A0A087XR93_POEFO Loading...

Mediator of RNA polymerase II transcription subunit 28

AlphaFold DB , UniProt , Accession A0A087XR93, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 180 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.4	Very low	43.8	Very low	247 Å²	247	138.6 Å²	138.6	100%	1.217	84%	0.843	S	S	*	*				0	135	0	-69.5	175.5	174	0	0	107.1
2	A	39.9	Very low	43.6	Very low	94 Å²	94	144.3 Å²	144.3	78%	0.777	85%	0.853	S	S	*	*			trans	61	129.6	-174.2	0	0	0	0	0	115.1
3	S	40.1	Very low	43.1	Very low	116 Å²	116	146.9 Å²	146.9	81%	0.811	85%	0.851	S	S	*	*			cis	72.3	130.2	35.1	-45.6	0	0	0	0	111.9
4	S	44.8	Very low	44.2	Very low	114 Å²	114	144.3 Å²	144.3	80%	0.797	84%	0.842	S	S	*	*			cis	-144.9	150.8	17.8	-69.8	0	0	0	0	110
5	M	49.6	Very low	44.5	Very low	171 Å²	171	142.5 Å²	142.5	84%	0.842	84%	0.836	S	S	*	*				87.7	120.7	56.5	-121.8	-177.8	-173.1	0	0	116.3
6	N	39.8	Very low	44.1	Very low	161 Å²	161	138.6 Å²	138.6	86%	0.861	84%	0.835	S	S	*	*			trans	71	128	154	-75.4	20.7	0	0	0	124.8
7	G	42.4	Very low	43.5	Very low	80 Å²	80	136.5 Å²	136.5	83%	0.825	84%	0.836	S	S	*	*			trans	-177	124.7	156	0	0	0	0	0	110.3
8	M	52.3	Low	43.3	Very low	169 Å²	169	139.4 Å²	139.4	83%	0.833	84%	0.838	S	S	*	*			trans	-143.4	119	-159.3	-173.5	84.5	140.6	0	0	113.4
9	F	36.2	Very low	43.8	Very low	184 Å²	184	138.4 Å²	138.4	81%	0.807	84%	0.835	S	S	*	*			trans	61.6	170.2	161.2	-88.2	-109.7	0	0	0	118.1
10	P	60	Low	43.7	Very low	118 Å²	118	138.8 Å²	138.8	77%	0.766	84%	0.838	S	S	*	*				-132.3	169.5	-64.5	39.8	-24	0	0	0	113.5
11	G	36.9	Very low	43.7	Very low	71 Å²	71	135.9 Å²	135.9	73%	0.732	84%	0.836	S	S	*	*			trans	171.9	114.7	165.4	0	0	0	0	0	120.1
12	Q	41.1	Very low	43.9	Very low	207 Å²	207	127.1 Å²	127.1	97%	0.967	81%	0.809	S	S	*	*			trans	54.3	155.9	142.4	-57.6	-168.9	17.4	0	0	122.8
13	Q	37.3	Very low	44.5	Very low	178 Å²	178	128.5 Å²	128.5	83%	0.832	81%	0.81	S	S	*	*			trans	-149.5	156.8	-172.3	174.7	-168.7	-21.3	0	0	108.6
14	P	57.4	Low	44.9	Very low	110 Å²	110	129.1 Å²	129.1	71%	0.714	81%	0.811	S	S	*	*			cis	-111.7	-104.1	-30.1	34.1	-13.2	0	0	0	108.7
15	P	49	Very low	45.3	Very low	117 Å²	117	126.4 Å²	126.4	76%	0.76	80%	0.801	S	S	*	*			cis	-116.1	152	-18.4	39.9	-26.2	0	0	0	116.2
16	G	38.2	Very low	45.5	Very low	80 Å²	80	124.4 Å²	124.4	83%	0.825	80%	0.801	S	S	*	*			trans	86.6	106.7	142.7	0	0	0	0	0	120.7
17	A	34.2	Very low	45.9	Very low	103 Å²	103	121.4 Å²	121.4	85%	0.851	80%	0.799	S	S	*	*			trans	-168.1	125.2	140.2	0	0	0	0	0	111.6
18	H	40.7	Very low	46.6	Very low	189 Å²	189	125.7 Å²	125.7	88%	0.875	80%	0.797	S	S	*	*			trans	-112.7	170.8	157.6	-56	-88.5	0	0	0	107.6
19	P	51.4	Low	46.4	Very low	120 Å²	120	122.2 Å²	122.2	78%	0.779	79%	0.787	S	S	*	*			cis	-123.1	171.4	-19.1	36.3	-21.6	0	0	0	112.4
20	V	42.8	Very low	46.8	Very low	147 Å²	147	119.2 Å²	119.2	89%	0.891	79%	0.789	S	S	*	*			trans	-128.3	123.3	150.1	117.6	0	0	0	0	108.3	G22	V20-G22 PolarHBondContact O-N 3.4Å
21	G	43.4	Very low	46.4	Very low	77 Å²	77	120.9 Å²	120.9	79%	0.794	79%	0.785	S	S	*	*			trans	-79.7	113.3	-174	0	0	0	0	0	111.6
22	G	45.5	Very low	46.8	Very low	63 Å²	63	122.6 Å²	122.6	65%	0.649	78%	0.783	S	S	*	*			trans	-75	151.2	156.2	0	0	0	0	0	110.3	V20	V20-G22 PolarHBondContact O-N 3.4Å
23	P	51.3	Low	47.4	Very low	123 Å²	123	116.7 Å²	116.7	80%	0.799	78%	0.778	S	S	*	*			trans	-64.6	148.4	177.8	28.5	-34.9	0	0	0	111	G25	P23-G25 PolarHBondContact O-N 3.11Å; P23-G25 VanDerWaalsContact O-N 3.11Å
24	P	47.9	Very low	47.9	Very low	129 Å²	129	113.8 Å²	113.8	84%	0.838	77%	0.772	S	S	*	*			trans	-68.7	111.7	175.9	28.7	-32.8	0	0	0	109.6
25	G	53.4	Low	47.7	Very low	57 Å²	57	112.7 Å²	112.7	59%	0.588	77%	0.773	S	S	*	*			trans	-59.7	152.7	158.9	0	0	0	0	0	109.8	P23 A27	P23-G25 PolarHBondContact O-N 3.11Å; P23-G25 VanDerWaalsContact O-N 3.11Å; G25-A27 PolarHBondContact O-N 3.12Å; G25-A27 VanDerWaalsContact O-N 3.12Å
26	P	55.1	Low	47.8	Very low	130 Å²	130	112.1 Å²	112.1	84%	0.844	77%	0.769	S	S	*	*			trans	-57.4	122.7	-178.9	24.3	-33.5	0	0	0	109.6	Q28	P26-Q28 PolarHBondContact O-N 2.95Å
27	A	47.1	Very low	48.3	Very low	97 Å²	97	119.2 Å²	119.2	80%	0.802	77%	0.771	S	S	*	*			trans	-60.4	107.3	-178.9	0	0	0	0	0	109.5	G25	G25-A27 PolarHBondContact O-N 3.12Å; G25-A27 VanDerWaalsContact O-N 3.12Å
28	Q	57	Low	49.2	Very low	171 Å²	171	118 Å²	118	80%	0.799	75%	0.753	S	S	*	*			trans	-60.8	130.2	163.3	-69.5	-162.6	-57.5	0	0	107.5	P26 S30	P26-Q28 PolarHBondContact O-N 2.95Å; Q28-S30 PolarHBondContact O-N 2.87Å
29	P	48	Very low	49.7	Very low	96 Å²	96	118 Å²	118	62%	0.623	75%	0.753	S	S	*	*			trans	-62.6	106.7	173.7	-17	29.3	0	0	0	108.5	F31	P29-F31 HydrophobicContact CB-CD2 4.16Å; P29-F31 HydrophobicContact CB-CE2 3.71Å; P29-F31 HydrophobicContact CB-CZ 3.99Å; P29-F31 HydrophobicContact CG-CE2 4.3Å; P29-F31 VanDerWaalsContact O-CD2 3.23Å; P29-F31 WeakPolarHBondContact O-CD2 3.23Å; P29-F31 PolarHBondContact O-N 2.9Å
30	S	45.8	Very low	49.9	Very low	121 Å²	121	114.3 Å²	114.3	85%	0.846	74%	0.736	S	S	*	*			trans	-71.3	82.7	169.6	-58.6	0	0	0	0	108.2	Q28	Q28-S30 PolarHBondContact O-N 2.87Å
31	F	51.2	Low	51.1	Low	152 Å²	152	115.5 Å²	115.5	67%	0.667	74%	0.738	S	S	*	*			trans	-59	129.9	170.9	-67.7	-81.6	0	0	0	108.7	P29 G33	P29-F31 HydrophobicContact CB-CD2 4.16Å; P29-F31 HydrophobicContact CB-CE2 3.71Å; P29-F31 HydrophobicContact CB-CZ 3.99Å; P29-F31 HydrophobicContact CG-CE2 4.3Å; P29-F31 VanDerWaalsContact O-CD2 3.23Å; P29-F31 WeakPolarHBondContact O-CD2 3.23Å; P29-F31 PolarHBondContact O-N 2.9Å; F31-G33 PolarHBondContact O-N 2.98Å
32	P	45.3	Very low	52.7	Low	108 Å²	108	116.9 Å²	116.9	70%	0.701	73%	0.727	S	S	*	*			trans	-62.6	110.7	177.7	24.6	-32.3	0	0	0	109.1	T34	P32-T34 PolarHBondContact O-N 2.84Å
33	G	52.8	Low	54.9	Low	83 Å²	83	117.4 Å²	117.4	86%	0.856	72%	0.717	S	S	*	*			trans	-73.3	66.9	178.1	0	0	0	0	0	111.9	F31	F31-G33 PolarHBondContact O-N 2.98Å
34	T	49.3	Very low	57	Low	117 Å²	117	113.1 Å²	113.1	72%	0.718	69%	0.687	S	S	*	*			trans	-113.2	63.6	172.7	55.5	0	0	0	0	110.2	P32 P36	P32-T34 PolarHBondContact O-N 2.84Å; T34-P36 WeakPolarHBondContact O-CD 3.44Å
35	A	53.1	Low	59.3	Low	87 Å²	87	110.4 Å²	110.4	72%	0.719	67%	0.668	S	S	*	*			trans	-70.6	120.8	149	0	0	0	0	0	106.5	R37	A35-R37 PolarHBondContact O-N 3.29Å
36	P	50.5	Low	61.3	Low	105 Å²	105	110.8 Å²	110.8	68%	0.682	66%	0.657	S	S	*	*			trans	-58	130.6	169.3	-18	30.9	0	0	0	107.9	T34 V38	T34-P36 WeakPolarHBondContact O-CD 3.44Å; P36-V38 VanDerWaalsContact C-N 3.3Å; P36-V38 PolarHBondContact O-N 3.45Å
37	R	48.8	Very low	63.3	Low	229 Å²	229	107.4 Å²	107.4	86%	0.864	63%	0.63	S	S	*	*			trans	-68.4	99.3	161	-74.4	-172.6	177.8	-141	1.6	106.1	A35 Q39	A35-R37 PolarHBondContact O-N 3.29Å; R37-Q39 PolarHBondContact O-N 2.91Å; R37-Q39 VanDerWaalsContact O-N 3.07Å
38	V	53	Low	65.6	Low	78 Å²	78	105 Å²	105	47%	0.473	60%	0.603	S	S	.	*			trans	-62.2	111.8	171.6	177.1	0	0	0	0	106.8	P36 G40	P36-V38 VanDerWaalsContact C-N 3.3Å; P36-V38 PolarHBondContact O-N 3.45Å; V38-G40 PolarHBondContact O-N 2.97Å
39	Q	50.5	Low	67.5	Low	189 Å²	189	102.3 Å²	102.3	88%	0.883	59%	0.591	S	S	*	*	S	Bend	trans	-76.6	79.3	171	-103.3	108.1	-120	0	0	108.1	R37	R37-Q39 PolarHBondContact O-N 2.91Å; R37-Q39 VanDerWaalsContact O-N 3.07Å
40	G	56.3	Low	69.9	Low	41 Å²	41	100.3 Å²	100.3	42%	0.423	58%	0.583	S	S	.	*	S	Bend	trans	-172.1	143.1	176.9	0	0	0	0	0	108.7	V38 N42	V38-G40 PolarHBondContact O-N 2.97Å; G40-N42 PolarHBondContact O-N 2.97Å
41	N	67.6	Low	72.3	Confident	173 Å²	173	94.6 Å²	94.6	93%	0.925	54%	0.543	S	S	*	.	S	Bend	trans	-76.3	0.1	179.4	-96.1	48	0	0	0	113.6
42	N	77.2	Confident	74.4	Confident	106 Å²	106	92.8 Å²	92.8	57%	0.567	54%	0.535	S	S	*	.			trans	-87.3	141.4	-178.8	-60	-20.2	0	0	0	110.3	G40 D46 E47	G40-N42 PolarHBondContact O-N 2.97Å; N42-D46 HydrophobicContact CB-CB 4.17Å; N42-E47 HydrophobicContact CB-CG 4.36Å
43	T	92.7	Very high	76.8	Confident	73 Å²	73	93.4 Å²	93.4	45%	0.448	53%	0.528	S	S	.	.			trans	-85.4	165.4	171.1	72.6	0	0	0	0	110.7	V45 D46 E47	T43-V45 PolarHBondContact O-N 3.07Å; T43-V45 VanDerWaalsContact O-N 3.13Å; T43-V45 PolarHBondContact OG1-N 3.46Å; T43-D46 WeakPolarHBondContact CA-OD2 3.45Å; T43-D46 VanDerWaalsContact CB-OD2 3.26Å; T43-D46 WeakPolarHBondContact CB-OD2 3.21Å; T43-D46 WeakPolarHBondContact CG2-OD2 3.25Å; T43-D46 PolarHBondContact N-OD2 2.99Å; T43-D46 PolarHBondContact O-N 3.07Å; T43-D46 VanDerWaalsContact O-N 3.07Å; T43-D46 PolarHBondContact OG1-N 3.27Å; T43-D46 PolarHBondContact OG1-OD2 3.38Å; T43-E47 PolarHBondContact O-N 3.33Å
44	L	94.3	Very high	78.8	Confident	33 Å²	33	91.5 Å²	91.5	17%	0.173	51%	0.505	C	S	.	.	H	α-helix	trans	-57.5	-25.5	172.1	-68.5	174.5	0	0	0	112.9	L48 Q90 T91 F94	L44-L48 VanDerWaalsContact O-CB 3.25Å; L44-L48 WeakPolarHBondContact O-CB 3.41Å; L44-L48 PolarHBondContact O-N 3.21Å; L44-Q90 HydrophobicContact CD2-CG 3.99Å; L44-T91 PolarHBondContact O-OG1 3.02Å; L44-F94 HydrophobicContact CD1-CB 3.64Å; L44-F94 HydrophobicContact CD1-CD1 4.23Å; L44-F94 HydrophobicContact CD1-CD2 3.87Å; L44-F94 HydrophobicContact CD1-CG 3.65Å
