 3.44Å; R89-T93 PolarHBondContact O-N 3.43Å; R89-T93 PolarHBondContact O-OG1 2.74Å
90	E	95.3	Very high	94.2	Very high	111 Å²	111	79 Å²	79	52%	0.519	38%	0.382	S	S	.	.	H	α-helix	trans	-61	-44.2	178.2	-73.3	160.7	-162.2	0	0	111.9	K86 K87 L92 T93 A94	K86-E90 WeakPolarHBondContact O-CG 2.95Å; K86-E90 PolarHBondContact O-N 3.06Å; K87-E90 PolarHBondContact O-N 3.36Å; E90-L92 PolarHBondContact O-N 2.95Å; E90-T93 PolarHBondContact O-N 3.21Å; E90-A94 PolarHBondContact O-N 3.34Å
91	E	94.6	Very high	93.9	Very high	76 Å²	76	83.8 Å²	83.8	36%	0.355	39%	0.39	S	S	.	.	H	α-helix	trans	-55.8	-51.9	174	-175	-165.4	150.8	0	0	111.6	R47 K87 K88 T93 A94 I95	R47-E91 IonicContact NH2-OE1 2.93Å; R47-E91 PolarHBondContact NH2-OE1 2.83Å; K87-E91 PolarHBondContact O-N 3.11Å; K88-E91 WeakPolarHBondContact CE-OE2 3.31Å; K88-E91 IonicContact NZ-OE1 3.36Å; K88-E91 PolarHBondContact NZ-OE1 3.5Å; K88-E91 IonicContact NZ-OE2 2.78Å; K88-E91 PolarHBondContact NZ-OE2 3.28Å; K88-E91 PolarHBondContact O-N 3.19Å; E91-T93 PolarHBondContact O-N 2.89Å; E91-A94 PolarHBondContact O-N 3.3Å; E91-I95 WeakPolarHBondContact O-CG1 3.4Å; E91-I95 PolarHBondContact O-N 3.26Å
92	L	95.3	Very high	92.6	Very high	0 Å²	0	94.2 Å²	94.2	0%	0	43%	0.428	C	S	.	.	H	α-helix	trans	-70.2	-32	-179.1	-64.4	-175.9	0	0	0	112.6	F52 E56 M59 L60 L63 K88 R89 E90 I95 V96	F52-L92 HydrophobicContact CD1-CD2 4.13Å; F52-L92 HydrophobicContact CE1-CD2 3.91Å; E56-L92 HydrophobicContact CB-CD1 4.22Å; E56-L92 HydrophobicContact CB-CD2 4.39Å; M59-L92 HydrophobicContact CB-CD1 3.44Å; M59-L92 VanDerWaalsContact CB-CD1 3.44Å; M59-L92 HydrophobicContact CE-CD1 3.88Å; M59-L92 HydrophobicContact CG-CD1 4.31Å; M59-L92 HydrophobicContact SD-CD1 3.99Å; L60-L92 HydrophobicContact CD2-CB 3.94Å; L60-L92 HydrophobicContact CD2-CD2 4.11Å; L60-L92 HydrophobicContact CD2-CG 4.44Å; L60-L92 HydrophobicContact CG-CD1 4.43Å; L60-L92 HydrophobicContact CG-CD2 4.25Å; L63-L92 HydrophobicContact CD1-CB 3.64Å; K88-L92 HydrophobicContact CD-CD1 4.39Å; K88-L92 HydrophobicContact CD-CG 4.23Å; K88-L92 HydrophobicContact CG-CD1 4.47Å; K88-L92 WeakPolarHBondContact O-CG 3.37Å; K88-L92 PolarHBondContact O-N 3.38Å; R89-L92 PolarHBondContact O-N 3.34Å; E90-L92 PolarHBondContact O-N 2.95Å; L92-I95 HydrophobicContact CD2-CD1 4.19Å; L92-I95 WeakPolarHBondContact O-CB 3.49Å; L92-I95 PolarHBondContact O-N 2.92Å; L92-V96 WeakPolarHBondContact O-CG2 3.22Å; L92-V96 PolarHBondContact O-N 3.08Å
