A0A077ZEH6_TRITR Loading...

Histone H3

Putative variant histone H3 which may replace conventional H3 in a subset of nucleosomes. 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 A0A077ZEH6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 136 aa.

						>A0A077ZEH6_TRITR|A0A077ZEH6
MARTKQTARKSTGGKAPRKQLATKAARKSAPSVGAVKKAHRYRPGTVALREIRRYQKSTEMLIGRLPLRRLVREIAQDFKPDLRFKVAAVLALQEAAEAYLVGLFEDTNLCAIHARRVTIMAKDIQLARRIRAERA
					

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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	47.5	Very low	64.1	Low	253 Å²	253	175.5 Å²	175.5	100%	1.246	90%	0.901	S	S	*	*				0	111.3	0	-77	179.2	176.6	0	0	109
2	A	61.4	Low	64	Low	101 Å²	101	170.9 Å²	170.9	84%	0.835	89%	0.888	S	S	*	*			trans	-99.9	116.6	176.4	0	0	0	0	0	109.7	T4	A2-T4 PolarHBondContact O-N 3.35Å
3	R	63.9	Low	63.5	Low	253 Å²	253	164.5 Å²	164.5	96%	0.955	89%	0.889	S	S	*	*			trans	-69.2	114.1	177.3	-96.9	178.6	167.1	178.4	-3.4	110.2
4	T	71.7	Confident	63.5	Low	135 Å²	135	157.6 Å²	157.6	83%	0.828	88%	0.875	S	S	*	*			trans	-78.6	118.6	165.7	43.3	0	0	0	0	109.6	A2 Q6	A2-T4 PolarHBondContact O-N 3.35Å; T4-Q6 PolarHBondContact O-N 2.86Å
5	K	71.3	Confident	63.4	Low	201 Å²	201	160.8 Å²	160.8	87%	0.874	88%	0.876	S	S	*	*			trans	-76.8	100.5	179	-148.2	175.9	-171.8	179.4	0	108.4	T7	K5-T7 PolarHBondContact O-N 3.08Å
6	Q	70.5	Confident	63.3	Low	192 Å²	192	156.5 Å²	156.5	90%	0.897	87%	0.869	S	S	*	*			trans	-64	112.1	169	-90.9	-174.9	-17.1	0	0	109.2	T4	T4-Q6 PolarHBondContact O-N 2.86Å
7	T	66.3	Low	63.6	Low	127 Å²	127	155.1 Å²	155.1	78%	0.779	87%	0.869	S	S	*	*	P	Polyproline II helix	trans	-84.2	119.1	166.3	52.6	0	0	0	0	109.2	K5 R9	K5-T7 PolarHBondContact O-N 3.08Å; T7-R9 PolarHBondContact O-N 3.13Å
8	A	64.5	Low	63.5	Low	103 Å²	103	160.1 Å²	160.1	85%	0.851	87%	0.872	S	S	*	*	P	Polyproline II helix	trans	-60.4	118.5	176.1	0	0	0	0	0	111.4
9	R	62.3	Low	63	Low	246 Å²	246	162.7 Å²	162.7	93%	0.928	87%	0.874	S	S	*	*	P	Polyproline II helix	trans	-79.2	119.5	165.8	-106.6	-179.6	165.8	-178.4	-2.7	108.4	T7	T7-R9 PolarHBondContact O-N 3.13Å
10	K	60.2	Low	62.5	Low	194 Å²	194	164.2 Å²	164.2	84%	0.843	88%	0.875	S	S	*	*	P	Polyproline II helix	trans	-57.9	137.9	172.1	-75.3	-179.3	176.6	-179.7	0	110.4	T12	K10-T12 VanDerWaalsContact C-N 3.25Å; K10-T12 PolarHBondContact O-N 3.19Å
11	S	65.2	Low	62.2	Low	125 Å²	125	164.6 Å²	164.6	87%	0.874	88%	0.877	S	S	*	*	S	Bend	trans	-75.4	2.2	-173.4	45.5	0	0	0	0	115.4
12	T	63.2	Low	62.7	Low	121 Å²	121	157.2 Å²	157.2	74%	0.742	86%	0.856	S	S	*	*			trans	-121.2	76.3	-177.9	44.6	0	0	0	0	111.3	K10 G14	K10-T12 VanDerWaalsContact C-N 3.25Å; K10-T12 PolarHBondContact O-N 3.19Å; T12-G14 VanDerWaalsContact C-N 3.34Å; T12-G14 PolarHBondContact O-N 3.2Å; T12-G14 VanDerWaalsContact O-N 3.13Å
13	G	57.1	Low	62.6	Low	88 Å²	88	158.6 Å²	158.6	91%	0.907	85%	0.854	S	S	*	*			trans	-82.4	69	174.7	0	0	0	0	0	112.9
14	G	64	Low	62.2	Low	67 Å²	67	156 Å²	156	69%	0.691	85%	0.85	S	S	*	*			trans	-102.9	130.3	166.9	0	0	0	0	0	110	T12	T12-G14 VanDerWaalsContact C-N 3.34Å; T12-G14 PolarHBondContact O-N 3.2Å; T12-G14 VanDerWaalsContact O-N 3.13Å
15	K	61.6	Low	61.5	Low	206 Å²	206	154.7 Å²	154.7	90%	0.896	85%	0.852	S	S	*	*			trans	-36.9	140.4	-170.8	-72.6	176.7	174.8	174.6	0	116
16	A	62.7	Low	60.7	Low	92 Å²	92	149.3 Å²	149.3	76%	0.76	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-55.2	134.8	170.4	0	0	0	0	0	111.9	R18	A16-R18 PolarHBondContact O-N 3.24Å
17	P	68.2	Low	60	Low	133 Å²	133	151.1 Å²	151.1	86%	0.864	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-75.3	118.5	177.6	25.5	-24.1	0	0	0	109.9
18	R	61.4	Low	59.4	Low	244 Å²	244	155.4 Å²	155.4	92%	0.921	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-96.2	132.5	170.5	-98.5	-176.5	173.7	179.1	-2.4	110	A16	A16-R18 PolarHBondContact O-N 3.24Å
19	K	54.2	Low	58.8	Low	211 Å²	211	155.7 Å²	155.7	92%	0.917	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-51	143.4	174.7	-90.7	177.5	169.5	179.7	0	112.3
