A0A044S3F6_ONCVO Loading...

Histone domain-containing protein

Core component of nucleosome. Nucleosomes wrap and compact DNA into chromatin, limiting DNA accessibility to the cellular machineries which require DNA as a template. Histones thereby play a central role in transcription regulation, DNA repair, DNA replication and chromosomal stability. DNA accessibility is regulated via a complex set of post-translational modifications of histones, also called histone code, and nucleosome remodeling.

AlphaFold DB , UniProt , Accession A0A044S3F6, Species ONCVO (Onchocerca volvulus), Gene n/a, Length 127 aa.

						>A0A044S3F6_ONCVO|A0A044S3F6
MSPKSSAKGEKKTEKLQKVRSSDKKRKSRNKESYSPYIYRVLKQIHPDIHISSKAMSVMNSFVNDIFERIAEEASRLSQHKKHSTITTNEIQTAVRLNIPGELAKHAVSNGTKALTRYIAKSKTTAQ
					

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(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	53	Low	51.1	Low	248 Å²	248	148.5 Å²	148.5	100%	1.222	85%	0.846	S	S	*	*				0	102.1	0	-73.7	-76.6	177.1	0	0	107.4
2	S	56.2	Low	50.3	Low	125 Å²	125	153.3 Å²	153.3	87%	0.874	85%	0.85	S	S	*	*			trans	-87.4	166.4	-176.2	-73.2	0	0	0	0	112.2
3	P	61.5	Low	49.9	Very low	119 Å²	119	152.2 Å²	152.2	77%	0.773	85%	0.85	S	S	*	*			trans	-110	-179	-140.6	41.9	-35.8	0	0	0	116
4	K	54.9	Low	49.9	Very low	195 Å²	195	154.1 Å²	154.1	85%	0.848	85%	0.849	S	S	*	*			trans	-134.8	110.6	163.1	-79.8	-177.2	177.5	175.9	0	108.1
5	S	55.9	Low	49.3	Very low	99 Å²	99	157.6 Å²	157.6	69%	0.692	85%	0.852	S	S	*	*				55.8	135.1	87.8	73.3	0	0	0	0	112.9
6	S	53.4	Low	49.2	Very low	109 Å²	109	158.3 Å²	158.3	76%	0.762	85%	0.854	S	S	*	*			cis	-179.8	160.3	6.9	-92.8	0	0	0	0	107.5
7	A	50.9	Low	48.9	Very low	98 Å²	98	159.6 Å²	159.6	81%	0.81	85%	0.854	S	S	*	*			trans	68.7	148.7	147.2	0	0	0	0	0	118.7
8	K	41.8	Very low	48.8	Very low	187 Å²	187	160.6 Å²	160.6	81%	0.813	85%	0.849	S	S	*	*			cis	177.1	133.7	-6	175.7	173.5	-173	177.2	0	104
9	G	41.3	Very low	48.5	Very low	81 Å²	81	159.1 Å²	159.1	84%	0.835	85%	0.847	S	S	*	*			trans	-169.4	71.8	-178.2	0	0	0	0	0	113.6
10	E	48.6	Very low	48.6	Very low	169 Å²	169	161.4 Å²	161.4	79%	0.79	84%	0.843	S	S	*	*			trans	-75.8	138.8	167.9	-72	163.2	109.2	0	0	111
11	K	45.1	Very low	48.6	Very low	204 Å²	204	158.1 Å²	158.1	89%	0.887	83%	0.834	S	S	*	*			trans	-166.7	106.8	136.4	-106.6	170.3	-171.8	-177.3	0	111
12	K	41.3	Very low	48.1	Very low	205 Å²	205	152.1 Å²	152.1	89%	0.891	82%	0.816	S	S	*	*			trans	-63.8	136.3	159.6	-77.9	171.6	171.5	173.2	0	109
13	T	45.3	Very low	47.9	Very low	139 Å²	139	152.9 Å²	152.9	85%	0.853	81%	0.811	S	S	*	*			trans	-134.8	135.7	154	27.5	0	0	0	0	109.6
14	E	49.5	Very low	47.5	Very low	180 Å²	180	156.9 Å²	156.9	84%	0.841	82%	0.816	S	S	*	*			trans	-75	158.3	-161.5	-71.1	150.2	150.2	0	0	114.3	L16	E14-L16 PolarHBondContact O-N 3.27Å
15	K	40.7	Very low	47.7	Very low	206 Å²	206	157.2 Å²	157.2	90%	0.896	82%	0.817	S	S	*	*			trans	-51.5	114.2	169	-68.7	171.1	173.8	177.2	0	110.9
16	L	47.3	Very low	47.8	Very low	168 Å²	168	163.9 Å²	163.9	88%	0.88	83%	0.827	S	S	*	*			trans	-97.3	97.2	158.2	-85	155	0	0	0	108.5	E14 K18	E14-L16 PolarHBondContact O-N 3.27Å; L16-K18 PolarHBondContact O-N 3.21Å
17	Q	45.4	Very low	48	Very low	181 Å²	181	168.3 Å²	168.3	85%	0.846	83%	0.833	S	S	*	*			trans	-58.5	104.7	159.2	-80.6	173.7	-42.3	0	0	108.4	V19	Q17-V19 PolarHBondContact O-N 2.85Å
18	K	46.8	Very low	48.4	Very low	177 Å²	177	168.6 Å²	168.6	77%	0.77	83%	0.829	S	S	*	*			trans	-90.7	81.2	171.1	-143	175.9	-169.7	177.2	0	108.5	L16 R20	L16-K18 PolarHBondContact O-N 3.21Å; K18-R20 PolarHBondContact O-N 2.71Å
19	V	42	Very low	49.3	Very low	133 Å²	133	171 Å²	171	81%	0.806	83%	0.833	S	S	*	*			trans	-70.4	101.4	158.2	177.4	0	0	0	0	106.5	Q17	Q17-V19 PolarHBondContact O-N 2.85Å
20	R	50.8	Low	50.5	Low	205 Å²	205	174.6 Å²	174.6	77%	0.774	83%	0.833	S	S	*	*			trans	-140.9	97.2	164.3	-74.9	-163.6	174.9	178.6	-2	110.8	K18	K18-R20 PolarHBondContact O-N 2.71Å
21	S	49.1	Very low	51.7	Low	93 Å²	93	175.4 Å²	175.4	65%	0.65	83%	0.834	S	S	*	*			trans	66.2	94.6	134.5	-41.8	0	0	0	0	116.4	D23	S21-D23 PolarHBondContact O-N 2.77Å
22	S	42.8	Very low	53.6	Low	122 Å²	122	174.8 Å²	174.8	85%	0.853	83%	0.834	S	S	*	*			trans	-52.9	76.7	148.8	51.5	0	0	0	0	111.9
23	D	51.6	Low	56.1	Low	141 Å²	141	166.9 Å²	166.9	75%	0.754	81%	0.805	S	S	*	*			trans	-95.9	96.8	155.8	-86.8	-47.8	0	0	0	107.4	S21 K25	S21-D23 PolarHBondContact O-N 2.77Å; D23-K25 PolarHBondContact O-N 3.02Å
24	K	54.1	Low	58.5	Low	203 Å²	203	164 Å²	164	88%	0.883	78%	0.779	S	S	*	*			trans	-52.3	89.7	159.5	-76.9	172.5	177.6	168.7	0	106.7	R26	K24-R26 VanDerWaalsContact C-N 3.29Å; K24-R26 PolarHBondContact O-N 2.77Å
25	K	57.8	Low	60.7	Low	202 Å²	202	157.1 Å²	157.1	88%	0.878	75%	0.75	S	S	*	*			trans	-50.5	103.1	165.6	-101.4	-177.8	176.2	175.6	0	105.3	D23 K27	D23-K25 PolarHBondContact O-N 3.02Å; K25-K27 PolarHBondContact O-N 3.19Å
26	R	58.3	Low	63.4	Low	238 Å²	238	150.7 Å²	150.7	90%	0.898	73%	0.73	S	S	*	*			trans	-40.1	118.3	172.8	-77.7	175.2	165.7	171.7	-4.8	105.8	K24 S28	K24-R26 VanDerWaalsContact C-N 3.29Å; K24-R26 PolarHBondContact O-N 2.77Å; R26-S28 VanDerWaalsContact C-N 3.34Å; R26-S28 PolarHBondContact O-N 2.93Å
27	K	58.1	Low	65.7	Low	203 Å²	203	149.4 Å²	149.4	88%	0.883	71%	0.714	S	S	*	*			trans	-44.8	107.5	173.9	-90.8	179.5	173.4	177.4	0	105.9	K25 R29	K25-K27 PolarHBondContact O-N 3.19Å; K27-R29 PolarHBondContact O-N 2.88Å
28	S	58.3	Low	68.2	Low	104 Å²	104	141.9 Å²	141.9	73%	0.727	68%	0.68	S	S	*	*			trans	-47.4	128.6	174	172.5	0	0	0	0	105.7	R26 N30	R26-S28 VanDerWaalsContact C-N 3.34Å; R26-S28 PolarHBondContact O-N 2.93Å; S28-N30 PolarHBondContact O-N 3.45Å
29	R	61.4	Low	70.6	Confident	236 Å²	236	138.2 Å²	138.2	89%	0.891	66%	0.662	S	S	*	*			trans	-40.2	123.3	175.5	-77.1	179.2	173.9	164.8	-2.7	107.1	K27 K31	K27-R29 PolarHBondContact O-N 2.88Å; R29-K31 VanDerWaalsContact C-N 3.34Å; R29-K31 PolarHBondContact O-N 3.48Å
30	N	65.9	Low	73.3	Confident	158 Å²	158	139.7 Å²	139.7	85%	0.845	65%	0.653	S	S	*	*			trans	-52.2	105.8	178	-91.1	-0.3	0	0	0	106.5	S28 E32	S28-N30 PolarHBondContact O-N 3.45Å; N30-E32 PolarHBondContact O-N 3.22Å; N30-E32 VanDerWaalsContact O-N 3.08Å
31	K	73.5	Confident	75.5	Confident	185 Å²	185	133.5 Å²	133.5	80%	0.804	64%	0.637	S	S	*	*			trans	-71.2	109.2	175.6	-173.2	174.6	-178.8	179.1	0	104.9	R29 S33	R29-K31 VanDerWaalsContact C-N 3.34Å; R29-K31 PolarHBondContact O-N 3.48Å; K31-S33 PolarHBondContact O-N 3.45Å
32	E	85.4	Confident	77.9	Confident	192 Å²	192	130.7 Å²	130.7	90%	0.897	62%	0.615	S	S	*	*			trans	-55.3	125.4	172	-66	-176.9	164.1	0	0	107.7	N30	N30-E32 PolarHBondContact O-N 3.22Å; N30-E32 VanDerWaalsContact O-N 3.08Å
33	S	94.2	Very high	80.5	Confident	39 Å²	39	127.3 Å²	127.3	27%	0.273	59%	0.585	S	S	.	*			trans	-150.1	146.9	-173.4	171.8	0	0	0	0	109	K31 S35 P36 N60	K31-S33 PolarHBondContact O-N 3.45Å; S33-S35 PolarHBondContact O-N 3.44Å; S33-S35 PolarHBondContact OG-N 3.38Å; S33-S35 PolarHBondContact OG-OG 3.17Å; S33-P36 WeakPolarHBondContact O-CD 3.49Å; S33-N60 WeakPolarHBondContact CA-OD1 3.48Å; S33-N60 PolarHBondContact OG-OD1 2.84Å