45	V	95.3	Very high	80.9	Confident	72 Å²	72	86.7 Å²	86.7	44%	0.436	48%	0.476	S	S	.	.	H	α-helix	trans	-74.4	-43	176.2	-178.3	0	0	0	0	110.4	T43 E47 L48 E49 F95	T43-V45 PolarHBondContact O-N 3.07Å; T43-V45 VanDerWaalsContact O-N 3.13Å; T43-V45 PolarHBondContact OG1-N 3.46Å; V45-E47 VanDerWaalsContact C-N 3.33Å; V45-E47 PolarHBondContact O-N 2.88Å; V45-L48 WeakPolarHBondContact O-CB 3.24Å; V45-L48 PolarHBondContact O-N 2.93Å; V45-E49 WeakPolarHBondContact O-CB 3.5Å; V45-E49 PolarHBondContact O-N 3.34Å; V45-F95 HydrophobicContact CG2-CZ 4.49Å
46	D	96.5	Very high	82.8	Confident	66 Å²	66	88.5 Å²	88.5	35%	0.353	47%	0.467	S	S	.	.	H	α-helix	trans	-66.4	-36.4	176.6	-46.3	-51.5	0	0	0	111.1	N42 T43 A50	N42-D46 HydrophobicContact CB-CB 4.17Å; T43-D46 WeakPolarHBondContact CA-OD2 3.45Å; T43-D46 VanDerWaalsContact CB-OD2 3.26Å; T43-D46 WeakPolarHBondContact CB-OD2 3.21Å; T43-D46 WeakPolarHBondContact CG2-OD2 3.25Å; T43-D46 PolarHBondContact N-OD2 2.99Å; T43-D46 PolarHBondContact O-N 3.07Å; T43-D46 VanDerWaalsContact O-N 3.07Å; T43-D46 PolarHBondContact OG1-N 3.27Å; T43-D46 PolarHBondContact OG1-OD2 3.38Å; D46-A50 VanDerWaalsContact O-CB 3.27Å; D46-A50 WeakPolarHBondContact O-CB 3.46Å; D46-A50 PolarHBondContact O-N 2.93Å
47	E	96.2	Very high	84.7	Confident	59 Å²	59	86.6 Å²	86.6	28%	0.276	46%	0.457	S	S	.	.	H	α-helix	trans	-67.2	-37.5	172.2	-70.5	-176.7	-165.1	0	0	112.2	N42 T43 V45 S51 V87	N42-E47 HydrophobicContact CB-CG 4.36Å; T43-E47 PolarHBondContact O-N 3.33Å; V45-E47 VanDerWaalsContact C-N 3.33Å; V45-E47 PolarHBondContact O-N 2.88Å; E47-S51 WeakPolarHBondContact O-CB 3.28Å; E47-S51 PolarHBondContact O-N 3.47Å; E47-S51 PolarHBondContact O-OG 2.92Å; E47-V87 HydrophobicContact CB-CG1 4.02Å
48	L	97.3	Very high	86.5	Confident	45 Å²	45	77.4 Å²	77.4	24%	0.236	43%	0.427	C	S	.	.	H	α-helix	trans	-66	-46.9	175.9	-179.8	66.3	0	0	0	110.9	L44 V45 S51 F52 F84 V87 A88 T91	L44-L48 VanDerWaalsContact O-CB 3.25Å; L44-L48 WeakPolarHBondContact O-CB 3.41Å; L44-L48 PolarHBondContact O-N 3.21Å; V45-L48 WeakPolarHBondContact O-CB 3.24Å; V45-L48 PolarHBondContact O-N 2.93Å; L48-S51 PolarHBondContact O-N 3.25Å; L48-S51 PolarHBondContact O-OG 3.31Å; L48-F52 WeakPolarHBondContact O-CB 3.32Å; L48-F52 PolarHBondContact O-N 3.45Å; L48-F84 HydrophobicContact CD1-CD2 4.04Å; L48-F84 HydrophobicContact CD1-CE2 3.75Å; L48-V87 HydrophobicContact CB-CG1 3.95Å; L48-V87 HydrophobicContact CD1-CG1 4.31Å; L48-A88 HydrophobicContact CD1-CB 3.81Å; L48-T91 HydrophobicContact CD2-CG2 4.24Å
49	E	96.9	Very high	88	Confident	115 Å²	115	79.7 Å²	79.7	54%	0.537	44%	0.436	S	S	.	.	H	α-helix	trans	-59.5	-51.7	175.8	-175.1	166.5	-154.1	0	0	111.1	V45 S51 F52 E53	V45-E49 WeakPolarHBondContact O-CB 3.5Å; V45-E49 PolarHBondContact O-N 3.34Å; E49-S51 VanDerWaalsContact C-N 3.3Å; E49-S51 PolarHBondContact O-N 2.92Å; E49-F52 WeakPolarHBondContact O-CB 3.47Å; E49-F52 PolarHBondContact O-N 2.98Å; E49-F52 VanDerWaalsContact O-N 3.08Å; E49-E53 WeakPolarHBondContact O-CG 3.41Å; E49-E53 PolarHBondContact O-N 3.24Å
50	A	96.6	Very high	89.7	Confident	55 Å²	55	74.8 Å²	74.8	46%	0.455	42%	0.419	S	S	.	.	H	α-helix	trans	-61.5	-35.1	178.1	0	0	0	0	0	113.2	D46 A54	D46-A50 VanDerWaalsContact O-CB 3.27Å; D46-A50 WeakPolarHBondContact O-CB 3.46Å; D46-A50 PolarHBondContact O-N 2.93Å; A50-A54 WeakPolarHBondContact O-CB 3.42Å; A50-A54 PolarHBondContact O-N 3.35Å; A50-A54 VanDerWaalsContact O-N 3.12Å
51	S	96.6	Very high	90.9	Very high	1 Å²	1	74.8 Å²	74.8	1%	0.007	41%	0.413	C	S	.	.	H	α-helix	trans	-71.4	-36.6	174.3	69.9	0	0	0	0	112.5	E47 L48 E49 C55 C80	E47-S51 WeakPolarHBondContact O-CB 3.28Å; E47-S51 PolarHBondContact O-N 3.47Å; E47-S51 PolarHBondContact O-OG 2.92Å; L48-S51 PolarHBondContact O-N 3.25Å; L48-S51 PolarHBondContact O-OG 3.31Å; E49-S51 VanDerWaalsContact C-N 3.3Å; E49-S51 PolarHBondContact O-N 2.92Å; S51-C55 PolarHBondContact O-N 3.3Å; S51-C55 PolarHBondContact O-SG 3.27Å; S51-C80 PolarHBondContact O-SG 3.32Å
52	F	96.4	Very high	91	Very high	114 Å²	114	74.2 Å²	74.2	50%	0.5	41%	0.405	S	S	.	.	H	α-helix	trans	-64.9	-47.8	173.8	176.1	-101.1	0	0	0	111.9	L48 E49 A54 C55 F56 F84	L48-F52 WeakPolarHBondContact O-CB 3.32Å; L48-F52 PolarHBondContact O-N 3.45Å; E49-F52 WeakPolarHBondContact O-CB 3.47Å; E49-F52 PolarHBondContact O-N 2.98Å; E49-F52 VanDerWaalsContact O-N 3.08Å; F52-A54 VanDerWaalsContact C-N 3.35Å; F52-A54 PolarHBondContact O-N 2.83Å; F52-C55 PolarHBondContact O-N 3.27Å; F52-C55 VanDerWaalsContact O-N 3.14Å; F52-F56 WeakPolarHBondContact O-CB 3.31Å; F52-F56 PolarHBondContact O-N 3.36Å; F52-F84 HydrophobicContact CB-CD2 3.93Å; F52-F84 HydrophobicContact CB-CE2 3.77Å; F52-F84 AromaticContact CD2-CE2 3.91Å; F52-F84 HydrophobicContact CD2-CE2 3.91Å; F52-F84 HydrophobicContact CD2-CZ 4.17Å; F52-F84 HydrophobicContact CG-CE2 4.31Å
53	E	95.8	Very high	90.6	Very high	120 Å²	120	74.9 Å²	74.9	56%	0.561	41%	0.408	S	S	*	.	H	α-helix	trans	-58.9	-44.8	177.6	-73.1	-168.3	145.5	0	0	112	E49 C55 F56 S57	E49-E53 WeakPolarHBondContact O-CG 3.41Å; E49-E53 PolarHBondContact O-N 3.24Å; E53-C55 VanDerWaalsContact C-N 3.28Å; E53-C55 PolarHBondContact O-N 2.93Å; E53-F56 PolarHBondContact O-N 3.46Å; E53-S57 VanDerWaalsContact O-CB 3.23Å; E53-S57 WeakPolarHBondContact O-CB 3.41Å; E53-S57 PolarHBondContact O-N 3.2Å
54	A	94.1	Very high	89.2	Confident	44 Å²	44	76 Å²	76	36%	0.364	41%	0.405	S	S	.	.	H	α-helix	trans	-57.4	-42.5	175.8	0	0	0	0	0	111.4	A50 F52 S57 S58	A50-A54 WeakPolarHBondContact O-CB 3.42Å; A50-A54 PolarHBondContact O-N 3.35Å; A50-A54 VanDerWaalsContact O-N 3.12Å; F52-A54 VanDerWaalsContact C-N 3.35Å; F52-A54 PolarHBondContact O-N 2.83Å; A54-S57 PolarHBondContact O-N 2.96Å; A54-S58 PolarHBondContact O-N 2.89Å; A54-S58 PolarHBondContact O-OG 3.37Å; A54-S58 VanDerWaalsContact O-OG 3.08Å
55	C	93.7	Very high	87.8	Confident	16 Å²	16	80 Å²	80	11%	0.108	43%	0.431	C	S	.	.	H	α-helix	trans	-77.4	-36.4	-174.8	-61.3	0	0	0	0	111.8	S51 F52 E53 L59 C80 I81	S51-C55 PolarHBondContact O-N 3.3Å; S51-C55 PolarHBondContact O-SG 3.27Å; F52-C55 PolarHBondContact O-N 3.27Å; F52-C55 VanDerWaalsContact O-N 3.14Å; E53-C55 VanDerWaalsContact C-N 3.28Å; E53-C55 PolarHBondContact O-N 2.93Å; C55-L59 VanDerWaalsContact O-CB 3.28Å; C55-L59 WeakPolarHBondContact O-CB 3.41Å; C55-L59 PolarHBondContact O-N 3.02Å; C55-C80 WeakPolarHBondContact CA-SG 3.48Å; C55-C80 HydrophobicContact CB-CB 4.07Å; C55-C80 WeakPolarHBondContact CB-SG 3.48Å; C55-C80 PolarHBondContact N-SG 2.73Å; C55-C80 WeakPolarHBondContact SG-CB 3.49Å; C55-C80 PolarHBondContact SG-O 3.07Å; C55-C80 CovalentContact SG-SG 2.06Å; C55-C80 PolarHBondContact SG-SG 2.97Å; C55-I81 PolarHBondContact SG-N 2.98Å
56	F	91.5	Very high	86.5	Confident	124 Å²	124	83 Å²	83	54%	0.544	44%	0.444	S	S	.	.	H	α-helix	trans	-60.6	-47.5	170.1	-176.1	-102.6	0	0	0	110.6	F52 E53 L59 V60	F52-F56 WeakPolarHBondContact O-CB 3.31Å; F52-F56 PolarHBondContact O-N 3.36Å; E53-F56 PolarHBondContact O-N 3.46Å; F56-L59 PolarHBondContact O-N 3.02Å; F56-V60 HydrophobicContact CD1-CG2 4.5Å; F56-V60 HydrophobicContact CD2-CG1 4.42Å; F56-V60 HydrophobicContact CE1-CG1 4.24Å; F56-V60 HydrophobicContact CE1-CG2 4.29Å; F56-V60 HydrophobicContact CE2-CG1 4.01Å; F56-V60 HydrophobicContact CZ-CG1 3.91Å; F56-V60 WeakPolarHBondContact O-CG2 3.37Å; F56-V60 PolarHBondContact O-N 3.34Å
57	S	91.1	Very high	85	Confident	66 Å²	66	82 Å²	82	46%	0.462	45%	0.45	S	S	.	.	H	α-helix	trans	-57.5	-50.5	176.9	-173.6	0	0	0	0	112.2	E53 A54 L59 V60 S61	E53-S57 VanDerWaalsContact O-CB 3.23Å; E53-S57 WeakPolarHBondContact O-CB 3.41Å; E53-S57 PolarHBondContact O-N 3.2Å; A54-S57 PolarHBondContact O-N 2.96Å; S57-L59 VanDerWaalsContact C-N 3.28Å; S57-L59 PolarHBondContact O-N 3.43Å; S57-V60 PolarHBondContact O-N 2.96Å; S57-S61 PolarHBondContact O-N 3.43Å; S57-S61 PolarHBondContact O-OG 2.85Å
58	S	87.4	Confident	83.3	Confident	35 Å²	35	85.8 Å²	85.8	25%	0.245	48%	0.477	C	S	.	.	H	α-helix	trans	-60.8	-34.7	176.5	-60.2	0	0	0	0	113.1	A54	A54-S58 PolarHBondContact O-N 2.89Å; A54-S58 PolarHBondContact O-OG 3.37Å; A54-S58 VanDerWaalsContact O-OG 3.08Å
59	L	83.4	Confident	82.2	Confident	126 Å²	126	88.2 Å²	88.2	66%	0.66	49%	0.49	S	S	*	.	H	α-helix	trans	-74.3	-30	179.3	-171.2	67	0	0	0	113.5	C55 F56 S57	C55-L59 VanDerWaalsContact O-CB 3.28Å; C55-L59 WeakPolarHBondContact O-CB 3.41Å; C55-L59 PolarHBondContact O-N 3.02Å; F56-L59 PolarHBondContact O-N 3.02Å; S57-L59 VanDerWaalsContact C-N 3.28Å; S57-L59 PolarHBondContact O-N 3.43Å
60	V	86.2	Confident	81.3	Confident	87 Å²	87	87 Å²	87	53%	0.527	49%	0.485	S	S	.	.	H	α-helix	trans	-100.2	3.3	-179.9	-52.6	0	0	0	0	114	F56 S57 Q62	F56-V60 HydrophobicContact CD1-CG2 4.5Å; F56-V60 HydrophobicContact CD2-CG1 4.42Å; F56-V60 HydrophobicContact CE1-CG1 4.24Å; F56-V60 HydrophobicContact CE1-CG2 4.29Å; F56-V60 HydrophobicContact CE2-CG1 4.01Å; F56-V60 HydrophobicContact CZ-CG1 3.91Å; F56-V60 WeakPolarHBondContact O-CG2 3.37Å; F56-V60 PolarHBondContact O-N 3.34Å; S57-V60 PolarHBondContact O-N 2.96Å; V60-Q62 PolarHBondContact O-N 3.18Å
