A0A060Y1R8_ONCMY Loading...

Succinate dehydrogenase assembly factor 2, mitochondrial

Plays an essential role in the assembly of succinate dehydrogenase (SDH), an enzyme complex (also referred to as respiratory complex II) that is a component of both the tricarboxylic acid (TCA) cycle and the mitochondrial electron transport chain, and which couples the oxidation of succinate to fumarate with the reduction of ubiquinone (coenzyme Q) to ubiquinol. Required for flavinylation (covalent attachment of FAD) of the flavoprotein subunit SDHA of the SDH catalytic dimer.

AlphaFold DB , UniProt , Accession A0A060Y1R8, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110506664, Length 163 aa.

						>A0A060Y1R8_ONCMY|A0A060Y1R8|LOC110506664
MLSAFVAKRLVSGVCQASWRPAVAELVTTRGYKGEAPDDSRGDLIEIPLPPWTEKDGETMDIKRRRLLFQSRKRGMLENCILLSLFAKQYLNTMTEHQLRQYDRLINEPSNDWDIYYWATEAQPVPDVYTGEIMDLLKEFTKNKDQEQRLDAPNLEYLDKGSQ
					

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	46.6	Very low	43.9	Very low	236 Å²	236	162.5 Å²	162.5	100%	1.163	87%	0.87	S	S	*	*				0	135.1	0	-78.8	-77.4	-177.9	0	0	107.5
2	L	42	Very low	43.7	Very low	179 Å²	179	157.3 Å²	157.3	94%	0.937	86%	0.856	S	S	*	*			trans	98.5	95.5	178.8	-61.9	158.2	0	0	0	116.5
3	S	34.3	Very low	43.7	Very low	99 Å²	99	150.4 Å²	150.4	69%	0.692	84%	0.843	S	S	*	*			trans	-68.5	150.9	163.2	178.9	0	0	0	0	111.3
4	A	42.6	Very low	44	Very low	99 Å²	99	148.6 Å²	148.6	82%	0.818	84%	0.837	S	S	*	*			trans	-149.4	115.9	152.7	0	0	0	0	0	110.2
5	F	43.8	Very low	44.2	Very low	194 Å²	194	146.9 Å²	146.9	85%	0.851	84%	0.837	S	S	*	*			trans	-69.5	137.6	170.7	-84.1	-103.7	0	0	0	110.7
6	V	45.2	Very low	44.8	Very low	147 Å²	147	149.4 Å²	149.4	89%	0.891	84%	0.839	S	S	*	*			trans	-136.6	133.7	154.8	-180	0	0	0	0	110.2
7	A	46.7	Very low	45	Very low	91 Å²	91	144.9 Å²	144.9	75%	0.752	83%	0.826	S	S	*	*			trans	-70.6	145.5	-160.5	0	0	0	0	0	115.4	R9	A7-R9 PolarHBondContact O-N 3.27Å
8	K	43.7	Very low	45.2	Very low	207 Å²	207	142.8 Å²	142.8	90%	0.9	82%	0.821	S	S	*	*			trans	-66.8	112.2	165.7	-68.6	179	177.8	-176.9	0	109.3
9	R	43.4	Very low	45.1	Very low	236 Å²	236	148.1 Å²	148.1	89%	0.891	83%	0.827	S	S	*	*			trans	-84	108.3	162.6	-88.3	-176.2	169	-163.4	-2.4	108.8	A7 V11	A7-R9 PolarHBondContact O-N 3.27Å; R9-V11 PolarHBondContact O-N 3.45Å
10	L	47.4	Very low	45.3	Very low	167 Å²	167	151.8 Å²	151.8	87%	0.874	83%	0.827	S	S	*	*			trans	-71.4	116.5	164.1	-117.8	120.3	0	0	0	107.8
11	V	46.8	Very low	45.4	Very low	133 Å²	133	150 Å²	150	81%	0.806	82%	0.823	S	S	*	*			trans	-95.3	103.5	167.2	-178.2	0	0	0	0	106.6	R9 G13	R9-V11 PolarHBondContact O-N 3.45Å; V11-G13 PolarHBondContact O-N 3.38Å
12	S	41.7	Very low	45.8	Very low	100 Å²	100	143.6 Å²	143.6	70%	0.699	81%	0.808	S	S	*	*			trans	-73.9	104	168.1	61.3	0	0	0	0	108.3	V14	S12-V14 PolarHBondContact O-N 2.94Å
13	G	43.5	Very low	46.4	Very low	67 Å²	67	140.4 Å²	140.4	69%	0.691	80%	0.796	S	S	*	*			trans	-68.8	112.8	167.4	0	0	0	0	0	109.4	V11 C15	V11-G13 PolarHBondContact O-N 3.38Å; G13-C15 PolarHBondContact O-N 3.23Å
14	V	47.8	Very low	47.6	Very low	125 Å²	125	140.4 Å²	140.4	76%	0.758	80%	0.801	S	S	*	*			trans	-79	103.8	170.2	175.6	0	0	0	0	107.3	S12 Q16	S12-V14 PolarHBondContact O-N 2.94Å; V14-Q16 PolarHBondContact O-N 3.18Å; V14-Q16 VanDerWaalsContact O-N 3.13Å
15	C	47.8	Very low	47.9	Very low	123 Å²	123	143.2 Å²	143.2	83%	0.831	80%	0.798	S	S	*	*			trans	-68.3	103.8	167.3	-69.1	0	0	0	0	108.5	G13 A17	G13-C15 PolarHBondContact O-N 3.23Å; C15-A17 VanDerWaalsContact C-N 3.3Å; C15-A17 PolarHBondContact O-N 3.07Å
16	Q	53.4	Low	48.6	Very low	187 Å²	187	141.7 Å²	141.7	87%	0.874	80%	0.797	S	S	*	*			trans	-69.2	93	164.3	-83	-177.2	-17	0	0	108.2	V14 S18	V14-Q16 PolarHBondContact O-N 3.18Å; V14-Q16 VanDerWaalsContact O-N 3.13Å; Q16-S18 PolarHBondContact O-N 2.89Å
17	A	47.8	Very low	48.9	Very low	74 Å²	74	140 Å²	140	61%	0.612	79%	0.787	S	S	*	*			trans	-63.2	120.1	162.4	0	0	0	0	0	107.4	C15 W19	C15-A17 VanDerWaalsContact C-N 3.3Å; C15-A17 PolarHBondContact O-N 3.07Å; A17-W19 PolarHBondContact O-N 3.34Å; A17-W19 VanDerWaalsContact O-N 3.14Å
18	S	49.2	Very low	49.4	Very low	106 Å²	106	140.8 Å²	140.8	74%	0.741	78%	0.783	S	S	*	*			trans	-68.4	108.5	171.2	48.1	0	0	0	0	108.3	Q16 R20	Q16-S18 PolarHBondContact O-N 2.89Å; S18-R20 PolarHBondContact O-N 3.23Å
19	W	43.3	Very low	50.1	Low	244 Å²	244	136.9 Å²	136.9	92%	0.924	78%	0.776	S	S	*	*			trans	-69.1	101.1	173.9	-67.6	66.8	0	0	0	107.6	A17	A17-W19 PolarHBondContact O-N 3.34Å; A17-W19 VanDerWaalsContact O-N 3.14Å
20	R	48.5	Very low	50.6	Low	221 Å²	221	137 Å²	137	83%	0.834	78%	0.777	S	S	*	*			trans	-75.9	130.6	162.6	-70.8	-175	178.3	-93.5	0.6	107.4	S18 A22	S18-R20 PolarHBondContact O-N 3.23Å; R20-A22 PolarHBondContact O-N 2.6Å
21	P	48.7	Very low	51.1	Low	115 Å²	115	132 Å²	132	75%	0.747	77%	0.766	S	S	*	*			trans	-64.7	125.9	172.1	27.4	-30.4	0	0	0	107.8	V23	P21-V23 VanDerWaalsContact C-N 3.32Å; P21-V23 PolarHBondContact O-N 3.31Å
22	A	54.6	Low	52.1	Low	102 Å²	102	135.6 Å²	135.6	84%	0.843	77%	0.766	S	S	*	*			trans	-70.9	93.7	169.7	0	0	0	0	0	107.6	R20 A24	R20-A22 PolarHBondContact O-N 2.6Å; A22-A24 PolarHBondContact O-N 3.26Å; A22-A24 VanDerWaalsContact O-N 3.16Å
23	V	53.3	Low	53.2	Low	112 Å²	112	140.4 Å²	140.4	68%	0.679	78%	0.775	S	S	*	*			trans	-73.5	102.4	161.4	-172.7	0	0	0	0	105.3	P21 E25	P21-V23 VanDerWaalsContact C-N 3.32Å; P21-V23 PolarHBondContact O-N 3.31Å; V23-E25 HydrophobicContact CG1-CG 3.98Å; V23-E25 PolarHBondContact O-N 2.97Å
24	A	59.9	Low	54.4	Low	98 Å²	98	138.5 Å²	138.5	81%	0.81	76%	0.755	S	S	*	*			trans	-71	73.6	166.2	0	0	0	0	0	107.9	A22 L26	A22-A24 PolarHBondContact O-N 3.26Å; A22-A24 VanDerWaalsContact O-N 3.16Å; A24-L26 PolarHBondContact O-N 3.02Å
25	E	49.9	Very low	55.3	Low	159 Å²	159	141.9 Å²	141.9	74%	0.743	76%	0.763	S	S	*	*			trans	-69	111.7	162.3	-95.8	-174.7	168.8	0	0	107	V23 V27	V23-E25 HydrophobicContact CG1-CG 3.98Å; V23-E25 PolarHBondContact O-N 2.97Å; E25-V27 PolarHBondContact O-N 2.88Å
26	L	57.7	Low	56.4	Low	162 Å²	162	139.9 Å²	139.9	85%	0.848	76%	0.755	S	S	*	*			trans	-65.6	90.1	167	-135.2	129.9	0	0	0	106.1	A24 T28	A24-L26 PolarHBondContact O-N 3.02Å; L26-T28 VanDerWaalsContact C-N 3.29Å; L26-T28 PolarHBondContact O-N 3.39Å
27	V	51.9	Low	57.2	Low	111 Å²	111	136.1 Å²	136.1	67%	0.673	75%	0.747	S	S	*	*			trans	-60.6	102	168.8	176.6	0	0	0	0	105.3	E25 T29	E25-V27 PolarHBondContact O-N 2.88Å; V27-T29 PolarHBondContact O-N 3.03Å
28	T	58	Low	58	Low	108 Å²	108	139.5 Å²	139.5	66%	0.663	76%	0.755	S	S	*	*			trans	-59	98.6	162.7	-85.8	0	0	0	0	105.5	L26 R30	L26-T28 VanDerWaalsContact C-N 3.29Å; L26-T28 PolarHBondContact O-N 3.39Å; T28-R30 HydrophobicContact CG2-CB 4.17Å; T28-R30 PolarHBondContact O-N 2.94Å
29	T	57.2	Low	58.6	Low	124 Å²	124	141.2 Å²	141.2	76%	0.761	76%	0.756	S	S	*	*			trans	-64.7	91.1	161.1	52	0	0	0	0	105	V27 G31	V27-T29 PolarHBondContact O-N 3.03Å; T29-G31 PolarHBondContact O-N 3.37Å
30	R	54.6	Low	59.6	Low	238 Å²	238	133.6 Å²	133.6	90%	0.898	74%	0.739	S	S	*	*			trans	-72.2	63.4	164.6	-159.9	177.9	-173	-171.2	1.4	107.1	T28 Y32	T28-R30 HydrophobicContact CG2-CB 4.17Å; T28-R30 PolarHBondContact O-N 2.94Å; R30-Y32 PolarHBondContact O-N 3.15Å
31	G	58.6	Low	60.2	Low	63 Å²	63	133.3 Å²	133.3	65%	0.649	74%	0.738	S	S	*	*			trans	-69.8	106.3	166.9	0	0	0	0	0	105.9	T29 K33	T29-G31 PolarHBondContact O-N 3.37Å; G31-K33 PolarHBondContact O-N 3.32Å
32	Y	66.7	Low	60.8	Low	209 Å²	209	131.3 Å²	131.3	82%	0.82	74%	0.739	S	S	*	*			trans	-64.6	93.8	161.7	177.8	-98.9	0	0	0	106.7	R30 G34	R30-Y32 PolarHBondContact O-N 3.15Å; Y32-G34 VanDerWaalsContact C-N 3.34Å; Y32-G34 PolarHBondContact O-N 2.98Å
33	K	65.1	Low	61.1	Low	200 Å²	200	133.5 Å²	133.5	87%	0.87	74%	0.736	S	S	*	*			trans	-83.2	91.7	162.6	-155.7	-164.2	-175.4	-159	0	104.7	G31 E35	G31-K33 PolarHBondContact O-N 3.32Å; K33-E35 PolarHBondContact O-N 3.18Å
34	G	69.3	Low	62	Low	28 Å²	28	133.7 Å²	133.7	29%	0.289	73%	0.733	S	S	.	*			trans	-52.8	140.8	179.3	0	0	0	0	0	110.2	Y32 A36	Y32-G34 VanDerWaalsContact C-N 3.34Å; Y32-G34 PolarHBondContact O-N 2.98Å; G34-A36 PolarHBondContact O-N 3.22Å
35	E	66.5	Low	62.8	Low	195 Å²	195	136.1 Å²	136.1	91%	0.911	73%	0.731	S	S	*	*			trans	-73.5	26.8	170.4	-64.5	-173.4	146.7	0	0	111.7	K33	K33-E35 PolarHBondContact O-N 3.18Å
36	A	70.8	Confident	63.8	Low	81 Å²	81	137.4 Å²	137.4	67%	0.669	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-60.1	128.2	171.1	0	0	0	0	0	106.8	G34 D38	G34-A36 PolarHBondContact O-N 3.22Å; A36-D38 PolarHBondContact O-N 3.33Å
37	P	69.6	Low	65.2	Low	109 Å²	109	136.2 Å²	136.2	71%	0.708	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-51.7	143.5	172.4	21.5	-30.6	0	0	0	108.5	D39	P37-D39 PolarHBondContact O-N 3.35Å
38	D	64.9	Low	66.8	Low	144 Å²	144	136.8 Å²	136.8	77%	0.77	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-50.4	134.5	172.1	-170.8	19.7	0	0	0	107.7	A36 S40	A36-D38 PolarHBondContact O-N 3.33Å; D38-S40 PolarHBondContact O-N 3.02Å; D38-S40 PolarHBondContact O-OG 3.19Å
39	D	62.2	Low	68.3	Low	143 Å²	143	137 Å²	137	77%	0.765	73%	0.733	S	S	*	*			trans	-69	67.7	-169.5	-144.8	17.4	0	0	0	108.3	P37 R41	P37-D39 PolarHBondContact O-N 3.35Å; D39-R41 VanDerWaalsContact C-N 3.31Å; D39-R41 PolarHBondContact O-N 3.32Å
40	S	63.4	Low	69.9	Low	83 Å²	83	136.5 Å²	136.5	58%	0.58	73%	0.732	S	S	*	*			trans	-69.3	98.2	-179.9	-58.7	0	0	0	0	102.4	D38 G42 D43	D38-S40 PolarHBondContact O-N 3.02Å; D38-S40 PolarHBondContact O-OG 3.19Å; S40-G42 PolarHBondContact O-N 2.96Å; S40-D43 PolarHBondContact O-N 3.14Å
41	R	61.1	Low	71.7	Confident	215 Å²	215	130.6 Å²	130.6	81%	0.811	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-42.4	-5.5	-177.4	-71.5	176.6	168.8	161.2	-5.5	116.4	D39 D43 L44	D39-R41 VanDerWaalsContact C-N 3.31Å; D39-R41 PolarHBondContact O-N 3.32Å; R41-D43 VanDerWaalsContact C-N 3.29Å; R41-D43 PolarHBondContact O-N 2.84Å; R41-L44 HydrophobicContact CB-CD1 4.05Å; R41-L44 HydrophobicContact CG-CD1 4.12Å; R41-L44 PolarHBondContact O-N 3.27Å
42	G	62.3	Low	73.3	Confident	74 Å²	74	131.1 Å²	131.1	76%	0.763	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-65.3	-17.9	172.4	0	0	0	0	0	115.9	S40	S40-G42 PolarHBondContact O-N 2.96Å
43	D	60.5	Low	74.6	Confident	147 Å²	147	126.4 Å²	126.4	79%	0.786	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-92.2	1.9	176.2	-69.2	-14.5	0	0	0	113.5	S40 R41 I45	S40-D43 PolarHBondContact O-N 3.14Å; R41-D43 VanDerWaalsContact C-N 3.29Å; R41-D43 PolarHBondContact O-N 2.84Å; D43-I45 PolarHBondContact O-N 3.13Å
44	L	71	Confident	75.8	Confident	116 Å²	116	119.9 Å²	119.9	61%	0.607	67%	0.672	S	S	*	*			trans	-74.5	107	176.2	-65.9	171.5	0	0	0	109.8	R41 E46	R41-L44 HydrophobicContact CB-CD1 4.05Å; R41-L44 HydrophobicContact CG-CD1 4.12Å; R41-L44 PolarHBondContact O-N 3.27Å; L44-E46 PolarHBondContact O-N 3.07Å; L44-E46 VanDerWaalsContact O-N 3.1Å
45	I	77.6	Confident	76.8	Confident	150 Å²	150	123.9 Å²	123.9	77%	0.769	68%	0.681	S	S	*	*			trans	-67.5	107.5	167.8	-60.3	169.4	0	0	0	107.5	D43 I47	D43-I45 PolarHBondContact O-N 3.13Å; I45-I47 HydrophobicContact CG2-CG1 4.2Å; I45-I47 PolarHBondContact O-N 2.84Å