34	Y	96.4	Very high	82.7	Confident	78 Å²	78	128.1 Å²	128.1	31%	0.306	58%	0.584	S	S	.	*	S	Bend	trans	-73.2	-4.6	175.2	-65.5	-74.9	0	0	0	113.2	P36 Y37 I38 N60 V63 N64	Y34-P36 VanDerWaalsContact C-CD 3.49Å; Y34-Y37 HydrophobicContact CD1-CD2 4.43Å; Y34-Y37 PolarHBondContact O-N 3.39Å; Y34-I38 WeakPolarHBondContact O-CG1 3.34Å; Y34-I38 PolarHBondContact O-N 3.16Å; Y34-N60 PolarHBondContact N-OD1 2.93Å; Y34-V63 HydrophobicContact CD1-CG1 3.95Å; Y34-V63 HydrophobicContact CD2-CB 3.91Å; Y34-V63 HydrophobicContact CD2-CG1 3.48Å; Y34-V63 VanDerWaalsContact CD2-CG1 3.48Å; Y34-V63 HydrophobicContact CE1-CG1 4.07Å; Y34-V63 HydrophobicContact CE2-CB 4.37Å; Y34-V63 HydrophobicContact CE2-CG1 3.61Å; Y34-V63 HydrophobicContact CG-CB 4.21Å; Y34-V63 HydrophobicContact CG-CG1 3.66Å; Y34-N64 WeakPolarHBondContact CE2-OD1 3.46Å
35	S	95.6	Very high	84.8	Confident	35 Å²	35	123.8 Å²	123.8	25%	0.245	57%	0.57	C	S	.	*	H	α-helix	trans	-51.1	-44.5	-174.4	-63.4	0	0	0	0	115.2	S33 Y37 I38 Y39 M56	S33-S35 PolarHBondContact O-N 3.44Å; S33-S35 PolarHBondContact OG-N 3.38Å; S33-S35 PolarHBondContact OG-OG 3.17Å; S35-Y37 VanDerWaalsContact C-N 3.28Å; S35-Y37 PolarHBondContact O-N 2.92Å; S35-I38 PolarHBondContact O-N 3.27Å; S35-Y39 WeakPolarHBondContact O-CB 3.28Å; S35-Y39 PolarHBondContact O-N 3.01Å; S35-M56 VanDerWaalsContact CA-SD 3.59Å; S35-M56 VanDerWaalsContact OG-CG 3.26Å; S35-M56 WeakPolarHBondContact OG-CG 3.39Å
36	P	95.6	Very high	86.7	Confident	71 Å²	71	118.6 Å²	118.6	46%	0.461	55%	0.548	S	S	.	.	H	α-helix	trans	-62.4	-35.5	177.7	-22.2	34.5	0	0	0	112.9	S33 Y34 R40	S33-P36 WeakPolarHBondContact O-CD 3.49Å; Y34-P36 VanDerWaalsContact C-CD 3.49Å; P36-R40 VanDerWaalsContact O-CG 3.29Å; P36-R40 WeakPolarHBondContact O-CG 3.43Å; P36-R40 PolarHBondContact O-N 3.25Å; P36-R40 VanDerWaalsContact O-N 3.14Å
37	Y	97.2	Very high	88.5	Confident	141 Å²	141	111.1 Å²	111.1	55%	0.553	53%	0.53	S	S	*	.	H	α-helix	trans	-78.9	-40.2	-178.9	-50.1	-77.9	0	0	0	111.7	Y34 S35 Y39 R40 V41	Y34-Y37 HydrophobicContact CD1-CD2 4.43Å; Y34-Y37 PolarHBondContact O-N 3.39Å; S35-Y37 VanDerWaalsContact C-N 3.28Å; S35-Y37 PolarHBondContact O-N 2.92Å; Y37-Y39 VanDerWaalsContact C-N 3.25Å; Y37-Y39 PolarHBondContact O-N 3.32Å; Y37-R40 PolarHBondContact O-N 3.02Å; Y37-R40 VanDerWaalsContact O-N 3.14Å; Y37-V41 WeakPolarHBondContact O-CG2 3.28Å; Y37-V41 PolarHBondContact O-N 3.23Å
38	I	97.6	Very high	90.4	Very high	24 Å²	24	108.3 Å²	108.3	12%	0.123	53%	0.525	C	S	.	.	H	α-helix	trans	-56.5	-45	173.2	-66.6	162.4	0	0	0	109.6	Y34 S35 V41 L42 M56 M59 N60 V63	Y34-I38 WeakPolarHBondContact O-CG1 3.34Å; Y34-I38 PolarHBondContact O-N 3.16Å; S35-I38 PolarHBondContact O-N 3.27Å; I38-V41 PolarHBondContact O-N 3.41Å; I38-L42 WeakPolarHBondContact O-CB 3.42Å; I38-L42 PolarHBondContact O-N 2.95Å; I38-M56 HydrophobicContact CB-CE 4.44Å; I38-M56 HydrophobicContact CB-SD 3.91Å; I38-M56 HydrophobicContact CD1-SD 4.14Å; I38-M56 HydrophobicContact CG2-CE 4.2Å; I38-M56 HydrophobicContact CG2-SD 3.78Å; I38-M59 HydrophobicContact CD1-CB 3.89Å; I38-M59 HydrophobicContact CG2-CB 4.08Å; I38-M59 HydrophobicContact CG2-CG 4.47Å; I38-N60 HydrophobicContact CD1-CB 4.34Å; I38-V63 HydrophobicContact CD1-CG2 4.39Å
39	Y	97.4	Very high	92.3	Very high	100 Å²	100	107.3 Å²	107.3	39%	0.392	51%	0.511	S	S	.	.	H	α-helix	trans	-64	-42.2	176.4	-172.9	-97.3	0	0	0	112.8	S35 Y37 V41 L42 K43 I51	S35-Y39 WeakPolarHBondContact O-CB 3.28Å; S35-Y39 PolarHBondContact O-N 3.01Å; Y37-Y39 VanDerWaalsContact C-N 3.25Å; Y37-Y39 PolarHBondContact O-N 3.32Å; Y39-V41 PolarHBondContact O-N 3.22Å; Y39-L42 PolarHBondContact O-N 3.18Å; Y39-K43 HydrophobicContact CD1-CG 4.18Å; Y39-K43 HydrophobicContact CE1-CG 3.77Å; Y39-K43 HydrophobicContact CE2-CG 4.44Å; Y39-K43 WeakPolarHBondContact O-CG 3.47Å; Y39-K43 PolarHBondContact O-N 3.38Å; Y39-K43 WeakPolarHBondContact OH-CE 3.39Å; Y39-I51 HydrophobicContact CD2-CG2 4.3Å
40	R	97.9	Very high	93.9	Very high	163 Å²	163	102.8 Å²	102.8	62%	0.615	50%	0.5	S	S	*	.	H	α-helix	trans	-60.3	-45.1	176.1	-75	172.1	-174.6	-175.5	2.1	111.9	P36 Y37 K43 Q44	P36-R40 VanDerWaalsContact O-CG 3.29Å; P36-R40 WeakPolarHBondContact O-CG 3.43Å; P36-R40 PolarHBondContact O-N 3.25Å; P36-R40 VanDerWaalsContact O-N 3.14Å; Y37-R40 PolarHBondContact O-N 3.02Å; Y37-R40 VanDerWaalsContact O-N 3.14Å; R40-K43 PolarHBondContact O-N 3.29Å; R40-Q44 WeakPolarHBondContact O-CG 3.47Å; R40-Q44 PolarHBondContact O-N 3.05Å; R40-Q44 VanDerWaalsContact O-N 3.12Å
41	V	97.7	Very high	95.4	Very high	75 Å²	75	97.7 Å²	97.7	46%	0.455	47%	0.472	S	S	.	.	H	α-helix	trans	-65.6	-41.2	177.6	175.1	0	0	0	0	111	Y37 I38 Y39 K43 Q44 I45	Y37-V41 WeakPolarHBondContact O-CG2 3.28Å; Y37-V41 PolarHBondContact O-N 3.23Å; I38-V41 PolarHBondContact O-N 3.41Å; Y39-V41 PolarHBondContact O-N 3.22Å; V41-K43 VanDerWaalsContact C-N 3.34Å; V41-K43 PolarHBondContact O-N 3.18Å; V41-Q44 WeakPolarHBondContact O-CB 3.45Å; V41-Q44 PolarHBondContact O-N 2.79Å; V41-I45 HydrophobicContact CG1-CD1 4.31Å; V41-I45 PolarHBondContact O-N 3.05Å
42	L	98.1	Very high	96.6	Very high	35 Å²	35	92.3 Å²	92.3	18%	0.183	46%	0.457	C	S	.	.	H	α-helix	trans	-56.5	-48	174.8	175	63.7	0	0	0	111.3	I38 Y39 Q44 I45 H46 I49 I51	I38-L42 WeakPolarHBondContact O-CB 3.42Å; I38-L42 PolarHBondContact O-N 2.95Å; Y39-L42 PolarHBondContact O-N 3.18Å; L42-Q44 VanDerWaalsContact C-N 3.27Å; L42-Q44 PolarHBondContact O-N 3.08Å; L42-I45 PolarHBondContact O-N 2.87Å; L42-I45 VanDerWaalsContact O-N 3.16Å; L42-H46 HydrophobicContact CD1-CB 4.38Å; L42-H46 PolarHBondContact O-N 2.56Å; L42-I49 HydrophobicContact CD1-CG2 4.32Å; L42-I51 HydrophobicContact CD2-CB 3.89Å; L42-I51 HydrophobicContact CD2-CG2 3.91Å
43	K	98.2	Very high	97.1	Very high	51 Å²	51	88.3 Å²	88.3	22%	0.222	45%	0.45	C	S	.	.	H	α-helix	trans	-70.3	-20	-179	-67	-56.1	-169.7	-179.4	0	114.1	Y39 R40 V41 P47 I49	Y39-K43 HydrophobicContact CD1-CG 4.18Å; Y39-K43 HydrophobicContact CE1-CG 3.77Å; Y39-K43 HydrophobicContact CE2-CG 4.44Å; Y39-K43 WeakPolarHBondContact O-CG 3.47Å; Y39-K43 PolarHBondContact O-N 3.38Å; Y39-K43 WeakPolarHBondContact OH-CE 3.39Å; R40-K43 PolarHBondContact O-N 3.29Å; V41-K43 VanDerWaalsContact C-N 3.34Å; V41-K43 PolarHBondContact O-N 3.18Å; K43-P47 WeakPolarHBondContact CD-O 3.34Å; K43-P47 PolarHBondContact NZ-O 3.23Å; K43-I49 PolarHBondContact NZ-O 2.96Å
44	Q	97.9	Very high	97.3	Very high	158 Å²	158	94.3 Å²	94.3	74%	0.738	47%	0.472	S	S	*	.	H	α-helix	trans	-71.5	-29.6	171.3	-74.8	175	-32.8	0	0	112.9	R40 V41 L42	R40-Q44 WeakPolarHBondContact O-CG 3.47Å; R40-Q44 PolarHBondContact O-N 3.05Å; R40-Q44 VanDerWaalsContact O-N 3.12Å; V41-Q44 WeakPolarHBondContact O-CB 3.45Å; V41-Q44 PolarHBondContact O-N 2.79Å; L42-Q44 VanDerWaalsContact C-N 3.27Å; L42-Q44 PolarHBondContact O-N 3.08Å
45	I	97.7	Very high	97.4	Very high	112 Å²	112	92.4 Å²	92.4	57%	0.574	47%	0.472	S	S	*	.	H	α-helix	trans	-100.8	-39.5	-176.3	-54.4	174	0	0	0	111	V41 L42	V41-I45 HydrophobicContact CG1-CD1 4.31Å; V41-I45 PolarHBondContact O-N 3.05Å; L42-I45 PolarHBondContact O-N 2.87Å; L42-I45 VanDerWaalsContact O-N 3.16Å