61	S	81.3	Confident	80.8	Confident	41 Å²	41	92.1 Å²	92.1	29%	0.287	50%	0.499	S	S	.	.			trans	-64.7	124.7	-178.9	-71.6	0	0	0	0	111.9	S57 D63 Y64	S57-S61 PolarHBondContact O-N 3.43Å; S57-S61 PolarHBondContact O-OG 2.85Å; S61-D63 PolarHBondContact O-N 3.24Å; S61-Y64 WeakPolarHBondContact O-CB 3.29Å; S61-Y64 PolarHBondContact O-N 2.87Å
62	Q	70.4	Confident	80.2	Confident	161 Å²	161	99.2 Å²	99.2	75%	0.752	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-63.3	-29.5	-179.4	-72.3	-171.9	-8.4	0	0	112.9	V60 Y64 V65 N66	V60-Q62 PolarHBondContact O-N 3.18Å; Q62-Y64 PolarHBondContact O-N 3.07Å; Q62-Y64 VanDerWaalsContact O-N 3.11Å; Q62-V65 PolarHBondContact O-N 3.47Å; Q62-N66 PolarHBondContact O-OD1 2.87Å
63	D	68.9	Low	79.5	Confident	120 Å²	120	96 Å²	96	64%	0.642	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-59.5	-25.1	-179.5	-55	-63.2	0	0	0	113.1	S61 V65 N66 I73	S61-D63 PolarHBondContact O-N 3.24Å; D63-V65 PolarHBondContact O-N 2.9Å; D63-V65 VanDerWaalsContact O-N 3.15Å; D63-N66 PolarHBondContact O-N 3.34Å; D63-I73 WeakPolarHBondContact O-CD1 3.27Å
64	Y	64	Low	79	Confident	95 Å²	95	96 Å²	96	37%	0.373	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-58.7	-24.7	174.2	-175.1	-100	0	0	0	113.7	S61 Q62 I73	S61-Y64 WeakPolarHBondContact O-CB 3.29Å; S61-Y64 PolarHBondContact O-N 2.87Å; Q62-Y64 PolarHBondContact O-N 3.07Å; Q62-Y64 VanDerWaalsContact O-N 3.11Å; Y64-I73 HydrophobicContact CD2-CB 4.44Å; Y64-I73 HydrophobicContact CD2-CG2 3.77Å
65	V	64.3	Low	78.8	Confident	119 Å²	119	97 Å²	97	72%	0.721	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-97.2	-14.5	-174.5	-176.2	0	0	0	0	112.3	Q62 D63	Q62-V65 PolarHBondContact O-N 3.47Å; D63-V65 PolarHBondContact O-N 2.9Å; D63-V65 VanDerWaalsContact O-N 3.15Å
66	N	67.6	Low	78.5	Confident	133 Å²	133	97.8 Å²	97.8	71%	0.711	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118	-6.5	-155.5	-84.3	66.9	0	0	0	117	Q62 D63	Q62-N66 PolarHBondContact O-OD1 2.87Å; D63-N66 PolarHBondContact O-N 3.34Å
67	G	65.5	Low	78.5	Confident	47 Å²	47	92.7 Å²	92.7	49%	0.485	51%	0.506	S	S	.	.			trans	-147.5	168.3	-166.4	0	0	0	0	0	117.9	D69	G67-D69 VanDerWaalsContact C-N 3.29Å; G67-D69 PolarHBondContact O-N 2.91Å
68	T	60.3	Low	78.5	Confident	137 Å²	137	94 Å²	94	84%	0.84	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-15.7	-174.4	34.4	0	0	0	0	115.5	Q70	T68-Q70 VanDerWaalsContact C-N 3.3Å; T68-Q70 PolarHBondContact O-N 3.34Å
69	D	74	Confident	78.9	Confident	97 Å²	97	98.6 Å²	98.6	52%	0.519	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	29.2	-170.9	-50.6	-54.3	0	0	0	112.7	G67 E71 E72 I73	G67-D69 VanDerWaalsContact C-N 3.29Å; G67-D69 PolarHBondContact O-N 2.91Å; D69-E71 PolarHBondContact O-N 3.44Å; D69-E72 PolarHBondContact O-N 3.27Å; D69-I73 WeakPolarHBondContact O-CG1 3.39Å; D69-I73 PolarHBondContact O-N 3.16Å; D69-I73 VanDerWaalsContact O-N 3.07Å
70	Q	79.1	Confident	79.4	Confident	90 Å²	90	93.2 Å²	93.2	42%	0.421	50%	0.498	S	S	.	.	H	α-helix	trans	-56	-28.2	-174.7	-171.1	179.5	72.3	0	0	113.8	T68 R74	T68-Q70 VanDerWaalsContact C-N 3.3Å; T68-Q70 PolarHBondContact O-N 3.34Å; Q70-R74 WeakPolarHBondContact O-CB 3.33Å; Q70-R74 PolarHBondContact O-N 2.83Å
71	E	84.5	Confident	79.9	Confident	162 Å²	162	92.6 Å²	92.6	76%	0.757	49%	0.491	S	S	*	.	H	α-helix	trans	-72.7	-38.4	176.2	-172.9	167.4	-169	0	0	112.5	D69 T75	D69-E71 PolarHBondContact O-N 3.44Å; E71-T75 VanDerWaalsContact O-CB 3.31Å; E71-T75 WeakPolarHBondContact O-CB 3.36Å; E71-T75 PolarHBondContact O-N 3.01Å; E71-T75 PolarHBondContact O-OG1 3.1Å
72	E	84.1	Confident	80.6	Confident	150 Å²	150	95.4 Å²	95.4	70%	0.701	50%	0.5	S	S	*	.	H	α-helix	trans	-68.4	-45.8	174.3	-175.3	173.8	-179	0	0	110.6	D69 R74 T75 G76	D69-E72 PolarHBondContact O-N 3.27Å; E72-R74 PolarHBondContact O-N 3.17Å; E72-T75 WeakPolarHBondContact O-CB 3.38Å; E72-T75 PolarHBondContact O-N 2.92Å; E72-G76 PolarHBondContact O-N 2.99Å
73	I	82.3	Confident	81.8	Confident	47 Å²	47	94 Å²	94	24%	0.241	49%	0.491	C	S	.	.	H	α-helix	trans	-61.8	-44.4	178	-53.6	170.9	0	0	0	110.4	D63 Y64 D69 T75 G76 V77	D63-I73 WeakPolarHBondContact O-CD1 3.27Å; Y64-I73 HydrophobicContact CD2-CB 4.44Å; Y64-I73 HydrophobicContact CD2-CG2 3.77Å; D69-I73 WeakPolarHBondContact O-CG1 3.39Å; D69-I73 PolarHBondContact O-N 3.16Å; D69-I73 VanDerWaalsContact O-N 3.07Å; I73-T75 PolarHBondContact O-N 2.89Å; I73-G76 PolarHBondContact O-N 3.25Å; I73-V77 WeakPolarHBondContact O-CG2 3.43Å; I73-V77 PolarHBondContact O-N 2.99Å
74	R	85.6	Confident	83.2	Confident	119 Å²	119	91.2 Å²	91.2	45%	0.449	47%	0.474	S	S	.	.	H	α-helix	trans	-59.4	-46.1	175.4	-173.9	-176.8	-55.5	172.8	7.2	111.6	Q70 E72 G76 V77 D78	Q70-R74 WeakPolarHBondContact O-CB 3.33Å; Q70-R74 PolarHBondContact O-N 2.83Å; E72-R74 PolarHBondContact O-N 3.17Å; R74-G76 VanDerWaalsContact C-N 3.26Å; R74-G76 PolarHBondContact O-N 3.49Å; R74-V77 PolarHBondContact O-N 2.75Å; R74-V77 VanDerWaalsContact O-N 3.14Å; R74-D78 PolarHBondContact O-N 3.31Å
75	T	88.9	Confident	84.8	Confident	65 Å²	65	90.9 Å²	90.9	40%	0.399	48%	0.478	S	S	.	.	H	α-helix	trans	-59.8	-37.5	176.4	-60.2	0	0	0	0	111.8	E71 E72 I73 Q79	E71-T75 VanDerWaalsContact O-CB 3.31Å; E71-T75 WeakPolarHBondContact O-CB 3.36Å; E71-T75 PolarHBondContact O-N 3.01Å; E71-T75 PolarHBondContact O-OG1 3.1Å; E72-T75 WeakPolarHBondContact O-CB 3.38Å; E72-T75 PolarHBondContact O-N 2.92Å; I73-T75 PolarHBondContact O-N 2.89Å; T75-Q79 WeakPolarHBondContact O-CB 3.37Å; T75-Q79 VanDerWaalsContact O-CG 3.29Å; T75-Q79 WeakPolarHBondContact O-CG 3.46Å; T75-Q79 PolarHBondContact O-N 3.13Å
76	G	88.9	Confident	86.4	Confident	32 Å²	32	88.8 Å²	88.8	33%	0.33	46%	0.462	S	S	.	.	H	α-helix	trans	-65.6	-41.8	173.4	0	0	0	0	0	113.7	E72 I73 R74 Q79 C80	E72-G76 PolarHBondContact O-N 2.99Å; I73-G76 PolarHBondContact O-N 3.25Å; R74-G76 VanDerWaalsContact C-N 3.26Å; R74-G76 PolarHBondContact O-N 3.49Å; G76-Q79 PolarHBondContact O-N 3.28Å; G76-C80 PolarHBondContact O-N 2.96Å
77	V	90.6	Very high	87.8	Confident	18 Å²	18	83 Å²	83	11%	0.109	43%	0.432	C	S	.	.	H	α-helix	trans	-61.8	-48.6	174.3	176.1	0	0	0	0	110.5	I73 R74 Q79 C80 I81	I73-V77 WeakPolarHBondContact O-CG2 3.43Å; I73-V77 PolarHBondContact O-N 2.99Å; R74-V77 PolarHBondContact O-N 2.75Å; R74-V77 VanDerWaalsContact O-N 3.14Å; V77-Q79 VanDerWaalsContact C-N 3.34Å; V77-Q79 PolarHBondContact O-N 2.66Å; V77-C80 PolarHBondContact O-N 3.48Å; V77-C80 VanDerWaalsContact O-N 3.15Å; V77-I81 HydrophobicContact CG1-CD1 3.75Å; V77-I81 HydrophobicContact CG1-CG1 4.42Å; V77-I81 WeakPolarHBondContact O-CG1 3.27Å; V77-I81 PolarHBondContact O-N 2.97Å
78	D	92.2	Very high	89.4	Confident	93 Å²	93	82.3 Å²	82.3	50%	0.497	42%	0.421	S	S	.	.	H	α-helix	trans	-60.8	-42.1	179.4	-70.6	-29.7	0	0	0	111.7	R74 C80 I81 Q82	R74-D78 PolarHBondContact O-N 3.31Å; D78-C80 PolarHBondContact O-N 2.72Å; D78-I81 PolarHBondContact O-N 3.06Å; D78-Q82 WeakPolarHBondContact O-CB 3.25Å; D78-Q82 PolarHBondContact O-N 2.96Å
79	Q	94.4	Very high	91.2	Very high	131 Å²	131	83.2 Å²	83.2	61%	0.612	41%	0.409	S	S	*	.	H	α-helix	trans	-61.3	-40.7	174.3	-79.2	179.8	43.2	0	0	112.6	T75 G76 V77 K83	T75-Q79 WeakPolarHBondContact O-CB 3.37Å; T75-Q79 VanDerWaalsContact O-CG 3.29Å; T75-Q79 WeakPolarHBondContact O-CG 3.46Å; T75-Q79 PolarHBondContact O-N 3.13Å; G76-Q79 PolarHBondContact O-N 3.28Å; V77-Q79 VanDerWaalsContact C-N 3.34Å; V77-Q79 PolarHBondContact O-N 2.66Å; Q79-K83 WeakPolarHBondContact O-CB 3.42Å; Q79-K83 PolarHBondContact O-N 3.15Å
80	C	95	Very high	92.3	Very high	13 Å²	13	82.8 Å²	82.8	9%	0.088	40%	0.404	C	S	.	.	H	α-helix	trans	-64.6	-51.6	175.2	-169.9	0	0	0	0	111.1	S51 C55 G76 V77 D78 Q82 K83 F84	S51-C80 PolarHBondContact O-SG 3.32Å; C55-C80 WeakPolarHBondContact CA-SG 3.48Å; C55-C80 HydrophobicContact CB-CB 4.07Å; C55-C80 WeakPolarHBondContact CB-SG 3.48Å; C55-C80 PolarHBondContact N-SG 2.73Å; C55-C80 WeakPolarHBondContact SG-CB 3.49Å; C55-C80 PolarHBondContact SG-O 3.07Å; C55-C80 CovalentContact SG-SG 2.06Å; C55-C80 PolarHBondContact SG-SG 2.97Å; G76-C80 PolarHBondContact O-N 2.96Å; V77-C80 PolarHBondContact O-N 3.48Å; V77-C80 VanDerWaalsContact O-N 3.15Å; D78-C80 PolarHBondContact O-N 2.72Å; C80-Q82 PolarHBondContact O-N 3.37Å; C80-K83 CarbonylContact O-C 3.6Å; C80-K83 WeakPolarHBondContact O-CA 3.36Å; C80-K83 WeakPolarHBondContact O-CB 3.4Å; C80-K83 PolarHBondContact O-N 3.05Å; C80-F84 PolarHBondContact O-N 3.43Å
81	I	95.1	Very high	93.2	Very high	75 Å²	75	79.1 Å²	79.1	39%	0.385	39%	0.388	S	S	.	.	H	α-helix	trans	-54.4	-44.7	-178.1	-69	168.3	0	0	0	110	C55 V77 D78 F84 L85	C55-I81 PolarHBondContact SG-N 2.98Å; V77-I81 HydrophobicContact CG1-CD1 3.75Å; V77-I81 HydrophobicContact CG1-CG1 4.42Å; V77-I81 WeakPolarHBondContact O-CG1 3.27Å; V77-I81 PolarHBondContact O-N 2.97Å; D78-I81 PolarHBondContact O-N 3.06Å; I81-F84 PolarHBondContact O-N 3.24Å; I81-L85 HydrophobicContact CG2-CD1 3.98Å; I81-L85 HydrophobicContact CG2-CG 4.45Å; I81-L85 VanDerWaalsContact O-CG 3.27Å; I81-L85 WeakPolarHBondContact O-CG 3.26Å; I81-L85 PolarHBondContact O-N 3.47Å