20	Q	53.7	Low	58.8	Low	192 Å²	192	148.1 Å²	148.1	90%	0.897	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-61.2	133.3	-177.4	-65.6	171.3	-6.9	0	0	113
21	L	55.1	Low	58.6	Low	172 Å²	172	144.9 Å²	144.9	90%	0.901	84%	0.837	S	S	*	*			trans	-151.1	118.3	152	-98.4	131.7	0	0	0	106.5	T23	L21-T23 PolarHBondContact O-N 3.16Å
22	A	57.3	Low	58.1	Low	99 Å²	99	143.9 Å²	143.9	82%	0.818	83%	0.829	S	S	*	*			trans	-72.6	119.1	-177.3	0	0	0	0	0	110.8
23	T	59.3	Low	57.8	Low	130 Å²	130	145.4 Å²	145.4	80%	0.798	84%	0.838	S	S	*	*			trans	-161.2	118.9	156.9	37.1	0	0	0	0	109.9	L21	L21-T23 PolarHBondContact O-N 3.16Å
24	K	56.4	Low	58.2	Low	199 Å²	199	143.9 Å²	143.9	87%	0.865	82%	0.823	S	S	*	*			trans	44.4	126.8	150.2	-76.2	174	173.3	174.6	0	118.2	A26	K24-A26 PolarHBondContact O-N 3.36Å
25	A	56.5	Low	58.4	Low	106 Å²	106	145.8 Å²	145.8	88%	0.876	83%	0.832	S	S	*	*			trans	-58.9	77.6	166.3	0	0	0	0	0	112.1	R27	A25-R27 PolarHBondContact O-N 3.28Å
26	A	55.5	Low	58.8	Low	88 Å²	88	142.4 Å²	142.4	73%	0.727	83%	0.829	S	S	*	*			trans	-80.7	90	165.2	0	0	0	0	0	107.4	K24 K28	K24-A26 PolarHBondContact O-N 3.36Å; A26-K28 PolarHBondContact O-N 3.23Å
27	R	56.2	Low	59.5	Low	230 Å²	230	147.5 Å²	147.5	87%	0.868	83%	0.833	S	S	*	*			trans	-57	111.2	167	-74.9	-179.6	177.2	176.8	0	107.7	A25 S29	A25-R27 PolarHBondContact O-N 3.28Å; R27-S29 PolarHBondContact O-N 2.93Å
28	K	52.3	Low	60.2	Low	217 Å²	217	151 Å²	151	94%	0.943	84%	0.835	S	S	*	*			trans	-7.5	86.9	169.6	-71.6	177.2	176.6	174.4	0	114.7	A26	A26-K28 PolarHBondContact O-N 3.23Å
29	S	53.3	Low	61.5	Low	109 Å²	109	143.9 Å²	143.9	76%	0.762	83%	0.828	S	S	*	*			trans	-113.4	117.2	153.4	44.9	0	0	0	0	107.3	R27	R27-S29 PolarHBondContact O-N 2.93Å
30	A	61.1	Low	63.2	Low	88 Å²	88	141 Å²	141	73%	0.727	82%	0.818	S	S	*	*			trans	16.9	123.9	175.3	0	0	0	0	0	120.4	S32	A30-S32 PolarHBondContact O-N 3.05Å
31	P	56.4	Low	65.1	Low	126 Å²	126	142.8 Å²	142.8	82%	0.818	82%	0.816	S	S	*	*			trans	-67.7	113.4	142.9	20.4	-7.8	0	0	0	107.6
32	S	55.5	Low	66.9	Low	103 Å²	103	140.3 Å²	140.3	72%	0.72	80%	0.796	S	S	*	*	S	Bend	trans	-52.1	139.9	160.5	53.8	0	0	0	0	110.1	A30	A30-S32 PolarHBondContact O-N 3.05Å
33	V	55.9	Low	68.8	Low	153 Å²	153	145.6 Å²	145.6	93%	0.927	80%	0.795	S	S	*	*	S	Bend	trans	74.2	65.9	171.4	-154.3	0	0	0	0	115
34	G	66.5	Low	70.5	Confident	57 Å²	57	145.7 Å²	145.7	59%	0.588	80%	0.797	S	S	*	*	S	Bend	trans	-167.6	145.9	164.6	0	0	0	0	0	109.9	V36	G34-V36 PolarHBondContact O-N 3.16Å
35	A	66.6	Low	72.4	Confident	107 Å²	107	138.2 Å²	138.2	88%	0.884	78%	0.777	S	S	*	*			trans	-51.3	106	178.8	0	0	0	0	0	110	K37	A35-K37 PolarHBondContact O-N 3.41Å; A35-K37 VanDerWaalsContact O-N 3.08Å
36	V	70.9	Confident	74.4	Confident	135 Å²	135	135.9 Å²	135.9	82%	0.818	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-57.8	118.2	176.6	177.5	0	0	0	0	106.6	G34 K38	G34-V36 PolarHBondContact O-N 3.16Å; V36-K38 PolarHBondContact O-N 3.05Å; V36-K38 VanDerWaalsContact O-N 3.13Å
37	K	77.7	Confident	76.4	Confident	198 Å²	198	134 Å²	134	86%	0.861	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-51.7	126	173	-74.6	-173.3	177.3	-175.4	0	107.6	A35 A39	A35-K37 PolarHBondContact O-N 3.41Å; A35-K37 VanDerWaalsContact O-N 3.08Å; K37-A39 PolarHBondContact O-N 2.69Å; K37-A39 VanDerWaalsContact O-N 3.16Å
38	K	83.3	Confident	78.4	Confident	207 Å²	207	125.2 Å²	125.2	90%	0.9	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-46.9	126	178.1	-68.9	-176.6	179.3	-179.6	0	108.8	V36 H40	V36-K38 PolarHBondContact O-N 3.05Å; V36-K38 VanDerWaalsContact O-N 3.13Å; K38-H40 PolarHBondContact O-N 3.49Å
39	A	88.1	Confident	80.5	Confident	94 Å²	94	119.4 Å²	119.4	78%	0.777	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-55.7	134.4	177.2	0	0	0	0	0	109.2	K37 R41	K37-A39 PolarHBondContact O-N 2.69Å; K37-A39 VanDerWaalsContact O-N 3.16Å; A39-R41 PolarHBondContact O-N 2.75Å
40	H	90.3	Very high	82.6	Confident	152 Å²	152	119.6 Å²	119.6	70%	0.704	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-63.3	122.8	177.7	174.2	-80.8	0	0	0	109.5	K38 Y42	K38-H40 PolarHBondContact O-N 3.49Å; H40-Y42 AromaticContact CE1-CD1 3.78Å; H40-Y42 AromaticContact CE1-CE1 3.7Å; H40-Y42 AromaticContact CE1-CZ 3.96Å