46	H	97.8	Very high	97.5	Very high	92 Å²	92	92 Å²	92	43%	0.426	47%	0.466	S	S	.	.			trans	-138.2	85.3	-175.7	-62.7	-62.8	0	0	0	111.3	L42 D48 I49	L42-H46 HydrophobicContact CD1-CB 4.38Å; L42-H46 PolarHBondContact O-N 2.56Å; H46-D48 VanDerWaalsContact C-N 3.26Å; H46-D48 PolarHBondContact O-N 3.42Å; H46-I49 HydrophobicContact CB-CB 3.88Å; H46-I49 HydrophobicContact CB-CD1 3.63Å; H46-I49 HydrophobicContact CB-CG1 3.8Å; H46-I49 PolarHBondContact O-N 2.95Å
47	P	97.6	Very high	97.5	Very high	81 Å²	81	92 Å²	92	53%	0.526	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-30.9	-175.1	22.8	-32.9	0	0	0	113.6	K43	K43-P47 WeakPolarHBondContact CD-O 3.34Å; K43-P47 PolarHBondContact NZ-O 3.23Å
48	D	97.8	Very high	97.6	Very high	144 Å²	144	89.7 Å²	89.7	77%	0.77	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-11.1	-175.4	-53.6	-44.8	0	0	0	113.9	H46 H50	H46-D48 VanDerWaalsContact C-N 3.26Å; H46-D48 PolarHBondContact O-N 3.42Å; D48-H50 PolarHBondContact O-ND1 3.48Å
49	I	97.1	Very high	97.6	Very high	84 Å²	84	92.2 Å²	92.2	43%	0.431	48%	0.481	S	S	.	.			trans	-86.1	142.4	-177.9	-62.8	-176.7	0	0	0	110.8	L42 K43 H46	L42-I49 HydrophobicContact CD1-CG2 4.32Å; K43-I49 PolarHBondContact NZ-O 2.96Å; H46-I49 HydrophobicContact CB-CB 3.88Å; H46-I49 HydrophobicContact CB-CD1 3.63Å; H46-I49 HydrophobicContact CB-CG1 3.8Å; H46-I49 PolarHBondContact O-N 2.95Å
50	H	96.2	Very high	97.6	Very high	141 Å²	141	88.2 Å²	88.2	65%	0.653	47%	0.467	S	S	*	.			trans	-115.6	156.6	174.9	-63.7	81.3	0	0	0	110.5	D48	D48-H50 PolarHBondContact O-ND1 3.48Å
51	I	97.5	Very high	97.6	Very high	51 Å²	51	83.5 Å²	83.5	26%	0.262	46%	0.459	S	S	.	.			trans	-120.3	133.4	179.7	-173.4	170.2	0	0	0	109.6	Y39 L42 A55 M56 M59	Y39-I51 HydrophobicContact CD2-CG2 4.3Å; L42-I51 HydrophobicContact CD2-CB 3.89Å; L42-I51 HydrophobicContact CD2-CG2 3.91Å; I51-A55 HydrophobicContact CD1-CB 4.13Å; I51-A55 HydrophobicContact CG1-CB 3.66Å; I51-M56 HydrophobicContact CD1-CB 4.45Å; I51-M56 HydrophobicContact CD1-CE 4.39Å; I51-M56 HydrophobicContact CG2-CE 3.52Å; I51-M59 HydrophobicContact CD1-CG 4.12Å
52	S	97.9	Very high	97.6	Very high	71 Å²	71	85.3 Å²	85.3	50%	0.497	46%	0.461	S	S	.	.			trans	-71.5	158.6	177.4	71.7	0	0	0	0	111.4	K54 A55 M56	S52-K54 VanDerWaalsContact C-N 3.28Å; S52-K54 PolarHBondContact O-N 3.43Å; S52-A55 PolarHBondContact O-N 3.47Å; S52-A55 WeakPolarHBondContact OG-CB 3.41Å; S52-A55 PolarHBondContact OG-N 3.21Å; S52-A55 VanDerWaalsContact OG-N 3.17Å; S52-M56 WeakPolarHBondContact O-CB 3.49Å; S52-M56 PolarHBondContact O-N 3.2Å
53	S	96.4	Very high	97.6	Very high	108 Å²	108	85.8 Å²	85.8	76%	0.755	46%	0.464	S	S	*	.	H	α-helix	trans	-59.8	-38.4	176.3	55.7	0	0	0	0	112.6	M56 S57	S53-M56 PolarHBondContact O-N 2.94Å; S53-S57 PolarHBondContact O-N 3.42Å
54	K	97.6	Very high	97.5	Very high	166 Å²	166	86.1 Å²	86.1	72%	0.722	47%	0.469	S	S	*	.	H	α-helix	trans	-63.7	-48.1	175.7	-172.6	175.1	-179	179.2	0	111.3	S52 M56 S57 V58	S52-K54 VanDerWaalsContact C-N 3.28Å; S52-K54 PolarHBondContact O-N 3.43Å; K54-M56 VanDerWaalsContact C-N 3.32Å; K54-M56 PolarHBondContact O-N 3.05Å; K54-S57 WeakPolarHBondContact O-CB 3.45Å; K54-S57 PolarHBondContact O-N 3.27Å; K54-V58 WeakPolarHBondContact O-CG2 3.35Å; K54-V58 PolarHBondContact O-N 3.48Å; K54-V58 VanDerWaalsContact O-N 3.09Å
55	A	98.2	Very high	97.5	Very high	38 Å²	38	81.5 Å²	81.5	31%	0.314	45%	0.449	S	S	.	.	H	α-helix	trans	-63.5	-39	176.7	0	0	0	0	0	111.8	I51 S52 S57 V58 M59	I51-A55 HydrophobicContact CD1-CB 4.13Å; I51-A55 HydrophobicContact CG1-CB 3.66Å; S52-A55 PolarHBondContact O-N 3.47Å; S52-A55 WeakPolarHBondContact OG-CB 3.41Å; S52-A55 PolarHBondContact OG-N 3.21Å; S52-A55 VanDerWaalsContact OG-N 3.17Å; A55-S57 VanDerWaalsContact C-N 3.32Å; A55-S57 PolarHBondContact O-N 2.95Å; A55-V58 PolarHBondContact O-N 3.32Å; A55-M59 WeakPolarHBondContact O-CG 3.41Å; A55-M59 PolarHBondContact O-N 2.91Å
56	M	97.4	Very high	97.5	Very high	25 Å²	25	78.5 Å²	78.5	12%	0.123	43%	0.434	C	S	.	.	H	α-helix	trans	-60.2	-40.9	174.2	-176.1	60.7	80.1	0	0	112.2	S35 I38 I51 S52 S53 K54 M59 N60	S35-M56 VanDerWaalsContact CA-SD 3.59Å; S35-M56 VanDerWaalsContact OG-CG 3.26Å; S35-M56 WeakPolarHBondContact OG-CG 3.39Å; I38-M56 HydrophobicContact CB-CE 4.44Å; I38-M56 HydrophobicContact CB-SD 3.91Å; I38-M56 HydrophobicContact CD1-SD 4.14Å; I38-M56 HydrophobicContact CG2-CE 4.2Å; I38-M56 HydrophobicContact CG2-SD 3.78Å; I51-M56 HydrophobicContact CD1-CB 4.45Å; I51-M56 HydrophobicContact CD1-CE 4.39Å; I51-M56 HydrophobicContact CG2-CE 3.52Å; S52-M56 WeakPolarHBondContact O-CB 3.49Å; S52-M56 PolarHBondContact O-N 3.2Å; S53-M56 PolarHBondContact O-N 2.94Å; K54-M56 VanDerWaalsContact C-N 3.32Å; K54-M56 PolarHBondContact O-N 3.05Å; M56-M59 PolarHBondContact O-N 3.3Å; M56-N60 WeakPolarHBondContact O-CB 3.22Å; M56-N60 PolarHBondContact O-N 2.96Å
57	S	96.8	Very high	97.5	Very high	73 Å²	73	79.9 Å²	79.9	51%	0.51	44%	0.439	S	S	.	.	H	α-helix	trans	-64.7	-39.4	175.7	-170.2	0	0	0	0	112.4	S53 K54 A55 S61	S53-S57 PolarHBondContact O-N 3.42Å; K54-S57 WeakPolarHBondContact O-CB 3.45Å; K54-S57 PolarHBondContact O-N 3.27Å; A55-S57 VanDerWaalsContact C-N 3.32Å; A55-S57 PolarHBondContact O-N 2.95Å; S57-S61 PolarHBondContact O-N 3.49Å; S57-S61 VanDerWaalsContact O-N 3.08Å; S57-S61 PolarHBondContact O-OG 2.89Å
58	V	98.2	Very high	97.5	Very high	91 Å²	91	81.3 Å²	81.3	55%	0.552	44%	0.438	S	S	*	.	H	α-helix	trans	-63.3	-48.4	174.8	173.9	0	0	0	0	110.1	K54 A55 N60 S61 F62	K54-V58 WeakPolarHBondContact O-CG2 3.35Å; K54-V58 PolarHBondContact O-N 3.48Å; K54-V58 VanDerWaalsContact O-N 3.09Å; A55-V58 PolarHBondContact O-N 3.32Å; V58-N60 VanDerWaalsContact C-N 3.35Å; V58-N60 PolarHBondContact O-N 3.5Å; V58-S61 PolarHBondContact O-N 3.19Å; V58-S61 VanDerWaalsContact O-N 3.16Å; V58-F62 WeakPolarHBondContact O-CB 3.23Å; V58-F62 PolarHBondContact O-N 2.98Å
59	M	98.2	Very high	97.6	Very high	77 Å²	77	80.2 Å²	80.2	38%	0.379	42%	0.424	S	S	.	.	H	α-helix	trans	-61.7	-40.4	178.6	-70.1	-59.8	-63.3	0	0	112.6	I38 I51 A55 M56 S61 F62 V63	I38-M59 HydrophobicContact CD1-CB 3.89Å; I38-M59 HydrophobicContact CG2-CB 4.08Å; I38-M59 HydrophobicContact CG2-CG 4.47Å; I51-M59 HydrophobicContact CD1-CG 4.12Å; A55-M59 WeakPolarHBondContact O-CG 3.41Å; A55-M59 PolarHBondContact O-N 2.91Å; M56-M59 PolarHBondContact O-N 3.3Å; M59-S61 VanDerWaalsContact C-N 3.33Å; M59-S61 PolarHBondContact O-N 2.89Å; M59-F62 PolarHBondContact O-N 3.46Å; M59-V63 WeakPolarHBondContact O-CG2 3.28Å; M59-V63 PolarHBondContact O-N 2.92Å
60	N	97.1	Very high	97.6	Very high	17 Å²	17	77.6 Å²	77.6	9%	0.091	41%	0.41	C	S	.	.	H	α-helix	trans	-61.9	-42.7	175.2	-178.2	89.3	0	0	0	111.8	S33 Y34 I38 M56 V58 F62 V63 N64	S33-N60 WeakPolarHBondContact CA-OD1 3.48Å; S33-N60 PolarHBondContact OG-OD1 2.84Å; Y34-N60 PolarHBondContact N-OD1 2.93Å; I38-N60 HydrophobicContact CD1-CB 4.34Å; M56-N60 WeakPolarHBondContact O-CB 3.22Å; M56-N60 PolarHBondContact O-N 2.96Å; V58-N60 VanDerWaalsContact C-N 3.35Å; V58-N60 PolarHBondContact O-N 3.5Å; N60-F62 VanDerWaalsContact C-N 3.34Å; N60-V63 PolarHBondContact O-N 3.24Å; N60-N64 PolarHBondContact ND2-ND2 3.43Å; N60-N64 PolarHBondContact O-N 3.48Å; N60-N64 VanDerWaalsContact O-N 3.14Å