46	E	72.1	Confident	77.8	Confident	185 Å²	185	120.3 Å²	120.3	86%	0.864	67%	0.669	S	S	*	*			trans	-69.4	101.6	171.7	-70.8	-175.4	179.5	0	0	109.4	L44 P48	L44-E46 PolarHBondContact O-N 3.07Å; L44-E46 VanDerWaalsContact O-N 3.1Å; E46-P48 WeakPolarHBondContact O-CD 3.04Å
47	I	85.2	Confident	78.6	Confident	138 Å²	138	120.6 Å²	120.6	71%	0.708	68%	0.68	S	S	*	*			trans	-84.2	112.3	173.2	-58	173.7	0	0	0	107.4	I45 L49	I45-I47 HydrophobicContact CG2-CG1 4.2Å; I45-I47 PolarHBondContact O-N 2.84Å; I47-L49 PolarHBondContact O-N 3.48Å
48	P	86.5	Confident	79.7	Confident	122 Å²	122	117.7 Å²	117.7	79%	0.792	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-69.1	123.5	-177.8	27.8	-33.5	0	0	0	110.1	E46	E46-P48 WeakPolarHBondContact O-CD 3.04Å
49	L	88.3	Confident	81.1	Confident	113 Å²	113	114.8 Å²	114.8	59%	0.592	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-75.5	152.2	170.9	-67.3	174.6	0	0	0	110.1	I47 S110	I47-L49 PolarHBondContact O-N 3.48Å; L49-S110 WeakPolarHBondContact CD1-OG 3.43Å
50	P	91.9	Very high	82.6	Confident	114 Å²	114	110.3 Å²	110.3	74%	0.74	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-59.4	137.6	174.6	25.8	-34	0	0	0	109.9
51	P	91.8	Very high	84.1	Confident	114 Å²	114	110.8 Å²	110.8	74%	0.74	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-63	142.2	178.2	27.2	-34	0	0	0	110
52	W	93.1	Very high	85.7	Confident	73 Å²	73	104.3 Å²	104.3	28%	0.277	60%	0.596	S	S	.	*	P	Polyproline II helix	trans	-65.3	137.4	172.1	177.3	91.5	0	0	0	110	E54 R104 E108	W52-E54 HydrophobicContact CH2-CB 3.56Å; W52-E54 HydrophobicContact CH2-CG 3.9Å; W52-E54 HydrophobicContact CZ2-CB 4.34Å; W52-E54 HydrophobicContact CZ3-CB 3.86Å; W52-R104 HydrophobicContact CH2-CB 4.17Å; W52-R104 HydrophobicContact CH2-CG 4.39Å; W52-R104 HydrophobicContact CZ2-CB 4.3Å; W52-R104 HydrophobicContact CZ3-CG 4.38Å; W52-E108 HydrophobicContact CB-CB 4.09Å; W52-E108 HydrophobicContact CB-CG 3.9Å; W52-E108 HydrophobicContact CD2-CB 4.35Å; W52-E108 HydrophobicContact CG-CB 3.97Å; W52-E108 HydrophobicContact CG-CG 4.25Å
53	T	93.1	Very high	87.3	Confident	110 Å²	110	101 Å²	101	68%	0.675	56%	0.561	S	S	*	*			trans	-124	128.8	179.2	-52.8	0	0	0	0	109.2
54	E	91.3	Very high	89	Confident	63 Å²	63	96.4 Å²	96.4	29%	0.294	53%	0.533	S	S	.	.			trans	-64	137.6	174.2	-167.9	170.8	175.3	0	0	110.5	W52 D56 R100	W52-E54 HydrophobicContact CH2-CB 3.56Å; W52-E54 HydrophobicContact CH2-CG 3.9Å; W52-E54 HydrophobicContact CZ2-CB 4.34Å; W52-E54 HydrophobicContact CZ3-CB 3.86Å; E54-D56 PolarHBondContact O-N 3.49Å; E54-R100 WeakPolarHBondContact OE1-CD 3.4Å; E54-R100 WeakPolarHBondContact OE1-CG 3.21Å; E54-R100 IonicContact OE1-CZ 3.46Å; E54-R100 IonicContact OE1-NE 3.44Å; E54-R100 PolarHBondContact OE1-NE 3.36Å; E54-R100 IonicContact OE1-NH1 3.96Å; E54-R100 PolarHBondContact OE1-NH1 2.87Å; E54-R100 IonicContact OE2-NH1 2.75Å
55	K	90.4	Very high	90.2	Very high	112 Å²	112	98.6 Å²	98.6	49%	0.487	53%	0.533	S	S	.	.			trans	-89.2	103.8	175	-68	-170	178.8	-174.5	0	110.2
56	D	86.7	Confident	91.1	Very high	120 Å²	120	93.2 Å²	93.2	64%	0.642	50%	0.503	S	S	*	.			trans	-90	149.2	174.7	-65.2	-46.7	0	0	0	112.2	E54	E54-D56 PolarHBondContact O-N 3.49Å
57	G	87	Confident	92.4	Very high	88 Å²	88	84.4 Å²	84.4	91%	0.907	46%	0.461	S	S	*	.	S	Bend	trans	88.8	0.2	171.8	0	0	0	0	0	116.7
58	E	92.7	Very high	93	Very high	47 Å²	47	78.6 Å²	78.6	22%	0.22	43%	0.432	C	S	.	.			trans	-83	147.3	170.2	64.9	179.9	175.8	0	0	112.1	I62 K63 R66	E58-I62 HydrophobicContact CB-CB 4.41Å; E58-I62 HydrophobicContact CB-CG2 4.14Å; E58-K63 HydrophobicContact CG-CB 4Å; E58-K63 WeakPolarHBondContact OE1-CB 3.13Å; E58-K63 WeakPolarHBondContact OE1-CE 3.5Å; E58-K63 VanDerWaalsContact OE1-CG 3.28Å; E58-K63 WeakPolarHBondContact OE1-CG 3.37Å; E58-R66 IonicContact OE1-CZ 2.81Å; E58-R66 IonicContact OE1-NE 3.34Å; E58-R66 PolarHBondContact OE1-NE 2.71Å; E58-R66 VanDerWaalsContact OE1-NE 3.14Å; E58-R66 IonicContact OE1-NH2 3.48Å; E58-R66 PolarHBondContact OE1-NH2 3.02Å; E58-R66 IonicContact OE2-NE 2.71Å; E58-R66 PolarHBondContact OE2-NE 2.9Å
59	T	95.3	Very high	93.5	Very high	83 Å²	83	79 Å²	79	51%	0.509	42%	0.422	S	S	.	.			trans	-70.7	155.2	173.2	62.6	0	0	0	0	111	D61 I62 K63	T59-D61 PolarHBondContact O-N 2.94Å; T59-I62 PolarHBondContact O-N 3.41Å; T59-I62 WeakPolarHBondContact OG1-CD1 3.5Å; T59-I62 VanDerWaalsContact OG1-CG1 3.31Å; T59-I62 WeakPolarHBondContact OG1-CG1 3.37Å; T59-K63 PolarHBondContact O-N 2.99Å
60	M	93.9	Very high	93.9	Very high	50 Å²	50	75.7 Å²	75.7	25%	0.246	40%	0.403	C	S	.	.	H	α-helix	trans	-52.4	-40.2	178.8	-74.2	-66.6	-73.6	0	0	113.1	I62 K63 R64 E96 L99	M60-I62 PolarHBondContact O-N 3.48Å; M60-K63 PolarHBondContact O-N 3.42Å; M60-R64 WeakPolarHBondContact O-CG 3.5Å; M60-R64 PolarHBondContact O-N 3.24Å; M60-E96 HydrophobicContact CE-CB 3.92Å; M60-E96 HydrophobicContact SD-CB 3.57Å; M60-E96 VanDerWaalsContact SD-CB 3.57Å; M60-E96 HydrophobicContact SD-CG 3.67Å; M60-L99 HydrophobicContact CE-CD1 3.33Å; M60-L99 HydrophobicContact CE-CG 4.21Å; M60-L99 HydrophobicContact SD-CD1 3.89Å
61	D	93.9	Very high	94.2	Very high	93 Å²	93	70.2 Å²	70.2	50%	0.497	37%	0.367	S	S	.	.	H	α-helix	trans	-70.5	-31.7	-180	-65.9	-18.1	0	0	0	113.1	T59 R64 R65	T59-D61 PolarHBondContact O-N 2.94Å; D61-R64 IonicContact OD1-NH1 3.82Å; D61-R64 PolarHBondContact OD1-NH1 3.17Å; D61-R65 WeakPolarHBondContact O-CG 2.94Å; D61-R65 PolarHBondContact O-N 2.91Å; D61-R65 PolarHBondContact O-NE 3.47Å
62	I	95.4	Very high	94.5	Very high	79 Å²	79	67.8 Å²	67.8	41%	0.405	34%	0.344	S	S	.	.	H	α-helix	trans	-72.3	-44.8	174.3	-67.3	172.2	0	0	0	109.3	E58 T59 M60 R64 R65 R66	E58-I62 HydrophobicContact CB-CB 4.41Å; E58-I62 HydrophobicContact CB-CG2 4.14Å; T59-I62 PolarHBondContact O-N 3.41Å; T59-I62 WeakPolarHBondContact OG1-CD1 3.5Å; T59-I62 VanDerWaalsContact OG1-CG1 3.31Å; T59-I62 WeakPolarHBondContact OG1-CG1 3.37Å; M60-I62 PolarHBondContact O-N 3.48Å; I62-R64 PolarHBondContact O-N 3.42Å; I62-R65 PolarHBondContact O-N 3.5Å; I62-R66 WeakPolarHBondContact O-CB 3.45Å; I62-R66 PolarHBondContact O-N 3.38Å
63	K	96.1	Very high	94.6	Very high	5 Å²	5	71.3 Å²	71.3	2%	0.022	36%	0.361	C	S	.	.	H	α-helix	trans	-56.2	-48.6	175.4	-174.5	165.6	-73.2	-174	0	111.4	E58 T59 M60 R65 R66 L67 L99	E58-K63 HydrophobicContact CG-CB 4Å; E58-K63 WeakPolarHBondContact OE1-CB 3.13Å; E58-K63 WeakPolarHBondContact OE1-CE 3.5Å; E58-K63 VanDerWaalsContact OE1-CG 3.28Å; E58-K63 WeakPolarHBondContact OE1-CG 3.37Å; T59-K63 PolarHBondContact O-N 2.99Å; M60-K63 PolarHBondContact O-N 3.42Å; K63-R65 PolarHBondContact O-N 3.31Å; K63-R66 PolarHBondContact O-N 3.42Å; K63-L67 HydrophobicContact CG-CD1 3.77Å; K63-L67 HydrophobicContact CG-CG 4.37Å; K63-L67 WeakPolarHBondContact O-CB 3.33Å; K63-L67 VanDerWaalsContact O-CG 3.25Å; K63-L67 WeakPolarHBondContact O-CG 3.06Å; K63-L67 PolarHBondContact O-N 3.29Å; K63-L99 HydrophobicContact CD-CB 3.98Å; K63-L99 HydrophobicContact CD-CD1 4.31Å; K63-L99 HydrophobicContact CG-CB 4.39Å; K63-L99 HydrophobicContact CG-CD1 4.25Å
64	R	96.3	Very high	94.8	Very high	50 Å²	50	68.1 Å²	68.1	19%	0.189	34%	0.336	C	S	.	.	H	α-helix	trans	-58.4	-47.5	175.4	-72.3	179.4	-178.4	124.9	-0.1	112.3	M60 D61 I62 R66 L67 L68 L91 M94 L99	M60-R64 WeakPolarHBondContact O-CG 3.5Å; M60-R64 PolarHBondContact O-N 3.24Å; D61-R64 IonicContact OD1-NH1 3.82Å; D61-R64 PolarHBondContact OD1-NH1 3.17Å; I62-R64 PolarHBondContact O-N 3.42Å; R64-R66 VanDerWaalsContact C-N 3.34Å; R64-R66 PolarHBondContact O-N 2.88Å; R64-L67 PolarHBondContact O-N 3.38Å; R64-L68 WeakPolarHBondContact O-CB 3.45Å; R64-L68 PolarHBondContact O-N 2.8Å; R64-L91 HydrophobicContact CB-CD2 4.34Å; R64-L91 HydrophobicContact CB-CG 4.36Å; R64-L91 WeakPolarHBondContact CD-O 3.45Å; R64-L91 HydrophobicContact CG-CG 4.3Å; R64-L91 PolarHBondContact NE-O 3.38Å; R64-L91 VanDerWaalsContact NE-O 3.09Å; R64-L91 WeakPolarHBondContact O-CD2 3.3Å; R64-M94 PolarHBondContact NH2-O 3.18Å; R64-L99 HydrophobicContact CG-CD1 3.68Å; R64-L99 HydrophobicContact CG-CD2 4.19Å
65	R	95.9	Very high	95	Very high	162 Å²	162	68.7 Å²	68.7	61%	0.611	36%	0.359	S	S	*	.	H	α-helix	trans	-61.7	-41.8	178.3	-79.8	178.5	-87.4	158.6	-13.8	112.4	D61 I62 K63 F69	D61-R65 WeakPolarHBondContact O-CG 2.94Å; D61-R65 PolarHBondContact O-N 2.91Å; D61-R65 PolarHBondContact O-NE 3.47Å; I62-R65 PolarHBondContact O-N 3.5Å; K63-R65 PolarHBondContact O-N 3.31Å; R65-F69 PolarHBondContact O-N 3.43Å; R65-F69 VanDerWaalsContact O-N 3.14Å
66	R	97.1	Very high	95.2	Very high	36 Å²	36	64.2 Å²	64.2	14%	0.136	34%	0.341	C	S	.	.	H	α-helix	trans	-62.4	-49.9	175.3	178.9	179.5	64.3	83.6	-12.3	111.6	E58 I62 K63 R64 L68 F69 Q70 D103	E58-R66 IonicContact OE1-CZ 2.81Å; E58-R66 IonicContact OE1-NE 3.34Å; E58-R66 PolarHBondContact OE1-NE 2.71Å; E58-R66 VanDerWaalsContact OE1-NE 3.14Å; E58-R66 IonicContact OE1-NH2 3.48Å; E58-R66 PolarHBondContact OE1-NH2 3.02Å; E58-R66 IonicContact OE2-NE 2.71Å; E58-R66 PolarHBondContact OE2-NE 2.9Å; I62-R66 WeakPolarHBondContact O-CB 3.45Å; I62-R66 PolarHBondContact O-N 3.38Å; K63-R66 PolarHBondContact O-N 3.42Å; R64-R66 VanDerWaalsContact C-N 3.34Å; R64-R66 PolarHBondContact O-N 2.88Å; R66-L68 VanDerWaalsContact C-N 3.32Å; R66-L68 PolarHBondContact O-N 2.85Å; R66-F69 WeakPolarHBondContact O-CB 3.41Å; R66-F69 PolarHBondContact O-N 3Å; R66-Q70 WeakPolarHBondContact O-CG 3.41Å; R66-Q70 PolarHBondContact O-N 3.09Å; R66-D103 IonicContact CZ-OD1 3.51Å; R66-D103 IonicContact CZ-OD2 3.29Å; R66-D103 IonicContact NH1-OD1 2.69Å; R66-D103 PolarHBondContact NH1-OD1 3.21Å; R66-D103 IonicContact NH1-OD2 2.75Å; R66-D103 PolarHBondContact NH1-OD2 3.36Å; R66-D103 IonicContact NH2-OD1 3.52Å; R66-D103 IonicContact NH2-OD2 3.14Å; R66-D103 PolarHBondContact NH2-OD2 3.48Å
67	L	97.6	Very high	95.7	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-64.2	-37.7	-179.3	-70.7	172.2	0	0	0	111.9	K63 R64 F69 Q70 S71 L91 L99 Y102 D103 I106	K63-L67 HydrophobicContact CG-CD1 3.77Å; K63-L67 HydrophobicContact CG-CG 4.37Å; K63-L67 WeakPolarHBondContact O-CB 3.33Å; K63-L67 VanDerWaalsContact O-CG 3.25Å; K63-L67 WeakPolarHBondContact O-CG 3.06Å; K63-L67 PolarHBondContact O-N 3.29Å; R64-L67 PolarHBondContact O-N 3.38Å; L67-F69 VanDerWaalsContact C-N 3.35Å; L67-F69 PolarHBondContact O-N 3.05Å; L67-Q70 PolarHBondContact O-N 3.16Å; L67-S71 WeakPolarHBondContact O-CB 3.26Å; L67-S71 PolarHBondContact O-N 3.02Å; L67-S71 PolarHBondContact O-OG 3.49Å; L67-L91 HydrophobicContact CB-CD1 4.05Å; L67-L91 HydrophobicContact CB-CD2 4.37Å; L67-L91 HydrophobicContact CD1-CD1 4.38Å; L67-L99 HydrophobicContact CD1-CB 4.12Å; L67-L99 HydrophobicContact CD1-CD2 3.99Å; L67-Y102 HydrophobicContact CB-CD1 4.36Å; L67-Y102 HydrophobicContact CB-CE1 4.37Å; L67-Y102 HydrophobicContact CD1-CD1 4.25Å; L67-Y102 HydrophobicContact CD2-CD1 4.38Å; L67-D103 HydrophobicContact CD1-CB 4.4Å; L67-D103 HydrophobicContact CD2-CB 3.62Å; L67-D103 WeakPolarHBondContact CD2-OD1 3.02Å; L67-I106 HydrophobicContact CD2-CD1 4.06Å