41	R	92.9	Very high	84.4	Confident	228 Å²	228	119.8 Å²	119.8	86%	0.86	66%	0.656	S	S	*	*			trans	-118.4	126.4	175.3	-169.1	176	-179.5	175.2	1	109.5	A39	A39-R41 PolarHBondContact O-N 2.75Å
42	Y	94.3	Very high	86.4	Confident	120 Å²	120	117.8 Å²	117.8	47%	0.471	64%	0.638	S	S	.	*	P	Polyproline II helix	trans	-63.8	148.1	171	-69.7	-73.4	0	0	0	110.5	H40 T46 V47	H40-Y42 AromaticContact CE1-CD1 3.78Å; H40-Y42 AromaticContact CE1-CE1 3.7Å; H40-Y42 AromaticContact CE1-CZ 3.96Å; Y42-T46 HydrophobicContact CD1-CG2 3.77Å; Y42-T46 HydrophobicContact CG-CG2 4.37Å; Y42-V47 HydrophobicContact CD2-CG2 3.92Å; Y42-V47 HydrophobicContact CG-CG2 4.03Å
43	R	95.5	Very high	88.4	Confident	210 Å²	210	120.7 Å²	120.7	79%	0.792	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-64.6	147.9	172.7	-65	-176.1	177	-165	-1	109.8	G45 T46	R43-G45 PolarHBondContact O-N 3.49Å; R43-T46 VanDerWaalsContact O-CB 3.31Å; R43-T46 WeakPolarHBondContact O-CB 3.31Å; R43-T46 PolarHBondContact O-N 3.29Å; R43-T46 PolarHBondContact O-OG1 2.94Å
44	P	96.4	Very high	90.4	Very high	132 Å²	132	120 Å²	120	86%	0.857	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.4	137.7	170.5	-25.2	34.6	0	0	0	110.6	T46	P44-T46 VanDerWaalsContact C-N 3.31Å; P44-T46 PolarHBondContact O-N 3.39Å
45	G	96.2	Very high	91.9	Very high	42 Å²	42	121.8 Å²	121.8	43%	0.433	60%	0.604	S	S	.	*	T	Hydrogen-bonded Turn	trans	86.1	-24.9	-175.1	0	0	0	0	0	115.5	R43 V47 A48 L49	R43-G45 PolarHBondContact O-N 3.49Å; G45-V47 PolarHBondContact O-N 3.47Å; G45-A48 PolarHBondContact O-N 2.69Å; G45-L49 WeakPolarHBondContact O-CG 3.48Å; G45-L49 PolarHBondContact O-N 2.91Å
46	T	97.7	Very high	93.3	Very high	58 Å²	58	124 Å²	124	36%	0.356	60%	0.595	S	S	.	*	H	α-helix	trans	-64	-41.7	179.5	-56.5	0	0	0	0	112.5	Y42 R43 P44 R50	Y42-T46 HydrophobicContact CD1-CG2 3.77Å; Y42-T46 HydrophobicContact CG-CG2 4.37Å; R43-T46 VanDerWaalsContact O-CB 3.31Å; R43-T46 WeakPolarHBondContact O-CB 3.31Å; R43-T46 PolarHBondContact O-N 3.29Å; R43-T46 PolarHBondContact O-OG1 2.94Å; P44-T46 VanDerWaalsContact C-N 3.31Å; P44-T46 PolarHBondContact O-N 3.39Å; T46-R50 PolarHBondContact O-N 3.34Å
47	V	97.4	Very high	94.6	Very high	47 Å²	47	126.3 Å²	126.3	29%	0.285	60%	0.595	S	S	.	*	H	α-helix	trans	-72.2	-43.3	178	-178.8	0	0	0	0	110.5	Y42 G45 L49 R50 E51	Y42-V47 HydrophobicContact CD2-CG2 3.92Å; Y42-V47 HydrophobicContact CG-CG2 4.03Å; G45-V47 PolarHBondContact O-N 3.47Å; V47-L49 PolarHBondContact O-N 3.4Å; V47-R50 WeakPolarHBondContact O-CB 3.36Å; V47-R50 PolarHBondContact O-N 3.01Å; V47-E51 HydrophobicContact CG1-CG 4.42Å; V47-E51 WeakPolarHBondContact CG1-OE1 3.32Å; V47-E51 WeakPolarHBondContact O-CG 3.32Å; V47-E51 PolarHBondContact O-N 3.43Å
48	A	97.3	Very high	95.5	Very high	46 Å²	46	118.8 Å²	118.8	38%	0.38	57%	0.567	S	S	.	*	H	α-helix	trans	-58.1	-46.7	178.1	0	0	0	0	0	112.4	G45 R50 E51 I52	G45-A48 PolarHBondContact O-N 2.69Å; A48-R50 VanDerWaalsContact C-N 3.26Å; A48-R50 PolarHBondContact O-N 3.13Å; A48-E51 PolarHBondContact O-N 3.38Å; A48-I52 VanDerWaalsContact O-CG1 3.3Å; A48-I52 WeakPolarHBondContact O-CG1 3.35Å; A48-I52 PolarHBondContact O-N 2.97Å
49	L	97.7	Very high	96.1	Very high	95 Å²	95	115.8 Å²	115.8	50%	0.497	57%	0.566	S	S	.	*	H	α-helix	trans	-63.8	-31.9	176.5	-72.2	174.7	0	0	0	113	G45 V47 I52 R53	G45-L49 WeakPolarHBondContact O-CG 3.48Å; G45-L49 PolarHBondContact O-N 2.91Å; V47-L49 PolarHBondContact O-N 3.4Å; L49-I52 HydrophobicContact CD2-CD1 4.5Å; L49-R53 VanDerWaalsContact O-CG 3.26Å; L49-R53 WeakPolarHBondContact O-CG 3.41Å; L49-R53 PolarHBondContact O-N 3.2Å
50	R	98	Very high	96.4	Very high	114 Å²	114	115.9 Å²	115.9	43%	0.43	55%	0.55	S	S	.	*	H	α-helix	trans	-70.5	-40.4	175.4	-177.8	174.5	61.6	-118.5	6	111.2	T46 V47 A48 R54	T46-R50 PolarHBondContact O-N 3.34Å; V47-R50 WeakPolarHBondContact O-CB 3.36Å; V47-R50 PolarHBondContact O-N 3.01Å; A48-R50 VanDerWaalsContact C-N 3.26Å; A48-R50 PolarHBondContact O-N 3.13Å; R50-R54 WeakPolarHBondContact O-CB 3.41Å; R50-R54 PolarHBondContact O-N 3.26Å