82	Q	96.7	Very high	93.8	Very high	99 Å²	99	77 Å²	77	46%	0.463	38%	0.378	S	S	.	.	H	α-helix	trans	-59.4	-48.1	175.5	-174.2	55.7	58.2	0	0	112	D78 C80 F84 L85 D86	D78-Q82 WeakPolarHBondContact O-CB 3.25Å; D78-Q82 PolarHBondContact O-N 2.96Å; C80-Q82 PolarHBondContact O-N 3.37Å; Q82-F84 PolarHBondContact O-N 3.36Å; Q82-L85 PolarHBondContact O-N 2.96Å; Q82-D86 PolarHBondContact NE2-OD1 3.49Å; Q82-D86 PolarHBondContact NE2-OD2 3.47Å; Q82-D86 VanDerWaalsContact O-CG 3.31Å; Q82-D86 PolarHBondContact O-N 3Å
83	K	96.4	Very high	94.5	Very high	133 Å²	133	73.3 Å²	73.3	58%	0.578	37%	0.368	S	S	*	.	H	α-helix	trans	-59.4	-44.2	177.2	-174.5	-177.1	177.9	-172.4	0	112.4	Q79 C80 D86 V87	Q79-K83 WeakPolarHBondContact O-CB 3.42Å; Q79-K83 PolarHBondContact O-N 3.15Å; C80-K83 CarbonylContact O-C 3.6Å; C80-K83 WeakPolarHBondContact O-CA 3.36Å; C80-K83 WeakPolarHBondContact O-CB 3.4Å; C80-K83 PolarHBondContact O-N 3.05Å; K83-D86 PolarHBondContact O-N 2.93Å; K83-V87 WeakPolarHBondContact O-CG2 3.44Å; K83-V87 PolarHBondContact O-N 3.17Å
84	F	97.7	Very high	95.2	Very high	61 Å²	61	75.4 Å²	75.4	27%	0.268	38%	0.376	S	S	.	.	H	α-helix	trans	-61.7	-44.3	176.4	168.7	-102.5	0	0	0	111.6	L48 F52 C80 I81 Q82 D86 V87 A88	L48-F84 HydrophobicContact CD1-CD2 4.04Å; L48-F84 HydrophobicContact CD1-CE2 3.75Å; F52-F84 HydrophobicContact CB-CD2 3.93Å; F52-F84 HydrophobicContact CB-CE2 3.77Å; F52-F84 AromaticContact CD2-CE2 3.91Å; F52-F84 HydrophobicContact CD2-CE2 3.91Å; F52-F84 HydrophobicContact CD2-CZ 4.17Å; F52-F84 HydrophobicContact CG-CE2 4.31Å; C80-F84 PolarHBondContact O-N 3.43Å; I81-F84 PolarHBondContact O-N 3.24Å; Q82-F84 PolarHBondContact O-N 3.36Å; F84-D86 VanDerWaalsContact C-N 3.32Å; F84-D86 PolarHBondContact O-N 3.35Å; F84-V87 PolarHBondContact O-N 2.89Å; F84-A88 WeakPolarHBondContact O-CB 3.31Å; F84-A88 PolarHBondContact O-N 3.21Å
85	L	97.8	Very high	95.8	Very high	87 Å²	87	75.2 Å²	75.2	46%	0.455	38%	0.378	S	S	.	.	H	α-helix	trans	-63.3	-37	177	-69.9	173	0	0	0	112.7	I81 Q82 R89	I81-L85 HydrophobicContact CG2-CD1 3.98Å; I81-L85 HydrophobicContact CG2-CG 4.45Å; I81-L85 VanDerWaalsContact O-CG 3.27Å; I81-L85 WeakPolarHBondContact O-CG 3.26Å; I81-L85 PolarHBondContact O-N 3.47Å; Q82-L85 PolarHBondContact O-N 2.96Å; L85-R89 WeakPolarHBondContact O-CB 3.27Å; L85-R89 PolarHBondContact O-N 3.44Å
86	D	97.9	Very high	96.2	Very high	75 Å²	75	75.6 Å²	75.6	40%	0.401	38%	0.377	S	S	.	.	H	α-helix	trans	-70.4	-44.3	178.2	-69.4	-30.6	0	0	0	111.8	Q82 K83 F84 R89 Q90	Q82-D86 PolarHBondContact NE2-OD1 3.49Å; Q82-D86 PolarHBondContact NE2-OD2 3.47Å; Q82-D86 VanDerWaalsContact O-CG 3.31Å; Q82-D86 PolarHBondContact O-N 3Å; K83-D86 PolarHBondContact O-N 2.93Å; F84-D86 VanDerWaalsContact C-N 3.32Å; F84-D86 PolarHBondContact O-N 3.35Å; D86-R89 PolarHBondContact O-N 2.85Å; D86-Q90 WeakPolarHBondContact O-CB 3.47Å; D86-Q90 PolarHBondContact O-N 3.15Å
87	V	97.6	Very high	96.6	Very high	12 Å²	12	78.9 Å²	78.9	7%	0.073	38%	0.384	C	S	.	.	H	α-helix	trans	-68.6	-36.4	176	179.3	0	0	0	0	111.6	E47 L48 K83 F84 Q90 T91	E47-V87 HydrophobicContact CB-CG1 4.02Å; L48-V87 HydrophobicContact CB-CG1 3.95Å; L48-V87 HydrophobicContact CD1-CG1 4.31Å; K83-V87 WeakPolarHBondContact O-CG2 3.44Å; K83-V87 PolarHBondContact O-N 3.17Å; F84-V87 PolarHBondContact O-N 2.89Å; V87-Q90 PolarHBondContact O-N 3.08Å; V87-T91 WeakPolarHBondContact O-CB 3.47Å; V87-T91 PolarHBondContact O-N 3.2Å; V87-T91 PolarHBondContact O-OG1 3.47Å
88	A	97.9	Very high	96.9	Very high	32 Å²	32	82.4 Å²	82.4	26%	0.264	40%	0.398	S	S	.	.	H	α-helix	trans	-61.6	-45.3	173	0	0	0	0	0	111.8	L48 F84 T91 E92	L48-A88 HydrophobicContact CD1-CB 3.81Å; F84-A88 WeakPolarHBondContact O-CB 3.31Å; F84-A88 PolarHBondContact O-N 3.21Å; A88-T91 PolarHBondContact O-N 3.49Å; A88-E92 PolarHBondContact O-N 2.06Å
89	R	98.3	Very high	97	Very high	156 Å²	156	86.2 Å²	86.2	59%	0.589	41%	0.406	S	S	*	.	H	α-helix	trans	-63.3	-43.1	174.7	-170.1	-174.2	-53.7	-162.6	4.2	111.9	L85 D86 T91 E92 C93	L85-R89 WeakPolarHBondContact O-CB 3.27Å; L85-R89 PolarHBondContact O-N 3.44Å; D86-R89 PolarHBondContact O-N 2.85Å; R89-T91 VanDerWaalsContact C-N 3.32Å; R89-T91 PolarHBondContact O-N 2.85Å; R89-E92 PolarHBondContact O-N 3.08Å; R89-C93 WeakPolarHBondContact O-CB 3.13Å; R89-C93 PolarHBondContact O-N 2.85Å; R89-C93 PolarHBondContact O-SG 2.96Å
90	Q	97.9	Very high	97.2	Very high	88 Å²	88	84.3 Å²	84.3	41%	0.411	40%	0.399	S	S	.	.	H	α-helix	trans	-61.6	-42	177	-171.4	179.3	19.7	0	0	111.6	L44 D86 V87 C93 F94	L44-Q90 HydrophobicContact CD2-CG 3.99Å; D86-Q90 WeakPolarHBondContact O-CB 3.47Å; D86-Q90 PolarHBondContact O-N 3.15Å; V87-Q90 PolarHBondContact O-N 3.08Å; Q90-C93 PolarHBondContact O-N 3.32Å; Q90-F94 WeakPolarHBondContact O-CB 3.44Å; Q90-F94 PolarHBondContact O-N 2.97Å
91	T	97.6	Very high	97.3	Very high	13 Å²	13	86.9 Å²	86.9	8%	0.08	41%	0.41	C	S	.	.	H	α-helix	trans	-63.6	-46.6	176.1	-60.9	0	0	0	0	111.5	L44 L48 V87 A88 R89 F94 F95	L44-T91 PolarHBondContact O-OG1 3.02Å; L48-T91 HydrophobicContact CD2-CG2 4.24Å; V87-T91 WeakPolarHBondContact O-CB 3.47Å; V87-T91 PolarHBondContact O-N 3.2Å; V87-T91 PolarHBondContact O-OG1 3.47Å; A88-T91 PolarHBondContact O-N 3.49Å; R89-T91 VanDerWaalsContact C-N 3.32Å; R89-T91 PolarHBondContact O-N 2.85Å; T91-F94 PolarHBondContact O-N 2.98Å; T91-F95 HydrophobicContact CG2-CD2 3.81Å; T91-F95 HydrophobicContact CG2-CE2 3.7Å; T91-F95 VanDerWaalsContact O-CD2 3.27Å; T91-F95 WeakPolarHBondContact O-CD2 3.19Å; T91-F95 PolarHBondContact O-N 2.86Å
92	E	97.4	Very high	97.3	Very high	118 Å²	118	87.4 Å²	87.4	55%	0.551	41%	0.413	S	S	*	.	H	α-helix	trans	-57.6	-53.4	173.7	-177.5	-175.5	-155.7	0	0	111	A88 R89 F94 F95 L96	A88-E92 PolarHBondContact O-N 2.06Å; R89-E92 PolarHBondContact O-N 3.08Å; E92-F94 VanDerWaalsContact C-N 3.27Å; E92-F94 PolarHBondContact O-N 3.08Å; E92-F95 PolarHBondContact O-N 2.91Å; E92-L96 HydrophobicContact CG-CD1 3.78Å; E92-L96 HydrophobicContact CG-CG 4.1Å; E92-L96 WeakPolarHBondContact O-CB 3.11Å; E92-L96 VanDerWaalsContact O-CG 3.31Å; E92-L96 WeakPolarHBondContact O-CG 3.21Å; E92-L96 PolarHBondContact O-N 3.34Å
93	C	97.8	Very high	97.3	Very high	72 Å²	72	85.1 Å²	85.1	49%	0.486	41%	0.408	S	S	.	.	H	α-helix	trans	-56.6	-40.1	178.9	-70.8	0	0	0	0	112.3	R89 Q90 Q97	R89-C93 WeakPolarHBondContact O-CB 3.13Å; R89-C93 PolarHBondContact O-N 2.85Å; R89-C93 PolarHBondContact O-SG 2.96Å; Q90-C93 PolarHBondContact O-N 3.32Å; C93-Q97 VanDerWaalsContact O-CB 3.24Å; C93-Q97 WeakPolarHBondContact O-CB 3.34Å; C93-Q97 PolarHBondContact O-N 2.96Å
94	F	97.1	Very high	97.3	Very high	91 Å²	91	84 Å²	84	40%	0.399	41%	0.412	S	S	.	.	H	α-helix	trans	-61.3	-50.6	176.1	176.8	-94	0	0	0	112	L44 Q90 T91 E92 Q97 K98	L44-F94 HydrophobicContact CD1-CB 3.64Å; L44-F94 HydrophobicContact CD1-CD1 4.23Å; L44-F94 HydrophobicContact CD1-CD2 3.87Å; L44-F94 HydrophobicContact CD1-CG 3.65Å; Q90-F94 WeakPolarHBondContact O-CB 3.44Å; Q90-F94 PolarHBondContact O-N 2.97Å; T91-F94 PolarHBondContact O-N 2.98Å; E92-F94 VanDerWaalsContact C-N 3.27Å; E92-F94 PolarHBondContact O-N 3.08Å; F94-Q97 PolarHBondContact O-N 3.29Å; F94-K98 HydrophobicContact CD1-CG 4.34Å; F94-K98 HydrophobicContact CE1-CG 4Å; F94-K98 HydrophobicContact CE2-CG 4.45Å; F94-K98 HydrophobicContact CZ-CD 4.47Å; F94-K98 HydrophobicContact CZ-CG 4.07Å; F94-K98 VanDerWaalsContact O-CG 3.32Å; F94-K98 WeakPolarHBondContact O-CG 3.13Å; F94-K98 PolarHBondContact O-N 3.12Å
95	F	97.4	Very high	97.4	Very high	115 Å²	115	87.3 Å²	87.3	50%	0.504	43%	0.428	S	S	.	.	H	α-helix	trans	-69.8	-35.8	-179.7	-75.8	-66	0	0	0	112.9	V45 T91 E92 K98 R99	V45-F95 HydrophobicContact CG2-CZ 4.49Å; T91-F95 HydrophobicContact CG2-CD2 3.81Å; T91-F95 HydrophobicContact CG2-CE2 3.7Å; T91-F95 VanDerWaalsContact O-CD2 3.27Å; T91-F95 WeakPolarHBondContact O-CD2 3.19Å; T91-F95 PolarHBondContact O-N 2.86Å; E92-F95 PolarHBondContact O-N 2.91Å; F95-K98 PolarHBondContact O-N 2.94Å; F95-R99 WeakPolarHBondContact O-CB 3.28Å; F95-R99 PolarHBondContact O-N 2.99Å
96	L	97.9	Very high	97.3	Very high	73 Å²	73	87.9 Å²	87.9	38%	0.382	43%	0.427	S	S	.	.	H	α-helix	trans	-60	-47.2	171	-71.7	179.6	0	0	0	111.4	E92 K98 R99 L100	E92-L96 HydrophobicContact CG-CD1 3.78Å; E92-L96 HydrophobicContact CG-CG 4.1Å; E92-L96 WeakPolarHBondContact O-CB 3.11Å; E92-L96 VanDerWaalsContact O-CG 3.31Å; E92-L96 WeakPolarHBondContact O-CG 3.21Å; E92-L96 PolarHBondContact O-N 3.34Å; L96-K98 VanDerWaalsContact C-N 3.33Å; L96-K98 PolarHBondContact O-N 3.06Å; L96-R99 PolarHBondContact O-N 3.18Å; L96-L100 WeakPolarHBondContact O-CB 3.43Å; L96-L100 PolarHBondContact O-N 3.14Å