68	L	97.7	Very high	96.1	Very high	17 Å²	17	64 Å²	64	9%	0.089	32%	0.315	C	S	.	.	H	α-helix	trans	-60	-46.6	173.3	177.8	64.5	0	0	0	111.3	R64 R66 S71 R72 A87 L91 L155 Y157 L158	R64-L68 WeakPolarHBondContact O-CB 3.45Å; R64-L68 PolarHBondContact O-N 2.8Å; R66-L68 VanDerWaalsContact C-N 3.32Å; R66-L68 PolarHBondContact O-N 2.85Å; L68-S71 PolarHBondContact O-N 3.43Å; L68-R72 HydrophobicContact CD1-CG 4.38Å; L68-R72 WeakPolarHBondContact O-CG 3.49Å; L68-R72 PolarHBondContact O-N 3.42Å; L68-R72 VanDerWaalsContact O-N 3.15Å; L68-A87 HydrophobicContact CD1-CB 3.91Å; L68-L91 HydrophobicContact CB-CD2 3.72Å; L68-L155 HydrophobicContact CD2-CD2 4.27Å; L68-Y157 WeakPolarHBondContact CD1-OH 3.12Å; L68-L158 HydrophobicContact CD2-CD1 3.42Å; L68-L158 VanDerWaalsContact CD2-CD1 3.42Å; L68-L158 HydrophobicContact CD2-CD2 4.5Å
69	F	97.6	Very high	96.4	Very high	131 Å²	131	61.7 Å²	61.7	58%	0.575	30%	0.304	S	S	*	.	H	α-helix	trans	-60	-48.5	177.1	176.4	-94	0	0	0	111.4	R65 R66 L67 S71 R72 K73	R65-F69 PolarHBondContact O-N 3.43Å; R65-F69 VanDerWaalsContact O-N 3.14Å; R66-F69 WeakPolarHBondContact O-CB 3.41Å; R66-F69 PolarHBondContact O-N 3Å; L67-F69 VanDerWaalsContact C-N 3.35Å; L67-F69 PolarHBondContact O-N 3.05Å; F69-S71 VanDerWaalsContact C-N 3.3Å; F69-S71 PolarHBondContact O-N 3.5Å; F69-R72 PolarHBondContact O-N 3.1Å; F69-R72 VanDerWaalsContact O-N 3.15Å; F69-K73 HydrophobicContact CD2-CG 4.23Å; F69-K73 HydrophobicContact CE1-CG 4.17Å; F69-K73 HydrophobicContact CE2-CG 3.85Å; F69-K73 HydrophobicContact CZ-CG 3.82Å; F69-K73 WeakPolarHBondContact O-CG 3.29Å; F69-K73 PolarHBondContact O-N 3.02Å; F69-K73 VanDerWaalsContact O-N 3.12Å
70	Q	97.4	Very high	96.4	Very high	42 Å²	42	58.9 Å²	58.9	20%	0.196	29%	0.288	C	S	.	.	H	α-helix	trans	-63.7	-33.8	179.5	-71.2	172.5	-39.9	0	0	112.8	R66 L67 R72 R74 I106 N107	R66-Q70 WeakPolarHBondContact O-CG 3.41Å; R66-Q70 PolarHBondContact O-N 3.09Å; L67-Q70 PolarHBondContact O-N 3.16Å; Q70-R72 VanDerWaalsContact C-N 3.33Å; Q70-R74 WeakPolarHBondContact O-CD 3.35Å; Q70-I106 HydrophobicContact CB-CD1 4.1Å; Q70-N107 VanDerWaalsContact CD-ND2 3.33Å; Q70-N107 PolarHBondContact NE2-ND2 3.49Å; Q70-N107 PolarHBondContact OE1-ND2 3.44Å
71	S	97.7	Very high	96.6	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-67.4	-34.4	175.5	-56.4	0	0	0	0	112.1	L67 L68 F69 R74 Y102	L67-S71 WeakPolarHBondContact O-CB 3.26Å; L67-S71 PolarHBondContact O-N 3.02Å; L67-S71 PolarHBondContact O-OG 3.49Å; L68-S71 PolarHBondContact O-N 3.43Å; F69-S71 VanDerWaalsContact C-N 3.3Å; F69-S71 PolarHBondContact O-N 3.5Å; S71-R74 WeakPolarHBondContact O-CG 3.4Å; S71-Y102 WeakPolarHBondContact OG-CE1 3.37Å; S71-Y102 PolarHBondContact OG-OH 3.2Å
72	R	97.4	Very high	96.8	Very high	63 Å²	63	53.7 Å²	53.7	24%	0.238	26%	0.261	C	S	.	.	H	α-helix	trans	-85.5	-16.6	-178.3	-67.4	177.5	75.1	94.2	-1	114	L68 F69 Q70 P153	L68-R72 HydrophobicContact CD1-CG 4.38Å; L68-R72 WeakPolarHBondContact O-CG 3.49Å; L68-R72 PolarHBondContact O-N 3.42Å; L68-R72 VanDerWaalsContact O-N 3.15Å; F69-R72 PolarHBondContact O-N 3.1Å; F69-R72 VanDerWaalsContact O-N 3.15Å; Q70-R72 VanDerWaalsContact C-N 3.33Å; R72-P153 VanDerWaalsContact CZ-O 3.29Å; R72-P153 PolarHBondContact NH1-O 2.61Å; R72-P153 PolarHBondContact NH2-O 3.43Å
73	K	96.4	Very high	96.9	Very high	146 Å²	146	50 Å²	50	64%	0.635	24%	0.242	S	C	*	.	S	Bend	trans	-115.1	70.9	-174.5	-63.9	-60.3	-175.4	-177.9	0	110.3	F69	F69-K73 HydrophobicContact CD2-CG 4.23Å; F69-K73 HydrophobicContact CE1-CG 4.17Å; F69-K73 HydrophobicContact CE2-CG 3.85Å; F69-K73 HydrophobicContact CZ-CG 3.82Å; F69-K73 WeakPolarHBondContact O-CG 3.29Å; F69-K73 PolarHBondContact O-N 3.02Å; F69-K73 VanDerWaalsContact O-N 3.12Å
74	R	96.9	Very high	97	Very high	43 Å²	43	49.7 Å²	49.7	16%	0.162	24%	0.24	C	C	.	.			trans	-103.2	164.1	178.1	-50.6	-58.5	-61.9	-171.5	-5.1	111.4	Q70 S71 M76 N79 C80 L83 I106 D112	Q70-R74 WeakPolarHBondContact O-CD 3.35Å; S71-R74 WeakPolarHBondContact O-CG 3.4Å; R74-M76 VanDerWaalsContact C-N 3.3Å; R74-M76 PolarHBondContact O-N 3.2Å; R74-N79 HydrophobicContact CB-CB 4.06Å; R74-N79 HydrophobicContact CG-CB 4Å; R74-C80 VanDerWaalsContact CB-SG 3.6Å; R74-C80 PolarHBondContact N-SG 3.19Å; R74-C80 VanDerWaalsContact N-SG 3.42Å; R74-L83 HydrophobicContact CG-CD1 4.19Å; R74-I106 VanDerWaalsContact CZ-O 3.3Å; R74-I106 PolarHBondContact NH1-O 3.43Å; R74-I106 PolarHBondContact NH2-O 2.91Å; R74-D112 IonicContact CZ-OD1 3.09Å; R74-D112 IonicContact NE-OD1 3.7Å; R74-D112 PolarHBondContact NE-OD1 3.08Å; R74-D112 IonicContact NH2-OD1 3.38Å; R74-D112 PolarHBondContact NH2-OD1 2.68Å
75	G	94.4	Very high	97	Very high	76 Å²	76	48.8 Å²	48.8	78%	0.784	24%	0.239	S	C	*	.	S	Bend	trans	-71.8	-21.4	177.7	0	0	0	0	0	114.4	D112	G75-D112 PolarHBondContact N-OD2 3.01Å
76	M	95.9	Very high	97.1	Very high	18 Å²	18	41.1 Å²	41.1	9%	0.089	21%	0.21	C	C	.	.	S	Bend	trans	-123.5	152.6	-178.7	67.6	176.4	54	0	0	112.4	R74 E78 N79 C80 D112 W113	R74-M76 VanDerWaalsContact C-N 3.3Å; R74-M76 PolarHBondContact O-N 3.2Å; M76-E78 HydrophobicContact CG-CB 4.5Å; M76-E78 HydrophobicContact SD-CB 4.21Å; M76-N79 HydrophobicContact CG-CB 3.68Å; M76-N79 HydrophobicContact SD-CB 4.05Å; M76-N79 PolarHBondContact SD-ND2 2.89Å; M76-C80 PolarHBondContact O-N 3.37Å; M76-C80 VanDerWaalsContact O-N 3.15Å; M76-C80 PolarHBondContact O-SG 3.04Å; M76-D112 HydrophobicContact CE-CB 3.6Å; M76-D112 HydrophobicContact CG-CB 4.27Å; M76-D112 HydrophobicContact SD-CB 4.26Å; M76-W113 HydrophobicContact CE-CB 4.15Å; M76-W113 HydrophobicContact CE-CD2 3.26Å; M76-W113 HydrophobicContact CE-CE3 3.77Å; M76-W113 HydrophobicContact CE-CG 3.43Å; M76-W113 VanDerWaalsContact CE-CG 3.43Å; M76-W113 HydrophobicContact CE-CH2 4.32Å; M76-W113 HydrophobicContact CE-CZ2 3.9Å; M76-W113 HydrophobicContact CE-CZ3 4.26Å; M76-W113 HydrophobicContact SD-CD2 4.36Å; M76-W113 HydrophobicContact SD-CE3 4.3Å; M76-W113 HydrophobicContact SD-CZ3 4.45Å
77	L	96.7	Very high	97.1	Very high	119 Å²	119	39.5 Å²	39.5	62%	0.623	20%	0.204	S	C	*	.	H	α-helix	trans	-71.4	-35.5	-176.8	-177.5	60.9	0	0	0	111.7	C80 I81	L77-C80 WeakPolarHBondContact O-CB 2.98Å; L77-C80 PolarHBondContact O-N 3.1Å; L77-I81 HydrophobicContact CD1-CD1 3.9Å; L77-I81 HydrophobicContact CD1-CG1 4.06Å; L77-I81 HydrophobicContact CD2-CD1 4.34Å; L77-I81 HydrophobicContact CG-CD1 3.77Å; L77-I81 HydrophobicContact CG-CG1 4.33Å; L77-I81 WeakPolarHBondContact O-CG1 3.39Å; L77-I81 PolarHBondContact O-N 3.17Å
78	E	96.4	Very high	97	Very high	83 Å²	83	43.9 Å²	43.9	39%	0.388	22%	0.223	S	C	.	.	H	α-helix	trans	-56.7	-54.8	180	-64.4	82.6	171.5	0	0	110.7	M76 I81 L82 Y116	M76-E78 HydrophobicContact CG-CB 4.5Å; M76-E78 HydrophobicContact SD-CB 4.21Å; E78-I81 PolarHBondContact O-N 2.75Å; E78-L82 VanDerWaalsContact O-CB 3.25Å; E78-L82 WeakPolarHBondContact O-CB 3.32Å; E78-L82 PolarHBondContact O-N 2.96Å; E78-Y116 HydrophobicContact CB-CD2 4.02Å; E78-Y116 HydrophobicContact CB-CE2 3.86Å; E78-Y116 HydrophobicContact CG-CE2 4.43Å
79	N	97.3	Very high	96.9	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-67	-36.3	175.2	-74.9	-7	0	0	0	112.3	R74 M76 I81 L82 L83 D112 Y116	R74-N79 HydrophobicContact CB-CB 4.06Å; R74-N79 HydrophobicContact CG-CB 4Å; M76-N79 HydrophobicContact CG-CB 3.68Å; M76-N79 HydrophobicContact SD-CB 4.05Å; M76-N79 PolarHBondContact SD-ND2 2.89Å; N79-I81 VanDerWaalsContact C-N 3.33Å; N79-I81 PolarHBondContact O-N 3.45Å; N79-L82 PolarHBondContact O-N 3Å; N79-L83 HydrophobicContact CB-CD1 4.27Å; N79-L83 VanDerWaalsContact O-CB 3.23Å; N79-L83 WeakPolarHBondContact O-CB 3.35Å; N79-L83 WeakPolarHBondContact O-CG 3.34Å; N79-L83 PolarHBondContact O-N 2.91Å; N79-D112 PolarHBondContact ND2-O 3.49Å; N79-D112 PolarHBondContact ND2-OD1 3.29Å; N79-Y116 WeakPolarHBondContact OD1-CB 3.48Å
80	C	97.2	Very high	96.9	Very high	23 Å²	23	43.7 Å²	43.7	16%	0.155	22%	0.222	C	C	.	.	H	α-helix	trans	-57.2	-48.1	176.1	-76.6	0	0	0	0	111.2	R74 M76 L77 S84	R74-C80 VanDerWaalsContact CB-SG 3.6Å; R74-C80 PolarHBondContact N-SG 3.19Å; R74-C80 VanDerWaalsContact N-SG 3.42Å; M76-C80 PolarHBondContact O-N 3.37Å; M76-C80 VanDerWaalsContact O-N 3.15Å; M76-C80 PolarHBondContact O-SG 3.04Å; L77-C80 WeakPolarHBondContact O-CB 2.98Å; L77-C80 PolarHBondContact O-N 3.1Å; C80-S84 WeakPolarHBondContact O-CB 3.17Å; C80-S84 PolarHBondContact O-N 2.91Å; C80-S84 VanDerWaalsContact O-N 3.17Å; C80-S84 PolarHBondContact O-OG 3.13Å
81	I	97.4	Very high	96.7	Very high	22 Å²	22	41.9 Å²	41.9	11%	0.113	21%	0.214	C	C	.	.	H	α-helix	trans	-70.1	-50.7	-180	-64.2	166.4	0	0	0	109.9	L77 E78 N79 L83 S84 L85 R149 L150	L77-I81 HydrophobicContact CD1-CD1 3.9Å; L77-I81 HydrophobicContact CD1-CG1 4.06Å; L77-I81 HydrophobicContact CD2-CD1 4.34Å; L77-I81 HydrophobicContact CG-CD1 3.77Å; L77-I81 HydrophobicContact CG-CG1 4.33Å; L77-I81 WeakPolarHBondContact O-CG1 3.39Å; L77-I81 PolarHBondContact O-N 3.17Å; E78-I81 PolarHBondContact O-N 2.75Å; N79-I81 VanDerWaalsContact C-N 3.33Å; N79-I81 PolarHBondContact O-N 3.45Å; I81-L83 PolarHBondContact O-N 3.25Å; I81-S84 PolarHBondContact O-N 2.99Å; I81-S84 PolarHBondContact O-OG 3.22Å; I81-L85 HydrophobicContact CG2-CD1 3.79Å; I81-L85 WeakPolarHBondContact O-CG 3.24Å; I81-L85 PolarHBondContact O-N 3.4Å; I81-L85 VanDerWaalsContact O-N 3.1Å; I81-R149 HydrophobicContact CG2-CB 4.16Å; I81-L150 VanDerWaalsContact CD1-O 3.24Å; I81-L150 WeakPolarHBondContact CD1-O 3.2Å
82	L	97.6	Very high	96.5	Very high	13 Å²	13	45.9 Å²	45.9	7%	0.068	24%	0.235	C	C	.	.	H	α-helix	trans	-58.9	-53.6	-176.2	-177.1	65.7	0	0	0	112.1	E78 N79 L85 F86 Y116 A119 F140 T141	E78-L82 VanDerWaalsContact O-CB 3.25Å; E78-L82 WeakPolarHBondContact O-CB 3.32Å; E78-L82 PolarHBondContact O-N 2.96Å; N79-L82 PolarHBondContact O-N 3Å; L82-L85 PolarHBondContact O-N 3.26Å; L82-F86 WeakPolarHBondContact O-CB 3.45Å; L82-F86 PolarHBondContact O-N 3.21Å; L82-Y116 HydrophobicContact CD2-CD2 4.49Å; L82-A119 HydrophobicContact CD2-CB 4.15Å; L82-F140 HydrophobicContact CD1-CD1 3.93Å; L82-F140 HydrophobicContact CD1-CE1 3.96Å; L82-T141 HydrophobicContact CD1-CG2 4.44Å; L82-T141 HydrophobicContact CD2-CG2 4.49Å
83	L	98.1	Very high	96.4	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-73.1	-30.3	-176.3	-61.4	178.9	0	0	0	112.3	R74 N79 I81 A87 I106 L137	R74-L83 HydrophobicContact CG-CD1 4.19Å; N79-L83 HydrophobicContact CB-CD1 4.27Å; N79-L83 VanDerWaalsContact O-CB 3.23Å; N79-L83 WeakPolarHBondContact O-CB 3.35Å; N79-L83 WeakPolarHBondContact O-CG 3.34Å; N79-L83 PolarHBondContact O-N 2.91Å; I81-L83 PolarHBondContact O-N 3.25Å; L83-A87 WeakPolarHBondContact O-CB 3.39Å; L83-A87 PolarHBondContact O-N 3.48Å; L83-I106 HydrophobicContact CD1-CG2 4.19Å; L83-I106 HydrophobicContact CD2-CG2 4.48Å; L83-L137 HydrophobicContact CD2-CD1 4.1Å; L83-L137 HydrophobicContact CD2-CD2 4.44Å