51	E	97.7	Very high	96.7	Very high	91 Å²	91	111.9 Å²	111.9	43%	0.425	53%	0.533	S	S	.	.	H	α-helix	trans	-65.3	-46.8	175.7	-73.4	169.4	-176.8	0	0	111.5	V47 A48 R53 R54 Y55	V47-E51 HydrophobicContact CG1-CG 4.42Å; V47-E51 WeakPolarHBondContact CG1-OE1 3.32Å; V47-E51 WeakPolarHBondContact O-CG 3.32Å; V47-E51 PolarHBondContact O-N 3.43Å; A48-E51 PolarHBondContact O-N 3.38Å; E51-R53 VanDerWaalsContact C-N 3.34Å; E51-R53 PolarHBondContact O-N 3.36Å; E51-R54 WeakPolarHBondContact O-CB 3.49Å; E51-R54 PolarHBondContact O-N 3.4Å; E51-Y55 HydrophobicContact CB-CD2 4.26Å; E51-Y55 HydrophobicContact CB-CE2 3.96Å; E51-Y55 HydrophobicContact CG-CE2 4.45Å; E51-Y55 WeakPolarHBondContact O-CD2 3.3Å; E51-Y55 PolarHBondContact O-N 3.34Å
52	I	97.6	Very high	96.8	Very high	85 Å²	85	105.8 Å²	105.8	44%	0.436	52%	0.517	S	S	.	.	H	α-helix	trans	-54.2	-50.5	175.6	-68.7	164.2	0	0	0	110.6	A48 L49 R54 Y55 Q56	A48-I52 VanDerWaalsContact O-CG1 3.3Å; A48-I52 WeakPolarHBondContact O-CG1 3.35Å; A48-I52 PolarHBondContact O-N 2.97Å; L49-I52 HydrophobicContact CD2-CD1 4.5Å; I52-R54 VanDerWaalsContact C-N 3.29Å; I52-R54 PolarHBondContact O-N 3.46Å; I52-Y55 PolarHBondContact O-N 3.46Å; I52-Q56 HydrophobicContact CG2-CG 4.38Å; I52-Q56 WeakPolarHBondContact O-CB 3.48Å; I52-Q56 VanDerWaalsContact O-CG 3.3Å; I52-Q56 WeakPolarHBondContact O-CG 3.31Å; I52-Q56 PolarHBondContact O-N 2.78Å
53	R	97.9	Very high	96.9	Very high	163 Å²	163	103 Å²	103	62%	0.615	51%	0.509	S	S	*	.	H	α-helix	trans	-65	-31.2	178.7	-70.2	172.3	-170.8	170.8	2.8	113.4	L49 E51 K57	L49-R53 VanDerWaalsContact O-CG 3.26Å; L49-R53 WeakPolarHBondContact O-CG 3.41Å; L49-R53 PolarHBondContact O-N 3.2Å; E51-R53 VanDerWaalsContact C-N 3.34Å; E51-R53 PolarHBondContact O-N 3.36Å; R53-K57 VanDerWaalsContact O-CG 3.28Å; R53-K57 WeakPolarHBondContact O-CG 3.35Å
54	R	97.9	Very high	96.9	Very high	138 Å²	138	94.9 Å²	94.9	52%	0.521	49%	0.491	S	S	.	.	H	α-helix	trans	-68.6	-53.5	175.8	177.3	-173.8	165.5	-157.4	-9.5	109.5	R50 E51 I52 Q56 K57 S58 E60	R50-R54 WeakPolarHBondContact O-CB 3.41Å; R50-R54 PolarHBondContact O-N 3.26Å; E51-R54 WeakPolarHBondContact O-CB 3.49Å; E51-R54 PolarHBondContact O-N 3.4Å; I52-R54 VanDerWaalsContact C-N 3.29Å; I52-R54 PolarHBondContact O-N 3.46Å; R54-Q56 PolarHBondContact O-N 3.15Å; R54-K57 PolarHBondContact O-N 3.02Å; R54-K57 VanDerWaalsContact O-N 3.11Å; R54-S58 PolarHBondContact O-N 2.98Å; R54-S58 PolarHBondContact O-OG 3.25Å; R54-E60 IonicContact CZ-OE1 3.72Å; R54-E60 IonicContact NE-OE1 3.92Å; R54-E60 IonicContact NH2-OE1 2.89Å; R54-E60 PolarHBondContact NH2-OE1 3.26Å
55	Y	97.6	Very high	96.7	Very high	96 Å²	96	95.5 Å²	95.5	38%	0.376	48%	0.476	S	S	.	.	H	α-helix	trans	-68.7	-33.7	-174.5	-63.5	-49	0	0	0	113	E51 I52 K57 S58 L62	E51-Y55 HydrophobicContact CB-CD2 4.26Å; E51-Y55 HydrophobicContact CB-CE2 3.96Å; E51-Y55 HydrophobicContact CG-CE2 4.45Å; E51-Y55 WeakPolarHBondContact O-CD2 3.3Å; E51-Y55 PolarHBondContact O-N 3.34Å; I52-Y55 PolarHBondContact O-N 3.46Å; Y55-K57 PolarHBondContact O-N 2.92Å; Y55-S58 WeakPolarHBondContact CA-OG 3.38Å; Y55-S58 PolarHBondContact O-N 3.49Å; Y55-S58 PolarHBondContact O-OG 3.18Å; Y55-L62 HydrophobicContact CD1-CD2 3.8Å; Y55-L62 HydrophobicContact CE1-CD2 3.92Å
56	Q	97.2	Very high	96.7	Very high	152 Å²	152	97.2 Å²	97.2	71%	0.71	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-21.9	172.7	-74.7	-179.9	-28	0	0	113.9	I52 R54	I52-Q56 HydrophobicContact CG2-CG 4.38Å; I52-Q56 WeakPolarHBondContact O-CB 3.48Å; I52-Q56 VanDerWaalsContact O-CG 3.3Å; I52-Q56 WeakPolarHBondContact O-CG 3.31Å; I52-Q56 PolarHBondContact O-N 2.78Å; R54-Q56 PolarHBondContact O-N 3.15Å
57	K	97.8	Very high	96.6	Very high	185 Å²	185	98.5 Å²	98.5	80%	0.804	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-21	177.3	-74.2	179.7	178.8	-168.5	0	113.1	R53 R54 Y55	R53-K57 VanDerWaalsContact O-CG 3.28Å; R53-K57 WeakPolarHBondContact O-CG 3.35Å; R54-K57 PolarHBondContact O-N 3.02Å; R54-K57 VanDerWaalsContact O-N 3.11Å; Y55-K57 PolarHBondContact O-N 2.92Å