97	Q	97.7	Very high	97.3	Very high	102 Å²	102	87.2 Å²	87.2	48%	0.477	43%	0.427	S	S	.	.	H	α-helix	trans	-63.1	-39.3	177.4	-174.5	61.8	36.4	0	0	111.7	C93 F94 Q101	C93-Q97 VanDerWaalsContact O-CB 3.24Å; C93-Q97 WeakPolarHBondContact O-CB 3.34Å; C93-Q97 PolarHBondContact O-N 2.96Å; F94-Q97 PolarHBondContact O-N 3.29Å; Q97-Q101 VanDerWaalsContact O-CB 3.28Å; Q97-Q101 WeakPolarHBondContact O-CB 3.45Å; Q97-Q101 PolarHBondContact O-N 3.07Å
98	K	96.4	Very high	97.3	Very high	92 Å²	92	93.7 Å²	93.7	40%	0.4	46%	0.456	S	S	.	.	H	α-helix	trans	-66.6	-41	175.3	-72.2	-69	172.5	-166.7	0	112.6	F94 F95 L96 Q101 L102	F94-K98 HydrophobicContact CD1-CG 4.34Å; F94-K98 HydrophobicContact CE1-CG 4Å; F94-K98 HydrophobicContact CE2-CG 4.45Å; F94-K98 HydrophobicContact CZ-CD 4.47Å; F94-K98 HydrophobicContact CZ-CG 4.07Å; F94-K98 VanDerWaalsContact O-CG 3.32Å; F94-K98 WeakPolarHBondContact O-CG 3.13Å; F94-K98 PolarHBondContact O-N 3.12Å; F95-K98 PolarHBondContact O-N 2.94Å; L96-K98 VanDerWaalsContact C-N 3.33Å; L96-K98 PolarHBondContact O-N 3.06Å; K98-Q101 WeakPolarHBondContact O-CB 3.45Å; K98-Q101 PolarHBondContact O-N 2.98Å; K98-L102 WeakPolarHBondContact O-CG 3.46Å; K98-L102 PolarHBondContact O-N 3.34Å
99	R	95.6	Very high	97.3	Very high	173 Å²	173	96.3 Å²	96.3	65%	0.653	46%	0.463	S	S	*	.	H	α-helix	trans	-64.7	-44.1	175.8	-174.5	171	63.9	179.6	0.8	111.8	F95 L96 Q101 L102 S103	F95-R99 WeakPolarHBondContact O-CB 3.28Å; F95-R99 PolarHBondContact O-N 2.99Å; L96-R99 PolarHBondContact O-N 3.18Å; R99-Q101 VanDerWaalsContact C-N 3.34Å; R99-L102 PolarHBondContact O-N 3.34Å; R99-S103 PolarHBondContact O-N 2.91Å
100	L	97	Very high	97.2	Very high	91 Å²	91	91 Å²	91	48%	0.476	45%	0.448	S	S	.	.	H	α-helix	trans	-63.4	-39.6	173.7	178.6	61.5	0	0	0	112	L96 L102 S103 V104	L96-L100 WeakPolarHBondContact O-CB 3.43Å; L96-L100 PolarHBondContact O-N 3.14Å; L100-L102 VanDerWaalsContact C-N 3.33Å; L100-L102 PolarHBondContact O-N 2.97Å; L100-S103 PolarHBondContact O-N 3.44Å; L100-S103 PolarHBondContact O-OG 3.08Å; L100-S103 VanDerWaalsContact O-OG 3.07Å; L100-V104 HydrophobicContact CD1-CG2 4.27Å; L100-V104 WeakPolarHBondContact O-CG2 3.32Å; L100-V104 PolarHBondContact O-N 2.91Å
101	Q	96.9	Very high	97.2	Very high	67 Å²	67	91.4 Å²	91.4	31%	0.313	45%	0.453	S	S	.	.	H	α-helix	trans	-60.2	-43.7	173.9	-179.3	173.1	23.1	0	0	111.1	Q97 K98 R99 Q105	Q97-Q101 VanDerWaalsContact O-CB 3.28Å; Q97-Q101 WeakPolarHBondContact O-CB 3.45Å; Q97-Q101 PolarHBondContact O-N 3.07Å; K98-Q101 WeakPolarHBondContact O-CB 3.45Å; K98-Q101 PolarHBondContact O-N 2.98Å; R99-Q101 VanDerWaalsContact C-N 3.34Å; Q101-Q105 HydrophobicContact CG-CG 4.21Å; Q101-Q105 WeakPolarHBondContact O-CB 3.38Å; Q101-Q105 VanDerWaalsContact O-CG 3.25Å; Q101-Q105 WeakPolarHBondContact O-CG 3.46Å; Q101-Q105 PolarHBondContact O-N 3.36Å
102	L	96.3	Very high	97.2	Very high	85 Å²	85	98.5 Å²	98.5	45%	0.445	48%	0.482	S	S	.	.	H	α-helix	trans	-67.4	-41.7	178.3	-72.9	171.4	0	0	0	113	K98 R99 L100 V104 Q105 K106	K98-L102 WeakPolarHBondContact O-CG 3.46Å; K98-L102 PolarHBondContact O-N 3.34Å; R99-L102 PolarHBondContact O-N 3.34Å; L100-L102 VanDerWaalsContact C-N 3.33Å; L100-L102 PolarHBondContact O-N 2.97Å; L102-V104 VanDerWaalsContact C-N 3.3Å; L102-V104 PolarHBondContact O-N 3.02Å; L102-Q105 PolarHBondContact O-N 3.14Å; L102-K106 HydrophobicContact CD2-CD 4.35Å; L102-K106 CarbonylContact O-C 3.49Å; L102-K106 WeakPolarHBondContact O-CA 3.27Å; L102-K106 PolarHBondContact O-N 3.4Å
103	S	96.4	Very high	97.2	Very high	52 Å²	52	97.6 Å²	97.6	36%	0.364	48%	0.478	S	S	.	.	H	α-helix	trans	-64.5	-34	179	65.6	0	0	0	0	112.9	R99 L100	R99-S103 PolarHBondContact O-N 2.91Å; L100-S103 PolarHBondContact O-N 3.44Å; L100-S103 PolarHBondContact O-OG 3.08Å; L100-S103 VanDerWaalsContact O-OG 3.07Å
104	V	97.6	Very high	97.2	Very high	110 Å²	110	98 Å²	98	67%	0.667	48%	0.475	S	S	*	.	H	α-helix	trans	-82.6	-38.1	176.9	179.2	0	0	0	0	112.5	L100 L102	L100-V104 HydrophobicContact CD1-CG2 4.27Å; L100-V104 WeakPolarHBondContact O-CG2 3.32Å; L100-V104 PolarHBondContact O-N 2.91Å; L102-V104 VanDerWaalsContact C-N 3.3Å; L102-V104 PolarHBondContact O-N 3.02Å
105	Q	97.9	Very high	97.2	Very high	129 Å²	129	96.9 Å²	96.9	60%	0.603	48%	0.476	S	S	*	.	H	α-helix	trans	-85.2	-23.7	-177	-67.2	-172.1	-14.4	0	0	114.1	Q101 L102	Q101-Q105 HydrophobicContact CG-CG 4.21Å; Q101-Q105 WeakPolarHBondContact O-CB 3.38Å; Q101-Q105 VanDerWaalsContact O-CG 3.25Å; Q101-Q105 WeakPolarHBondContact O-CG 3.46Å; Q101-Q105 PolarHBondContact O-N 3.36Å; L102-Q105 PolarHBondContact O-N 3.14Å
106	K	97.3	Very high	97.3	Very high	100 Å²	100	94.1 Å²	94.1	44%	0.435	47%	0.471	S	S	.	.			trans	-142.2	51.4	-175.9	-55.1	-168.3	-177.3	-179.3	0	113.3	L102 E108 Q109 V110	L102-K106 HydrophobicContact CD2-CD 4.35Å; L102-K106 CarbonylContact O-C 3.49Å; L102-K106 WeakPolarHBondContact O-CA 3.27Å; L102-K106 PolarHBondContact O-N 3.4Å; K106-E108 VanDerWaalsContact C-N 3.3Å; K106-E108 PolarHBondContact O-N 3.22Å; K106-Q109 HydrophobicContact CB-CB 3.98Å; K106-Q109 WeakPolarHBondContact O-CB 3.19Å; K106-Q109 PolarHBondContact O-N 2.96Å; K106-V110 PolarHBondContact O-N 3.14Å
107	P	96.7	Very high	97.3	Very high	60 Å²	60	95.7 Å²	95.7	39%	0.39	48%	0.479	S	S	.	.	H	α-helix	trans	-54.7	-43	-176.6	22	-33.4	0	0	0	112.9	Q109 V110 L111	P107-Q109 VanDerWaalsContact C-N 3.28Å; P107-Q109 PolarHBondContact O-N 3.35Å; P107-V110 PolarHBondContact O-N 3.4Å; P107-L111 WeakPolarHBondContact O-CB 3.28Å; P107-L111 WeakPolarHBondContact O-CG 3.44Å; P107-L111 PolarHBondContact O-N 3.45Å
108	E	98	Very high	97.4	Very high	149 Å²	149	96.8 Å²	96.8	70%	0.696	49%	0.488	S	S	*	.	H	α-helix	trans	-61.7	-31.4	177.3	-60.8	-58.3	146.6	0	0	113.7	K106 K112	K106-E108 VanDerWaalsContact C-N 3.3Å; K106-E108 PolarHBondContact O-N 3.22Å; E108-K112 VanDerWaalsContact O-CB 3.27Å; E108-K112 WeakPolarHBondContact O-CB 3.39Å; E108-K112 PolarHBondContact O-N 2.87Å; E108-K112 VanDerWaalsContact O-N 3.16Å
109	Q	97.3	Very high	97.5	Very high	87 Å²	87	100.9 Å²	100.9	41%	0.407	50%	0.501	S	S	.	.	H	α-helix	trans	-72.2	-47.1	176.3	-173.7	-176.7	-26.1	0	0	110.1	K106 P107 K112 E113	K106-Q109 HydrophobicContact CB-CB 3.98Å; K106-Q109 WeakPolarHBondContact O-CB 3.19Å; K106-Q109 PolarHBondContact O-N 2.96Å; P107-Q109 VanDerWaalsContact C-N 3.28Å; P107-Q109 PolarHBondContact O-N 3.35Å; Q109-K112 WeakPolarHBondContact O-CB 3.41Å; Q109-K112 PolarHBondContact O-N 3.08Å; Q109-K112 VanDerWaalsContact O-N 3.17Å; Q109-E113 WeakPolarHBondContact CG-OE1 3.47Å; Q109-E113 PolarHBondContact NE2-OE1 3.32Å; Q109-E113 WeakPolarHBondContact O-CG 3.49Å; Q109-E113 PolarHBondContact O-N 2.98Å
110	V	97.1	Very high	97.6	Very high	45 Å²	45	96.8 Å²	96.8	27%	0.273	49%	0.492	S	S	.	.	H	α-helix	trans	-60.4	-48.2	178.9	-179.7	0	0	0	0	110.4	K106 P107 K112 E113 D114	K106-V110 PolarHBondContact O-N 3.14Å; P107-V110 PolarHBondContact O-N 3.4Å; V110-K112 VanDerWaalsContact C-N 3.26Å; V110-K112 PolarHBondContact O-N 2.87Å; V110-E113 PolarHBondContact O-N 3.27Å; V110-E113 VanDerWaalsContact O-N 3.1Å; V110-D114 PolarHBondContact O-N 3.42Å
111	L	97.6	Very high	97.7	Very high	96 Å²	96	95.5 Å²	95.5	50%	0.503	48%	0.484	S	S	.	.	H	α-helix	trans	-59.6	-35.5	176.3	-71.3	173.3	0	0	0	112.8	P107 V115	P107-L111 WeakPolarHBondContact O-CB 3.28Å; P107-L111 WeakPolarHBondContact O-CG 3.44Å; P107-L111 PolarHBondContact O-N 3.45Å; L111-V115 WeakPolarHBondContact O-CB 3.5Å; L111-V115 WeakPolarHBondContact O-CG2 3.43Å; L111-V115 PolarHBondContact O-N 2.69Å
112	K	98.1	Very high	97.8	Very high	161 Å²	161	96.9 Å²	96.9	70%	0.7	49%	0.493	S	S	*	.	H	α-helix	trans	-70.2	-36.7	176.7	-176.6	-178.4	176.2	-173.6	0	112.2	E108 Q109 V110 S116	E108-K112 VanDerWaalsContact O-CB 3.27Å; E108-K112 WeakPolarHBondContact O-CB 3.39Å; E108-K112 PolarHBondContact O-N 2.87Å; E108-K112 VanDerWaalsContact O-N 3.16Å; Q109-K112 WeakPolarHBondContact O-CB 3.41Å; Q109-K112 PolarHBondContact O-N 3.08Å; Q109-K112 VanDerWaalsContact O-N 3.17Å; V110-K112 VanDerWaalsContact C-N 3.26Å; V110-K112 PolarHBondContact O-N 2.87Å; K112-S116 WeakPolarHBondContact O-CB 3.28Å; K112-S116 PolarHBondContact O-N 3.04Å; K112-S116 VanDerWaalsContact O-N 3.08Å
113	E	97.3	Very high	97.9	Very high	99 Å²	99	99 Å²	99	46%	0.463	50%	0.5	S	S	.	.	H	α-helix	trans	-66.2	-50.3	173.6	-72.3	166	-167.4	0	0	110	Q109 V110 V115 S116 D117	Q109-E113 WeakPolarHBondContact CG-OE1 3.47Å; Q109-E113 PolarHBondContact NE2-OE1 3.32Å; Q109-E113 WeakPolarHBondContact O-CG 3.49Å; Q109-E113 PolarHBondContact O-N 2.98Å; V110-E113 PolarHBondContact O-N 3.27Å; V110-E113 VanDerWaalsContact O-N 3.1Å; E113-V115 VanDerWaalsContact C-N 3.35Å; E113-V115 PolarHBondContact O-N 3.3Å; E113-S116 WeakPolarHBondContact O-CA 3.44Å; E113-S116 VanDerWaalsContact O-CB 3.28Å; E113-S116 WeakPolarHBondContact O-CB 3.22Å; E113-S116 PolarHBondContact O-N 3.26Å; E113-D117 PolarHBondContact O-N 3.19Å
114	D	97.3	Very high	98	Very high	80 Å²	80	102.8 Å²	102.8	43%	0.428	51%	0.506	S	S	.	.	H	α-helix	trans	-55.1	-45.8	175.2	-68.1	-26.7	0	0	0	112.3	V110 S116 D117 L118	V110-D114 PolarHBondContact O-N 3.42Å; D114-S116 VanDerWaalsContact C-N 3.3Å; D114-S116 PolarHBondContact O-N 3.28Å; D114-D117 PolarHBondContact O-N 3.37Å; D114-L118 WeakPolarHBondContact O-CB 3.5Å; D114-L118 VanDerWaalsContact O-CG 3.28Å; D114-L118 WeakPolarHBondContact O-CG 3.49Å; D114-L118 PolarHBondContact O-N 2.93Å