93	T	94.7	Very high	92.5	Very high	29 Å²	29	94.5 Å²	94.5	18%	0.178	43%	0.429	C	S	.	.	H	α-helix	trans	-66.3	-40.3	175.5	-55	0	0	0	0	110.7	R89 E90 E91 I95 V96 K97	R89-T93 VanDerWaalsContact O-CB 3.32Å; R89-T93 WeakPolarHBondContact O-CB 3.44Å; R89-T93 PolarHBondContact O-N 3.43Å; R89-T93 PolarHBondContact O-OG1 2.74Å; E90-T93 PolarHBondContact O-N 3.21Å; E91-T93 PolarHBondContact O-N 2.89Å; T93-I95 VanDerWaalsContact C-N 3.27Å; T93-I95 PolarHBondContact O-N 3.15Å; T93-V96 PolarHBondContact O-N 2.74Å; T93-K97 WeakPolarHBondContact O-CG 3.45Å; T93-K97 PolarHBondContact O-N 2.71Å
94	A	93.8	Very high	92.2	Very high	59 Å²	59	87.7 Å²	87.7	49%	0.488	41%	0.407	S	S	.	.	H	α-helix	trans	-61.1	-38.1	174.2	0	0	0	0	0	111.7	E90 E91 K97 S98	E90-A94 PolarHBondContact O-N 3.34Å; E91-A94 PolarHBondContact O-N 3.3Å; A94-K97 PolarHBondContact O-N 2.79Å; A94-S98 PolarHBondContact O-N 3.22Å
95	I	92.5	Very high	92	Very high	32 Å²	32	82.6 Å²	82.6	16%	0.164	39%	0.392	C	S	.	.	H	α-helix	trans	-67.6	-44.8	176.3	-66.6	170.1	0	0	0	111.5	F52 L60 E91 L92 T93 K97 S98 M99	F52-I95 HydrophobicContact CE1-CD1 3.61Å; F52-I95 HydrophobicContact CE1-CG2 4.44Å; F52-I95 HydrophobicContact CZ-CD1 3.79Å; F52-I95 HydrophobicContact CZ-CG2 3.76Å; L60-I95 HydrophobicContact CD2-CG2 4.45Å; E91-I95 WeakPolarHBondContact O-CG1 3.4Å; E91-I95 PolarHBondContact O-N 3.26Å; L92-I95 HydrophobicContact CD2-CD1 4.19Å; L92-I95 WeakPolarHBondContact O-CB 3.49Å; L92-I95 PolarHBondContact O-N 2.92Å; T93-I95 VanDerWaalsContact C-N 3.27Å; T93-I95 PolarHBondContact O-N 3.15Å; I95-K97 VanDerWaalsContact C-N 3.28Å; I95-K97 PolarHBondContact O-N 3.07Å; I95-S98 WeakPolarHBondContact CA-OG 3.3Å; I95-S98 PolarHBondContact O-N 3.16Å; I95-S98 PolarHBondContact O-OG 3.36Å; I95-M99 HydrophobicContact CG2-CE 3.75Å; I95-M99 HydrophobicContact CG2-SD 4.14Å; I95-M99 WeakPolarHBondContact O-CB 3.2Å; I95-M99 VanDerWaalsContact O-CG 3.31Å; I95-M99 WeakPolarHBondContact O-CG 3.42Å; I95-M99 PolarHBondContact O-N 3.48Å
96	V	91.9	Very high	91.7	Very high	10 Å²	10	87.5 Å²	87.5	6%	0.061	42%	0.415	C	S	.	.	H	α-helix	trans	-60.4	-41.5	175.7	173.2	0	0	0	0	110.5	L60 L63 K64 L92 T93 M99 R100	L60-V96 HydrophobicContact CD2-CG2 3.6Å; L63-V96 HydrophobicContact CB-CG2 4.34Å; K64-V96 HydrophobicContact CG-CG1 4.36Å; K64-V96 HydrophobicContact CG-CG2 4.47Å; L92-V96 WeakPolarHBondContact O-CG2 3.22Å; L92-V96 PolarHBondContact O-N 3.08Å; T93-V96 PolarHBondContact O-N 2.74Å; V96-M99 PolarHBondContact O-N 3Å; V96-R100 WeakPolarHBondContact O-CG 3.27Å; V96-R100 PolarHBondContact O-N 3.4Å; V96-R100 VanDerWaalsContact O-N 3.08Å