58	S	96.2	Very high	96.6	Very high	40 Å²	40	97.1 Å²	97.1	28%	0.28	48%	0.475	S	S	.	.			trans	-100.3	157.6	-177.7	58.8	0	0	0	0	111.2	R54 Y55	R54-S58 PolarHBondContact O-N 2.98Å; R54-S58 PolarHBondContact O-OG 3.25Å; Y55-S58 WeakPolarHBondContact CA-OG 3.38Å; Y55-S58 PolarHBondContact O-N 3.49Å; Y55-S58 PolarHBondContact O-OG 3.18Å
59	T	95.9	Very high	96.5	Very high	143 Å²	143	100.8 Å²	100.8	88%	0.877	48%	0.479	S	S	*	.			trans	-117.3	22.5	171.3	55.8	0	0	0	0	111.3
60	E	95.3	Very high	96.4	Very high	96 Å²	96	104.3 Å²	104.3	45%	0.449	49%	0.486	S	S	.	.			trans	-70.7	140.2	178.7	66.1	-176.1	167.9	0	0	110.8	R54 L62	R54-E60 IonicContact CZ-OE1 3.72Å; R54-E60 IonicContact NE-OE1 3.92Å; R54-E60 IonicContact NH2-OE1 2.89Å; R54-E60 PolarHBondContact NH2-OE1 3.26Å; E60-L62 HydrophobicContact CG-CD2 4.26Å; E60-L62 PolarHBondContact O-N 3.45Å
61	M	95.3	Very high	96.4	Very high	69 Å²	69	102.8 Å²	102.8	34%	0.34	49%	0.486	S	S	.	.			trans	-68.2	129.3	175.1	-64.1	-69.9	166.4	0	0	109.9	Q94 E95 E98	M61-Q94 HydrophobicContact SD-CG 3.93Å; M61-E95 HydrophobicContact CE-CB 3.85Å; M61-E95 HydrophobicContact CE-CG 4.03Å; M61-E98 WeakPolarHBondContact CA-OE2 3.26Å
62	L	96.5	Very high	96.3	Very high	100 Å²	100	99.4 Å²	99.4	52%	0.524	47%	0.472	S	S	.	.			trans	-94.1	-28.3	-173	-57.9	-178.7	0	0	0	112.8	Y55 E60 E98	Y55-L62 HydrophobicContact CD1-CD2 3.8Å; Y55-L62 HydrophobicContact CE1-CD2 3.92Å; E60-L62 HydrophobicContact CG-CD2 4.26Å; E60-L62 PolarHBondContact O-N 3.45Å; L62-E98 PolarHBondContact N-OE1 3.37Å; L62-E98 PolarHBondContact N-OE2 3.3Å
63	I	96	Very high	96.2	Very high	60 Å²	60	100.6 Å²	100.6	31%	0.308	47%	0.471	S	S	.	.	S	Bend	trans	-84.1	134.2	179.2	-58.1	177.2	0	0	0	109.4	R65 L68 Q94 E98 L101	I63-R65 PolarHBondContact O-N 2.88Å; I63-L68 HydrophobicContact CG2-CB 4.05Å; I63-Q94 PolarHBondContact O-NE2 2.89Å; I63-E98 HydrophobicContact CB-CG 4.43Å; I63-E98 WeakPolarHBondContact CB-OE1 3.06Å; I63-E98 HydrophobicContact CD1-CG 3.72Å; I63-E98 HydrophobicContact CG1-CG 3.9Å; I63-E98 PolarHBondContact N-OE1 3.01Å; I63-L101 HydrophobicContact CD1-CD1 4.21Å
64	G	95.5	Very high	96.1	Very high	40 Å²	40	99 Å²	99	41%	0.412	47%	0.471	S	S	.	.			trans	-58.7	126.6	176.5	0	0	0	0	0	112	L66 P67 L68	G64-L66 PolarHBondContact O-N 3.26Å; G64-P67 VanDerWaalsContact O-CD 3.31Å; G64-P67 WeakPolarHBondContact O-CD 3.25Å; G64-L68 PolarHBondContact O-N 3.47Å; G64-L68 VanDerWaalsContact O-N 3.16Å
65	R	92.5	Very high	96	Very high	145 Å²	145	96.6 Å²	96.6	55%	0.547	47%	0.467	S	S	.	.	H	α-helix	trans	-58.5	-41.3	-176.2	-61.3	-173.9	-174.3	-78.4	8.7	113.7	I63 R69	I63-R65 PolarHBondContact O-N 2.88Å; R65-R69 VanDerWaalsContact O-CB 3.28Å; R65-R69 WeakPolarHBondContact O-CB 3.41Å; R65-R69 PolarHBondContact O-N 2.97Å
66	L	95.2	Very high	95.9	Very high	79 Å²	79	92.6 Å²	92.6	41%	0.414	45%	0.454	S	S	.	.	H	α-helix	trans	-70.2	-49.6	-178	173.8	66.9	0	0	0	112.7	G64 L68 R69 R70	G64-L66 PolarHBondContact O-N 3.26Å; L66-L68 PolarHBondContact O-N 3.4Å; L66-R69 PolarHBondContact O-N 3.44Å; L66-R70 PolarHBondContact O-N 2.92Å; L66-R70 VanDerWaalsContact O-N 3.09Å
67	P	96.9	Very high	95.8	Very high	84 Å²	84	90.4 Å²	90.4	55%	0.545	44%	0.444	S	S	.	.	H	α-helix	trans	-54.4	-47.9	172.6	-28.8	33.8	0	0	0	113.2	G64 R69 R70 L71	G64-P67 VanDerWaalsContact O-CD 3.31Å; G64-P67 WeakPolarHBondContact O-CD 3.25Å; P67-R69 VanDerWaalsContact C-N 3.33Å; P67-R69 PolarHBondContact O-N 3.37Å; P67-R70 WeakPolarHBondContact O-CB 3.48Å; P67-R70 PolarHBondContact O-N 2.97Å; P67-R70 VanDerWaalsContact O-N 3.1Å; P67-L71 PolarHBondContact O-N 3.17Å
68	L	96.2	Very high	95.7	Very high	18 Å²	18	88.2 Å²	88.2	9%	0.094	44%	0.441	C	S	.	.	H	α-helix	trans	-62	-42.4	179.7	-176.7	68.2	0	0	0	111.7	I63 G64 L66 R70 L71 V72 Q94	I63-L68 HydrophobicContact CG2-CB 4.05Å; G64-L68 PolarHBondContact O-N 3.47Å; G64-L68 VanDerWaalsContact O-N 3.16Å; L66-L68 PolarHBondContact O-N 3.4Å; L68-R70 VanDerWaalsContact C-N 3.27Å; L68-R70 PolarHBondContact O-N 2.93Å; L68-L71 PolarHBondContact O-N 3.19Å; L68-V72 HydrophobicContact CD1-CG2 4.49Å; L68-V72 HydrophobicContact CG-CG2 4.38Å; L68-V72 WeakPolarHBondContact O-CG2 3.31Å; L68-V72 PolarHBondContact O-N 3.32Å; L68-Q94 HydrophobicContact CD2-CB 3.31Å; L68-Q94 HydrophobicContact CD2-CG 3.38Å