84	S	97.4	Very high	96.3	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-70	-37.1	176.8	66.6	0	0	0	0	112.9	C80 I81 K88 A152 P153	C80-S84 WeakPolarHBondContact O-CB 3.17Å; C80-S84 PolarHBondContact O-N 2.91Å; C80-S84 VanDerWaalsContact O-N 3.17Å; C80-S84 PolarHBondContact O-OG 3.13Å; I81-S84 PolarHBondContact O-N 2.99Å; I81-S84 PolarHBondContact O-OG 3.22Å; S84-K88 PolarHBondContact O-N 2.89Å; S84-K88 VanDerWaalsContact O-N 3.08Å; S84-A152 WeakPolarHBondContact OG-CB 3.39Å; S84-P153 WeakPolarHBondContact OG-CD 3.4Å
85	L	97.4	Very high	96.3	Very high	30 Å²	30	42.8 Å²	42.8	16%	0.157	24%	0.241	C	C	.	.	H	α-helix	trans	-70.8	-43.5	173.5	-68.1	169	0	0	0	111.1	I81 L82 A87 K88 Q89 F140 R149 P153	I81-L85 HydrophobicContact CG2-CD1 3.79Å; I81-L85 WeakPolarHBondContact O-CG 3.24Å; I81-L85 PolarHBondContact O-N 3.4Å; I81-L85 VanDerWaalsContact O-N 3.1Å; L82-L85 PolarHBondContact O-N 3.26Å; L85-A87 VanDerWaalsContact C-N 3.34Å; L85-A87 PolarHBondContact O-N 2.95Å; L85-K88 WeakPolarHBondContact O-CB 3.29Å; L85-K88 PolarHBondContact O-N 3.44Å; L85-Q89 PolarHBondContact O-N 2.7Å; L85-F140 HydrophobicContact CB-CE1 4.15Å; L85-F140 HydrophobicContact CB-CZ 3.74Å; L85-R149 HydrophobicContact CD1-CB 3.77Å; L85-R149 HydrophobicContact CD1-CG 3.62Å; L85-P153 HydrophobicContact CD2-CB 4.25Å; L85-P153 HydrophobicContact CD2-CG 4Å
86	F	97.7	Very high	96.3	Very high	1 Å²	1	43.5 Å²	43.5	0%	0.004	22%	0.223	C	C	.	.	H	α-helix	trans	-57.1	-47.3	174.2	-180	-95	0	0	0	111.6	L82 K88 Q89 Y90 M94 Y102 I133 L136 L137 F140	L82-F86 WeakPolarHBondContact O-CB 3.45Å; L82-F86 PolarHBondContact O-N 3.21Å; F86-K88 VanDerWaalsContact C-N 3.35Å; F86-K88 PolarHBondContact O-N 3.16Å; F86-Q89 PolarHBondContact O-N 3.44Å; F86-Y90 AromaticContact CD2-CD2 3.52Å; F86-Y90 HydrophobicContact CD2-CD2 3.52Å; F86-Y90 AromaticContact CD2-CE2 3.82Å; F86-Y90 HydrophobicContact CD2-CE2 3.82Å; F86-Y90 AromaticContact CE2-CD2 3.54Å; F86-Y90 HydrophobicContact CE2-CD2 3.54Å; F86-Y90 AromaticContact CE2-CE2 3.89Å; F86-Y90 HydrophobicContact CE2-CE2 3.89Å; F86-Y90 HydrophobicContact CE2-CG 4.36Å; F86-Y90 HydrophobicContact CG-CD2 4.08Å; F86-Y90 HydrophobicContact CZ-CD2 4.12Å; F86-Y90 WeakPolarHBondContact O-CD2 3.35Å; F86-Y90 PolarHBondContact O-N 2.87Å; F86-M94 HydrophobicContact CE1-CE 3.54Å; F86-M94 HydrophobicContact CZ-CE 3.71Å; F86-Y102 HydrophobicContact CD1-CD2 4.43Å; F86-Y102 AromaticContact CD1-CE2 3.66Å; F86-Y102 HydrophobicContact CD1-CE2 3.66Å; F86-Y102 AromaticContact CE1-CD2 3.78Å; F86-Y102 HydrophobicContact CE1-CD2 3.78Å; F86-Y102 AromaticContact CE1-CE2 3.46Å; F86-Y102 HydrophobicContact CE1-CE2 3.46Å; F86-Y102 VanDerWaalsContact CE1-CE2 3.46Å; F86-I133 HydrophobicContact CZ-CG2 4.44Å; F86-L136 HydrophobicContact CE2-CB 4.33Å; F86-L136 HydrophobicContact CE2-CD2 3.85Å; F86-L136 HydrophobicContact CE2-CG 3.95Å; F86-L136 HydrophobicContact CZ-CD2 3.8Å; F86-L136 HydrophobicContact CZ-CG 4.31Å; F86-L137 HydrophobicContact CD2-CD1 3.96Å; F86-L137 HydrophobicContact CE2-CB 4.21Å; F86-L137 HydrophobicContact CE2-CD1 4.27Å; F86-L137 HydrophobicContact CG-CD1 4.17Å; F86-L137 HydrophobicContact CZ-CB 4.48Å; F86-F140 HydrophobicContact CB-CD1 3.95Å; F86-F140 HydrophobicContact CB-CE1 3.86Å; F86-F140 HydrophobicContact CB-CZ 4.45Å; F86-F140 HydrophobicContact CD2-CB 3.96Å; F86-F140 AromaticContact CD2-CD1 3.92Å; F86-F140 HydrophobicContact CD2-CD1 3.92Å; F86-F140 AromaticContact CD2-CG 3.87Å; F86-F140 HydrophobicContact CD2-CG 3.87Å; F86-F140 HydrophobicContact CE2-CB 4.4Å; F86-F140 HydrophobicContact CG-CD1 4.44Å
87	A	97.4	Very high	96.2	Very high	2 Å²	2	47.9 Å²	47.9	2%	0.017	24%	0.243	C	C	.	.	H	α-helix	trans	-62.2	-40.1	177.5	0	0	0	0	0	112.3	L68 L83 L85 Q89 L91	L68-A87 HydrophobicContact CD1-CB 3.91Å; L83-A87 WeakPolarHBondContact O-CB 3.39Å; L83-A87 PolarHBondContact O-N 3.48Å; L85-A87 VanDerWaalsContact C-N 3.34Å; L85-A87 PolarHBondContact O-N 2.95Å; A87-Q89 VanDerWaalsContact C-N 3.27Å; A87-Q89 PolarHBondContact O-N 2.91Å; A87-L91 HydrophobicContact CB-CB 4.38Å; A87-L91 HydrophobicContact CB-CD2 4.32Å; A87-L91 WeakPolarHBondContact O-CB 3.42Å; A87-L91 PolarHBondContact O-N 3.46Å
88	K	96	Very high	96.2	Very high	92 Å²	92	44.3 Å²	44.3	40%	0.4	22%	0.224	S	C	.	.	H	α-helix	trans	-57.5	-41.5	175.8	171.4	177	175.8	-171.2	0	111.9	S84 L85 F86 P153 Y157	S84-K88 PolarHBondContact O-N 2.89Å; S84-K88 VanDerWaalsContact O-N 3.08Å; L85-K88 WeakPolarHBondContact O-CB 3.29Å; L85-K88 PolarHBondContact O-N 3.44Å; F86-K88 VanDerWaalsContact C-N 3.35Å; F86-K88 PolarHBondContact O-N 3.16Å; K88-P153 HydrophobicContact CB-CG 4.06Å; K88-P153 HydrophobicContact CD-CB 3.55Å; K88-P153 HydrophobicContact CD-CG 3.77Å; K88-Y157 HydrophobicContact CB-CE1 4.09Å; K88-Y157 HydrophobicContact CB-CE2 4.07Å; K88-Y157 HydrophobicContact CD-CD1 3.88Å; K88-Y157 HydrophobicContact CD-CE1 3.93Å; K88-Y157 HydrophobicContact CD-CG 4.3Å; K88-Y157 HydrophobicContact CG-CD1 3.96Å; K88-Y157 HydrophobicContact CG-CD2 3.98Å; K88-Y157 HydrophobicContact CG-CE1 3.82Å; K88-Y157 HydrophobicContact CG-CE2 3.82Å; K88-Y157 HydrophobicContact CG-CG 4.05Å
89	Q	94.9	Very high	96.2	Very high	96 Å²	96	40.4 Å²	40.4	45%	0.449	21%	0.205	S	C	.	.	H	α-helix	trans	-80.4	-43.3	-175.5	-174.2	168.7	3	0	0	113	L85 F86 A87	L85-Q89 PolarHBondContact O-N 2.7Å; F86-Q89 PolarHBondContact O-N 3.44Å; A87-Q89 VanDerWaalsContact C-N 3.27Å; A87-Q89 PolarHBondContact O-N 2.91Å
90	Y	96.3	Very high	96.1	Very high	48 Å²	48	44.5 Å²	44.5	19%	0.188	22%	0.221	C	C	.	.	H	α-helix	trans	-108.7	-25.4	-166.1	-62.8	-70.4	0	0	0	114.7	F86 N92 T93 M94 L136 F140	F86-Y90 AromaticContact CD2-CD2 3.52Å; F86-Y90 HydrophobicContact CD2-CD2 3.52Å; F86-Y90 AromaticContact CD2-CE2 3.82Å; F86-Y90 HydrophobicContact CD2-CE2 3.82Å; F86-Y90 AromaticContact CE2-CD2 3.54Å; F86-Y90 HydrophobicContact CE2-CD2 3.54Å; F86-Y90 AromaticContact CE2-CE2 3.89Å; F86-Y90 HydrophobicContact CE2-CE2 3.89Å; F86-Y90 HydrophobicContact CE2-CG 4.36Å; F86-Y90 HydrophobicContact CG-CD2 4.08Å; F86-Y90 HydrophobicContact CZ-CD2 4.12Å; F86-Y90 WeakPolarHBondContact O-CD2 3.35Å; F86-Y90 PolarHBondContact O-N 2.87Å; Y90-N92 VanDerWaalsContact C-N 3.26Å; Y90-N92 PolarHBondContact O-N 3.3Å; Y90-N92 VanDerWaalsContact O-N 3.16Å; Y90-T93 PolarHBondContact O-N 2.93Å; Y90-T93 PolarHBondContact O-OG1 3.49Å; Y90-M94 VanDerWaalsContact O-CG 3.29Å; Y90-M94 WeakPolarHBondContact O-CG 3.34Å; Y90-M94 PolarHBondContact O-N 3.01Å; Y90-L136 HydrophobicContact CD1-CD1 4.45Å; Y90-L136 HydrophobicContact CD1-CD2 3.66Å; Y90-L136 HydrophobicContact CD1-CG 4.41Å; Y90-L136 HydrophobicContact CD2-CD2 4.03Å; Y90-L136 HydrophobicContact CE1-CD1 3.88Å; Y90-L136 HydrophobicContact CE1-CD2 3.89Å; Y90-L136 HydrophobicContact CE1-CG 4.15Å; Y90-L136 HydrophobicContact CE2-CD2 4.27Å; Y90-L136 HydrophobicContact CE2-CG 4.3Å; Y90-L136 HydrophobicContact CG-CD2 3.71Å; Y90-F140 HydrophobicContact CE2-CB 4.45Å; Y90-F140 AromaticContact CE2-CD2 3.82Å; Y90-F140 HydrophobicContact CE2-CD2 3.82Å; Y90-F140 HydrophobicContact CE2-CE2 4.46Å; Y90-F140 HydrophobicContact CE2-CG 4.32Å
91	L	95.2	Very high	96.1	Very high	5 Å²	5	46 Å²	46	3%	0.026	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-31.6	-168.4	-160.9	72.4	0	0	0	113.3	R64 L67 L68 A87 M94 L99 Y102	R64-L91 HydrophobicContact CB-CD2 4.34Å; R64-L91 HydrophobicContact CB-CG 4.36Å; R64-L91 WeakPolarHBondContact CD-O 3.45Å; R64-L91 HydrophobicContact CG-CG 4.3Å; R64-L91 PolarHBondContact NE-O 3.38Å; R64-L91 VanDerWaalsContact NE-O 3.09Å; R64-L91 WeakPolarHBondContact O-CD2 3.3Å; L67-L91 HydrophobicContact CB-CD1 4.05Å; L67-L91 HydrophobicContact CB-CD2 4.37Å; L67-L91 HydrophobicContact CD1-CD1 4.38Å; L68-L91 HydrophobicContact CB-CD2 3.72Å; A87-L91 HydrophobicContact CB-CB 4.38Å; A87-L91 HydrophobicContact CB-CD2 4.32Å; A87-L91 WeakPolarHBondContact O-CB 3.42Å; A87-L91 PolarHBondContact O-N 3.46Å; L91-M94 HydrophobicContact CD1-SD 4.37Å; L91-L99 HydrophobicContact CD1-CD2 3.61Å; L91-L99 HydrophobicContact CG-CD2 4.25Å; L91-Y102 HydrophobicContact CD1-CD1 3.9Å; L91-Y102 HydrophobicContact CD1-CE1 3.96Å
92	N	93.3	Very high	96.1	Very high	83 Å²	83	45 Å²	45	44%	0.444	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-28.1	177.7	-71	-24.3	0	0	0	112.9	Y90	Y90-N92 VanDerWaalsContact C-N 3.26Å; Y90-N92 PolarHBondContact O-N 3.3Å; Y90-N92 VanDerWaalsContact O-N 3.16Å
93	T	93.8	Very high	96	Very high	107 Å²	107	44.6 Å²	44.6	66%	0.656	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-16	-177.7	58.7	0	0	0	0	113.2	Y90	Y90-T93 PolarHBondContact O-N 2.93Å; Y90-T93 PolarHBondContact O-OG1 3.49Å
94	M	95.5	Very high	95.9	Very high	5 Å²	5	49.1 Å²	49.1	3%	0.025	24%	0.235	C	C	.	.			trans	-63.3	140.6	-179.7	-78.9	177.1	-174.7	0	0	113	R64 F86 Y90 L91 Q98 L99 I133 L136	R64-M94 PolarHBondContact NH2-O 3.18Å; F86-M94 HydrophobicContact CE1-CE 3.54Å; F86-M94 HydrophobicContact CZ-CE 3.71Å; Y90-M94 VanDerWaalsContact O-CG 3.29Å; Y90-M94 WeakPolarHBondContact O-CG 3.34Å; Y90-M94 PolarHBondContact O-N 3.01Å; L91-M94 HydrophobicContact CD1-SD 4.37Å; M94-Q98 HydrophobicContact CB-CB 3.95Å; M94-Q98 HydrophobicContact CG-CB 3.99Å; M94-L99 HydrophobicContact CB-CD2 3.72Å; M94-L99 HydrophobicContact CB-CG 4.03Å; M94-L99 HydrophobicContact CG-CD2 4.48Å; M94-L99 HydrophobicContact SD-CD2 3.96Å; M94-I133 HydrophobicContact CE-CD1 3.58Å; M94-I133 HydrophobicContact CG-CD1 4.49Å; M94-I133 HydrophobicContact SD-CD1 4.09Å; M94-L136 HydrophobicContact CE-CD2 4.35Å
95	T	96.5	Very high	95.9	Very high	76 Å²	76	49.4 Å²	49.4	47%	0.466	24%	0.237	S	C	.	.			trans	-74.4	168.9	169.7	66.3	0	0	0	0	111.4	H97 Q98 L99	T95-H97 VanDerWaalsContact C-N 3.33Å; T95-H97 PolarHBondContact O-N 3.44Å; T95-Q98 PolarHBondContact O-N 3.15Å; T95-Q98 WeakPolarHBondContact OG1-CG 3.36Å; T95-Q98 PolarHBondContact OG1-N 3.43Å; T95-Q98 PolarHBondContact OG1-OE1 3.14Å; T95-L99 WeakPolarHBondContact O-CG 3.39Å; T95-L99 PolarHBondContact O-N 2.94Å
96	E	94.4	Very high	95.8	Very high	91 Å²	91	48 Å²	48	43%	0.425	23%	0.229	S	C	.	.	H	α-helix	trans	-59.5	-43	178.2	-173.8	178	170.1	0	0	112.6	M60 Q98 L99 R100	M60-E96 HydrophobicContact CE-CB 3.92Å; M60-E96 HydrophobicContact SD-CB 3.57Å; M60-E96 VanDerWaalsContact SD-CB 3.57Å; M60-E96 HydrophobicContact SD-CG 3.67Å; E96-Q98 VanDerWaalsContact C-N 3.33Å; E96-Q98 PolarHBondContact O-N 2.66Å; E96-L99 PolarHBondContact O-N 2.88Å; E96-R100 WeakPolarHBondContact O-CG 3.41Å; E96-R100 PolarHBondContact O-N 3.5Å; E96-R100 IonicContact OE1-CZ 3.3Å; E96-R100 IonicContact OE1-NE 3.48Å; E96-R100 PolarHBondContact OE1-NE 3.44Å; E96-R100 IonicContact OE1-NH2 3.42Å; E96-R100 PolarHBondContact OE1-NH2 3.36Å
97	H	94.7	Very high	95.7	Very high	109 Å²	109	50 Å²	50	51%	0.505	24%	0.24	S	C	.	.	H	α-helix	trans	-59.7	-45.1	177.1	178.6	-97.2	0	0	0	111.5	T95 R100 Q101	T95-H97 VanDerWaalsContact C-N 3.33Å; T95-H97 PolarHBondContact O-N 3.44Å; H97-R100 PolarHBondContact O-N 2.9Å; H97-Q101 PolarHBondContact CE1-NE2 3.15Å; H97-Q101 PolarHBondContact O-N 3.17Å