61	S	97.8	Very high	97.7	Very high	64 Å²	64	72.6 Å²	72.6	45%	0.448	39%	0.393	S	S	.	.	H	α-helix	trans	-67.7	-37.3	178.4	-51	0	0	0	0	111.4	S57 V58 M59 N64 D65	S57-S61 PolarHBondContact O-N 3.49Å; S57-S61 VanDerWaalsContact O-N 3.08Å; S57-S61 PolarHBondContact O-OG 2.89Å; V58-S61 PolarHBondContact O-N 3.19Å; V58-S61 VanDerWaalsContact O-N 3.16Å; M59-S61 VanDerWaalsContact C-N 3.33Å; M59-S61 PolarHBondContact O-N 2.89Å; S61-N64 PolarHBondContact O-N 3.45Å; S61-D65 WeakPolarHBondContact O-CB 3.33Å; S61-D65 PolarHBondContact O-N 3.23Å
62	F	98.1	Very high	97.7	Very high	113 Å²	113	75.2 Å²	75.2	50%	0.496	41%	0.405	S	S	.	.	H	α-helix	trans	-60.9	-44.4	173.8	174.5	-109.3	0	0	0	112.3	V58 M59 N60 N64 D65 I66	V58-F62 WeakPolarHBondContact O-CB 3.23Å; V58-F62 PolarHBondContact O-N 2.98Å; M59-F62 PolarHBondContact O-N 3.46Å; N60-F62 VanDerWaalsContact C-N 3.34Å; F62-N64 VanDerWaalsContact C-N 3.33Å; F62-N64 PolarHBondContact O-N 3.21Å; F62-D65 PolarHBondContact O-N 3.15Å; F62-I66 HydrophobicContact CD2-CG1 4.18Å; F62-I66 HydrophobicContact CE1-CG1 4.43Å; F62-I66 HydrophobicContact CE2-CD1 4.06Å; F62-I66 HydrophobicContact CE2-CG1 3.7Å; F62-I66 HydrophobicContact CZ-CD1 4.42Å; F62-I66 HydrophobicContact CZ-CG1 3.85Å; F62-I66 WeakPolarHBondContact O-CG1 3.21Å; F62-I66 PolarHBondContact O-N 3.21Å; F62-I66 VanDerWaalsContact O-N 3.09Å
63	V	97.8	Very high	97.7	Very high	44 Å²	44	74 Å²	74	27%	0.267	39%	0.391	S	S	.	.	H	α-helix	trans	-62.5	-42	176.4	176	0	0	0	0	111.2	Y34 I38 M59 N60 F67	Y34-V63 HydrophobicContact CD1-CG1 3.95Å; Y34-V63 HydrophobicContact CD2-CB 3.91Å; Y34-V63 HydrophobicContact CD2-CG1 3.48Å; Y34-V63 VanDerWaalsContact CD2-CG1 3.48Å; Y34-V63 HydrophobicContact CE1-CG1 4.07Å; Y34-V63 HydrophobicContact CE2-CB 4.37Å; Y34-V63 HydrophobicContact CE2-CG1 3.61Å; Y34-V63 HydrophobicContact CG-CB 4.21Å; Y34-V63 HydrophobicContact CG-CG1 3.66Å; I38-V63 HydrophobicContact CD1-CG2 4.39Å; M59-V63 WeakPolarHBondContact O-CG2 3.28Å; M59-V63 PolarHBondContact O-N 2.92Å; N60-V63 PolarHBondContact O-N 3.24Å; V63-F67 VanDerWaalsContact O-CB 3.25Å; V63-F67 WeakPolarHBondContact O-CB 3.2Å; V63-F67 PolarHBondContact O-N 3.44Å
64	N	97.6	Very high	97.8	Very high	59 Å²	59	68.9 Å²	68.9	32%	0.316	36%	0.355	S	S	.	.	H	α-helix	trans	-61.2	-48.1	175.8	-73.5	-24.3	0	0	0	112.1	Y34 N60 S61 F62 I66 F67 E68	Y34-N64 WeakPolarHBondContact CE2-OD1 3.46Å; N60-N64 PolarHBondContact ND2-ND2 3.43Å; N60-N64 PolarHBondContact O-N 3.48Å; N60-N64 VanDerWaalsContact O-N 3.14Å; S61-N64 PolarHBondContact O-N 3.45Å; F62-N64 VanDerWaalsContact C-N 3.33Å; F62-N64 PolarHBondContact O-N 3.21Å; N64-I66 PolarHBondContact O-N 3.31Å; N64-F67 PolarHBondContact O-N 3.49Å; N64-E68 WeakPolarHBondContact O-CG 3.4Å; N64-E68 PolarHBondContact O-N 2.83Å
65	D	97.7	Very high	97.9	Very high	60 Å²	60	63 Å²	63	32%	0.321	34%	0.335	S	S	.	.	H	α-helix	trans	-58.6	-48.1	-179.4	-178.7	22.9	0	0	0	111.5	S61 F62 F67 E68 R69	S61-D65 WeakPolarHBondContact O-CB 3.33Å; S61-D65 PolarHBondContact O-N 3.23Å; F62-D65 PolarHBondContact O-N 3.15Å; D65-F67 PolarHBondContact O-N 2.74Å; D65-E68 PolarHBondContact O-N 2.97Å; D65-R69 VanDerWaalsContact CG-NH2 3.35Å; D65-R69 WeakPolarHBondContact O-CB 3.48Å; D65-R69 VanDerWaalsContact O-CG 3.26Å; D65-R69 WeakPolarHBondContact O-CG 3.36Å; D65-R69 PolarHBondContact O-N 3.27Å; D65-R69 IonicContact OD1-CZ 3.33Å; D65-R69 IonicContact OD1-NE 2.73Å; D65-R69 PolarHBondContact OD1-NE 3.11Å; D65-R69 IonicContact OD1-NH2 3.1Å; D65-R69 PolarHBondContact OD1-NH2 2.96Å; D65-R69 VanDerWaalsContact OD1-NH2 3.1Å; D65-R69 IonicContact OD2-CZ 3.47Å; D65-R69 IonicContact OD2-NE 3.59Å; D65-R69 IonicContact OD2-NH2 2.79Å; D65-R69 PolarHBondContact OD2-NH2 3.38Å
66	I	97.4	Very high	97.8	Very high	49 Å²	49	67.3 Å²	67.3	25%	0.251	34%	0.343	S	S	.	.	H	α-helix	trans	-66.7	-37.3	177.5	-61.9	-58.6	0	0	0	111.9	F62 N64 I70	F62-I66 HydrophobicContact CD2-CG1 4.18Å; F62-I66 HydrophobicContact CE1-CG1 4.43Å; F62-I66 HydrophobicContact CE2-CD1 4.06Å; F62-I66 HydrophobicContact CE2-CG1 3.7Å; F62-I66 HydrophobicContact CZ-CD1 4.42Å; F62-I66 HydrophobicContact CZ-CG1 3.85Å; F62-I66 WeakPolarHBondContact O-CG1 3.21Å; F62-I66 PolarHBondContact O-N 3.21Å; F62-I66 VanDerWaalsContact O-N 3.09Å; N64-I66 PolarHBondContact O-N 3.31Å; I66-I70 HydrophobicContact CG2-CD1 3.69Å; I66-I70 HydrophobicContact CG2-CG1 4.43Å; I66-I70 VanDerWaalsContact O-CG1 3.28Å; I66-I70 WeakPolarHBondContact O-CG1 3.27Å; I66-I70 PolarHBondContact O-N 2.92Å; I66-I70 VanDerWaalsContact O-N 3.09Å
67	F	97.8	Very high	97.8	Very high	122 Å²	122	67.5 Å²	67.5	54%	0.535	34%	0.344	S	S	.	.	H	α-helix	trans	-62.6	-49.6	176.6	177.3	-89.6	0	0	0	111.5	V63 N64 D65 I70 A71	V63-F67 VanDerWaalsContact O-CB 3.25Å; V63-F67 WeakPolarHBondContact O-CB 3.2Å; V63-F67 PolarHBondContact O-N 3.44Å; N64-F67 PolarHBondContact O-N 3.49Å; D65-F67 PolarHBondContact O-N 2.74Å; F67-I70 PolarHBondContact O-N 2.96Å; F67-A71 HydrophobicContact CE1-CB 4.41Å; F67-A71 VanDerWaalsContact O-CB 3.28Å; F67-A71 WeakPolarHBondContact O-CB 3.47Å; F67-A71 PolarHBondContact O-N 3.27Å
68	E	97.9	Very high	97.9	Very high	110 Å²	110	64.2 Å²	64.2	51%	0.514	32%	0.321	S	S	.	.	H	α-helix	trans	-60.5	-47.9	179.4	-74.3	176.2	-177.3	0	0	110.9	N64 D65 I70 A71 E72	N64-E68 WeakPolarHBondContact O-CG 3.4Å; N64-E68 PolarHBondContact O-N 2.83Å; D65-E68 PolarHBondContact O-N 2.97Å; E68-I70 PolarHBondContact O-N 3.18Å; E68-A71 PolarHBondContact O-N 3.36Å; E68-E72 WeakPolarHBondContact O-CB 3.49Å; E68-E72 WeakPolarHBondContact O-CG 3.38Å; E68-E72 PolarHBondContact O-N 3.1Å
69	R	98	Very high	97.8	Very high	122 Å²	122	65.9 Å²	65.9	46%	0.46	32%	0.323	S	S	.	.	H	α-helix	trans	-56.8	-44.7	177	-72.3	-179.7	-162.4	-157.7	7.9	113.3	D65 E73	D65-R69 VanDerWaalsContact CG-NH2 3.35Å; D65-R69 WeakPolarHBondContact O-CB 3.48Å; D65-R69 VanDerWaalsContact O-CG 3.26Å; D65-R69 WeakPolarHBondContact O-CG 3.36Å; D65-R69 PolarHBondContact O-N 3.27Å; D65-R69 IonicContact OD1-CZ 3.33Å; D65-R69 IonicContact OD1-NE 2.73Å; D65-R69 PolarHBondContact OD1-NE 3.11Å; D65-R69 IonicContact OD1-NH2 3.1Å; D65-R69 PolarHBondContact OD1-NH2 2.96Å; D65-R69 VanDerWaalsContact OD1-NH2 3.1Å; D65-R69 IonicContact OD2-CZ 3.47Å; D65-R69 IonicContact OD2-NE 3.59Å; D65-R69 IonicContact OD2-NH2 2.79Å; D65-R69 PolarHBondContact OD2-NH2 3.38Å; R69-E73 WeakPolarHBondContact O-CB 3.36Å; R69-E73 PolarHBondContact O-N 2.8Å; R69-E73 VanDerWaalsContact O-N 3.14Å
70	I	98.2	Very high	97.7	Very high	28 Å²	28	69.4 Å²	69.4	14%	0.144	34%	0.338	C	S	.	.	H	α-helix	trans	-68.9	-42.7	178.6	-68	167.7	0	0	0	110.6	I66 F67 E68 E73 A74 I91 A94 V95	I66-I70 HydrophobicContact CG2-CD1 3.69Å; I66-I70 HydrophobicContact CG2-CG1 4.43Å; I66-I70 VanDerWaalsContact O-CG1 3.28Å; I66-I70 WeakPolarHBondContact O-CG1 3.27Å; I66-I70 PolarHBondContact O-N 2.92Å; I66-I70 VanDerWaalsContact O-N 3.09Å; F67-I70 PolarHBondContact O-N 2.96Å; E68-I70 PolarHBondContact O-N 3.18Å; I70-E73 PolarHBondContact O-N 3.25Å; I70-A74 VanDerWaalsContact O-CB 3.22Å; I70-A74 WeakPolarHBondContact O-CB 3.26Å; I70-A74 PolarHBondContact O-N 3.49Å; I70-I91 HydrophobicContact CG2-CG2 4.32Å; I70-A94 HydrophobicContact CG2-CB 4.07Å; I70-V95 HydrophobicContact CD1-CG2 3.93Å; I70-V95 HydrophobicContact CG1-CG2 4.38Å; I70-V95 HydrophobicContact CG2-CG2 4.28Å