69	R	95.1	Very high	95.7	Very high	123 Å²	123	94.3 Å²	94.3	46%	0.464	46%	0.463	S	S	.	.	H	α-helix	trans	-60.2	-35.8	175.8	-175.1	178.5	70	173.1	3	112.6	R65 L66 P67 R73 V90	R65-R69 VanDerWaalsContact O-CB 3.28Å; R65-R69 WeakPolarHBondContact O-CB 3.41Å; R65-R69 PolarHBondContact O-N 2.97Å; L66-R69 PolarHBondContact O-N 3.44Å; P67-R69 VanDerWaalsContact C-N 3.33Å; P67-R69 PolarHBondContact O-N 3.37Å; R69-R73 WeakPolarHBondContact O-CG 3.29Å; R69-R73 PolarHBondContact O-N 2.9Å; R69-V90 HydrophobicContact CB-CG1 4.19Å; R69-V90 HydrophobicContact CG-CG1 4.36Å
70	R	96.4	Very high	95.6	Very high	169 Å²	169	93.6 Å²	93.6	64%	0.638	45%	0.447	S	S	*	.	H	α-helix	trans	-67.4	-47.5	175.7	-71.5	177.2	177.9	174	-0.9	110.5	L66 P67 L68 V72 R73 E74	L66-R70 PolarHBondContact O-N 2.92Å; L66-R70 VanDerWaalsContact O-N 3.09Å; P67-R70 WeakPolarHBondContact O-CB 3.48Å; P67-R70 PolarHBondContact O-N 2.97Å; P67-R70 VanDerWaalsContact O-N 3.1Å; L68-R70 VanDerWaalsContact C-N 3.27Å; L68-R70 PolarHBondContact O-N 2.93Å; R70-V72 PolarHBondContact O-N 3.42Å; R70-R73 PolarHBondContact O-N 3.2Å; R70-R73 VanDerWaalsContact O-N 3.14Å; R70-E74 WeakPolarHBondContact O-CB 3.49Å; R70-E74 PolarHBondContact O-N 3.48Å
71	L	97	Very high	95.5	Very high	83 Å²	83	92.7 Å²	92.7	44%	0.435	45%	0.45	S	S	.	.	H	α-helix	trans	-59.2	-45.2	177.2	-179.9	63.9	0	0	0	112.4	P67 L68 R73 E74 I75	P67-L71 PolarHBondContact O-N 3.17Å; L68-L71 PolarHBondContact O-N 3.19Å; L71-R73 VanDerWaalsContact C-N 3.26Å; L71-R73 PolarHBondContact O-N 2.87Å; L71-E74 WeakPolarHBondContact O-CB 3.38Å; L71-E74 PolarHBondContact O-N 2.93Å; L71-I75 HydrophobicContact CD1-CD1 3.94Å; L71-I75 HydrophobicContact CD1-CG1 4.23Å; L71-I75 HydrophobicContact CG-CD1 3.95Å; L71-I75 WeakPolarHBondContact O-CG1 3.48Å; L71-I75 PolarHBondContact O-N 3.07Å
72	V	96	Very high	95.3	Very high	20 Å²	20	96.4 Å²	96.4	12%	0.121	47%	0.471	C	S	.	.	H	α-helix	trans	-59.5	-39.5	177	168.8	0	0	0	0	111.2	L68 R70 A76 F85 L93	L68-V72 HydrophobicContact CD1-CG2 4.49Å; L68-V72 HydrophobicContact CG-CG2 4.38Å; L68-V72 WeakPolarHBondContact O-CG2 3.31Å; L68-V72 PolarHBondContact O-N 3.32Å; R70-V72 PolarHBondContact O-N 3.42Å; V72-A76 WeakPolarHBondContact O-CB 3.4Å; V72-A76 PolarHBondContact O-N 3.2Å; V72-F85 HydrophobicContact CG1-CD1 4.33Å; V72-F85 HydrophobicContact CG1-CE1 3.97Å; V72-F85 HydrophobicContact CG1-CZ 4.15Å; V72-L93 HydrophobicContact CG1-CD1 3.64Å; V72-L93 HydrophobicContact CG2-CD1 4.12Å
73	R	95.3	Very high	95.2	Very high	109 Å²	109	94.8 Å²	94.8	41%	0.411	46%	0.463	S	S	.	.	H	α-helix	trans	-72.4	-38.6	178	-74.3	-177.9	175.2	-75.2	1	112.7	R69 R70 L71 A76 Q77 L83 F85	R69-R73 WeakPolarHBondContact O-CG 3.29Å; R69-R73 PolarHBondContact O-N 2.9Å; R70-R73 PolarHBondContact O-N 3.2Å; R70-R73 VanDerWaalsContact O-N 3.14Å; L71-R73 VanDerWaalsContact C-N 3.26Å; L71-R73 PolarHBondContact O-N 2.87Å; R73-A76 PolarHBondContact O-N 3.5Å; R73-Q77 WeakPolarHBondContact O-CB 3.43Å; R73-Q77 PolarHBondContact O-N 2.67Å; R73-L83 PolarHBondContact NH1-O 2.98Å; R73-F85 HydrophobicContact CG-CD2 4.25Å; R73-F85 HydrophobicContact CG-CE2 4.36Å
74	E	95.6	Very high	95.2	Very high	131 Å²	131	103.4 Å²	103.4	61%	0.612	49%	0.491	S	S	*	.	H	α-helix	trans	-58.5	-54.8	174.9	-176.5	-177.9	155.6	0	0	110.5	R70 L71 A76 Q77	R70-E74 WeakPolarHBondContact O-CB 3.49Å; R70-E74 PolarHBondContact O-N 3.48Å; L71-E74 WeakPolarHBondContact O-CB 3.38Å; L71-E74 PolarHBondContact O-N 2.93Å; E74-A76 VanDerWaalsContact C-N 3.34Å; E74-A76 PolarHBondContact O-N 2.93Å; E74-Q77 WeakPolarHBondContact O-CB 3.44Å; E74-Q77 PolarHBondContact O-N 3.18Å