115	V	98.6	Very high	98.1	Very high	68 Å²	68	102.6 Å²	102.6	41%	0.412	50%	0.497	S	S	.	.	H	α-helix	trans	-64.9	-33.2	176.9	166.2	0	0	0	0	112	L111 E113 R119	L111-V115 WeakPolarHBondContact O-CB 3.5Å; L111-V115 WeakPolarHBondContact O-CG2 3.43Å; L111-V115 PolarHBondContact O-N 2.69Å; E113-V115 VanDerWaalsContact C-N 3.35Å; E113-V115 PolarHBondContact O-N 3.3Å; V115-R119 WeakPolarHBondContact O-CB 3.23Å; V115-R119 WeakPolarHBondContact O-CD 3.28Å; V115-R119 WeakPolarHBondContact O-CG 3.4Å; V115-R119 PolarHBondContact O-N 2.97Å; V115-R119 VanDerWaalsContact O-N 3.14Å
116	S	98.6	Very high	98.1	Very high	57 Å²	57	101 Å²	101	40%	0.399	49%	0.49	S	S	.	.	H	α-helix	trans	-67.5	-46.2	175.3	-174	0	0	0	0	111	K112 E113 D114 R119 N120	K112-S116 WeakPolarHBondContact O-CB 3.28Å; K112-S116 PolarHBondContact O-N 3.04Å; K112-S116 VanDerWaalsContact O-N 3.08Å; E113-S116 WeakPolarHBondContact O-CA 3.44Å; E113-S116 VanDerWaalsContact O-CB 3.28Å; E113-S116 WeakPolarHBondContact O-CB 3.22Å; E113-S116 PolarHBondContact O-N 3.26Å; D114-S116 VanDerWaalsContact C-N 3.3Å; D114-S116 PolarHBondContact O-N 3.28Å; S116-R119 WeakPolarHBondContact O-CB 3.37Å; S116-R119 PolarHBondContact O-N 2.91Å; S116-N120 VanDerWaalsContact O-CG 3.32Å; S116-N120 PolarHBondContact O-N 3.06Å; S116-N120 PolarHBondContact O-ND2 3.11Å
117	D	98.6	Very high	98.2	Very high	106 Å²	106	101.8 Å²	101.8	57%	0.567	50%	0.498	S	S	*	.	H	α-helix	trans	-65.9	-41.3	179.6	-74.7	-9	0	0	0	112.1	E113 D114 R119 N120 E121	E113-D117 PolarHBondContact O-N 3.19Å; D114-D117 PolarHBondContact O-N 3.37Å; D117-R119 VanDerWaalsContact C-N 3.31Å; D117-R119 PolarHBondContact O-N 3Å; D117-N120 PolarHBondContact O-N 3.29Å; D117-E121 WeakPolarHBondContact O-CB 3.44Å; D117-E121 PolarHBondContact O-N 3.15Å
118	L	98.8	Very high	98.3	Very high	126 Å²	126	102.4 Å²	102.4	66%	0.66	50%	0.497	S	S	*	.	H	α-helix	trans	-61.4	-37	173.5	-71.8	171.9	0	0	0	112.6	D114 L122	D114-L118 WeakPolarHBondContact O-CB 3.5Å; D114-L118 VanDerWaalsContact O-CG 3.28Å; D114-L118 WeakPolarHBondContact O-CG 3.49Å; D114-L118 PolarHBondContact O-N 2.93Å; L118-L122 VanDerWaalsContact O-CB 3.28Å; L118-L122 WeakPolarHBondContact O-CB 3.41Å; L118-L122 PolarHBondContact O-N 2.71Å
119	R	98.8	Very high	98.4	Very high	177 Å²	177	99.3 Å²	99.3	67%	0.668	49%	0.488	S	S	*	.	H	α-helix	trans	-68.3	-43.5	175	-76.8	169.7	175.8	-169.2	-0.8	112.1	V115 S116 D117 L122 Q123	V115-R119 WeakPolarHBondContact O-CB 3.23Å; V115-R119 WeakPolarHBondContact O-CD 3.28Å; V115-R119 WeakPolarHBondContact O-CG 3.4Å; V115-R119 PolarHBondContact O-N 2.97Å; V115-R119 VanDerWaalsContact O-N 3.14Å; S116-R119 WeakPolarHBondContact O-CB 3.37Å; S116-R119 PolarHBondContact O-N 2.91Å; D117-R119 VanDerWaalsContact C-N 3.31Å; D117-R119 PolarHBondContact O-N 3Å; R119-L122 PolarHBondContact O-N 3.4Å; R119-Q123 WeakPolarHBondContact O-CB 3.5Å; R119-Q123 PolarHBondContact O-N 3.47Å
120	N	98.7	Very high	98.4	Very high	87 Å²	87	101 Å²	101	47%	0.465	50%	0.496	S	S	.	.	H	α-helix	trans	-61.8	-44.8	176.6	-70.6	-30.5	0	0	0	111.3	S116 D117 Q123 R124	S116-N120 VanDerWaalsContact O-CG 3.32Å; S116-N120 PolarHBondContact O-N 3.06Å; S116-N120 PolarHBondContact O-ND2 3.11Å; D117-N120 PolarHBondContact O-N 3.29Å; N120-Q123 PolarHBondContact O-N 3.27Å; N120-R124 WeakPolarHBondContact O-CB 3.49Å; N120-R124 PolarHBondContact O-N 3.01Å
121	E	98.7	Very high	98.5	Very high	65 Å²	65	105 Å²	105	30%	0.304	51%	0.51	S	S	.	.	H	α-helix	trans	-67.9	-38.1	177.5	176.5	57.3	-166.7	0	0	112.1	D117 R124 K125	D117-E121 WeakPolarHBondContact O-CB 3.44Å; D117-E121 PolarHBondContact O-N 3.15Å; E121-R124 VanDerWaalsContact CD-NH2 3.3Å; E121-R124 PolarHBondContact O-N 3.04Å; E121-R124 IonicContact OE1-CZ 3.66Å; E121-R124 IonicContact OE1-NE 3.82Å; E121-R124 IonicContact OE1-NH2 2.71Å; E121-R124 PolarHBondContact OE1-NH2 2.63Å; E121-R124 IonicContact OE2-CZ 3.3Å; E121-R124 VanDerWaalsContact OE2-CZ 3.3Å; E121-R124 IonicContact OE2-NE 2.71Å; E121-R124 PolarHBondContact OE2-NE 2.71Å; E121-R124 IonicContact OE2-NH2 3.06Å; E121-R124 PolarHBondContact OE2-NH2 3.06Å; E121-K125 WeakPolarHBondContact O-CG 3.34Å; E121-K125 PolarHBondContact O-N 3.05Å; E121-K125 WeakPolarHBondContact OE1-CE 3.41Å; E121-K125 IonicContact OE1-NZ 2.63Å; E121-K125 PolarHBondContact OE1-NZ 3.38Å
122	L	98.8	Very high	98.6	Very high	95 Å²	95	105.1 Å²	105.1	50%	0.497	51%	0.508	S	S	.	.	H	α-helix	trans	-58.9	-53.1	172.5	176.6	62	0	0	0	111.2	L118 R119 R124 K125 E126	L118-L122 VanDerWaalsContact O-CB 3.28Å; L118-L122 WeakPolarHBondContact O-CB 3.41Å; L118-L122 PolarHBondContact O-N 2.71Å; R119-L122 PolarHBondContact O-N 3.4Å; L122-R124 VanDerWaalsContact C-N 3.26Å; L122-R124 PolarHBondContact O-N 3.41Å; L122-K125 WeakPolarHBondContact O-CB 3.47Å; L122-K125 PolarHBondContact O-N 3.4Å; L122-E126 HydrophobicContact CD1-CG 4.25Å; L122-E126 HydrophobicContact CG-CG 4.46Å; L122-E126 WeakPolarHBondContact O-CG 3.41Å; L122-E126 PolarHBondContact O-N 2.9Å
123	Q	98.8	Very high	98.6	Very high	129 Å²	129	101.5 Å²	101.5	60%	0.603	50%	0.495	S	S	*	.	H	α-helix	trans	-57.1	-40.7	178.3	-175.4	-175.5	0.4	0	0	111.8	R119 N120 E126 L127	R119-Q123 WeakPolarHBondContact O-CB 3.5Å; R119-Q123 PolarHBondContact O-N 3.47Å; N120-Q123 PolarHBondContact O-N 3.27Å; Q123-E126 PolarHBondContact O-N 3.21Å; Q123-L127 PolarHBondContact O-N 2.86Å
124	R	98.8	Very high	98.7	Very high	132 Å²	132	99.8 Å²	99.8	50%	0.498	50%	0.498	S	S	.	.	H	α-helix	trans	-64.4	-40.3	176.4	-166.6	-166.8	67.8	78.7	0.3	112.1	N120 E121 L122 L128	N120-R124 WeakPolarHBondContact O-CB 3.49Å; N120-R124 PolarHBondContact O-N 3.01Å; E121-R124 VanDerWaalsContact CD-NH2 3.3Å; E121-R124 PolarHBondContact O-N 3.04Å; E121-R124 IonicContact OE1-CZ 3.66Å; E121-R124 IonicContact OE1-NE 3.82Å; E121-R124 IonicContact OE1-NH2 2.71Å; E121-R124 PolarHBondContact OE1-NH2 2.63Å; E121-R124 IonicContact OE2-CZ 3.3Å; E121-R124 VanDerWaalsContact OE2-CZ 3.3Å; E121-R124 IonicContact OE2-NE 2.71Å; E121-R124 PolarHBondContact OE2-NE 2.71Å; E121-R124 IonicContact OE2-NH2 3.06Å; E121-R124 PolarHBondContact OE2-NH2 3.06Å; L122-R124 VanDerWaalsContact C-N 3.26Å; L122-R124 PolarHBondContact O-N 3.41Å; R124-L128 PolarHBondContact O-N 3.38Å
125	K	98.8	Very high	98.7	Very high	106 Å²	106	101.6 Å²	101.6	46%	0.461	50%	0.502	S	S	.	.	H	α-helix	trans	-66.8	-43.2	174.4	-71.1	-175.9	-162.9	-52.6	0	111.7	E121 L122 L127 L128 V129	E121-K125 WeakPolarHBondContact O-CG 3.34Å; E121-K125 PolarHBondContact O-N 3.05Å; E121-K125 WeakPolarHBondContact OE1-CE 3.41Å; E121-K125 IonicContact OE1-NZ 2.63Å; E121-K125 PolarHBondContact OE1-NZ 3.38Å; L122-K125 WeakPolarHBondContact O-CB 3.47Å; L122-K125 PolarHBondContact O-N 3.4Å; K125-L127 PolarHBondContact O-N 3.29Å; K125-L128 WeakPolarHBondContact O-CB 3.2Å; K125-L128 PolarHBondContact O-N 2.95Å; K125-V129 WeakPolarHBondContact O-CG2 3.35Å; K125-V129 PolarHBondContact O-N 3.34Å
126	E	98.8	Very high	98.7	Very high	97 Å²	97	103.1 Å²	103.1	45%	0.453	51%	0.508	S	S	.	.	H	α-helix	trans	-58.5	-47.6	177.3	-72.6	173.4	169.2	0	0	111.6	L122 Q123 L128 V129 Q130	L122-E126 HydrophobicContact CD1-CG 4.25Å; L122-E126 HydrophobicContact CG-CG 4.46Å; L122-E126 WeakPolarHBondContact O-CG 3.41Å; L122-E126 PolarHBondContact O-N 2.9Å; Q123-E126 PolarHBondContact O-N 3.21Å; E126-L128 VanDerWaalsContact C-N 3.3Å; E126-L128 PolarHBondContact O-N 3.18Å; E126-V129 PolarHBondContact O-N 3.04Å; E126-Q130 WeakPolarHBondContact O-CG 3.45Å; E126-Q130 PolarHBondContact O-N 3.17Å
127	L	98.7	Very high	98.7	Very high	116 Å²	116	106 Å²	106	61%	0.607	52%	0.515	S	S	*	.	H	α-helix	trans	-60.4	-38.9	175.8	-178.8	63	0	0	0	112.3	Q123 K125 K131	Q123-L127 PolarHBondContact O-N 2.86Å; K125-L127 PolarHBondContact O-N 3.29Å; L127-K131 WeakPolarHBondContact O-CB 3.46Å; L127-K131 PolarHBondContact O-N 3.49Å
128	L	98.8	Very high	98.7	Very high	73 Å²	73	106.1 Å²	106.1	38%	0.382	51%	0.512	S	S	.	.	H	α-helix	trans	-66.4	-41.8	176.4	-176.3	61.2	0	0	0	111.7	R124 K125 E126 K131 H132	R124-L128 PolarHBondContact O-N 3.38Å; K125-L128 WeakPolarHBondContact O-CB 3.2Å; K125-L128 PolarHBondContact O-N 2.95Å; E126-L128 VanDerWaalsContact C-N 3.3Å; E126-L128 PolarHBondContact O-N 3.18Å; L128-K131 PolarHBondContact O-N 3Å; L128-H132 WeakPolarHBondContact CD1-NE2 3.42Å; L128-H132 PolarHBondContact O-CD2 2.86Å; L128-H132 PolarHBondContact O-N 2.89Å
129	V	98.8	Very high	98.7	Very high	83 Å²	83	107.6 Å²	107.6	50%	0.503	51%	0.508	S	S	.	.	H	α-helix	trans	-62.9	-47.7	174.8	170.2	0	0	0	0	110.8	K125 E126 K131 H132 L133	K125-V129 WeakPolarHBondContact O-CG2 3.35Å; K125-V129 PolarHBondContact O-N 3.34Å; E126-V129 PolarHBondContact O-N 3.04Å; V129-K131 VanDerWaalsContact C-N 3.31Å; V129-K131 PolarHBondContact O-N 3.36Å; V129-H132 PolarHBondContact O-N 3.05Å; V129-L133 HydrophobicContact CG1-CD1 3.92Å; V129-L133 HydrophobicContact CG1-CG 4.29Å; V129-L133 WeakPolarHBondContact O-CG 3.44Å; V129-L133 PolarHBondContact O-N 3.03Å