71	A	98.2	Very high	97.6	Very high	37 Å²	37	73.6 Å²	73.6	31%	0.306	36%	0.356	S	S	.	.	H	α-helix	trans	-65.3	-43.2	-178.8	0	0	0	0	0	111.9	F67 E68 A74 S75	F67-A71 HydrophobicContact CE1-CB 4.41Å; F67-A71 VanDerWaalsContact O-CB 3.28Å; F67-A71 WeakPolarHBondContact O-CB 3.47Å; F67-A71 PolarHBondContact O-N 3.27Å; E68-A71 PolarHBondContact O-N 3.36Å; A71-A74 PolarHBondContact O-N 2.95Å; A71-S75 WeakPolarHBondContact O-CB 3.47Å; A71-S75 PolarHBondContact O-N 3.42Å
72	E	98.2	Very high	97.5	Very high	106 Å²	106	79.8 Å²	79.8	50%	0.495	37%	0.374	S	S	.	.	H	α-helix	trans	-61.1	-48.6	175	-74.8	-176.3	-168.4	0	0	111.5	E68 A74 S75 R76	E68-E72 WeakPolarHBondContact O-CB 3.49Å; E68-E72 WeakPolarHBondContact O-CG 3.38Å; E68-E72 PolarHBondContact O-N 3.1Å; E72-A74 PolarHBondContact O-N 3.11Å; E72-S75 WeakPolarHBondContact O-CB 3.25Å; E72-S75 PolarHBondContact O-N 2.95Å; E72-R76 WeakPolarHBondContact O-CG 3.28Å; E72-R76 PolarHBondContact O-N 3.03Å; E72-R76 IonicContact OE2-NH2 3.91Å
73	E	98.1	Very high	97.4	Very high	46 Å²	46	79.4 Å²	79.4	22%	0.215	37%	0.374	C	S	.	.	H	α-helix	trans	-65.9	-40.1	-179.3	-167.9	59.9	-149.3	0	0	111.5	R69 I70 S75 R76 L77 A94 L97 N98	R69-E73 WeakPolarHBondContact O-CB 3.36Å; R69-E73 PolarHBondContact O-N 2.8Å; R69-E73 VanDerWaalsContact O-N 3.14Å; I70-E73 PolarHBondContact O-N 3.25Å; E73-S75 VanDerWaalsContact C-N 3.32Å; E73-S75 PolarHBondContact O-N 3.38Å; E73-R76 PolarHBondContact O-N 3.34Å; E73-L77 HydrophobicContact CG-CD1 4.38Å; E73-L77 WeakPolarHBondContact O-CB 3.48Å; E73-L77 VanDerWaalsContact O-CG 3.23Å; E73-L77 WeakPolarHBondContact O-CG 3.44Å; E73-L77 PolarHBondContact O-N 3.14Å; E73-A94 HydrophobicContact CB-CB 3.85Å; E73-A94 HydrophobicContact CG-CB 4.02Å; E73-L97 HydrophobicContact CG-CB 4.31Å; E73-L97 HydrophobicContact CG-CD1 3.85Å; E73-L97 WeakPolarHBondContact OE1-CD1 3.47Å; E73-N98 WeakPolarHBondContact CB-ND2 3.49Å
74	A	98.3	Very high	97.2	Very high	0 Å²	0	83.5 Å²	83.5	0%	0	41%	0.405	C	S	.	.	H	α-helix	trans	-64.6	-37	175.3	0	0	0	0	0	112.4	I70 A71 E72 L77 S78 I86 E90 I91 A94	I70-A74 VanDerWaalsContact O-CB 3.22Å; I70-A74 WeakPolarHBondContact O-CB 3.26Å; I70-A74 PolarHBondContact O-N 3.49Å; A71-A74 PolarHBondContact O-N 2.95Å; E72-A74 PolarHBondContact O-N 3.11Å; A74-L77 PolarHBondContact O-N 3.09Å; A74-S78 PolarHBondContact O-N 3.35Å; A74-I86 HydrophobicContact CB-CG2 3.91Å; A74-E90 HydrophobicContact CB-CB 4.15Å; A74-I91 HydrophobicContact CB-CD1 3.66Å; A74-A94 HydrophobicContact CB-CB 3.99Å
75	S	97.9	Very high	97.2	Very high	42 Å²	42	85.4 Å²	85.4	29%	0.294	42%	0.418	S	S	.	.	H	α-helix	trans	-63.4	-47.6	173.6	-174.1	0	0	0	0	111.2	A71 E72 E73 L77 S78 Q79	A71-S75 WeakPolarHBondContact O-CB 3.47Å; A71-S75 PolarHBondContact O-N 3.42Å; E72-S75 WeakPolarHBondContact O-CB 3.25Å; E72-S75 PolarHBondContact O-N 2.95Å; E73-S75 VanDerWaalsContact C-N 3.32Å; E73-S75 PolarHBondContact O-N 3.38Å; S75-L77 VanDerWaalsContact C-N 3.34Å; S75-L77 PolarHBondContact O-N 2.92Å; S75-S78 PolarHBondContact O-N 3.45Å; S75-Q79 VanDerWaalsContact O-CG 3.28Å; S75-Q79 WeakPolarHBondContact O-CG 3.28Å; S75-Q79 PolarHBondContact O-N 3.19Å; S75-Q79 PolarHBondContact OG-NE2 2.88Å; S75-Q79 VanDerWaalsContact OG-NE2 3.16Å
76	R	97.7	Very high	97.2	Very high	128 Å²	128	86.2 Å²	86.2	48%	0.483	42%	0.422	S	S	.	.	H	α-helix	trans	-58.2	-44.8	175.3	-68.4	176.2	-167.1	-168.9	6	111.7	E72 E73 S78 Q79 H80	E72-R76 WeakPolarHBondContact O-CG 3.28Å; E72-R76 PolarHBondContact O-N 3.03Å; E72-R76 IonicContact OE2-NH2 3.91Å; E73-R76 PolarHBondContact O-N 3.34Å; R76-S78 PolarHBondContact O-N 3.46Å; R76-Q79 PolarHBondContact O-N 3.46Å; R76-H80 VanDerWaalsContact O-CG 3.23Å; R76-H80 PolarHBondContact O-N 2.92Å
77	L	97.8	Very high	97.2	Very high	29 Å²	29	86.6 Å²	86.6	15%	0.152	43%	0.427	C	S	.	.	H	α-helix	trans	-62.4	-41	177.5	-71	167.6	0	0	0	112.9	E73 A74 S75 K81 E90 T93 A94 L97	E73-L77 HydrophobicContact CG-CD1 4.38Å; E73-L77 WeakPolarHBondContact O-CB 3.48Å; E73-L77 VanDerWaalsContact O-CG 3.23Å; E73-L77 WeakPolarHBondContact O-CG 3.44Å; E73-L77 PolarHBondContact O-N 3.14Å; A74-L77 PolarHBondContact O-N 3.09Å; S75-L77 VanDerWaalsContact C-N 3.34Å; S75-L77 PolarHBondContact O-N 2.92Å; L77-K81 PolarHBondContact O-N 3.16Å; L77-E90 HydrophobicContact CB-CB 4.29Å; L77-E90 HydrophobicContact CB-CG 3.9Å; L77-T93 HydrophobicContact CD1-CG2 3.68Å; L77-T93 HydrophobicContact CD2-CG2 4.15Å; L77-A94 HydrophobicContact CD1-CB 4.19Å; L77-L97 HydrophobicContact CD1-CD1 4.29Å; L77-L97 HydrophobicContact CD2-CD1 4.42Å
78	S	97.5	Very high	97.1	Very high	4 Å²	4	84.1 Å²	84.1	3%	0.028	42%	0.422	C	S	.	.	H	α-helix	trans	-65.5	-43.6	176.3	-170	0	0	0	0	111.3	A74 S75 R76 H80 K81 K82 H83 T85	A74-S78 PolarHBondContact O-N 3.35Å; S75-S78 PolarHBondContact O-N 3.45Å; R76-S78 PolarHBondContact O-N 3.46Å; S78-H80 PolarHBondContact O-N 3.48Å; S78-K81 PolarHBondContact O-N 3.08Å; S78-K82 PolarHBondContact O-N 2.86Å; S78-H83 PolarHBondContact O-N 3.14Å; S78-H83 PolarHBondContact OG-O 3.09Å; S78-T85 PolarHBondContact OG-O 3.44Å
79	Q	96.9	Very high	97	Very high	126 Å²	126	83.2 Å²	83.2	59%	0.589	42%	0.421	S	S	*	.	H	α-helix	trans	-63.5	-41.5	177.5	-70.5	174.4	26.2	0	0	112.4	S75 R76 K81 K82	S75-Q79 VanDerWaalsContact O-CG 3.28Å; S75-Q79 WeakPolarHBondContact O-CG 3.28Å; S75-Q79 PolarHBondContact O-N 3.19Å; S75-Q79 PolarHBondContact OG-NE2 2.88Å; S75-Q79 VanDerWaalsContact OG-NE2 3.16Å; R76-Q79 PolarHBondContact O-N 3.46Å; Q79-K81 PolarHBondContact O-N 3.3Å; Q79-K82 PolarHBondContact O-N 2.69Å
80	H	95.8	Very high	97	Very high	152 Å²	152	77.6 Å²	77.6	70%	0.704	40%	0.399	S	S	*	.	H	α-helix	trans	-59.3	-32.6	175.7	-71.4	170.5	0	0	0	112.7	R76 S78 K82	R76-H80 VanDerWaalsContact O-CG 3.23Å; R76-H80 PolarHBondContact O-N 2.92Å; S78-H80 PolarHBondContact O-N 3.48Å; H80-K82 VanDerWaalsContact C-N 3.3Å
81	K	95	Very high	97	Very high	104 Å²	104	79.6 Å²	79.6	45%	0.452	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	1.5	175.6	-64.4	179.4	-175	174	0	113.8	L77 S78 Q79 H83 E90	L77-K81 PolarHBondContact O-N 3.16Å; S78-K81 PolarHBondContact O-N 3.08Å; Q79-K81 PolarHBondContact O-N 3.3Å; K81-H83 PolarHBondContact O-N 3.4Å; K81-E90 IonicContact NZ-OE1 2.74Å; K81-E90 PolarHBondContact NZ-OE1 3.48Å
82	K	95.8	Very high	96.9	Very high	194 Å²	194	80.4 Å²	80.4	84%	0.843	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	34.7	-173.2	-54.2	177.9	-179.3	178.1	0	112.5	S78 Q79 H80	S78-K82 PolarHBondContact O-N 2.86Å; Q79-K82 PolarHBondContact O-N 2.69Å; H80-K82 VanDerWaalsContact C-N 3.3Å
83	H	94.8	Very high	96.9	Very high	106 Å²	106	78.1 Å²	78.1	49%	0.491	40%	0.4	S	S	.	.			trans	-96.9	146.4	173.4	-68.2	-33.9	0	0	0	110.5	S78 K81	S78-H83 PolarHBondContact O-N 3.14Å; S78-H83 PolarHBondContact OG-O 3.09Å; K81-H83 PolarHBondContact O-N 3.4Å
84	S	95.3	Very high	96.9	Very high	130 Å²	130	75.9 Å²	75.9	91%	0.909	39%	0.39	S	S	*	.	S	Bend	trans	-94.7	-2.8	174.3	-53.6	0	0	0	0	112.9
85	T	97.1	Very high	96.9	Very high	98 Å²	98	76.7 Å²	76.7	60%	0.601	40%	0.395	S	S	*	.	S	Bend	trans	-122.6	127.6	-175.9	-53.8	0	0	0	0	109.3	S78	S78-T85 PolarHBondContact OG-O 3.44Å