98	Q	96.4	Very high	95.6	Very high	45 Å²	45	52.3 Å²	52.3	21%	0.21	25%	0.251	C	S	.	.	H	α-helix	trans	-64.1	-40.3	176.8	-79.1	171.8	-19.2	0	0	112.4	M94 T95 E96 R100 Q101 Y102 E132 I133	M94-Q98 HydrophobicContact CB-CB 3.95Å; M94-Q98 HydrophobicContact CG-CB 3.99Å; T95-Q98 PolarHBondContact O-N 3.15Å; T95-Q98 WeakPolarHBondContact OG1-CG 3.36Å; T95-Q98 PolarHBondContact OG1-N 3.43Å; T95-Q98 PolarHBondContact OG1-OE1 3.14Å; E96-Q98 VanDerWaalsContact C-N 3.33Å; E96-Q98 PolarHBondContact O-N 2.66Å; Q98-R100 VanDerWaalsContact C-N 3.32Å; Q98-R100 PolarHBondContact O-N 3.49Å; Q98-Q101 PolarHBondContact O-N 2.85Å; Q98-Y102 WeakPolarHBondContact O-CB 3.25Å; Q98-Y102 PolarHBondContact O-N 3.18Å; Q98-E132 PolarHBondContact NE2-OE2 3.22Å; Q98-E132 VanDerWaalsContact NE2-OE2 3.07Å; Q98-I133 HydrophobicContact CB-CD1 3.87Å; Q98-I133 HydrophobicContact CB-CG1 4.35Å; Q98-I133 HydrophobicContact CG-CD1 3.95Å; Q98-I133 HydrophobicContact CG-CG1 4.46Å
99	L	96.4	Very high	95.5	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63.9	-36.5	174.5	-69.9	-176.1	0	0	0	112.3	M60 K63 R64 L67 L91 M94 T95 E96 Y102 D103	M60-L99 HydrophobicContact CE-CD1 3.33Å; M60-L99 HydrophobicContact CE-CG 4.21Å; M60-L99 HydrophobicContact SD-CD1 3.89Å; K63-L99 HydrophobicContact CD-CB 3.98Å; K63-L99 HydrophobicContact CD-CD1 4.31Å; K63-L99 HydrophobicContact CG-CB 4.39Å; K63-L99 HydrophobicContact CG-CD1 4.25Å; R64-L99 HydrophobicContact CG-CD1 3.68Å; R64-L99 HydrophobicContact CG-CD2 4.19Å; L67-L99 HydrophobicContact CD1-CB 4.12Å; L67-L99 HydrophobicContact CD1-CD2 3.99Å; L91-L99 HydrophobicContact CD1-CD2 3.61Å; L91-L99 HydrophobicContact CG-CD2 4.25Å; M94-L99 HydrophobicContact CB-CD2 3.72Å; M94-L99 HydrophobicContact CB-CG 4.03Å; M94-L99 HydrophobicContact CG-CD2 4.48Å; M94-L99 HydrophobicContact SD-CD2 3.96Å; T95-L99 WeakPolarHBondContact O-CG 3.39Å; T95-L99 PolarHBondContact O-N 2.94Å; E96-L99 PolarHBondContact O-N 2.88Å; L99-Y102 PolarHBondContact O-N 3.43Å; L99-D103 VanDerWaalsContact O-CB 3.31Å; L99-D103 WeakPolarHBondContact O-CB 3.31Å; L99-D103 PolarHBondContact O-N 3.19Å
100	R	95.3	Very high	95.2	Very high	86 Å²	86	48.8 Å²	48.8	33%	0.325	25%	0.248	S	C	.	.	H	α-helix	trans	-67.1	-44.1	175.6	-68.2	171.6	-177.7	-126.4	10	111.5	E54 E96 H97 Q98 Y102 D103 R104	E54-R100 WeakPolarHBondContact OE1-CD 3.4Å; E54-R100 WeakPolarHBondContact OE1-CG 3.21Å; E54-R100 IonicContact OE1-CZ 3.46Å; E54-R100 IonicContact OE1-NE 3.44Å; E54-R100 PolarHBondContact OE1-NE 3.36Å; E54-R100 IonicContact OE1-NH1 3.96Å; E54-R100 PolarHBondContact OE1-NH1 2.87Å; E54-R100 IonicContact OE2-NH1 2.75Å; E96-R100 WeakPolarHBondContact O-CG 3.41Å; E96-R100 PolarHBondContact O-N 3.5Å; E96-R100 IonicContact OE1-CZ 3.3Å; E96-R100 IonicContact OE1-NE 3.48Å; E96-R100 PolarHBondContact OE1-NE 3.44Å; E96-R100 IonicContact OE1-NH2 3.42Å; E96-R100 PolarHBondContact OE1-NH2 3.36Å; H97-R100 PolarHBondContact O-N 2.9Å; Q98-R100 VanDerWaalsContact C-N 3.32Å; Q98-R100 PolarHBondContact O-N 3.49Å; R100-Y102 VanDerWaalsContact C-N 3.32Å; R100-Y102 PolarHBondContact O-N 2.9Å; R100-D103 PolarHBondContact O-N 3.35Å; R100-R104 WeakPolarHBondContact O-CB 3.41Å; R100-R104 PolarHBondContact O-N 3.3Å
101	Q	95.8	Very high	95.1	Very high	56 Å²	56	49.8 Å²	49.8	26%	0.262	26%	0.256	S	S	.	.	H	α-helix	trans	-59.9	-43.6	173.6	-72.6	-175.6	-43.8	0	0	111.7	H97 Q98 R104 L105 I133	H97-Q101 PolarHBondContact CE1-NE2 3.15Å; H97-Q101 PolarHBondContact O-N 3.17Å; Q98-Q101 PolarHBondContact O-N 2.85Å; Q101-R104 PolarHBondContact O-N 2.75Å; Q101-L105 WeakPolarHBondContact O-CB 3.23Å; Q101-L105 PolarHBondContact O-N 3.35Å; Q101-I133 HydrophobicContact CB-CB 4.35Å; Q101-I133 HydrophobicContact CB-CG1 3.86Å
102	Y	97.5	Very high	95	Very high	1 Å²	1	51.1 Å²	51.1	0%	0.004	26%	0.264	C	S	.	.	H	α-helix	trans	-65.9	-42.9	177.2	-174.2	-115.4	0	0	0	112.5	L67 S71 F86 L91 Q98 L99 R100 R104 L105 I106 I133	L67-Y102 HydrophobicContact CB-CD1 4.36Å; L67-Y102 HydrophobicContact CB-CE1 4.37Å; L67-Y102 HydrophobicContact CD1-CD1 4.25Å; L67-Y102 HydrophobicContact CD2-CD1 4.38Å; S71-Y102 WeakPolarHBondContact OG-CE1 3.37Å; S71-Y102 PolarHBondContact OG-OH 3.2Å; F86-Y102 HydrophobicContact CD1-CD2 4.43Å; F86-Y102 AromaticContact CD1-CE2 3.66Å; F86-Y102 HydrophobicContact CD1-CE2 3.66Å; F86-Y102 AromaticContact CE1-CD2 3.78Å; F86-Y102 HydrophobicContact CE1-CD2 3.78Å; F86-Y102 AromaticContact CE1-CE2 3.46Å; F86-Y102 HydrophobicContact CE1-CE2 3.46Å; F86-Y102 VanDerWaalsContact CE1-CE2 3.46Å; L91-Y102 HydrophobicContact CD1-CD1 3.9Å; L91-Y102 HydrophobicContact CD1-CE1 3.96Å; Q98-Y102 WeakPolarHBondContact O-CB 3.25Å; Q98-Y102 PolarHBondContact O-N 3.18Å; L99-Y102 PolarHBondContact O-N 3.43Å; R100-Y102 VanDerWaalsContact C-N 3.32Å; R100-Y102 PolarHBondContact O-N 2.9Å; Y102-R104 VanDerWaalsContact C-N 3.32Å; Y102-R104 PolarHBondContact O-N 2.81Å; Y102-L105 PolarHBondContact O-N 2.75Å; Y102-I106 HydrophobicContact CD1-CD1 4.32Å; Y102-I106 HydrophobicContact CD2-CG2 4.09Å; Y102-I106 HydrophobicContact CE1-CD1 3.82Å; Y102-I106 HydrophobicContact CE1-CG2 4.4Å; Y102-I106 HydrophobicContact CE2-CG2 3.61Å; Y102-I106 WeakPolarHBondContact O-CG1 3.33Å; Y102-I106 PolarHBondContact O-N 2.96Å; Y102-I106 VanDerWaalsContact O-N 3.08Å; Y102-I133 HydrophobicContact CD2-CG2 3.76Å; Y102-I133 HydrophobicContact CG-CG2 4.38Å
103	D	96.6	Very high	95.1	Very high	3 Å²	3	52.1 Å²	52.1	2%	0.016	26%	0.261	C	S	.	.	H	α-helix	trans	-56.7	-47.8	176	-168.7	17.6	0	0	0	111.5	R66 L67 L99 R100 N107	R66-D103 IonicContact CZ-OD1 3.51Å; R66-D103 IonicContact CZ-OD2 3.29Å; R66-D103 IonicContact NH1-OD1 2.69Å; R66-D103 PolarHBondContact NH1-OD1 3.21Å; R66-D103 IonicContact NH1-OD2 2.75Å; R66-D103 PolarHBondContact NH1-OD2 3.36Å; R66-D103 IonicContact NH2-OD1 3.52Å; R66-D103 IonicContact NH2-OD2 3.14Å; R66-D103 PolarHBondContact NH2-OD2 3.48Å; L67-D103 HydrophobicContact CD1-CB 4.4Å; L67-D103 HydrophobicContact CD2-CB 3.62Å; L67-D103 WeakPolarHBondContact CD2-OD1 3.02Å; L99-D103 VanDerWaalsContact O-CB 3.31Å; L99-D103 WeakPolarHBondContact O-CB 3.31Å; L99-D103 PolarHBondContact O-N 3.19Å; R100-D103 PolarHBondContact O-N 3.35Å; D103-N107 VanDerWaalsContact O-CB 3.3Å; D103-N107 WeakPolarHBondContact O-CB 3.25Å; D103-N107 PolarHBondContact O-N 2.99Å; D103-N107 VanDerWaalsContact O-N 3.12Å; D103-N107 PolarHBondContact O-ND2 3.14Å; D103-N107 PolarHBondContact OD1-ND2 3.31Å
104	R	95.7	Very high	95.2	Very high	96 Å²	96	49.4 Å²	49.4	36%	0.362	24%	0.242	S	C	.	.	H	α-helix	trans	-60.7	-49.8	176.6	-171.3	175.5	-171.9	174.9	10.8	111.2	W52 R100 Q101 Y102 I106 N107 E108 Y129	W52-R104 HydrophobicContact CH2-CB 4.17Å; W52-R104 HydrophobicContact CH2-CG 4.39Å; W52-R104 HydrophobicContact CZ2-CB 4.3Å; W52-R104 HydrophobicContact CZ3-CG 4.38Å; R100-R104 WeakPolarHBondContact O-CB 3.41Å; R100-R104 PolarHBondContact O-N 3.3Å; Q101-R104 PolarHBondContact O-N 2.75Å; Y102-R104 VanDerWaalsContact C-N 3.32Å; Y102-R104 PolarHBondContact O-N 2.81Å; R104-I106 VanDerWaalsContact C-N 3.35Å; R104-I106 PolarHBondContact O-N 3.37Å; R104-N107 PolarHBondContact O-N 3.31Å; R104-E108 WeakPolarHBondContact CD-OE2 3.32Å; R104-E108 HydrophobicContact CG-CB 4.22Å; R104-E108 WeakPolarHBondContact CG-OE2 3.33Å; R104-E108 IonicContact CZ-OE1 3.64Å; R104-E108 IonicContact CZ-OE2 3.42Å; R104-E108 IonicContact NE-OE1 2.83Å; R104-E108 PolarHBondContact NE-OE1 2.88Å; R104-E108 IonicContact NE-OE2 2.68Å; R104-E108 PolarHBondContact NE-OE2 2.96Å; R104-E108 IonicContact NH2-OE1 2.95Å; R104-E108 PolarHBondContact NH2-OE1 3.27Å; R104-E108 IonicContact NH2-OE2 3.65Å; R104-E108 WeakPolarHBondContact O-CB 3.46Å; R104-E108 PolarHBondContact O-N 3.32Å; R104-Y129 HydrophobicContact CG-CE1 4.46Å
105	L	96.6	Very high	95.2	Very high	5 Å²	5	49.1 Å²	49.1	3%	0.026	24%	0.241	C	C	.	.	H	α-helix	trans	-56.5	-43.5	-178.8	174.5	59.3	0	0	0	113.4	Q101 Y102 P109 W118 Y129 I133 M134 L137	Q101-L105 WeakPolarHBondContact O-CB 3.23Å; Q101-L105 PolarHBondContact O-N 3.35Å; Y102-L105 PolarHBondContact O-N 2.75Å; L105-P109 WeakPolarHBondContact O-CD 3.46Å; L105-P109 VanDerWaalsContact O-CG 3.29Å; L105-P109 WeakPolarHBondContact O-CG 3.41Å; L105-W118 HydrophobicContact CD1-CE3 4.25Å; L105-W118 HydrophobicContact CD1-CZ3 4.37Å; L105-Y129 HydrophobicContact CD1-CD1 4.32Å; L105-Y129 HydrophobicContact CD1-CG 4.42Å; L105-I133 HydrophobicContact CD2-CG2 3.98Å; L105-M134 HydrophobicContact CD1-CE 3.28Å; L105-M134 HydrophobicContact CD2-CE 4.03Å; L105-M134 HydrophobicContact CG-CE 4.31Å; L105-L137 HydrophobicContact CD2-CD2 3.95Å
106	I	96.6	Very high	95.3	Very high	1 Å²	1	49 Å²	49	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-88.5	-21.8	-174	70.9	175.5	0	0	0	113.5	L67 Q70 R74 L83 Y102 R104	L67-I106 HydrophobicContact CD2-CD1 4.06Å; Q70-I106 HydrophobicContact CB-CD1 4.1Å; R74-I106 VanDerWaalsContact CZ-O 3.3Å; R74-I106 PolarHBondContact NH1-O 3.43Å; R74-I106 PolarHBondContact NH2-O 2.91Å; L83-I106 HydrophobicContact CD1-CG2 4.19Å; L83-I106 HydrophobicContact CD2-CG2 4.48Å; Y102-I106 HydrophobicContact CD1-CD1 4.32Å; Y102-I106 HydrophobicContact CD2-CG2 4.09Å; Y102-I106 HydrophobicContact CE1-CD1 3.82Å; Y102-I106 HydrophobicContact CE1-CG2 4.4Å; Y102-I106 HydrophobicContact CE2-CG2 3.61Å; Y102-I106 WeakPolarHBondContact O-CG1 3.33Å; Y102-I106 PolarHBondContact O-N 2.96Å; Y102-I106 VanDerWaalsContact O-N 3.08Å; R104-I106 VanDerWaalsContact C-N 3.35Å; R104-I106 PolarHBondContact O-N 3.37Å
107	N	95.9	Very high	95.4	Very high	44 Å²	44	48.3 Å²	48.3	24%	0.235	23%	0.227	C	C	.	.	H	α-helix	trans	-115.3	-19.1	-170.9	-64.7	-49.9	0	0	0	115	Q70 D103 R104	Q70-N107 VanDerWaalsContact CD-ND2 3.33Å; Q70-N107 PolarHBondContact NE2-ND2 3.49Å; Q70-N107 PolarHBondContact OE1-ND2 3.44Å; D103-N107 VanDerWaalsContact O-CB 3.3Å; D103-N107 WeakPolarHBondContact O-CB 3.25Å; D103-N107 PolarHBondContact O-N 2.99Å; D103-N107 VanDerWaalsContact O-N 3.12Å; D103-N107 PolarHBondContact O-ND2 3.14Å; D103-N107 PolarHBondContact OD1-ND2 3.31Å; R104-N107 PolarHBondContact O-N 3.31Å
108	E	94.7	Very high	95.6	Very high	50 Å²	50	43.9 Å²	43.9	23%	0.234	21%	0.205	C	C	.	.	S	Bend	trans	-78	-42.9	176.8	-172.8	-178.8	-149.9	0	0	112.8	W52 R104 S110 Y129	W52-E108 HydrophobicContact CB-CB 4.09Å; W52-E108 HydrophobicContact CB-CG 3.9Å; W52-E108 HydrophobicContact CD2-CB 4.35Å; W52-E108 HydrophobicContact CG-CB 3.97Å; W52-E108 HydrophobicContact CG-CG 4.25Å; R104-E108 WeakPolarHBondContact CD-OE2 3.32Å; R104-E108 HydrophobicContact CG-CB 4.22Å; R104-E108 WeakPolarHBondContact CG-OE2 3.33Å; R104-E108 IonicContact CZ-OE1 3.64Å; R104-E108 IonicContact CZ-OE2 3.42Å; R104-E108 IonicContact NE-OE1 2.83Å; R104-E108 PolarHBondContact NE-OE1 2.88Å; R104-E108 IonicContact NE-OE2 2.68Å; R104-E108 PolarHBondContact NE-OE2 2.96Å; R104-E108 IonicContact NH2-OE1 2.95Å; R104-E108 PolarHBondContact NH2-OE1 3.27Å; R104-E108 IonicContact NH2-OE2 3.65Å; R104-E108 WeakPolarHBondContact O-CB 3.46Å; R104-E108 PolarHBondContact O-N 3.32Å; E108-S110 PolarHBondContact O-N 3.08Å; E108-Y129 HydrophobicContact CB-CE1 4.11Å; E108-Y129 HydrophobicContact CG-CE1 4.35Å; E108-Y129 WeakPolarHBondContact CG-OH 3.44Å; E108-Y129 WeakPolarHBondContact OE2-CE1 3.34Å; E108-Y129 PolarHBondContact OE2-OH 3.44Å