130	Q	98.8	Very high	98.6	Very high	122 Å²	122	103.6 Å²	103.6	57%	0.57	50%	0.497	S	S	*	.	H	α-helix	trans	-56.9	-44	176	-71.3	173.4	9.6	0	0	111.8	E126 H132 L133 A134	E126-Q130 WeakPolarHBondContact O-CG 3.45Å; E126-Q130 PolarHBondContact O-N 3.17Å; Q130-H132 VanDerWaalsContact C-N 3.3Å; Q130-H132 PolarHBondContact O-N 3.07Å; Q130-L133 PolarHBondContact O-N 3.3Å; Q130-A134 WeakPolarHBondContact O-CB 3.36Å; Q130-A134 PolarHBondContact O-N 3.39Å
131	K	98.8	Very high	98.5	Very high	130 Å²	130	104.1 Å²	104.1	57%	0.565	50%	0.497	S	S	*	.	H	α-helix	trans	-60.7	-36	174.9	-179.8	179.5	179.8	177.7	0	112.9	L127 L128 V129 K135	L127-K131 WeakPolarHBondContact O-CB 3.46Å; L127-K131 PolarHBondContact O-N 3.49Å; L128-K131 PolarHBondContact O-N 3Å; V129-K131 VanDerWaalsContact C-N 3.31Å; V129-K131 PolarHBondContact O-N 3.36Å; K131-K135 PolarHBondContact O-N 2.93Å
132	H	98.8	Very high	98.4	Very high	98 Å²	98	103.5 Å²	103.5	45%	0.454	50%	0.497	S	S	.	.	H	α-helix	trans	-75.7	-40.9	176.2	-72.1	-53.3	0	0	0	112.6	L128 V129 Q130 A134 K135 L136	L128-H132 WeakPolarHBondContact CD1-NE2 3.42Å; L128-H132 PolarHBondContact O-CD2 2.86Å; L128-H132 PolarHBondContact O-N 2.89Å; V129-H132 PolarHBondContact O-N 3.05Å; Q130-H132 VanDerWaalsContact C-N 3.3Å; Q130-H132 PolarHBondContact O-N 3.07Å; H132-A134 PolarHBondContact O-N 3.38Å; H132-K135 WeakPolarHBondContact O-CB 3.49Å; H132-K135 PolarHBondContact O-N 2.94Å; H132-L136 WeakPolarHBondContact O-CG 3.48Å; H132-L136 PolarHBondContact O-N 3.48Å
133	L	98.8	Very high	98.3	Very high	85 Å²	85	104.8 Å²	104.8	45%	0.445	50%	0.504	S	S	.	.	H	α-helix	trans	-59.8	-44.2	173.8	-70.5	172	0	0	0	111.7	V129 Q130 K135 L136 H137	V129-L133 HydrophobicContact CG1-CD1 3.92Å; V129-L133 HydrophobicContact CG1-CG 4.29Å; V129-L133 WeakPolarHBondContact O-CG 3.44Å; V129-L133 PolarHBondContact O-N 3.03Å; Q130-L133 PolarHBondContact O-N 3.3Å; L133-K135 VanDerWaalsContact C-N 3.29Å; L133-K135 PolarHBondContact O-N 2.93Å; L133-L136 PolarHBondContact O-N 3.35Å; L133-L136 VanDerWaalsContact O-N 3.11Å; L133-H137 PolarHBondContact O-CD2 2.86Å; L133-H137 VanDerWaalsContact O-CD2 3.3Å; L133-H137 PolarHBondContact O-N 3.37Å
134	A	98.6	Very high	98.1	Very high	63 Å²	63	104.3 Å²	104.3	52%	0.521	50%	0.502	S	S	.	.	H	α-helix	trans	-58.7	-39.7	175.2	0	0	0	0	0	112.6	Q130 H132 H138	Q130-A134 WeakPolarHBondContact O-CB 3.36Å; Q130-A134 PolarHBondContact O-N 3.39Å; H132-A134 PolarHBondContact O-N 3.38Å; A134-H138 WeakPolarHBondContact O-CB 3.45Å; A134-H138 PolarHBondContact O-N 3.11Å
135	K	98.6	Very high	97.8	Very high	119 Å²	119	101.9 Å²	101.9	52%	0.517	50%	0.499	S	S	.	.	H	α-helix	trans	-67.1	-40.6	173.5	-75.3	-173.4	173.2	-162.4	0	112.6	K131 H132 L133 H138 W139	K131-K135 PolarHBondContact O-N 2.93Å; H132-K135 WeakPolarHBondContact O-CB 3.49Å; H132-K135 PolarHBondContact O-N 2.94Å; L133-K135 VanDerWaalsContact C-N 3.29Å; L133-K135 PolarHBondContact O-N 2.93Å; K135-H138 PolarHBondContact O-N 3.18Å; K135-W139 PolarHBondContact O-N 3.24Å
136	L	98.6	Very high	97.4	Very high	100 Å²	100	101 Å²	101	52%	0.524	50%	0.502	S	S	.	.	H	α-helix	trans	-62.9	-46	177.8	-72.5	170.6	0	0	0	111.2	H132 L133 H138 W139 Q140	H132-L136 WeakPolarHBondContact O-CG 3.48Å; H132-L136 PolarHBondContact O-N 3.48Å; L133-L136 PolarHBondContact O-N 3.35Å; L133-L136 VanDerWaalsContact O-N 3.11Å; L136-H138 PolarHBondContact O-N 3.06Å; L136-W139 PolarHBondContact O-N 2.99Å; L136-Q140 WeakPolarHBondContact O-CB 3.29Å; L136-Q140 VanDerWaalsContact O-CG 3.29Å; L136-Q140 WeakPolarHBondContact O-CG 3.49Å; L136-Q140 PolarHBondContact O-N 3.46Å
137	H	98.6	Very high	96.6	Very high	117 Å²	117	99.7 Å²	99.7	54%	0.542	50%	0.504	S	S	.	.	H	α-helix	trans	-61.3	-40.9	174.6	-72.3	-50.2	0	0	0	112.8	L133 W139 Q140 Q141	L133-H137 PolarHBondContact O-CD2 2.86Å; L133-H137 VanDerWaalsContact O-CD2 3.3Å; L133-H137 PolarHBondContact O-N 3.37Å; H137-W139 PolarHBondContact O-N 2.99Å; H137-Q140 PolarHBondContact ND1-OE1 3.49Å; H137-Q140 PolarHBondContact O-N 3.36Å; H137-Q141 PolarHBondContact O-N 3.35Å
138	H	98.2	Very high	95.2	Very high	109 Å²	109	96.4 Å²	96.4	51%	0.505	50%	0.498	S	S	.	.	H	α-helix	trans	-60.2	-45.1	174.1	177	58.9	0	0	0	112.3	A134 K135 L136 Q141 V142	A134-H138 WeakPolarHBondContact O-CB 3.45Å; A134-H138 PolarHBondContact O-N 3.11Å; K135-H138 PolarHBondContact O-N 3.18Å; L136-H138 PolarHBondContact O-N 3.06Å; H138-Q141 PolarHBondContact O-N 3.18Å; H138-V142 WeakPolarHBondContact O-CG2 3.43Å; H138-V142 PolarHBondContact O-N 3.17Å
139	W	98.3	Very high	93.4	Very high	156 Å²	156	100.7 Å²	100.7	59%	0.591	52%	0.516	S	S	*	.	H	α-helix	trans	-69.3	-34.3	177.5	-71.1	122.9	0	0	0	113.4	K135 L136 H137 V142 L143	K135-W139 PolarHBondContact O-N 3.24Å; L136-W139 PolarHBondContact O-N 2.99Å; H137-W139 PolarHBondContact O-N 2.99Å; W139-V142 HydrophobicContact CE3-CB 4.37Å; W139-V142 HydrophobicContact CE3-CG1 4.38Å; W139-V142 HydrophobicContact CZ3-CG1 4.48Å; W139-V142 PolarHBondContact O-N 3.01Å; W139-L143 VanDerWaalsContact O-CG 3.29Å; W139-L143 WeakPolarHBondContact O-CG 3.48Å; W139-L143 PolarHBondContact O-N 3.42Å
140	Q	97.2	Very high	91.3	Very high	94 Å²	94	104.8 Å²	104.8	44%	0.439	53%	0.529	S	S	.	.	H	α-helix	trans	-59.1	-50.1	171.5	-75.1	167.4	-20.7	0	0	110.6	L136 H137 V142 L143 E144	L136-Q140 WeakPolarHBondContact O-CB 3.29Å; L136-Q140 VanDerWaalsContact O-CG 3.29Å; L136-Q140 WeakPolarHBondContact O-CG 3.49Å; L136-Q140 PolarHBondContact O-N 3.46Å; H137-Q140 PolarHBondContact ND1-OE1 3.49Å; H137-Q140 PolarHBondContact O-N 3.36Å; Q140-V142 PolarHBondContact O-N 3.41Å; Q140-L143 PolarHBondContact O-N 3.05Å; Q140-E144 WeakPolarHBondContact O-CG 3.35Å; Q140-E144 PolarHBondContact O-N 3.4Å
141	Q	97	Very high	89.1	Confident	98 Å²	98	109.5 Å²	109.5	46%	0.458	54%	0.542	S	S	.	.	H	α-helix	trans	-57	-47.6	176.1	-173.3	66.4	57.3	0	0	112	H137 H138 L143 E144 D145	H137-Q141 PolarHBondContact O-N 3.35Å; H138-Q141 PolarHBondContact O-N 3.18Å; Q141-L143 VanDerWaalsContact C-N 3.29Å; Q141-L143 PolarHBondContact O-N 2.88Å; Q141-E144 PolarHBondContact O-N 2.84Å; Q141-D145 PolarHBondContact NE2-OD1 3.34Å; Q141-D145 WeakPolarHBondContact O-CB 3.29Å; Q141-D145 PolarHBondContact O-N 2.91Å
142	V	96.8	Very high	86.5	Confident	51 Å²	51	111.8 Å²	111.8	31%	0.309	55%	0.552	S	S	.	*	H	α-helix	trans	-60.4	-38.3	178.9	170.2	0	0	0	0	111.9	H138 W139 Q140 V146	H138-V142 WeakPolarHBondContact O-CG2 3.43Å; H138-V142 PolarHBondContact O-N 3.17Å; W139-V142 HydrophobicContact CE3-CB 4.37Å; W139-V142 HydrophobicContact CE3-CG1 4.38Å; W139-V142 HydrophobicContact CZ3-CG1 4.48Å; W139-V142 PolarHBondContact O-N 3.01Å; Q140-V142 PolarHBondContact O-N 3.41Å; V142-V146 VanDerWaalsContact O-CG2 3.25Å; V142-V146 WeakPolarHBondContact O-CG2 3.39Å; V142-V146 PolarHBondContact O-N 3.14Å
143	L	95.6	Very high	84	Confident	122 Å²	122	113.6 Å²	113.6	64%	0.639	57%	0.572	S	S	*	*	H	α-helix	trans	-70.2	-40.2	175.9	-71.2	169.9	0	0	0	112.1	W139 Q140 Q141 S147	W139-L143 VanDerWaalsContact O-CG 3.29Å; W139-L143 WeakPolarHBondContact O-CG 3.48Å; W139-L143 PolarHBondContact O-N 3.42Å; Q140-L143 PolarHBondContact O-N 3.05Å; Q141-L143 VanDerWaalsContact C-N 3.29Å; Q141-L143 PolarHBondContact O-N 2.88Å; L143-S147 WeakPolarHBondContact O-CB 3.25Å; L143-S147 PolarHBondContact O-N 2.94Å; L143-S147 PolarHBondContact O-OG 3.22Å
144	E	94.2	Very high	81.7	Confident	120 Å²	120	115.2 Å²	115.2	56%	0.561	59%	0.586	S	S	*	*	H	α-helix	trans	-61.6	-49.4	175.6	-75.1	175.1	-157.5	0	0	111	Q140 Q141 V146 S147 G148	Q140-E144 WeakPolarHBondContact O-CG 3.35Å; Q140-E144 PolarHBondContact O-N 3.4Å; Q141-E144 PolarHBondContact O-N 2.84Å; E144-V146 PolarHBondContact O-N 2.81Å; E144-S147 PolarHBondContact O-N 2.87Å; E144-S147 VanDerWaalsContact O-N 3.14Å; E144-S147 PolarHBondContact O-OG 3.39Å; E144-G148 PolarHBondContact O-N 3.17Å
145	D	92.3	Very high	79.3	Confident	81 Å²	81	119.6 Å²	119.6	43%	0.433	60%	0.601	S	S	.	*	H	α-helix	trans	-57.2	-45.6	178.3	-66.3	-19.8	0	0	0	111.7	Q141 Q149	Q141-D145 PolarHBondContact NE2-OD1 3.34Å; Q141-D145 WeakPolarHBondContact O-CB 3.29Å; Q141-D145 PolarHBondContact O-N 2.91Å; D145-Q149 WeakPolarHBondContact O-CG 3.33Å; D145-Q149 PolarHBondContact O-N 3.42Å
146	V	91.8	Very high	77.4	Confident	86 Å²	86	121.7 Å²	121.7	52%	0.521	62%	0.616	S	S	.	*	H	α-helix	trans	-65.7	-41	176.7	170.3	0	0	0	0	111.6	V142 E144	V142-V146 VanDerWaalsContact O-CG2 3.25Å; V142-V146 WeakPolarHBondContact O-CG2 3.39Å; V142-V146 PolarHBondContact O-N 3.14Å; E144-V146 PolarHBondContact O-N 2.81Å
147	S	81.4	Confident	75.5	Confident	71 Å²	71	122 Å²	122	50%	0.497	63%	0.625	S	S	.	*	H	α-helix	trans	-69	-35.9	179.6	78.7	0	0	0	0	112.9	L143 E144 H150	L143-S147 WeakPolarHBondContact O-CB 3.25Å; L143-S147 PolarHBondContact O-N 2.94Å; L143-S147 PolarHBondContact O-OG 3.22Å; E144-S147 PolarHBondContact O-N 2.87Å; E144-S147 VanDerWaalsContact O-N 3.14Å; E144-S147 PolarHBondContact O-OG 3.39Å; S147-H150 PolarHBondContact O-N 3.49Å