86	I	97.5	Very high	96.9	Very high	78 Å²	78	82.4 Å²	82.4	40%	0.4	41%	0.41	S	S	.	.			trans	-82	117.6	170.3	-61.3	175.9	0	0	0	107.5	A74 E90 I91	A74-I86 HydrophobicContact CB-CG2 3.91Å; I86-E90 HydrophobicContact CG2-CB 3.98Å; I86-I91 HydrophobicContact CG2-CD1 3.83Å; I86-I91 HydrophobicContact CG2-CG1 4.01Å
87	T	96.8	Very high	96.9	Very high	56 Å²	56	81.3 Å²	81.3	34%	0.344	41%	0.413	S	S	.	.			trans	-98.5	175	178	79.6	0	0	0	0	111	N89 E90 I91	T87-N89 PolarHBondContact O-N 2.97Å; T87-N89 VanDerWaalsContact O-N 3.15Å; T87-N89 WeakPolarHBondContact OG1-CB 3.26Å; T87-N89 PolarHBondContact OG1-N 3.02Å; T87-E90 WeakPolarHBondContact CA-OE2 3.43Å; T87-E90 VanDerWaalsContact CB-OE2 3.28Å; T87-E90 WeakPolarHBondContact CB-OE2 3.37Å; T87-E90 PolarHBondContact N-OE2 3.47Å; T87-E90 PolarHBondContact O-N 3.35Å; T87-E90 PolarHBondContact OG1-OE2 2.9Å; T87-I91 PolarHBondContact O-N 2.97Å
88	T	96.2	Very high	96.8	Very high	70 Å²	70	82.8 Å²	82.8	43%	0.429	42%	0.421	S	S	.	.	H	α-helix	trans	-56.5	-27.8	172.4	51.5	0	0	0	0	112.6	Q92 L115	T88-Q92 WeakPolarHBondContact O-CB 3.36Å; T88-Q92 VanDerWaalsContact O-CG 3.27Å; T88-Q92 WeakPolarHBondContact O-CG 3.39Å; T88-Q92 PolarHBondContact O-N 3.33Å; T88-L115 HydrophobicContact CG2-CD1 4.47Å; T88-L115 HydrophobicContact CG2-CD2 3.89Å
89	N	96.3	Very high	96.8	Very high	92 Å²	92	84.4 Å²	84.4	49%	0.492	43%	0.429	S	S	.	.	H	α-helix	trans	-68.4	-44.7	179.6	-64.4	-23.5	0	0	0	111.5	T87 I91 Q92 T93	T87-N89 PolarHBondContact O-N 2.97Å; T87-N89 VanDerWaalsContact O-N 3.15Å; T87-N89 WeakPolarHBondContact OG1-CB 3.26Å; T87-N89 PolarHBondContact OG1-N 3.02Å; N89-I91 VanDerWaalsContact C-N 3.34Å; N89-I91 PolarHBondContact O-N 3.04Å; N89-Q92 PolarHBondContact O-N 2.92Å; N89-T93 WeakPolarHBondContact O-CB 3.48Å; N89-T93 PolarHBondContact O-N 3.29Å; N89-T93 PolarHBondContact O-OG1 3Å; N89-T93 VanDerWaalsContact O-OG1 3.11Å
90	E	97.5	Very high	96.7	Very high	3 Å²	3	83 Å²	83	1%	0.014	43%	0.431	C	S	.	.	H	α-helix	trans	-63	-42.1	176.4	-74.4	66.7	-130.1	0	0	110.9	A74 L77 K81 I86 T87 T93 A94	A74-E90 HydrophobicContact CB-CB 4.15Å; L77-E90 HydrophobicContact CB-CB 4.29Å; L77-E90 HydrophobicContact CB-CG 3.9Å; K81-E90 IonicContact NZ-OE1 2.74Å; K81-E90 PolarHBondContact NZ-OE1 3.48Å; I86-E90 HydrophobicContact CG2-CB 3.98Å; T87-E90 WeakPolarHBondContact CA-OE2 3.43Å; T87-E90 VanDerWaalsContact CB-OE2 3.28Å; T87-E90 WeakPolarHBondContact CB-OE2 3.37Å; T87-E90 PolarHBondContact N-OE2 3.47Å; T87-E90 PolarHBondContact O-N 3.35Å; T87-E90 PolarHBondContact OG1-OE2 2.9Å; E90-T93 PolarHBondContact O-N 2.98Å; E90-A94 WeakPolarHBondContact O-CB 3.29Å; E90-A94 PolarHBondContact O-N 3.03Å
91	I	98	Very high	96.8	Very high	70 Å²	70	78.5 Å²	78.5	36%	0.359	43%	0.425	S	S	.	.	H	α-helix	trans	-63.5	-45.8	176.9	-58.9	-67.3	0	0	0	111.3	I70 A74 I86 T87 N89 T93 A94 V95	I70-I91 HydrophobicContact CG2-CG2 4.32Å; A74-I91 HydrophobicContact CB-CD1 3.66Å; I86-I91 HydrophobicContact CG2-CD1 3.83Å; I86-I91 HydrophobicContact CG2-CG1 4.01Å; T87-I91 PolarHBondContact O-N 2.97Å; N89-I91 VanDerWaalsContact C-N 3.34Å; N89-I91 PolarHBondContact O-N 3.04Å; I91-T93 PolarHBondContact O-N 3.37Å; I91-A94 PolarHBondContact O-N 3.36Å; I91-V95 VanDerWaalsContact O-CG2 3.28Å; I91-V95 WeakPolarHBondContact O-CG2 3.32Å; I91-V95 PolarHBondContact O-N 2.9Å
92	Q	97.4	Very high	96.9	Very high	54 Å²	54	78.8 Å²	78.8	25%	0.252	43%	0.428	S	S	.	.	H	α-helix	trans	-64	-40.3	178.9	-76.4	-178.3	10.8	0	0	112.3	T88 N89 R96 V108 T112	T88-Q92 WeakPolarHBondContact O-CB 3.36Å; T88-Q92 VanDerWaalsContact O-CG 3.27Å; T88-Q92 WeakPolarHBondContact O-CG 3.39Å; T88-Q92 PolarHBondContact O-N 3.33Å; N89-Q92 PolarHBondContact O-N 2.92Å; Q92-R96 WeakPolarHBondContact O-CG 3.48Å; Q92-R96 PolarHBondContact O-N 3.11Å; Q92-R96 VanDerWaalsContact O-N 3.16Å; Q92-V108 HydrophobicContact CG-CG1 4.39Å; Q92-T112 PolarHBondContact NE2-OG1 2.86Å
93	T	97.6	Very high	97	Very high	58 Å²	58	75 Å²	75	36%	0.356	42%	0.417	S	S	.	.	H	α-helix	trans	-67.7	-44.2	175.5	-61.4	0	0	0	0	110.9	L77 N89 E90 I91 V95 R96 L97	L77-T93 HydrophobicContact CD1-CG2 3.68Å; L77-T93 HydrophobicContact CD2-CG2 4.15Å; N89-T93 WeakPolarHBondContact O-CB 3.48Å; N89-T93 PolarHBondContact O-N 3.29Å; N89-T93 PolarHBondContact O-OG1 3Å; N89-T93 VanDerWaalsContact O-OG1 3.11Å; E90-T93 PolarHBondContact O-N 2.98Å; I91-T93 PolarHBondContact O-N 3.37Å; T93-V95 VanDerWaalsContact C-N 3.28Å; T93-V95 PolarHBondContact O-N 3.28Å; T93-R96 WeakPolarHBondContact O-CB 3.45Å; T93-R96 PolarHBondContact O-N 3.14Å; T93-L97 HydrophobicContact CG2-CD1 4.13Å; T93-L97 HydrophobicContact CG2-CG 4.45Å; T93-L97 WeakPolarHBondContact O-CG 3.41Å; T93-L97 PolarHBondContact O-N 3.47Å
94	A	98.1	Very high	97.1	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-57.2	-40.7	175.3	0	0	0	0	0	112.5	I70 E73 A74 L77 E90 I91 L97 N98	I70-A94 HydrophobicContact CG2-CB 4.07Å; E73-A94 HydrophobicContact CB-CB 3.85Å; E73-A94 HydrophobicContact CG-CB 4.02Å; A74-A94 HydrophobicContact CB-CB 3.99Å; L77-A94 HydrophobicContact CD1-CB 4.19Å; E90-A94 WeakPolarHBondContact O-CB 3.29Å; E90-A94 PolarHBondContact O-N 3.03Å; I91-A94 PolarHBondContact O-N 3.36Å; A94-L97 PolarHBondContact O-N 2.92Å; A94-N98 WeakPolarHBondContact O-CB 3.47Å; A94-N98 PolarHBondContact O-N 3.14Å; A94-N98 PolarHBondContact O-ND2 2.91Å
95	V	98.2	Very high	97.2	Very high	16 Å²	16	70.6 Å²	70.6	10%	0.097	38%	0.382	C	S	.	.	H	α-helix	trans	-60.3	-44.8	173.4	165.5	0	0	0	0	111.4	I70 I91 T93 L97 N98 I99 A107 V108	I70-V95 HydrophobicContact CD1-CG2 3.93Å; I70-V95 HydrophobicContact CG1-CG2 4.38Å; I70-V95 HydrophobicContact CG2-CG2 4.28Å; I91-V95 VanDerWaalsContact O-CG2 3.28Å; I91-V95 WeakPolarHBondContact O-CG2 3.32Å; I91-V95 PolarHBondContact O-N 2.9Å; T93-V95 VanDerWaalsContact C-N 3.28Å; T93-V95 PolarHBondContact O-N 3.28Å; V95-L97 VanDerWaalsContact C-N 3.28Å; V95-L97 PolarHBondContact O-N 3.39Å; V95-N98 PolarHBondContact O-N 3.49Å; V95-I99 HydrophobicContact CG1-CD1 4.04Å; V95-I99 HydrophobicContact CG1-CG1 4.47Å; V95-I99 WeakPolarHBondContact O-CB 3.4Å; V95-I99 PolarHBondContact O-N 3.42Å; V95-A107 HydrophobicContact CG1-CB 3.74Å; V95-V108 HydrophobicContact CG1-CG2 3.93Å
96	R	97.3	Very high	97.2	Very high	162 Å²	162	71.3 Å²	71.3	61%	0.611	38%	0.378	S	S	*	.	H	α-helix	trans	-66.8	-29.2	178.8	-69.3	172.2	-175.7	-116.2	5.2	113	Q92 T93 V108	Q92-R96 WeakPolarHBondContact O-CG 3.48Å; Q92-R96 PolarHBondContact O-N 3.11Å; Q92-R96 VanDerWaalsContact O-N 3.16Å; T93-R96 WeakPolarHBondContact O-CB 3.45Å; T93-R96 PolarHBondContact O-N 3.14Å; R96-V108 HydrophobicContact CG-CG2 4.05Å
97	L	97.5	Very high	97.2	Very high	105 Å²	105	69.2 Å²	69.2	55%	0.55	37%	0.373	S	S	.	.	H	α-helix	trans	-78.5	-34.9	177.3	-68	173.1	0	0	0	112.4	E73 L77 T93 A94 V95	E73-L97 HydrophobicContact CG-CB 4.31Å; E73-L97 HydrophobicContact CG-CD1 3.85Å; E73-L97 WeakPolarHBondContact OE1-CD1 3.47Å; L77-L97 HydrophobicContact CD1-CD1 4.29Å; L77-L97 HydrophobicContact CD2-CD1 4.42Å; T93-L97 HydrophobicContact CG2-CD1 4.13Å; T93-L97 HydrophobicContact CG2-CG 4.45Å; T93-L97 WeakPolarHBondContact O-CG 3.41Å; T93-L97 PolarHBondContact O-N 3.47Å; A94-L97 PolarHBondContact O-N 2.92Å; V95-L97 VanDerWaalsContact C-N 3.28Å; V95-L97 PolarHBondContact O-N 3.39Å