97	K	91.7	Very high	91.3	Very high	136 Å²	136	87.5 Å²	87.5	59%	0.591	42%	0.418	S	S	*	.	H	α-helix	trans	-62.6	-46	174.8	-72.6	-179.8	178.6	-171.9	0	111.9	T93 A94 I95 M99 R100 M101	T93-K97 WeakPolarHBondContact O-CG 3.45Å; T93-K97 PolarHBondContact O-N 2.71Å; A94-K97 PolarHBondContact O-N 2.79Å; I95-K97 VanDerWaalsContact C-N 3.28Å; I95-K97 PolarHBondContact O-N 3.07Å; K97-M99 VanDerWaalsContact C-N 3.25Å; K97-M99 PolarHBondContact O-N 3.15Å; K97-R100 PolarHBondContact O-N 3.31Å; K97-R100 VanDerWaalsContact O-N 3.14Å; K97-M101 WeakPolarHBondContact O-CG 3.49Å; K97-M101 PolarHBondContact O-N 3.07Å
98	S	91	Very high	91	Very high	65 Å²	65	83.1 Å²	83.1	46%	0.455	40%	0.401	S	S	.	.	H	α-helix	trans	-66.4	-27.7	178.5	71	0	0	0	0	113.1	A94 I95	A94-S98 PolarHBondContact O-N 3.22Å; I95-S98 WeakPolarHBondContact CA-OG 3.3Å; I95-S98 PolarHBondContact O-N 3.16Å; I95-S98 PolarHBondContact O-OG 3.36Å
99	M	88.5	Confident	90.7	Very high	96 Å²	96	86.1 Å²	86.1	47%	0.473	42%	0.417	S	S	.	.	H	α-helix	trans	-74.4	-29.3	173.2	-73.2	176.1	173.7	0	0	113	F52 I95 V96 K97	F52-M99 HydrophobicContact CE2-CE 4.31Å; I95-M99 HydrophobicContact CG2-CE 3.75Å; I95-M99 HydrophobicContact CG2-SD 4.14Å; I95-M99 WeakPolarHBondContact O-CB 3.2Å; I95-M99 VanDerWaalsContact O-CG 3.31Å; I95-M99 WeakPolarHBondContact O-CG 3.42Å; I95-M99 PolarHBondContact O-N 3.48Å; V96-M99 PolarHBondContact O-N 3Å; K97-M99 VanDerWaalsContact C-N 3.25Å; K97-M99 PolarHBondContact O-N 3.15Å
100	R	87.2	Confident	90.3	Very high	138 Å²	138	88.8 Å²	88.8	52%	0.521	43%	0.434	S	S	.	.	H	α-helix	trans	-79.3	-21.2	177.3	-74	-178.9	-179.7	179	2.1	113.5	K64 D66 V96 K97	K64-R100 PolarHBondContact O-NH2 2.94Å; D66-R100 IonicContact OD1-NH2 3.44Å; V96-R100 WeakPolarHBondContact O-CG 3.27Å; V96-R100 PolarHBondContact O-N 3.4Å; V96-R100 VanDerWaalsContact O-N 3.08Å; K97-R100 PolarHBondContact O-N 3.31Å; K97-R100 VanDerWaalsContact O-N 3.14Å
101	M	87.5	Confident	89.9	Confident	161 Å²	161	86.9 Å²	86.9	79%	0.793	43%	0.427	S	S	*	.			trans	-91.7	-7.8	179.8	-62	-69.1	104.6	0	0	113	K97	K97-M101 WeakPolarHBondContact O-CG 3.49Å; K97-M101 PolarHBondContact O-N 3.07Å
102	K	70.3	Confident	89.5	Confident	241 Å²	241	87.9 Å²	87.9	100%	1.048	43%	0.434	S	S	*	.			trans	-90.7	0	168.2	-74.7	-173	176.9	-168.4	0	108.5

Retrieved 102 of 102 residues in 184.3 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).