109	P	92.9	Very high	95.6	Very high	16 Å²	16	41.8 Å²	41.8	10%	0.104	20%	0.196	C	C	.	.			trans	-64.9	134.3	176.6	-18.8	31.1	0	0	0	111.8	L105 I115 W118 Y129	L105-P109 WeakPolarHBondContact O-CD 3.46Å; L105-P109 VanDerWaalsContact O-CG 3.29Å; L105-P109 WeakPolarHBondContact O-CG 3.41Å; P109-I115 HydrophobicContact CB-CD1 4.41Å; P109-I115 HydrophobicContact CB-CG1 4.27Å; P109-I115 HydrophobicContact CG-CD1 4.29Å; P109-I115 HydrophobicContact CG-CG1 4.09Å; P109-W118 HydrophobicContact CB-CH2 3.92Å; P109-W118 HydrophobicContact CB-CZ3 4.1Å; P109-W118 HydrophobicContact CG-CH2 3.75Å; P109-W118 HydrophobicContact CG-CZ3 3.55Å; P109-Y129 HydrophobicContact CG-CE1 3.99Å; P109-Y129 HydrophobicContact CG-CE2 4.28Å
110	S	89.9	Confident	95.6	Very high	98 Å²	98	44.2 Å²	44.2	69%	0.685	21%	0.211	S	C	*	.	S	Bend	trans	-78.2	-26.7	-179.2	-47.4	0	0	0	0	113.2	L49 E108	L49-S110 WeakPolarHBondContact CD1-OG 3.43Å; E108-S110 PolarHBondContact O-N 3.08Å
111	N	92.8	Very high	95.7	Very high	68 Å²	68	45 Å²	45	36%	0.364	22%	0.218	S	C	.	.			trans	-109.5	123.3	-177.1	-179.7	17.6	0	0	0	110.9	W113 D114	N111-W113 PolarHBondContact O-N 3.35Å; N111-W113 PolarHBondContact OD1-N 2.86Å; N111-W113 VanDerWaalsContact OD1-N 3.12Å; N111-D114 WeakPolarHBondContact CB-OD2 3.39Å; N111-D114 PolarHBondContact ND2-OD1 2.89Å; N111-D114 PolarHBondContact O-N 3.46Å
112	D	93.8	Very high	95.8	Very high	34 Å²	34	45.6 Å²	45.6	18%	0.182	23%	0.233	C	C	.	.	H	α-helix	trans	-61	-32.5	176.7	-94.1	-56.3	0	0	0	112.7	R74 G75 M76 N79 D114 I115 Y116	R74-D112 IonicContact CZ-OD1 3.09Å; R74-D112 IonicContact NE-OD1 3.7Å; R74-D112 PolarHBondContact NE-OD1 3.08Å; R74-D112 IonicContact NH2-OD1 3.38Å; R74-D112 PolarHBondContact NH2-OD1 2.68Å; G75-D112 PolarHBondContact N-OD2 3.01Å; M76-D112 HydrophobicContact CE-CB 3.6Å; M76-D112 HydrophobicContact CG-CB 4.27Å; M76-D112 HydrophobicContact SD-CB 4.26Å; N79-D112 PolarHBondContact ND2-O 3.49Å; N79-D112 PolarHBondContact ND2-OD1 3.29Å; D112-D114 PolarHBondContact O-N 3.46Å; D112-I115 PolarHBondContact O-N 3.15Å; D112-Y116 PolarHBondContact O-N 2.71Å
113	W	95.3	Very high	95.7	Very high	104 Å²	104	49.8 Å²	49.8	39%	0.394	25%	0.252	S	S	.	.	H	α-helix	trans	-63.9	-32.2	-179.9	-76	105.1	0	0	0	112.7	M76 N111 I115 Y116 Y117	M76-W113 HydrophobicContact CE-CB 4.15Å; M76-W113 HydrophobicContact CE-CD2 3.26Å; M76-W113 HydrophobicContact CE-CE3 3.77Å; M76-W113 HydrophobicContact CE-CG 3.43Å; M76-W113 VanDerWaalsContact CE-CG 3.43Å; M76-W113 HydrophobicContact CE-CH2 4.32Å; M76-W113 HydrophobicContact CE-CZ2 3.9Å; M76-W113 HydrophobicContact CE-CZ3 4.26Å; M76-W113 HydrophobicContact SD-CD2 4.36Å; M76-W113 HydrophobicContact SD-CE3 4.3Å; M76-W113 HydrophobicContact SD-CZ3 4.45Å; N111-W113 PolarHBondContact O-N 3.35Å; N111-W113 PolarHBondContact OD1-N 2.86Å; N111-W113 VanDerWaalsContact OD1-N 3.12Å; W113-I115 VanDerWaalsContact C-N 3.32Å; W113-I115 PolarHBondContact O-N 3.37Å; W113-Y116 HydrophobicContact CE3-CD1 4.29Å; W113-Y116 HydrophobicContact CZ3-CD1 4.2Å; W113-Y116 WeakPolarHBondContact O-CB 3.14Å; W113-Y116 PolarHBondContact O-N 2.83Å; W113-Y116 VanDerWaalsContact O-N 3.15Å; W113-Y117 HydrophobicContact CB-CD2 4.24Å; W113-Y117 HydrophobicContact CB-CE2 3.74Å; W113-Y117 HydrophobicContact CE3-CE1 4.22Å; W113-Y117 AromaticContact CE3-CZ 3.95Å; W113-Y117 WeakPolarHBondContact O-CD2 3.22Å; W113-Y117 VanDerWaalsContact O-CG 3.29Å; W113-Y117 PolarHBondContact O-N 2.92Å
114	D	95.9	Very high	95.7	Very high	49 Å²	49	55.1 Å²	55.1	26%	0.262	29%	0.287	S	S	.	.	H	α-helix	trans	-62.4	-44.3	-179	-60.2	-11	0	0	0	110.1	N111 D112 Y116 Y117 W118	N111-D114 WeakPolarHBondContact CB-OD2 3.39Å; N111-D114 PolarHBondContact ND2-OD1 2.89Å; N111-D114 PolarHBondContact O-N 3.46Å; D112-D114 PolarHBondContact O-N 3.46Å; D114-Y116 VanDerWaalsContact C-N 3.31Å; D114-Y116 PolarHBondContact O-N 2.71Å; D114-Y117 PolarHBondContact O-N 3.34Å; D114-W118 HydrophobicContact CB-CD2 4.46Å; D114-W118 HydrophobicContact CB-CH2 3.87Å; D114-W118 HydrophobicContact CB-CZ2 3.55Å; D114-W118 HydrophobicContact CB-CZ3 4.44Å; D114-W118 WeakPolarHBondContact O-CB 3.46Å; D114-W118 PolarHBondContact O-N 2.73Å
115	I	96.4	Very high	95.7	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-59.2	-43.7	175.8	-62.2	165.5	0	0	0	110.7	P109 D112 W113 W118 A119	P109-I115 HydrophobicContact CB-CD1 4.41Å; P109-I115 HydrophobicContact CB-CG1 4.27Å; P109-I115 HydrophobicContact CG-CD1 4.29Å; P109-I115 HydrophobicContact CG-CG1 4.09Å; D112-I115 PolarHBondContact O-N 3.15Å; W113-I115 VanDerWaalsContact C-N 3.32Å; W113-I115 PolarHBondContact O-N 3.37Å; I115-W118 HydrophobicContact CG1-CE3 4.3Å; I115-W118 HydrophobicContact CG1-CZ3 4.11Å; I115-W118 PolarHBondContact O-N 3.29Å; I115-A119 VanDerWaalsContact O-CB 3.3Å; I115-A119 WeakPolarHBondContact O-CB 3.48Å; I115-A119 PolarHBondContact O-N 3.48Å
116	Y	97.3	Very high	95.7	Very high	72 Å²	72	53.7 Å²	53.7	28%	0.282	29%	0.29	S	S	.	.	H	α-helix	trans	-64.1	-43.7	178.6	-172.9	-102.4	0	0	0	111.8	E78 N79 L82 D112 W113 D114 W118 A119 T120	E78-Y116 HydrophobicContact CB-CD2 4.02Å; E78-Y116 HydrophobicContact CB-CE2 3.86Å; E78-Y116 HydrophobicContact CG-CE2 4.43Å; N79-Y116 WeakPolarHBondContact OD1-CB 3.48Å; L82-Y116 HydrophobicContact CD2-CD2 4.49Å; D112-Y116 PolarHBondContact O-N 2.71Å; W113-Y116 HydrophobicContact CE3-CD1 4.29Å; W113-Y116 HydrophobicContact CZ3-CD1 4.2Å; W113-Y116 WeakPolarHBondContact O-CB 3.14Å; W113-Y116 PolarHBondContact O-N 2.83Å; W113-Y116 VanDerWaalsContact O-N 3.15Å; D114-Y116 VanDerWaalsContact C-N 3.31Å; D114-Y116 PolarHBondContact O-N 2.71Å; Y116-W118 PolarHBondContact O-N 3.14Å; Y116-A119 PolarHBondContact O-N 3.15Å; Y116-T120 HydrophobicContact CD1-CG2 4.3Å; Y116-T120 HydrophobicContact CD2-CG2 4.49Å; Y116-T120 HydrophobicContact CE1-CG2 3.88Å; Y116-T120 HydrophobicContact CE2-CG2 4.08Å; Y116-T120 WeakPolarHBondContact O-CB 3.35Å; Y116-T120 WeakPolarHBondContact O-CG2 3.31Å; Y116-T120 PolarHBondContact O-N 3.17Å; Y116-T120 PolarHBondContact O-OG1 3.39Å
117	Y	97.6	Very high	95.6	Very high	78 Å²	78	61 Å²	61	31%	0.306	33%	0.329	S	S	.	.	H	α-helix	trans	-66.5	-36.3	178.4	-64.5	-40.4	0	0	0	112.8	W113 D114 T120 E121 A122 Q123	W113-Y117 HydrophobicContact CB-CD2 4.24Å; W113-Y117 HydrophobicContact CB-CE2 3.74Å; W113-Y117 HydrophobicContact CE3-CE1 4.22Å; W113-Y117 AromaticContact CE3-CZ 3.95Å; W113-Y117 WeakPolarHBondContact O-CD2 3.22Å; W113-Y117 VanDerWaalsContact O-CG 3.29Å; W113-Y117 PolarHBondContact O-N 2.92Å; D114-Y117 PolarHBondContact O-N 3.34Å; Y117-T120 WeakPolarHBondContact CA-OG1 3.46Å; Y117-T120 PolarHBondContact O-OG1 2.98Å; Y117-E121 CarbonylContact O-C 3.6Å; Y117-E121 PolarHBondContact O-N 3.15Å; Y117-E121 VanDerWaalsContact O-N 3.13Å; Y117-A122 HydrophobicContact CD1-CB 4.08Å; Y117-A122 PolarHBondContact O-N 3.49Å; Y117-Q123 HydrophobicContact CG-CG 4.35Å; Y117-Q123 PolarHBondContact O-N 3.12Å
118	W	97.6	Very high	95.4	Very high	15 Å²	15	62.6 Å²	62.6	6%	0.057	34%	0.34	C	S	.	.	H	α-helix	trans	-67.2	-44.2	174.2	-60.7	-21.2	0	0	0	111.9	L105 P109 D114 I115 Y116 T120 E121 V125 P126 Y129 M134 K138	L105-W118 HydrophobicContact CD1-CE3 4.25Å; L105-W118 HydrophobicContact CD1-CZ3 4.37Å; P109-W118 HydrophobicContact CB-CH2 3.92Å; P109-W118 HydrophobicContact CB-CZ3 4.1Å; P109-W118 HydrophobicContact CG-CH2 3.75Å; P109-W118 HydrophobicContact CG-CZ3 3.55Å; D114-W118 HydrophobicContact CB-CD2 4.46Å; D114-W118 HydrophobicContact CB-CH2 3.87Å; D114-W118 HydrophobicContact CB-CZ2 3.55Å; D114-W118 HydrophobicContact CB-CZ3 4.44Å; D114-W118 WeakPolarHBondContact O-CB 3.46Å; D114-W118 PolarHBondContact O-N 2.73Å; I115-W118 HydrophobicContact CG1-CE3 4.3Å; I115-W118 HydrophobicContact CG1-CZ3 4.11Å; I115-W118 PolarHBondContact O-N 3.29Å; Y116-W118 PolarHBondContact O-N 3.14Å; W118-T120 VanDerWaalsContact C-N 3.34Å; W118-T120 PolarHBondContact O-N 3.27Å; W118-E121 PolarHBondContact O-N 3.42Å; W118-V125 HydrophobicContact CB-CG2 3.87Å; W118-V125 HydrophobicContact CG-CG2 4.21Å; W118-P126 HydrophobicContact CH2-CG 4.43Å; W118-P126 HydrophobicContact CZ2-CG 3.77Å; W118-Y129 HydrophobicContact CE3-CD2 4.44Å; W118-Y129 AromaticContact CH2-CD2 3.61Å; W118-Y129 HydrophobicContact CH2-CD2 3.61Å; W118-Y129 AromaticContact CH2-CE2 3.51Å; W118-Y129 HydrophobicContact CH2-CE2 3.51Å; W118-Y129 HydrophobicContact CH2-CG 4.49Å; W118-Y129 HydrophobicContact CZ2-CD2 4.26Å; W118-Y129 HydrophobicContact CZ2-CE2 4.3Å; W118-Y129 AromaticContact CZ3-CD2 3.71Å; W118-Y129 HydrophobicContact CZ3-CD2 3.71Å; W118-Y129 AromaticContact CZ3-CE2 3.93Å; W118-Y129 HydrophobicContact CZ3-CE2 3.93Å; W118-Y129 HydrophobicContact CZ3-CG 4.15Å; W118-M134 HydrophobicContact CB-CE 3.94Å; W118-M134 HydrophobicContact CB-SD 4.17Å; W118-M134 HydrophobicContact CE3-CE 4.14Å; W118-K138 WeakPolarHBondContact O-CE 3.16Å
119	A	97.2	Very high	95.4	Very high	2 Å²	2	62.1 Å²	62.1	2%	0.017	34%	0.337	C	S	.	.	H	α-helix	trans	-65.2	-36.8	179.1	0	0	0	0	0	112.5	L82 I115 Y116 E121 L137	L82-A119 HydrophobicContact CD2-CB 4.15Å; I115-A119 VanDerWaalsContact O-CB 3.3Å; I115-A119 WeakPolarHBondContact O-CB 3.48Å; I115-A119 PolarHBondContact O-N 3.48Å; Y116-A119 PolarHBondContact O-N 3.15Å; A119-E121 VanDerWaalsContact C-N 3.3Å; A119-L137 HydrophobicContact CB-CD2 3.95Å; A119-L137 HydrophobicContact CB-CG 3.92Å
120	T	97.1	Very high	95.5	Very high	51 Å²	51	65.2 Å²	65.2	31%	0.313	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	0.6	176.8	54.3	0	0	0	0	113.9	Y116 Y117 W118 A122 T141	Y116-T120 HydrophobicContact CD1-CG2 4.3Å; Y116-T120 HydrophobicContact CD2-CG2 4.49Å; Y116-T120 HydrophobicContact CE1-CG2 3.88Å; Y116-T120 HydrophobicContact CE2-CG2 4.08Å; Y116-T120 WeakPolarHBondContact O-CB 3.35Å; Y116-T120 WeakPolarHBondContact O-CG2 3.31Å; Y116-T120 PolarHBondContact O-N 3.17Å; Y116-T120 PolarHBondContact O-OG1 3.39Å; Y117-T120 WeakPolarHBondContact CA-OG1 3.46Å; Y117-T120 PolarHBondContact O-OG1 2.98Å; W118-T120 VanDerWaalsContact C-N 3.34Å; W118-T120 PolarHBondContact O-N 3.27Å; T120-A122 PolarHBondContact O-N 2.75Å; T120-A122 VanDerWaalsContact O-N 3.16Å; T120-T141 HydrophobicContact CG2-CG2 3.88Å
121	E	97.1	Very high	95.7	Very high	102 Å²	102	61.4 Å²	61.4	48%	0.477	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	20	-176.7	-49.6	-176.2	107.2	0	0	113.5	Y117 W118 A119 Q123 K138 K142	Y117-E121 CarbonylContact O-C 3.6Å; Y117-E121 PolarHBondContact O-N 3.15Å; Y117-E121 VanDerWaalsContact O-N 3.13Å; W118-E121 PolarHBondContact O-N 3.42Å; A119-E121 VanDerWaalsContact C-N 3.3Å; E121-Q123 VanDerWaalsContact C-N 3.32Å; E121-K138 HydrophobicContact CG-CB 4.48Å; E121-K138 HydrophobicContact CG-CD 3.98Å; E121-K138 HydrophobicContact CG-CG 4.04Å; E121-K142 IonicContact OE1-NZ 2.84Å; E121-K142 WeakPolarHBondContact OE2-CE 3.01Å; E121-K142 IonicContact OE2-NZ 3.96Å; E121-K142 PolarHBondContact OE2-NZ 3.16Å