98	N	97.1	Very high	97.3	Very high	61 Å²	61	67.4 Å²	67.4	33%	0.326	36%	0.361	S	S	.	.	H	α-helix	trans	-91.8	-28.1	-175.8	-78.8	-82.1	0	0	0	114.4	E73 A94 V95	E73-N98 WeakPolarHBondContact CB-ND2 3.49Å; A94-N98 WeakPolarHBondContact O-CB 3.47Å; A94-N98 PolarHBondContact O-N 3.14Å; A94-N98 PolarHBondContact O-ND2 2.91Å; V95-N98 PolarHBondContact O-N 3.49Å
99	I	96	Very high	97.4	Very high	37 Å²	37	66.4 Å²	66.4	19%	0.19	36%	0.358	C	S	.	.	S	Bend	trans	-108.4	128.8	-172.8	-54.5	-171.2	0	0	0	109.9	V95 L103 A104 A107	V95-I99 HydrophobicContact CG1-CD1 4.04Å; V95-I99 HydrophobicContact CG1-CG1 4.47Å; V95-I99 WeakPolarHBondContact O-CB 3.4Å; V95-I99 PolarHBondContact O-N 3.42Å; I99-L103 HydrophobicContact CG2-CB 3.45Å; I99-L103 VanDerWaalsContact CG2-CB 3.45Å; I99-A104 HydrophobicContact CB-CB 4.18Å; I99-A104 HydrophobicContact CG2-CB 4.31Å; I99-A104 VanDerWaalsContact O-CB 3.27Å; I99-A104 WeakPolarHBondContact O-CB 3.46Å; I99-A107 HydrophobicContact CD1-CB 4.19Å
100	P	96.4	Very high	97.4	Very high	97 Å²	97	66.7 Å²	66.7	63%	0.63	36%	0.359	S	S	*	.			trans	-80.5	147.1	-175.1	30.7	-35.2	0	0	0	113.7	L103	P100-L103 WeakPolarHBondContact O-CB 3.39Å; P100-L103 PolarHBondContact O-N 3.37Å
101	G	96	Very high	97.4	Very high	57 Å²	57	68.5 Å²	68.5	59%	0.588	38%	0.378	S	S	*	.	H	α-helix	trans	54.7	-133.2	160.8	0	0	0	0	0	115.6	L103 A104	G101-L103 PolarHBondContact O-N 3.12Å; G101-A104 PolarHBondContact O-N 2.79Å
102	E	97.3	Very high	97.4	Very high	110 Å²	110	67.9 Å²	67.9	51%	0.514	38%	0.378	S	S	.	.	H	α-helix	trans	-62	-30.2	-178.4	-67.8	-55.3	122.3	0	0	112.9	A104 K105 H106	E102-A104 VanDerWaalsContact C-N 3.3Å; E102-A104 PolarHBondContact O-N 3.1Å; E102-K105 WeakPolarHBondContact O-CB 3.33Å; E102-K105 PolarHBondContact O-N 2.98Å; E102-K105 VanDerWaalsContact O-N 3.11Å; E102-K105 WeakPolarHBondContact OE1-CE 3.49Å; E102-K105 IonicContact OE1-NZ 2.68Å; E102-K105 PolarHBondContact OE1-NZ 3.49Å; E102-K105 WeakPolarHBondContact OE2-CD 3.32Å; E102-K105 IonicContact OE2-NZ 3.79Å; E102-H106 PolarHBondContact O-CD2 3.21Å; E102-H106 PolarHBondContact O-N 3.45Å
103	L	97.6	Very high	97.4	Very high	115 Å²	115	70.8 Å²	70.8	60%	0.602	39%	0.39	S	S	*	.	H	α-helix	trans	-61.4	-38.8	178.4	-65.8	174.8	0	0	0	111.6	I99 P100 G101 H106 A107	I99-L103 HydrophobicContact CG2-CB 3.45Å; I99-L103 VanDerWaalsContact CG2-CB 3.45Å; P100-L103 WeakPolarHBondContact O-CB 3.39Å; P100-L103 PolarHBondContact O-N 3.37Å; G101-L103 PolarHBondContact O-N 3.12Å; L103-H106 PolarHBondContact O-N 3.36Å; L103-A107 VanDerWaalsContact O-CB 3.29Å; L103-A107 WeakPolarHBondContact O-CB 3.47Å; L103-A107 PolarHBondContact O-N 2.99Å
104	A	97.6	Very high	97.3	Very high	11 Å²	11	70.9 Å²	70.9	9%	0.091	40%	0.396	C	S	.	.	H	α-helix	trans	-64.5	-40.5	174.9	0	0	0	0	0	112.1	I99 G101 E102 H106 A107 V108	I99-A104 HydrophobicContact CB-CB 4.18Å; I99-A104 HydrophobicContact CG2-CB 4.31Å; I99-A104 VanDerWaalsContact O-CB 3.27Å; I99-A104 WeakPolarHBondContact O-CB 3.46Å; G101-A104 PolarHBondContact O-N 2.79Å; E102-A104 VanDerWaalsContact C-N 3.3Å; E102-A104 PolarHBondContact O-N 3.1Å; A104-H106 PolarHBondContact O-N 2.73Å; A104-A107 PolarHBondContact O-N 3.36Å; A104-V108 WeakPolarHBondContact O-CB 3.39Å; A104-V108 WeakPolarHBondContact O-CG2 3.38Å; A104-V108 PolarHBondContact O-N 3.4Å
105	K	97.5	Very high	97.2	Very high	133 Å²	133	73.9 Å²	73.9	58%	0.578	41%	0.412	S	S	*	.	H	α-helix	trans	-61.2	-46	177.5	-64.1	-179.8	-175.8	168.7	0	111	E102 S109	E102-K105 WeakPolarHBondContact O-CB 3.33Å; E102-K105 PolarHBondContact O-N 2.98Å; E102-K105 VanDerWaalsContact O-N 3.11Å; E102-K105 WeakPolarHBondContact OE1-CE 3.49Å; E102-K105 IonicContact OE1-NZ 2.68Å; E102-K105 PolarHBondContact OE1-NZ 3.49Å; E102-K105 WeakPolarHBondContact OE2-CD 3.32Å; E102-K105 IonicContact OE2-NZ 3.79Å; K105-S109 WeakPolarHBondContact O-CB 3.29Å; K105-S109 PolarHBondContact O-N 3.46Å
106	H	97.9	Very high	97.1	Very high	112 Å²	112	77.2 Å²	77.2	52%	0.519	43%	0.433	S	S	.	.	H	α-helix	trans	-65.5	-42.8	176.4	-71	-67.3	0	0	0	112.6	E102 L103 A104 S109 N110	E102-H106 PolarHBondContact O-CD2 3.21Å; E102-H106 PolarHBondContact O-N 3.45Å; L103-H106 PolarHBondContact O-N 3.36Å; A104-H106 PolarHBondContact O-N 2.73Å; H106-S109 PolarHBondContact O-N 3.09Å; H106-N110 WeakPolarHBondContact O-CB 3.32Å; H106-N110 VanDerWaalsContact O-CG 3.28Å; H106-N110 PolarHBondContact O-N 3.34Å; H106-N110 PolarHBondContact O-ND2 3.41Å
107	A	97.7	Very high	97.1	Very high	35 Å²	35	78.8 Å²	78.8	29%	0.289	44%	0.439	S	S	.	.	H	α-helix	trans	-60.7	-47.9	178.5	0	0	0	0	0	111.8	V95 I99 L103 A104 N110 G111	V95-A107 HydrophobicContact CG1-CB 3.74Å; I99-A107 HydrophobicContact CD1-CB 4.19Å; L103-A107 VanDerWaalsContact O-CB 3.29Å; L103-A107 WeakPolarHBondContact O-CB 3.47Å; L103-A107 PolarHBondContact O-N 2.99Å; A104-A107 PolarHBondContact O-N 3.36Å; A107-N110 PolarHBondContact O-N 3.21Å; A107-G111 PolarHBondContact O-N 2.91Å
108	V	97.6	Very high	97	Very high	17 Å²	17	81.8 Å²	81.8	10%	0.103	44%	0.444	C	S	.	.	H	α-helix	trans	-63.2	-43.8	176.1	174	0	0	0	0	110.9	Q92 V95 R96 A104 N110 G111 T112	Q92-V108 HydrophobicContact CG-CG1 4.39Å; V95-V108 HydrophobicContact CG1-CG2 3.93Å; R96-V108 HydrophobicContact CG-CG2 4.05Å; A104-V108 WeakPolarHBondContact O-CB 3.39Å; A104-V108 WeakPolarHBondContact O-CG2 3.38Å; A104-V108 PolarHBondContact O-N 3.4Å; V108-N110 PolarHBondContact O-N 3.42Å; V108-G111 PolarHBondContact O-N 3.39Å; V108-T112 PolarHBondContact O-N 3.42Å; V108-T112 PolarHBondContact O-OG1 3.49Å; V108-T112 VanDerWaalsContact O-OG1 3.11Å
109	S	97.8	Very high	96.9	Very high	50 Å²	50	82.3 Å²	82.3	35%	0.35	45%	0.446	S	S	.	.	H	α-helix	trans	-59.2	-46.1	177	-174.3	0	0	0	0	112.2	K105 H106 T112 K113	K105-S109 WeakPolarHBondContact O-CB 3.29Å; K105-S109 PolarHBondContact O-N 3.46Å; H106-S109 PolarHBondContact O-N 3.09Å; S109-T112 PolarHBondContact O-N 3.16Å; S109-K113 WeakPolarHBondContact O-CG 3.39Å; S109-K113 PolarHBondContact O-N 2.94Å
110	N	97.2	Very high	96.8	Very high	97 Å²	97	83.1 Å²	83.1	52%	0.519	46%	0.458	S	S	.	.	H	α-helix	trans	-65.3	-41	177.7	-72.8	-19.3	0	0	0	111.7	H106 A107 V108 K113 A114	H106-N110 WeakPolarHBondContact O-CB 3.32Å; H106-N110 VanDerWaalsContact O-CG 3.28Å; H106-N110 PolarHBondContact O-N 3.34Å; H106-N110 PolarHBondContact O-ND2 3.41Å; A107-N110 PolarHBondContact O-N 3.21Å; V108-N110 PolarHBondContact O-N 3.42Å; N110-K113 PolarHBondContact O-N 2.86Å; N110-A114 WeakPolarHBondContact O-CB 3.47Å; N110-A114 PolarHBondContact O-N 2.96Å
111	G	97.4	Very high	96.7	Very high	41 Å²	41	85.9 Å²	85.9	42%	0.423	46%	0.46	S	S	.	.	H	α-helix	trans	-59.7	-47.2	174.7	0	0	0	0	0	112.5	A107 V108 K113 A114 L115	A107-G111 PolarHBondContact O-N 2.91Å; V108-G111 PolarHBondContact O-N 3.39Å; G111-K113 PolarHBondContact O-N 2.91Å; G111-A114 PolarHBondContact O-N 2.93Å; G111-L115 PolarHBondContact O-N 3.4Å