75	I	96.3	Very high	95.1	Very high	86 Å²	86	104.3 Å²	104.3	44%	0.441	48%	0.484	S	S	.	.	H	α-helix	trans	-60.4	-43.6	178.2	-65	170.3	0	0	0	111.1	L71 Q77 D78 F79	L71-I75 HydrophobicContact CD1-CD1 3.94Å; L71-I75 HydrophobicContact CD1-CG1 4.23Å; L71-I75 HydrophobicContact CG-CD1 3.95Å; L71-I75 WeakPolarHBondContact O-CG1 3.48Å; L71-I75 PolarHBondContact O-N 3.07Å; I75-Q77 VanDerWaalsContact C-N 3.27Å; I75-Q77 PolarHBondContact O-N 3.45Å; I75-D78 PolarHBondContact O-N 3.23Å; I75-F79 HydrophobicContact CG2-CD2 4.47Å; I75-F79 HydrophobicContact CG2-CE2 3.85Å; I75-F79 WeakPolarHBondContact O-CD2 3.44Å
76	A	96.1	Very high	95.3	Very high	13 Å²	13	105.5 Å²	105.5	11%	0.107	49%	0.493	C	S	.	.	H	α-helix	trans	-66	-30	-178.3	0	0	0	0	0	113.6	V72 R73 E74 D78 F79 K80 L83 F85	V72-A76 WeakPolarHBondContact O-CB 3.4Å; V72-A76 PolarHBondContact O-N 3.2Å; R73-A76 PolarHBondContact O-N 3.5Å; E74-A76 VanDerWaalsContact C-N 3.34Å; E74-A76 PolarHBondContact O-N 2.93Å; A76-D78 PolarHBondContact O-N 2.99Å; A76-F79 PolarHBondContact O-N 3.02Å; A76-K80 PolarHBondContact O-N 3.42Å; A76-L83 HydrophobicContact CB-CD1 4.16Å; A76-F85 HydrophobicContact CB-CE2 3.83Å; A76-F85 HydrophobicContact CB-CZ 3.47Å; A76-F85 VanDerWaalsContact CB-CZ 3.47Å
77	Q	95.5	Very high	95.2	Very high	105 Å²	105	107.3 Å²	107.3	49%	0.491	51%	0.507	S	S	.	.	H	α-helix	trans	-61.6	-34	178.8	-172.3	68.2	19.6	0	0	111.6	R73 E74 I75 F79	R73-Q77 WeakPolarHBondContact O-CB 3.43Å; R73-Q77 PolarHBondContact O-N 2.67Å; E74-Q77 WeakPolarHBondContact O-CB 3.44Å; E74-Q77 PolarHBondContact O-N 3.18Å; I75-Q77 VanDerWaalsContact C-N 3.27Å; I75-Q77 PolarHBondContact O-N 3.45Å; Q77-F79 VanDerWaalsContact C-N 3.27Å; Q77-F79 PolarHBondContact O-N 3.27Å
78	D	95.7	Very high	95.2	Very high	139 Å²	139	106.6 Å²	106.6	74%	0.743	51%	0.508	S	S	*	.	H	α-helix	trans	-68.1	-25.3	178.6	-64.2	-22.8	0	0	0	112.9	I75 A76	I75-D78 PolarHBondContact O-N 3.23Å; A76-D78 PolarHBondContact O-N 2.99Å
79	F	95.2	Very high	95.2	Very high	169 Å²	169	107.7 Å²	107.7	74%	0.741	52%	0.52	S	S	*	.	H	α-helix	trans	-92.9	-43.9	179	-64	-83.6	0	0	0	112.7	I75 A76 Q77	I75-F79 HydrophobicContact CG2-CD2 4.47Å; I75-F79 HydrophobicContact CG2-CE2 3.85Å; I75-F79 WeakPolarHBondContact O-CD2 3.44Å; A76-F79 PolarHBondContact O-N 3.02Å; Q77-F79 VanDerWaalsContact C-N 3.27Å; Q77-F79 PolarHBondContact O-N 3.27Å
80	K	94.7	Very high	95.2	Very high	128 Å²	128	102.7 Å²	102.7	56%	0.557	50%	0.503	S	S	*	.			trans	-153.5	118.9	179.1	-174.8	176.4	177.2	72.2	0	110.6	A76 L83	A76-K80 PolarHBondContact O-N 3.42Å; K80-L83 HydrophobicContact CB-CD1 3.92Å; K80-L83 HydrophobicContact CB-CG 4.06Å; K80-L83 HydrophobicContact CD-CD2 3.94Å; K80-L83 HydrophobicContact CD-CG 4.31Å; K80-L83 HydrophobicContact CG-CD2 4.4Å; K80-L83 HydrophobicContact CG-CG 4.23Å; K80-L83 WeakPolarHBondContact O-CG 3.46Å
81	P	93.2	Very high	95.2	Very high	77 Å²	77	98 Å²	98	50%	0.5	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	155.9	175.3	28	-34.3	0	0	0	111.4	L83	P81-L83 VanDerWaalsContact C-N 3.33Å; P81-L83 PolarHBondContact O-N 3.49Å
82	D	91.1	Very high	95.2	Very high	146 Å²	146	96.8 Å²	96.8	78%	0.781	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.3	23.8	172.9	-55	-43.6	0	0	0	116.3	R84	D82-R84 PolarHBondContact O-N 2.93Å
83	L	94.4	Very high	95.2	Very high	67 Å²	67	99.7 Å²	99.7	35%	0.351	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-67.4	130.5	174.2	-77.9	176.7	0	0	0	113.2	R73 A76 K80 P81 F85	R73-L83 PolarHBondContact NH1-O 2.98Å; A76-L83 HydrophobicContact CB-CD1 4.16Å; K80-L83 HydrophobicContact CB-CD1 3.92Å; K80-L83 HydrophobicContact CB-CG 4.06Å; K80-L83 HydrophobicContact CD-CD2 3.94Å; K80-L83 HydrophobicContact CD-CG 4.31Å; K80-L83 HydrophobicContact CG-CD2 4.4Å; K80-L83 HydrophobicContact CG-CG 4.23Å; K80-L83 WeakPolarHBondContact O-CG 3.46Å; P81-L83 VanDerWaalsContact C-N 3.33Å; P81-L83 PolarHBondContact O-N 3.49Å; L83-F85 HydrophobicContact CB-CE2 3.97Å; L83-F85 HydrophobicContact CB-CZ 4.42Å
84	R	94.6	Very high	95.3	Very high	241 Å²	241	94.6 Å²	94.6	91%	0.909	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-99.8	127.6	171.1	-67	-175.5	176.7	-172.8	-0.4	110.4	D82	D82-R84 PolarHBondContact O-N 2.93Å