122	A	96.9	Very high	95.8	Very high	68 Å²	68	63.5 Å²	63.5	56%	0.562	34%	0.339	S	S	*	.	S	Bend	trans	-72.5	-27.1	176.5	0	0	0	0	0	112.4	Y117 T120	Y117-A122 HydrophobicContact CD1-CB 4.08Å; Y117-A122 PolarHBondContact O-N 3.49Å; T120-A122 PolarHBondContact O-N 2.75Å; T120-A122 VanDerWaalsContact O-N 3.16Å
123	Q	96.3	Very high	96	Very high	89 Å²	89	62.1 Å²	62.1	42%	0.416	33%	0.332	S	S	.	.	S	Bend	trans	-132.1	151.1	174.1	-69.1	-171.4	12.1	0	0	110.8	Y117 E121	Y117-Q123 HydrophobicContact CG-CG 4.35Å; Y117-Q123 PolarHBondContact O-N 3.12Å; E121-Q123 VanDerWaalsContact C-N 3.32Å
124	P	95.9	Very high	96.1	Very high	115 Å²	115	57.3 Å²	57.3	75%	0.747	31%	0.314	S	S	*	.	P	Polyproline II helix	trans	-63.9	141.4	175.5	28.5	-34.9	0	0	0	110.4
125	V	96.1	Very high	96.2	Very high	21 Å²	21	59.2 Å²	59.2	13%	0.127	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-79.2	131.7	176.6	-172.3	0	0	0	0	108.8	W118 M134 K138	W118-V125 HydrophobicContact CB-CG2 3.87Å; W118-V125 HydrophobicContact CG-CG2 4.21Å; V125-M134 HydrophobicContact CG1-CE 3.78Å; V125-M134 HydrophobicContact CG1-CG 4.05Å; V125-M134 HydrophobicContact CG1-SD 4.33Å; V125-M134 HydrophobicContact CG2-CE 4.36Å; V125-M134 HydrophobicContact CG2-CG 4.03Å; V125-M134 HydrophobicContact CG2-SD 3.98Å; V125-K138 VanDerWaalsContact CG2-CE 3.46Å
126	P	96.1	Very high	96.2	Very high	51 Å²	51	61.9 Å²	61.9	33%	0.331	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-59.2	146.1	170.6	-22.8	32.2	0	0	0	111.9	W118 V128 Y129 T130	W118-P126 HydrophobicContact CH2-CG 4.43Å; W118-P126 HydrophobicContact CZ2-CG 3.77Å; P126-V128 PolarHBondContact O-N 3.28Å; P126-Y129 HydrophobicContact CB-CD2 3.85Å; P126-Y129 HydrophobicContact CB-CE2 4.31Å; P126-Y129 HydrophobicContact CG-CD2 3.84Å; P126-Y129 HydrophobicContact CG-CE2 4.21Å; P126-Y129 PolarHBondContact O-N 3.19Å; P126-T130 PolarHBondContact O-N 2.93Å; P126-T130 PolarHBondContact O-OG1 3.38Å
127	D	94.6	Very high	96.2	Very high	153 Å²	153	58.5 Å²	58.5	82%	0.818	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-54.2	-33	-178.1	-63.5	-29.1	0	0	0	112.8	Y129 T130	D127-Y129 PolarHBondContact O-N 3.01Å; D127-T130 WeakPolarHBondContact O-CB 2.97Å; D127-T130 PolarHBondContact O-N 3.04Å
128	V	92.9	Very high	96.2	Very high	78 Å²	78	56.6 Å²	56.6	47%	0.473	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-60.1	-32.6	178.7	-175.7	0	0	0	0	112.9	P126	P126-V128 PolarHBondContact O-N 3.28Å
129	Y	94.9	Very high	96.2	Very high	41 Å²	41	59.9 Å²	59.9	16%	0.161	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-103.6	3.6	-177.9	-54.8	-63.3	0	0	0	112.8	R104 L105 E108 P109 W118 P126 D127 M134	R104-Y129 HydrophobicContact CG-CE1 4.46Å; L105-Y129 HydrophobicContact CD1-CD1 4.32Å; L105-Y129 HydrophobicContact CD1-CG 4.42Å; E108-Y129 HydrophobicContact CB-CE1 4.11Å; E108-Y129 HydrophobicContact CG-CE1 4.35Å; E108-Y129 WeakPolarHBondContact CG-OH 3.44Å; E108-Y129 WeakPolarHBondContact OE2-CE1 3.34Å; E108-Y129 PolarHBondContact OE2-OH 3.44Å; P109-Y129 HydrophobicContact CG-CE1 3.99Å; P109-Y129 HydrophobicContact CG-CE2 4.28Å; W118-Y129 HydrophobicContact CE3-CD2 4.44Å; W118-Y129 AromaticContact CH2-CD2 3.61Å; W118-Y129 HydrophobicContact CH2-CD2 3.61Å; W118-Y129 AromaticContact CH2-CE2 3.51Å; W118-Y129 HydrophobicContact CH2-CE2 3.51Å; W118-Y129 HydrophobicContact CH2-CG 4.49Å; W118-Y129 HydrophobicContact CZ2-CD2 4.26Å; W118-Y129 HydrophobicContact CZ2-CE2 4.3Å; W118-Y129 AromaticContact CZ3-CD2 3.71Å; W118-Y129 HydrophobicContact CZ3-CD2 3.71Å; W118-Y129 AromaticContact CZ3-CE2 3.93Å; W118-Y129 HydrophobicContact CZ3-CE2 3.93Å; W118-Y129 HydrophobicContact CZ3-CG 4.15Å; P126-Y129 HydrophobicContact CB-CD2 3.85Å; P126-Y129 HydrophobicContact CB-CE2 4.31Å; P126-Y129 HydrophobicContact CG-CD2 3.84Å; P126-Y129 HydrophobicContact CG-CE2 4.21Å; P126-Y129 PolarHBondContact O-N 3.19Å; D127-Y129 PolarHBondContact O-N 3.01Å; Y129-M134 VanDerWaalsContact O-CB 3.29Å; Y129-M134 WeakPolarHBondContact O-CB 3.44Å
130	T	93.4	Very high	96.2	Very high	80 Å²	80	60.3 Å²	60.3	49%	0.491	34%	0.336	S	S	.	.			trans	-76.4	130.8	176.8	-59.9	0	0	0	0	109.5	P126 D127	P126-T130 PolarHBondContact O-N 2.93Å; P126-T130 PolarHBondContact O-OG1 3.38Å; D127-T130 WeakPolarHBondContact O-CB 2.97Å; D127-T130 PolarHBondContact O-N 3.04Å
131	G	94.4	Very high	96.2	Very high	18 Å²	18	59.3 Å²	59.3	19%	0.186	33%	0.33	C	S	.	.	S	Bend	trans	163.4	-179.1	179.8	0	0	0	0	0	113.2	I133 M134 D135	G131-I133 VanDerWaalsContact C-N 3.26Å; G131-I133 PolarHBondContact O-N 2.69Å; G131-I133 VanDerWaalsContact O-N 3.17Å; G131-M134 PolarHBondContact O-N 3.37Å; G131-D135 PolarHBondContact O-N 3.31Å; G131-D135 VanDerWaalsContact O-N 3.1Å
132	E	95.9	Very high	96.2	Very high	112 Å²	112	59.5 Å²	59.5	52%	0.523	33%	0.329	S	S	.	.	H	α-helix	trans	-52.7	-41.8	-174.2	-61.7	178.2	-173.1	0	0	113.2	Q98 D135 L136	Q98-E132 PolarHBondContact NE2-OE2 3.22Å; Q98-E132 VanDerWaalsContact NE2-OE2 3.07Å; E132-D135 PolarHBondContact O-N 3.42Å; E132-L136 WeakPolarHBondContact O-CB 3.47Å; E132-L136 PolarHBondContact O-N 3.34Å
133	I	97.4	Very high	96.2	Very high	5 Å²	5	58.2 Å²	58.2	3%	0.026	31%	0.312	C	S	.	.	H	α-helix	trans	-68.4	-37.7	-178.7	-65.3	-51.4	0	0	0	112.3	F86 M94 Q98 Q101 Y102 L105 G131 L136 L137	F86-I133 HydrophobicContact CZ-CG2 4.44Å; M94-I133 HydrophobicContact CE-CD1 3.58Å; M94-I133 HydrophobicContact CG-CD1 4.49Å; M94-I133 HydrophobicContact SD-CD1 4.09Å; Q98-I133 HydrophobicContact CB-CD1 3.87Å; Q98-I133 HydrophobicContact CB-CG1 4.35Å; Q98-I133 HydrophobicContact CG-CD1 3.95Å; Q98-I133 HydrophobicContact CG-CG1 4.46Å; Q101-I133 HydrophobicContact CB-CB 4.35Å; Q101-I133 HydrophobicContact CB-CG1 3.86Å; Y102-I133 HydrophobicContact CD2-CG2 3.76Å; Y102-I133 HydrophobicContact CG-CG2 4.38Å; L105-I133 HydrophobicContact CD2-CG2 3.98Å; G131-I133 VanDerWaalsContact C-N 3.26Å; G131-I133 PolarHBondContact O-N 2.69Å; G131-I133 VanDerWaalsContact O-N 3.17Å; I133-L136 PolarHBondContact O-N 3.33Å; I133-L137 WeakPolarHBondContact O-CB 3.39Å; I133-L137 PolarHBondContact O-N 3.12Å
134	M	97.3	Very high	96.1	Very high	3 Å²	3	60.4 Å²	60.4	2%	0.015	32%	0.321	C	S	.	.	H	α-helix	trans	-67.6	-42.2	176.4	174.9	58.6	67.4	0	0	110.7	L105 W118 V125 Y129 G131 L136 L137 K138	L105-M134 HydrophobicContact CD1-CE 3.28Å; L105-M134 HydrophobicContact CD2-CE 4.03Å; L105-M134 HydrophobicContact CG-CE 4.31Å; W118-M134 HydrophobicContact CB-CE 3.94Å; W118-M134 HydrophobicContact CB-SD 4.17Å; W118-M134 HydrophobicContact CE3-CE 4.14Å; V125-M134 HydrophobicContact CG1-CE 3.78Å; V125-M134 HydrophobicContact CG1-CG 4.05Å; V125-M134 HydrophobicContact CG1-SD 4.33Å; V125-M134 HydrophobicContact CG2-CE 4.36Å; V125-M134 HydrophobicContact CG2-CG 4.03Å; V125-M134 HydrophobicContact CG2-SD 3.98Å; Y129-M134 VanDerWaalsContact O-CB 3.29Å; Y129-M134 WeakPolarHBondContact O-CB 3.44Å; G131-M134 PolarHBondContact O-N 3.37Å; M134-L136 VanDerWaalsContact C-N 3.33Å; M134-L136 PolarHBondContact O-N 3.27Å; M134-L137 PolarHBondContact O-N 2.96Å; M134-K138 HydrophobicContact CG-CD 4.36Å; M134-K138 WeakPolarHBondContact O-CG 3.28Å; M134-K138 PolarHBondContact O-N 3.44Å; M134-K138 HydrophobicContact SD-CD 4.47Å; M134-K138 HydrophobicContact SD-CG 4.22Å
135	D	97.4	Very high	96.1	Very high	90 Å²	90	61.5 Å²	61.5	48%	0.481	32%	0.32	S	S	.	.	H	α-helix	trans	-63.8	-41.3	177.3	-65.5	-24.8	0	0	0	111.3	G131 E132 L137 K138 E139	G131-D135 PolarHBondContact O-N 3.31Å; G131-D135 VanDerWaalsContact O-N 3.1Å; E132-D135 PolarHBondContact O-N 3.42Å; D135-L137 VanDerWaalsContact C-N 3.34Å; D135-L137 PolarHBondContact O-N 3.12Å; D135-K138 PolarHBondContact O-N 3.44Å; D135-E139 WeakPolarHBondContact O-CB 3.45Å; D135-E139 PolarHBondContact O-N 3.43Å
136	L	97.3	Very high	96	Very high	56 Å²	56	68.6 Å²	68.6	29%	0.293	35%	0.352	S	S	.	.	H	α-helix	trans	-61.9	-41	173.4	-166.2	76.5	0	0	0	111.8	F86 Y90 M94 E132 I133 M134 E139 F140	F86-L136 HydrophobicContact CE2-CB 4.33Å; F86-L136 HydrophobicContact CE2-CD2 3.85Å; F86-L136 HydrophobicContact CE2-CG 3.95Å; F86-L136 HydrophobicContact CZ-CD2 3.8Å; F86-L136 HydrophobicContact CZ-CG 4.31Å; Y90-L136 HydrophobicContact CD1-CD1 4.45Å; Y90-L136 HydrophobicContact CD1-CD2 3.66Å; Y90-L136 HydrophobicContact CD1-CG 4.41Å; Y90-L136 HydrophobicContact CD2-CD2 4.03Å; Y90-L136 HydrophobicContact CE1-CD1 3.88Å; Y90-L136 HydrophobicContact CE1-CD2 3.89Å; Y90-L136 HydrophobicContact CE1-CG 4.15Å; Y90-L136 HydrophobicContact CE2-CD2 4.27Å; Y90-L136 HydrophobicContact CE2-CG 4.3Å; Y90-L136 HydrophobicContact CG-CD2 3.71Å; M94-L136 HydrophobicContact CE-CD2 4.35Å; E132-L136 WeakPolarHBondContact O-CB 3.47Å; E132-L136 PolarHBondContact O-N 3.34Å; I133-L136 PolarHBondContact O-N 3.33Å; M134-L136 VanDerWaalsContact C-N 3.33Å; M134-L136 PolarHBondContact O-N 3.27Å; L136-E139 PolarHBondContact O-N 2.99Å; L136-F140 VanDerWaalsContact O-CB 3.26Å; L136-F140 WeakPolarHBondContact O-CB 3.47Å; L136-F140 PolarHBondContact O-N 2.74Å
137	L	97.8	Very high	95.9	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-66.5	-42.9	178.3	-179.9	61.9	0	0	0	111.8	L83 F86 L105 A119 I133 M134 D135 F140 T141	L83-L137 HydrophobicContact CD2-CD1 4.1Å; L83-L137 HydrophobicContact CD2-CD2 4.44Å; F86-L137 HydrophobicContact CD2-CD1 3.96Å; F86-L137 HydrophobicContact CE2-CB 4.21Å; F86-L137 HydrophobicContact CE2-CD1 4.27Å; F86-L137 HydrophobicContact CG-CD1 4.17Å; F86-L137 HydrophobicContact CZ-CB 4.48Å; L105-L137 HydrophobicContact CD2-CD2 3.95Å; A119-L137 HydrophobicContact CB-CD2 3.95Å; A119-L137 HydrophobicContact CB-CG 3.92Å; I133-L137 WeakPolarHBondContact O-CB 3.39Å; I133-L137 PolarHBondContact O-N 3.12Å; M134-L137 PolarHBondContact O-N 2.96Å; D135-L137 VanDerWaalsContact C-N 3.34Å; D135-L137 PolarHBondContact O-N 3.12Å; L137-F140 PolarHBondContact O-N 2.68Å; L137-T141 WeakPolarHBondContact O-CB 3.08Å; L137-T141 PolarHBondContact O-N 3.48Å; L137-T141 PolarHBondContact O-OG1 3.32Å
138	K	97.8	Very high	95.9	Very high	38 Å²	38	71.4 Å²	71.4	17%	0.165	36%	0.356	C	S	.	.	H	α-helix	trans	-61.1	-47.3	174.9	-72.5	171.6	178.7	176.3	0	111.5	W118 E121 V125 M134 D135 F140 T141 K142	W118-K138 WeakPolarHBondContact O-CE 3.16Å; E121-K138 HydrophobicContact CG-CB 4.48Å; E121-K138 HydrophobicContact CG-CD 3.98Å; E121-K138 HydrophobicContact CG-CG 4.04Å; V125-K138 VanDerWaalsContact CG2-CE 3.46Å; M134-K138 HydrophobicContact CG-CD 4.36Å; M134-K138 WeakPolarHBondContact O-CG 3.28Å; M134-K138 PolarHBondContact O-N 3.44Å; M134-K138 HydrophobicContact SD-CD 4.47Å; M134-K138 HydrophobicContact SD-CG 4.22Å; D135-K138 PolarHBondContact O-N 3.44Å; K138-F140 VanDerWaalsContact C-N 3.34Å; K138-F140 PolarHBondContact O-N 2.77Å; K138-T141 WeakPolarHBondContact O-CB 3.43Å; K138-T141 PolarHBondContact O-N 2.95Å; K138-K142 PolarHBondContact O-N 2.99Å