112	T	97.4	Very high	96.3	Very high	57 Å²	57	85.9 Å²	85.9	35%	0.35	45%	0.451	S	S	.	.	H	α-helix	trans	-62.8	-43.1	176.7	-59.5	0	0	0	0	111.8	Q92 V108 S109 A114 L115 T116	Q92-T112 PolarHBondContact NE2-OG1 2.86Å; V108-T112 PolarHBondContact O-N 3.42Å; V108-T112 PolarHBondContact O-OG1 3.49Å; V108-T112 VanDerWaalsContact O-OG1 3.11Å; S109-T112 PolarHBondContact O-N 3.16Å; T112-A114 VanDerWaalsContact C-N 3.32Å; T112-A114 PolarHBondContact O-N 3.42Å; T112-L115 PolarHBondContact O-N 2.87Å; T112-T116 PolarHBondContact O-N 2.98Å; T112-T116 PolarHBondContact O-OG1 2.74Å; T112-T116 VanDerWaalsContact O-OG1 3.11Å
113	K	97.5	Very high	95.5	Very high	115 Å²	115	87.7 Å²	87.7	50%	0.5	46%	0.457	S	S	.	.	H	α-helix	trans	-59.4	-42.7	174.9	-73	172.2	-172.4	172.4	0	111.9	S109 N110 G111 R117	S109-K113 WeakPolarHBondContact O-CG 3.39Å; S109-K113 PolarHBondContact O-N 2.94Å; N110-K113 PolarHBondContact O-N 2.86Å; G111-K113 PolarHBondContact O-N 2.91Å; K113-R117 WeakPolarHBondContact O-CG 3.07Å; K113-R117 PolarHBondContact O-N 3.35Å; K113-R117 VanDerWaalsContact O-N 3.1Å
114	A	96.9	Very high	94.2	Very high	60 Å²	60	87 Å²	87	50%	0.496	46%	0.458	S	S	.	.	H	α-helix	trans	-63.5	-44.2	177.6	0	0	0	0	0	111.6	N110 G111 T112 R117 Y118	N110-A114 WeakPolarHBondContact O-CB 3.47Å; N110-A114 PolarHBondContact O-N 2.96Å; G111-A114 PolarHBondContact O-N 2.93Å; T112-A114 VanDerWaalsContact C-N 3.32Å; T112-A114 PolarHBondContact O-N 3.42Å; A114-R117 PolarHBondContact O-N 3.43Å; A114-Y118 WeakPolarHBondContact O-CB 3.46Å; A114-Y118 PolarHBondContact O-N 3.01Å
115	L	95.5	Very high	92.8	Very high	63 Å²	63	91.7 Å²	91.7	33%	0.33	49%	0.486	S	S	.	.	H	α-helix	trans	-61.1	-46.6	176.8	-178.4	62.3	0	0	0	111.9	T88 G111 T112 R117 Y118 I119	T88-L115 HydrophobicContact CG2-CD1 4.47Å; T88-L115 HydrophobicContact CG2-CD2 3.89Å; G111-L115 PolarHBondContact O-N 3.4Å; T112-L115 PolarHBondContact O-N 2.87Å; L115-R117 PolarHBondContact O-N 3.31Å; L115-Y118 WeakPolarHBondContact O-CB 3.27Å; L115-Y118 PolarHBondContact O-N 3.32Å; L115-I119 HydrophobicContact CD1-CD1 4Å; L115-I119 HydrophobicContact CD1-CG1 4.3Å; L115-I119 HydrophobicContact CG-CD1 3.87Å; L115-I119 WeakPolarHBondContact O-CG1 3.35Å; L115-I119 PolarHBondContact O-N 3.4Å
116	T	96.2	Very high	91.2	Very high	86 Å²	86	89.6 Å²	89.6	53%	0.528	49%	0.493	S	S	.	.	H	α-helix	trans	-59.8	-44.5	177.5	-59	0	0	0	0	111.8	T112 Y118 I119 A120	T112-T116 PolarHBondContact O-N 2.98Å; T112-T116 PolarHBondContact O-OG1 2.74Å; T112-T116 VanDerWaalsContact O-OG1 3.11Å; T116-Y118 VanDerWaalsContact C-N 3.33Å; T116-Y118 PolarHBondContact O-N 3.41Å; T116-I119 PolarHBondContact O-N 3.19Å; T116-A120 WeakPolarHBondContact O-CB 3.44Å; T116-A120 PolarHBondContact O-N 3.17Å
117	R	96.3	Very high	88.8	Confident	195 Å²	195	95.2 Å²	95.2	74%	0.736	52%	0.52	S	S	*	.	H	α-helix	trans	-63.1	-39.8	176.6	-72.3	178.4	-177.6	-163.1	0.4	112	K113 A114 L115 A120 K121	K113-R117 WeakPolarHBondContact O-CG 3.07Å; K113-R117 PolarHBondContact O-N 3.35Å; K113-R117 VanDerWaalsContact O-N 3.1Å; A114-R117 PolarHBondContact O-N 3.43Å; L115-R117 PolarHBondContact O-N 3.31Å; R117-A120 PolarHBondContact O-N 2.74Å; R117-K121 WeakPolarHBondContact O-CB 3.41Å; R117-K121 PolarHBondContact O-N 3.26Å
118	Y	95.5	Very high	88.3	Confident	168 Å²	168	98.3 Å²	98.3	66%	0.659	53%	0.531	S	S	*	.	H	α-helix	trans	-62.8	-49.1	177	177.8	-98.9	0	0	0	111.5	A114 L115 T116 A120 K121 S122	A114-Y118 WeakPolarHBondContact O-CB 3.46Å; A114-Y118 PolarHBondContact O-N 3.01Å; L115-Y118 WeakPolarHBondContact O-CB 3.27Å; L115-Y118 PolarHBondContact O-N 3.32Å; T116-Y118 VanDerWaalsContact C-N 3.33Å; T116-Y118 PolarHBondContact O-N 3.41Å; Y118-A120 VanDerWaalsContact C-N 3.33Å; Y118-A120 PolarHBondContact O-N 2.8Å; Y118-K121 PolarHBondContact O-N 3.16Å; Y118-S122 PolarHBondContact O-N 3.35Å
119	I	95.2	Very high	87.8	Confident	73 Å²	73	102.5 Å²	102.5	37%	0.374	55%	0.554	S	S	.	*	H	α-helix	trans	-62.2	-39.6	177.8	-65.7	167.4	0	0	0	111.3	L115 T116 S122 K123	L115-I119 HydrophobicContact CD1-CD1 4Å; L115-I119 HydrophobicContact CD1-CG1 4.3Å; L115-I119 HydrophobicContact CG-CD1 3.87Å; L115-I119 WeakPolarHBondContact O-CG1 3.35Å; L115-I119 PolarHBondContact O-N 3.4Å; T116-I119 PolarHBondContact O-N 3.19Å; I119-S122 WeakPolarHBondContact CA-OG 3.46Å; I119-S122 PolarHBondContact O-N 3.27Å; I119-S122 PolarHBondContact O-OG 3.1Å; I119-K123 WeakPolarHBondContact O-CG 3.49Å; I119-K123 PolarHBondContact O-N 3.02Å
120	A	94.5	Very high	87.3	Confident	53 Å²	53	105.4 Å²	105.4	44%	0.438	57%	0.565	S	S	.	*	H	α-helix	trans	-61.9	-46	176.4	0	0	0	0	0	111.4	T116 R117 Y118 S122 K123 T124	T116-A120 WeakPolarHBondContact O-CB 3.44Å; T116-A120 PolarHBondContact O-N 3.17Å; R117-A120 PolarHBondContact O-N 2.74Å; Y118-A120 VanDerWaalsContact C-N 3.33Å; Y118-A120 PolarHBondContact O-N 2.8Å; A120-S122 PolarHBondContact O-N 3.31Å; A120-K123 PolarHBondContact O-N 3.3Å; A120-T124 PolarHBondContact O-N 3.26Å; A120-T124 PolarHBondContact O-OG1 3.35Å
121	K	93.3	Very high	86.7	Confident	156 Å²	156	105.9 Å²	105.9	68%	0.678	57%	0.568	S	S	*	*	H	α-helix	trans	-65.7	-37.2	178.7	-172.2	177.3	178.8	-178.3	0	112.7	R117 Y118 T124 T125	R117-K121 WeakPolarHBondContact O-CB 3.41Å; R117-K121 PolarHBondContact O-N 3.26Å; Y118-K121 PolarHBondContact O-N 3.16Å; K121-T124 PolarHBondContact O-N 2.88Å; K121-T125 PolarHBondContact O-N 3.43Å; K121-T125 PolarHBondContact O-OG1 3.24Å
122	S	88.2	Confident	86	Confident	57 Å²	57	110 Å²	110	40%	0.399	58%	0.577	S	S	.	*	H	α-helix	trans	-68.3	-34.8	179	66.7	0	0	0	0	112.3	Y118 I119 A120 T125	Y118-S122 PolarHBondContact O-N 3.35Å; I119-S122 WeakPolarHBondContact CA-OG 3.46Å; I119-S122 PolarHBondContact O-N 3.27Å; I119-S122 PolarHBondContact O-OG 3.1Å; A120-S122 PolarHBondContact O-N 3.31Å; S122-T125 PolarHBondContact O-N 3.11Å
123	K	79.8	Confident	85.3	Confident	147 Å²	147	113.5 Å²	113.5	64%	0.639	59%	0.592	S	S	*	*	H	α-helix	trans	-66.5	-41.5	174.6	-72.1	-178.7	179.7	-173.3	0	112.4	I119 A120 T125 A126	I119-K123 WeakPolarHBondContact O-CG 3.49Å; I119-K123 PolarHBondContact O-N 3.02Å; A120-K123 PolarHBondContact O-N 3.3Å; K123-T125 VanDerWaalsContact C-N 3.28Å; K123-T125 PolarHBondContact O-N 3.31Å; K123-A126 PolarHBondContact O-N 2.68Å
124	T	71.9	Confident	84.4	Confident	102 Å²	102	113.4 Å²	113.4	63%	0.626	60%	0.598	S	S	*	*	H	α-helix	trans	-67.2	-27.3	178.2	-52.4	0	0	0	0	113	A120 K121 A126	A120-T124 PolarHBondContact O-N 3.26Å; A120-T124 PolarHBondContact O-OG1 3.35Å; K121-T124 PolarHBondContact O-N 2.88Å; T124-A126 VanDerWaalsContact C-N 3.29Å
125	T	66.4	Low	83.4	Confident	109 Å²	109	117.5 Å²	117.5	67%	0.669	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	-11	179.3	-46	0	0	0	0	112.5	K121 S122 K123	K121-T125 PolarHBondContact O-N 3.43Å; K121-T125 PolarHBondContact O-OG1 3.24Å; S122-T125 PolarHBondContact O-N 3.11Å; K123-T125 VanDerWaalsContact C-N 3.28Å; K123-T125 PolarHBondContact O-N 3.31Å
126	A	64.3	Low	82.4	Confident	88 Å²	88	122.1 Å²	122.1	73%	0.727	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	6.6	-179.7	0	0	0	0	0	113.6	K123 T124	K123-A126 PolarHBondContact O-N 2.68Å; T124-A126 VanDerWaalsContact C-N 3.29Å
127	Q	47.6	Very low	81.2	Confident	231 Å²	231	125.4 Å²	125.4	100%	1.079	64%	0.639	S	S	*	*			trans	-114	0	172.2	-67.2	-173.6	-23.6	0	0	109.3

Retrieved 127 of 127 residues in 211.5 ms (Link to these results)

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