148	G	69.7	Low	73.9	Confident	47 Å²	47	122 Å²	122	49%	0.485	64%	0.635	S	S	.	*	H	α-helix	trans	-66.8	-39.7	177.2	0	0	0	0	0	112.3	E144 H150 R151	E144-G148 PolarHBondContact O-N 3.17Å; G148-H150 VanDerWaalsContact C-N 3.25Å; G148-H150 PolarHBondContact O-N 3.18Å; G148-R151 PolarHBondContact O-N 3.38Å
149	Q	60.3	Low	72.2	Confident	163 Å²	163	121.2 Å²	121.2	76%	0.762	64%	0.64	S	S	*	*	H	α-helix	trans	-65	-26.2	177.2	-72.6	-179.2	12.7	0	0	113.6	D145 R151	D145-Q149 WeakPolarHBondContact O-CG 3.33Å; D145-Q149 PolarHBondContact O-N 3.42Å; Q149-R151 VanDerWaalsContact C-N 3.32Å; Q149-R151 PolarHBondContact O-N 3.31Å
150	H	54.7	Low	70.7	Confident	168 Å²	168	115.7 Å²	115.7	78%	0.778	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-6	176.5	-106.7	78.5	0	0	0	114.5	S147 G148 K152	S147-H150 PolarHBondContact O-N 3.49Å; G148-H150 VanDerWaalsContact C-N 3.25Å; G148-H150 PolarHBondContact O-N 3.18Å; H150-K152 PolarHBondContact O-N 3.4Å
151	R	52.2	Low	69	Low	222 Å²	222	116.9 Å²	116.9	84%	0.838	65%	0.647	S	S	*	*			trans	-92	64.7	176.2	-71.1	-165.5	175.9	-170.1	1.4	113.1	G148 Q149	G148-R151 PolarHBondContact O-N 3.38Å; Q149-R151 VanDerWaalsContact C-N 3.32Å; Q149-R151 PolarHBondContact O-N 3.31Å
152	K	45.6	Very low	67.3	Low	178 Å²	178	118.9 Å²	118.9	77%	0.774	66%	0.66	S	S	*	*			trans	-81.5	133.4	154	-92.4	-178.9	175.1	175.9	0	109.3	H150 T154	H150-K152 PolarHBondContact O-N 3.4Å; K152-T154 PolarHBondContact O-N 3Å
153	P	45.8	Very low	65.8	Low	135 Å²	135	118.4 Å²	118.4	88%	0.877	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	20.9	-171.6	-22.8	35.2	0	0	0	118.3
154	T	49.3	Very low	64.2	Low	119 Å²	119	119.8 Å²	119.8	73%	0.73	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.2	-5.2	-160.3	-26.5	0	0	0	0	116.5	K152	K152-T154 PolarHBondContact O-N 3Å
155	D	50.3	Low	62.7	Low	156 Å²	156	119.7 Å²	119.7	83%	0.834	67%	0.665	S	S	*	*			trans	-121.2	92.2	173.7	-85.6	-70.2	0	0	0	111.1
156	L	57.4	Low	61.5	Low	162 Å²	162	122.8 Å²	122.8	85%	0.848	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-65.3	125.7	156.8	-78	160.3	0	0	0	107.3
157	P	58.9	Low	60.3	Low	108 Å²	108	125 Å²	125	70%	0.701	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-61.2	141.5	174.3	26.7	-33.4	0	0	0	109.1
158	P	64.6	Low	59.3	Low	115 Å²	115	123.7 Å²	123.7	75%	0.747	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-56.1	141	175.2	24	-33.3	0	0	0	109.4	G160	P158-G160 PolarHBondContact O-N 2.97Å; P158-G160 VanDerWaalsContact O-N 3.08Å
159	P	63.3	Low	59	Low	94 Å²	94	124.9 Å²	124.9	61%	0.61	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-52.6	119.8	-173.9	17.2	-30.1	0	0	0	110.7	A163	P159-A163 HydrophobicContact CB-CB 3.72Å
160	G	65.3	Low	59.2	Low	39 Å²	39	121.3 Å²	121.3	40%	0.402	67%	0.674	S	S	.	*	P	Polyproline II helix	trans	-62	164.9	-177.5	0	0	0	0	0	112.2	P158 L162 A163	P158-G160 PolarHBondContact O-N 2.97Å; P158-G160 VanDerWaalsContact O-N 3.08Å; G160-L162 PolarHBondContact O-N 3.38Å; G160-A163 WeakPolarHBondContact O-CB 3.33Å; G160-A163 PolarHBondContact O-N 3.46Å
161	P	62.4	Low	59.6	Low	120 Å²	120	117.6 Å²	117.6	78%	0.779	67%	0.667	S	S	*	*	H	α-helix	trans	-53	-27.8	-170.8	-29.5	35.9	0	0	0	115.7	L165	P161-L165 PolarHBondContact O-N 3.01Å
162	L	61.7	Low	59.9	Low	140 Å²	140	113.1 Å²	113.1	73%	0.733	66%	0.659	S	S	*	*	H	α-helix	trans	-69.7	-37.4	175.2	-64.9	178.4	0	0	0	113.5	G160 F164 L165 E166	G160-L162 PolarHBondContact O-N 3.38Å; L162-F164 VanDerWaalsContact C-N 3.31Å; L162-F164 PolarHBondContact O-N 3.4Å; L162-L165 WeakPolarHBondContact O-CB 3.49Å; L162-L165 PolarHBondContact O-N 3.12Å; L162-L165 VanDerWaalsContact O-N 3.12Å; L162-E166 PolarHBondContact O-N 2.85Å
163	A	65.2	Low	60.7	Low	40 Å²	40	109.8 Å²	109.8	33%	0.331	66%	0.655	S	S	.	*	H	α-helix	trans	-68.3	-32.5	177.4	0	0	0	0	0	111.8	P159 G160 E166 Q167	P159-A163 HydrophobicContact CB-CB 3.72Å; G160-A163 WeakPolarHBondContact O-CB 3.33Å; G160-A163 PolarHBondContact O-N 3.46Å; A163-E166 PolarHBondContact O-N 2.91Å; A163-Q167 PolarHBondContact O-N 2.95Å
164	F	61.9	Low	61.6	Low	151 Å²	151	109.3 Å²	109.3	66%	0.662	65%	0.653	S	S	*	*	H	α-helix	trans	-64.8	-40.4	169.3	-174.7	-95.8	0	0	0	111.8	L162 E166 Q167 A168	L162-F164 VanDerWaalsContact C-N 3.31Å; L162-F164 PolarHBondContact O-N 3.4Å; F164-E166 VanDerWaalsContact C-N 3.31Å; F164-E166 PolarHBondContact O-N 3.08Å; F164-Q167 PolarHBondContact O-N 2.88Å; F164-A168 WeakPolarHBondContact O-CB 3.33Å; F164-A168 PolarHBondContact O-N 3.26Å
165	L	61.9	Low	62.3	Low	118 Å²	118	107.7 Å²	107.7	62%	0.618	65%	0.651	S	S	*	*	H	α-helix	trans	-63.8	-36.4	176	-145.7	84.8	0	0	0	112.3	P161 L162 A168 S169	P161-L165 PolarHBondContact O-N 3.01Å; L162-L165 WeakPolarHBondContact O-CB 3.49Å; L162-L165 PolarHBondContact O-N 3.12Å; L162-L165 VanDerWaalsContact O-N 3.12Å; L165-A168 PolarHBondContact O-N 3.22Å; L165-S169 PolarHBondContact O-N 3.46Å
166	E	67.2	Low	62.6	Low	146 Å²	146	106.3 Å²	106.3	68%	0.682	65%	0.651	S	S	*	*	H	α-helix	trans	-73.3	-37.6	178.3	-158.4	172	114.6	0	0	112.3	L162 A163 F164 A168 S169 A170	L162-E166 PolarHBondContact O-N 2.85Å; A163-E166 PolarHBondContact O-N 2.91Å; F164-E166 VanDerWaalsContact C-N 3.31Å; F164-E166 PolarHBondContact O-N 3.08Å; E166-A168 VanDerWaalsContact C-N 3.34Å; E166-S169 PolarHBondContact O-N 3.15Å; E166-S169 PolarHBondContact O-OG 3.36Å; E166-A170 WeakPolarHBondContact O-CB 3.34Å; E166-A170 PolarHBondContact O-N 3.37Å
167	Q	67.3	Low	63	Low	133 Å²	133	106.5 Å²	106.5	62%	0.621	65%	0.652	S	S	*	*	H	α-helix	trans	-67.4	-33.7	168.5	-78.3	-174	-97.7	0	0	112.7	A163 F164 S171	A163-Q167 PolarHBondContact O-N 2.95Å; F164-Q167 PolarHBondContact O-N 2.88Å; Q167-S171 PolarHBondContact O-N 3.27Å; Q167-S171 PolarHBondContact O-OG 3.03Å
168	A	60.8	Low	62.9	Low	44 Å²	44	111 Å²	111	36%	0.364	66%	0.66	S	S	.	*	H	α-helix	trans	-68.8	-36.8	175.8	0	0	0	0	0	112.2	F164 L165 E166 S171	F164-A168 WeakPolarHBondContact O-CB 3.33Å; F164-A168 PolarHBondContact O-N 3.26Å; L165-A168 PolarHBondContact O-N 3.22Å; E166-A168 VanDerWaalsContact C-N 3.34Å; A168-S171 PolarHBondContact O-OG 3.17Å
169	S	62.4	Low	62.7	Low	71 Å²	71	111.3 Å²	111.3	50%	0.497	66%	0.662	S	S	.	*	H	α-helix	trans	-73.1	-36.9	174.8	66.7	0	0	0	0	112.4	L165 E166 S171 L172	L165-S169 PolarHBondContact O-N 3.46Å; E166-S169 PolarHBondContact O-N 3.15Å; E166-S169 PolarHBondContact O-OG 3.36Å; S169-S171 PolarHBondContact O-N 3.27Å; S169-L172 PolarHBondContact O-N 2.78Å
170	A	64.3	Low	62.2	Low	88 Å²	88	116.2 Å²	116.2	73%	0.727	70%	0.699	S	S	*	*	H	α-helix	trans	-69	-12.9	176.4	0	0	0	0	0	114.7	E166	E166-A170 WeakPolarHBondContact O-CB 3.34Å; E166-A170 PolarHBondContact O-N 3.37Å
171	S	63	Low	62	Low	90 Å²	90	120.1 Å²	120.1	63%	0.629	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.1	4.2	178.6	47.6	0	0	0	0	114.2	Q167 A168 S169	Q167-S171 PolarHBondContact O-N 3.27Å; Q167-S171 PolarHBondContact O-OG 3.03Å; A168-S171 PolarHBondContact O-OG 3.17Å; S169-S171 PolarHBondContact O-N 3.27Å
172	L	59.2	Low	62	Low	128 Å²	128	120.1 Å²	120.1	67%	0.67	71%	0.71	S	S	*	*	S	Bend	trans	-73.3	129	172.6	-65.7	174.3	0	0	0	110.8	S169	S169-L172 PolarHBondContact O-N 2.78Å
173	P	61.8	Low	62	Low	108 Å²	108	119 Å²	119	70%	0.701	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-65.9	146.9	174.5	28	-34	0	0	0	110.7	A175	P173-A175 PolarHBondContact O-N 3.47Å
174	P	65	Low	61.8	Low	126 Å²	126	123.6 Å²	123.6	82%	0.818	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-60.3	132.2	-179	24.1	-33.4	0	0	0	111.1
175	A	64.1	Low	61.8	Low	84 Å²	84	121.9 Å²	121.9	69%	0.694	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-61.1	134.2	-177.5	0	0	0	0	0	111.1	P173 L177	P173-A175 PolarHBondContact O-N 3.47Å; A175-L177 PolarHBondContact O-N 2.93Å; A175-L177 VanDerWaalsContact O-N 3.15Å
176	P	56.9	Low	61.8	Low	128 Å²	128	122.2 Å²	122.2	83%	0.831	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-66.8	117.2	-178.3	24.4	-31.1	0	0	0	110.5	K178	P176-K178 PolarHBondContact O-N 3.44Å
177	L	65.8	Low	61.4	Low	166 Å²	166	120.5 Å²	120.5	87%	0.869	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-66.5	126.1	174.6	-62.6	177.4	0	0	0	109.5	A175	A175-L177 PolarHBondContact O-N 2.93Å; A175-L177 VanDerWaalsContact O-N 3.15Å
178	K	57.8	Low	61	Low	203 Å²	203	119.5 Å²	119.5	88%	0.883	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-76.2	126.1	178.2	-137.3	172.8	-173.9	177.6	0	109	P176	P176-K178 PolarHBondContact O-N 3.44Å
179	P	59.8	Low	61	Low	120 Å²	120	125.8 Å²	125.8	78%	0.779	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-65.7	150.4	169.8	-14.3	28.6	0	0	0	110.6
180	S	52	Low	60.9	Low	198 Å²	198	130.8 Å²	130.8	100%	1.385	82%	0.817	S	S	*	*			trans	-69.5	0	171.2	-56	0	0	0	0	112.9

Retrieved 180 of 180 residues in 526.7 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).