139	E	97.7	Very high	96	Very high	84 Å²	84	70.1 Å²	70.1	39%	0.393	34%	0.342	S	S	.	.	H	α-helix	trans	-62.5	-42.5	177.8	-178.1	57.9	-161	0	0	111.5	D135 L136 T141 K142 K144	D135-E139 WeakPolarHBondContact O-CB 3.45Å; D135-E139 PolarHBondContact O-N 3.43Å; L136-E139 PolarHBondContact O-N 2.99Å; E139-T141 VanDerWaalsContact C-N 3.29Å; E139-T141 PolarHBondContact O-N 3.26Å; E139-K142 PolarHBondContact O-N 2.95Å; E139-K144 WeakPolarHBondContact OE1-CD 3.45Å; E139-K144 WeakPolarHBondContact OE1-CE 3.38Å; E139-K144 IonicContact OE1-NZ 2.6Å; E139-K144 PolarHBondContact OE1-NZ 3.27Å; E139-K144 IonicContact OE2-NZ 3.31Å; E139-K144 PolarHBondContact OE2-NZ 3.06Å
140	F	97.2	Very high	96	Very high	12 Å²	12	74 Å²	74	5%	0.053	37%	0.365	C	S	.	.	H	α-helix	trans	-61.2	-37.6	174.4	-177.8	-102.3	0	0	0	112.4	L82 L85 F86 Y90 L136 L137 K138 K142 N143 R149	L82-F140 HydrophobicContact CD1-CD1 3.93Å; L82-F140 HydrophobicContact CD1-CE1 3.96Å; L85-F140 HydrophobicContact CB-CE1 4.15Å; L85-F140 HydrophobicContact CB-CZ 3.74Å; F86-F140 HydrophobicContact CB-CD1 3.95Å; F86-F140 HydrophobicContact CB-CE1 3.86Å; F86-F140 HydrophobicContact CB-CZ 4.45Å; F86-F140 HydrophobicContact CD2-CB 3.96Å; F86-F140 AromaticContact CD2-CD1 3.92Å; F86-F140 HydrophobicContact CD2-CD1 3.92Å; F86-F140 AromaticContact CD2-CG 3.87Å; F86-F140 HydrophobicContact CD2-CG 3.87Å; F86-F140 HydrophobicContact CE2-CB 4.4Å; F86-F140 HydrophobicContact CG-CD1 4.44Å; Y90-F140 HydrophobicContact CE2-CB 4.45Å; Y90-F140 AromaticContact CE2-CD2 3.82Å; Y90-F140 HydrophobicContact CE2-CD2 3.82Å; Y90-F140 HydrophobicContact CE2-CE2 4.46Å; Y90-F140 HydrophobicContact CE2-CG 4.32Å; L136-F140 VanDerWaalsContact O-CB 3.26Å; L136-F140 WeakPolarHBondContact O-CB 3.47Å; L136-F140 PolarHBondContact O-N 2.74Å; L137-F140 PolarHBondContact O-N 2.68Å; K138-F140 VanDerWaalsContact C-N 3.34Å; K138-F140 PolarHBondContact O-N 2.77Å; F140-K142 VanDerWaalsContact C-N 3.3Å; F140-K142 PolarHBondContact O-N 3.45Å; F140-N143 PolarHBondContact O-N 2.86Å; F140-R149 VanDerWaalsContact O-CZ 3.29Å; F140-R149 PolarHBondContact O-NH1 2.91Å; F140-R149 PolarHBondContact O-NH2 2.92Å
141	T	96.8	Very high	96.1	Very high	30 Å²	30	76.3 Å²	76.3	18%	0.184	38%	0.375	C	S	.	.	H	α-helix	trans	-66.9	-30.6	-179.1	-57.8	0	0	0	0	112.4	L82 T120 L137 K138 E139 N143	L82-T141 HydrophobicContact CD1-CG2 4.44Å; L82-T141 HydrophobicContact CD2-CG2 4.49Å; T120-T141 HydrophobicContact CG2-CG2 3.88Å; L137-T141 WeakPolarHBondContact O-CB 3.08Å; L137-T141 PolarHBondContact O-N 3.48Å; L137-T141 PolarHBondContact O-OG1 3.32Å; K138-T141 WeakPolarHBondContact O-CB 3.43Å; K138-T141 PolarHBondContact O-N 2.95Å; E139-T141 VanDerWaalsContact C-N 3.29Å; E139-T141 PolarHBondContact O-N 3.26Å; T141-N143 PolarHBondContact O-N 2.85Å; T141-N143 VanDerWaalsContact O-N 3.15Å
142	K	96.4	Very high	96.1	Very high	105 Å²	105	77.5 Å²	77.5	46%	0.457	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-20.2	177.7	-70.8	171.5	-177.7	172.1	0	114	E121 K138 E139 F140 K144	E121-K142 IonicContact OE1-NZ 2.84Å; E121-K142 WeakPolarHBondContact OE2-CE 3.01Å; E121-K142 IonicContact OE2-NZ 3.96Å; E121-K142 PolarHBondContact OE2-NZ 3.16Å; K138-K142 PolarHBondContact O-N 2.99Å; E139-K142 PolarHBondContact O-N 2.95Å; F140-K142 VanDerWaalsContact C-N 3.3Å; F140-K142 PolarHBondContact O-N 3.45Å; K142-K144 VanDerWaalsContact C-N 3.35Å; K142-K144 HydrophobicContact CB-CG 4.46Å; K142-K144 PolarHBondContact O-N 2.98Å
143	N	96.1	Very high	96.1	Very high	41 Å²	41	72.9 Å²	72.9	22%	0.219	36%	0.362	C	S	.	.			trans	46.1	53.4	175.3	-166.8	25.4	0	0	0	113.2	F140 T141 D145 Q146 E147 R149	F140-N143 PolarHBondContact O-N 2.86Å; T141-N143 PolarHBondContact O-N 2.85Å; T141-N143 VanDerWaalsContact O-N 3.15Å; N143-D145 PolarHBondContact O-N 2.9Å; N143-Q146 PolarHBondContact O-N 2.78Å; N143-E147 PolarHBondContact ND2-N 2.84Å; N143-E147 PolarHBondContact ND2-O 3.2Å; N143-E147 WeakPolarHBondContact OD1-CB 3.29Å; N143-E147 PolarHBondContact OD1-N 2.82Å; N143-R149 PolarHBondContact OD1-NH2 3.29Å
144	K	95.3	Very high	96	Very high	136 Å²	136	77.5 Å²	77.5	59%	0.591	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-32.7	-175.2	-69.8	179.7	177.4	168.1	0	112.9	E139 K142 Q146	E139-K144 WeakPolarHBondContact OE1-CD 3.45Å; E139-K144 WeakPolarHBondContact OE1-CE 3.38Å; E139-K144 IonicContact OE1-NZ 2.6Å; E139-K144 PolarHBondContact OE1-NZ 3.27Å; E139-K144 IonicContact OE2-NZ 3.31Å; E139-K144 PolarHBondContact OE2-NZ 3.06Å; K142-K144 VanDerWaalsContact C-N 3.35Å; K142-K144 HydrophobicContact CB-CG 4.46Å; K142-K144 PolarHBondContact O-N 2.98Å; K144-Q146 PolarHBondContact O-N 2.82Å
145	D	94.7	Very high	95.8	Very high	138 Å²	138	81 Å²	81	74%	0.738	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	0.9	179.6	-56.6	-47.2	0	0	0	113.5	N143 E147	N143-D145 PolarHBondContact O-N 2.9Å; D145-E147 HydrophobicContact CB-CG 4.1Å; D145-E147 PolarHBondContact O-N 3.29Å
146	Q	93.9	Very high	95.6	Very high	169 Å²	169	82.3 Å²	82.3	79%	0.79	41%	0.408	S	S	*	.			trans	53.7	37.9	178.9	-57	-178	4.1	0	0	113.1	N143 K144	N143-Q146 PolarHBondContact O-N 2.78Å; K144-Q146 PolarHBondContact O-N 2.82Å
147	E	94.6	Very high	95.2	Very high	91 Å²	91	81.9 Å²	81.9	43%	0.425	40%	0.403	S	S	.	.			trans	-61.7	145.2	177.8	-58	178.8	151.7	0	0	110.5	N143 D145 R149	N143-E147 PolarHBondContact ND2-N 2.84Å; N143-E147 PolarHBondContact ND2-O 3.2Å; N143-E147 WeakPolarHBondContact OD1-CB 3.29Å; N143-E147 PolarHBondContact OD1-N 2.82Å; D145-E147 HydrophobicContact CB-CG 4.1Å; D145-E147 PolarHBondContact O-N 3.29Å; E147-R149 PolarHBondContact O-N 3.17Å; E147-R149 IonicContact OE2-NE 2.73Å; E147-R149 IonicContact OE2-NH2 3.75Å
148	Q	94.8	Very high	94.7	Very high	172 Å²	172	85.1 Å²	85.1	80%	0.804	42%	0.42	S	S	*	.			trans	-74.7	116.3	173	-67.4	-171.8	3.4	0	0	110.2
149	R	95.3	Very high	94.3	Very high	52 Å²	52	87.9 Å²	87.9	20%	0.196	44%	0.437	C	S	.	.			trans	-115.4	66.4	179.8	-57.8	-171.7	178.5	172.6	-1.6	110.5	I81 L85 F140 N143 E147	I81-R149 HydrophobicContact CG2-CB 4.16Å; L85-R149 HydrophobicContact CD1-CB 3.77Å; L85-R149 HydrophobicContact CD1-CG 3.62Å; F140-R149 VanDerWaalsContact O-CZ 3.29Å; F140-R149 PolarHBondContact O-NH1 2.91Å; F140-R149 PolarHBondContact O-NH2 2.92Å; N143-R149 PolarHBondContact OD1-NH2 3.29Å; E147-R149 PolarHBondContact O-N 3.17Å; E147-R149 IonicContact OE2-NE 2.73Å; E147-R149 IonicContact OE2-NH2 3.75Å
150	L	94.6	Very high	93	Very high	122 Å²	122	93.6 Å²	93.6	64%	0.639	46%	0.46	S	S	*	.	S	Bend	trans	-89.4	-41.2	-176.4	-59.1	177.7	0	0	0	112	I81	I81-L150 VanDerWaalsContact CD1-O 3.24Å; I81-L150 WeakPolarHBondContact CD1-O 3.2Å
151	D	95.2	Very high	91.1	Very high	129 Å²	129	96.6 Å²	96.6	69%	0.69	50%	0.495	S	S	*	.	S	Bend	trans	-136.3	159.7	-172.4	-64.6	-52.5	0	0	0	111.5
152	A	94.9	Very high	89	Confident	43 Å²	43	99 Å²	99	36%	0.355	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-65.1	140.8	169	0	0	0	0	0	110.3	S84	S84-A152 WeakPolarHBondContact OG-CB 3.39Å
153	P	95.3	Very high	86.6	Confident	14 Å²	14	105.3 Å²	105.3	9%	0.091	54%	0.544	C	S	.	.	P	Polyproline II helix	trans	-67.5	150.1	-176	27.5	-33.3	0	0	0	111.6	R72 S84 L85 K88	R72-P153 VanDerWaalsContact CZ-O 3.29Å; R72-P153 PolarHBondContact NH1-O 2.61Å; R72-P153 PolarHBondContact NH2-O 3.43Å; S84-P153 WeakPolarHBondContact OG-CD 3.4Å; L85-P153 HydrophobicContact CD2-CB 4.25Å; L85-P153 HydrophobicContact CD2-CG 4Å; K88-P153 HydrophobicContact CB-CG 4.06Å; K88-P153 HydrophobicContact CD-CB 3.55Å; K88-P153 HydrophobicContact CD-CG 3.77Å
154	N	95	Very high	86.1	Confident	102 Å²	102	108.6 Å²	108.6	55%	0.545	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-62.1	157.4	167.2	-165.2	-0.4	0	0	0	110.4	E156 Y157	N154-E156 WeakPolarHBondContact ND2-CG 3.3Å; N154-E156 PolarHBondContact ND2-OE1 3.45Å; N154-Y157 WeakPolarHBondContact O-CD1 3.12Å; N154-Y157 WeakPolarHBondContact O-CE1 3.5Å
155	L	94.3	Very high	85.7	Confident	76 Å²	76	107.1 Å²	107.1	40%	0.398	56%	0.558	S	S	.	*	S	Bend	trans	-87.1	-2.7	-175.8	-63.4	178	0	0	0	114.3	L68 Y157 L158	L68-L155 HydrophobicContact CD2-CD2 4.27Å; L155-Y157 PolarHBondContact O-N 3.28Å; L155-L158 HydrophobicContact CB-CD1 4.41Å; L155-L158 HydrophobicContact CD2-CD1 4.06Å; L155-L158 WeakPolarHBondContact O-CB 3.16Å; L155-L158 PolarHBondContact O-N 3.46Å
156	E	92.8	Very high	85.2	Confident	118 Å²	118	105.4 Å²	105.4	55%	0.551	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-55.1	-24.8	-178.1	-68.7	171.3	-174.1	0	0	114.2	N154 L158 D159	N154-E156 WeakPolarHBondContact ND2-CG 3.3Å; N154-E156 PolarHBondContact ND2-OE1 3.45Å; E156-L158 PolarHBondContact O-N 2.59Å; E156-D159 WeakPolarHBondContact O-CB 3.34Å; E156-D159 PolarHBondContact O-N 3.17Å; E156-D159 VanDerWaalsContact O-N 3.14Å
157	Y	88.7	Confident	84.6	Confident	48 Å²	48	101.6 Å²	101.6	19%	0.188	53%	0.534	C	S	.	.	G	3₁₀ helix	trans	-68.4	-10.9	176.7	71.4	-89.4	0	0	0	113.9	L68 K88 N154 L155	L68-Y157 WeakPolarHBondContact CD1-OH 3.12Å; K88-Y157 HydrophobicContact CB-CE1 4.09Å; K88-Y157 HydrophobicContact CB-CE2 4.07Å; K88-Y157 HydrophobicContact CD-CD1 3.88Å; K88-Y157 HydrophobicContact CD-CE1 3.93Å; K88-Y157 HydrophobicContact CD-CG 4.3Å; K88-Y157 HydrophobicContact CG-CD1 3.96Å; K88-Y157 HydrophobicContact CG-CD2 3.98Å; K88-Y157 HydrophobicContact CG-CE1 3.82Å; K88-Y157 HydrophobicContact CG-CE2 3.82Å; K88-Y157 HydrophobicContact CG-CG 4.05Å; N154-Y157 WeakPolarHBondContact O-CD1 3.12Å; N154-Y157 WeakPolarHBondContact O-CE1 3.5Å; L155-Y157 PolarHBondContact O-N 3.28Å
158	L	88.4	Confident	84	Confident	67 Å²	67	102.3 Å²	102.3	35%	0.351	54%	0.541	S	S	.	.	G	3₁₀ helix	trans	-90.5	-15.6	175.6	-60.9	171.7	0	0	0	112.3	L68 L155 E156 K160	L68-L158 HydrophobicContact CD2-CD1 3.42Å; L68-L158 VanDerWaalsContact CD2-CD1 3.42Å; L68-L158 HydrophobicContact CD2-CD2 4.5Å; L155-L158 HydrophobicContact CB-CD1 4.41Å; L155-L158 HydrophobicContact CD2-CD1 4.06Å; L155-L158 WeakPolarHBondContact O-CB 3.16Å; L155-L158 PolarHBondContact O-N 3.46Å; E156-L158 PolarHBondContact O-N 2.59Å; L158-K160 PolarHBondContact O-N 2.98Å
159	D	87.8	Confident	83.3	Confident	96 Å²	96	97.7 Å²	97.7	51%	0.513	52%	0.524	S	S	.	.	S	Bend	trans	-76.3	117.7	-179.5	-65.5	-27.4	0	0	0	108.9	E156 G161 S162	E156-D159 WeakPolarHBondContact O-CB 3.34Å; E156-D159 PolarHBondContact O-N 3.17Å; E156-D159 VanDerWaalsContact O-N 3.14Å; D159-G161 PolarHBondContact O-N 3.1Å; D159-S162 PolarHBondContact O-N 3.47Å; D159-S162 VanDerWaalsContact O-N 3.07Å
160	K	70.2	Confident	82.5	Confident	205 Å²	205	100.9 Å²	100.9	89%	0.891	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-4.5	-177.5	-65.1	-172.6	178.7	-173.6	0	114.8	L158	L158-K160 PolarHBondContact O-N 2.98Å
161	G	59.1	Low	81.5	Confident	75 Å²	75	99.3 Å²	99.3	77%	0.773	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-1.2	177.6	0	0	0	0	0	114.8	D159	D159-G161 PolarHBondContact O-N 3.1Å
162	S	50.9	Low	80.4	Confident	80 Å²	80	96.8 Å²	96.8	56%	0.559	53%	0.527	S	S	*	.			trans	-104.6	13.7	-175.2	-54.5	0	0	0	0	113.7	D159	D159-S162 PolarHBondContact O-N 3.47Å; D159-S162 VanDerWaalsContact O-N 3.07Å
163	Q	47.3	Very low	79.1	Confident	238 Å²	238	101.7 Å²	101.7	100%	1.112	54%	0.543	S	S	*	.			trans	-119.8	0	176.6	-86.9	174.5	-17.4	0	0	111.5

Retrieved 163 of 163 residues in 63.6 ms (Link to these results)

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