85	F	94.2	Very high	95.4	Very high	58 Å²	58	94.3 Å²	94.3	25%	0.254	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-102.9	130.4	177.5	-69.7	-90.5	0	0	0	111	V72 R73 A76 L83 V90	V72-F85 HydrophobicContact CG1-CD1 4.33Å; V72-F85 HydrophobicContact CG1-CE1 3.97Å; V72-F85 HydrophobicContact CG1-CZ 4.15Å; R73-F85 HydrophobicContact CG-CD2 4.25Å; R73-F85 HydrophobicContact CG-CE2 4.36Å; A76-F85 HydrophobicContact CB-CE2 3.83Å; A76-F85 HydrophobicContact CB-CZ 3.47Å; A76-F85 VanDerWaalsContact CB-CZ 3.47Å; L83-F85 HydrophobicContact CB-CE2 3.97Å; L83-F85 HydrophobicContact CB-CZ 4.42Å; F85-V90 HydrophobicContact CB-CG2 3.87Å; F85-V90 HydrophobicContact CG-CG2 4.41Å
86	K	96	Very high	95.4	Very high	170 Å²	170	93.2 Å²	93.2	74%	0.739	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-65.4	149.7	162.7	-68.5	-176.7	178.5	177.9	0	109.3	A88 A89 V90	K86-A88 VanDerWaalsContact C-N 3.27Å; K86-A88 PolarHBondContact O-N 2.98Å; K86-A89 HydrophobicContact CB-CB 4.32Å; K86-A89 WeakPolarHBondContact O-CB 3.41Å; K86-A89 PolarHBondContact O-N 3.23Å; K86-A89 VanDerWaalsContact O-N 3.11Å; K86-V90 PolarHBondContact O-N 3.01Å
87	V	94.3	Very high	95.5	Very high	117 Å²	117	94.3 Å²	94.3	71%	0.709	50%	0.499	S	S	*	.	H	α-helix	trans	-58.3	-43.7	175.2	179.4	0	0	0	0	110.6	A89 V90 L91	V87-A89 VanDerWaalsContact C-N 3.27Å; V87-A89 PolarHBondContact O-N 3.22Å; V87-V90 PolarHBondContact O-N 3.39Å; V87-L91 HydrophobicContact CG1-CD1 4.26Å; V87-L91 HydrophobicContact CG1-CG 4.42Å; V87-L91 WeakPolarHBondContact O-CG 3.31Å; V87-L91 PolarHBondContact O-N 3.32Å
88	A	96.2	Very high	95.5	Very high	69 Å²	69	90.2 Å²	90.2	57%	0.57	48%	0.48	S	S	*	.	H	α-helix	trans	-59.3	-34	176.9	0	0	0	0	0	113.6	K86 L91 A92	K86-A88 VanDerWaalsContact C-N 3.27Å; K86-A88 PolarHBondContact O-N 2.98Å; A88-L91 PolarHBondContact O-N 3.1Å; A88-A92 WeakPolarHBondContact O-CB 3.18Å; A88-A92 PolarHBondContact O-N 3.36Å
89	A	96.3	Very high	95.6	Very high	42 Å²	42	86.7 Å²	86.7	35%	0.347	47%	0.47	S	S	.	.	H	α-helix	trans	-67.4	-41.9	177.8	0	0	0	0	0	111.5	K86 V87 L91 A92 L93	K86-A89 HydrophobicContact CB-CB 4.32Å; K86-A89 WeakPolarHBondContact O-CB 3.41Å; K86-A89 PolarHBondContact O-N 3.23Å; K86-A89 VanDerWaalsContact O-N 3.11Å; V87-A89 VanDerWaalsContact C-N 3.27Å; V87-A89 PolarHBondContact O-N 3.22Å; A89-L91 VanDerWaalsContact C-N 3.32Å; A89-A92 PolarHBondContact O-N 3.31Å; A89-L93 WeakPolarHBondContact O-CG 3.28Å; A89-L93 PolarHBondContact O-N 2.89Å
90	V	95.5	Very high	95.7	Very high	17 Å²	17	83.2 Å²	83.2	10%	0.103	45%	0.452	C	S	.	.	H	α-helix	trans	-66.8	-37.1	176	-176.6	0	0	0	0	111	R69 F85 K86 V87 L93 Q94	R69-V90 HydrophobicContact CB-CG1 4.19Å; R69-V90 HydrophobicContact CG-CG1 4.36Å; F85-V90 HydrophobicContact CB-CG2 3.87Å; F85-V90 HydrophobicContact CG-CG2 4.41Å; K86-V90 PolarHBondContact O-N 3.01Å; V87-V90 PolarHBondContact O-N 3.39Å; V90-L93 PolarHBondContact O-N 3.4Å; V90-Q94 WeakPolarHBondContact O-CB 3.3Å; V90-Q94 PolarHBondContact O-N 3.36Å
91	L	96	Very high	95.8	Very high	71 Å²	71	80.3 Å²	80.3	37%	0.372	44%	0.443	S	S	.	.	H	α-helix	trans	-64.1	-43.9	175	-69.1	179.6	0	0	0	112.4	V87 A88 A89 L93 Q94 E95	V87-L91 HydrophobicContact CG1-CD1 4.26Å; V87-L91 HydrophobicContact CG1-CG 4.42Å; V87-L91 WeakPolarHBondContact O-CG 3.31Å; V87-L91 PolarHBondContact O-N 3.32Å; A88-L91 PolarHBondContact O-N 3.1Å; A89-L91 VanDerWaalsContact C-N 3.32Å; L91-L93 VanDerWaalsContact C-N 3.34Å; L91-L93 PolarHBondContact O-N 3.04Å; L91-Q94 WeakPolarHBondContact O-CB 3.49Å; L91-Q94 PolarHBondContact O-N 3.35Å; L91-Q94 VanDerWaalsContact O-N 3.16Å; L91-E95 PolarHBondContact O-N 2.88Å
92	A	97	Very high	96	Very high	57 Å²	57	80.3 Å²	80.3	47%	0.471	44%	0.441	S	S	.	.	H	α-helix	trans	-62.7	-41.5	176.8	0	0	0	0	0	111.9	A88 A89 Q94 E95 A96	A88-A92 WeakPolarHBondContact O-CB 3.18Å; A88-A92 PolarHBondContact O-N 3.36Å; A89-A92 PolarHBondContact O-N 3.31Å; A92-Q94 VanDerWaalsContact C-N 3.31Å; A92-Q94 PolarHBondContact O-N 2.95Å; A92-E95 PolarHBondContact O-N 3.03Å; A92-A96 WeakPolarHBondContact O-CB 3.36Å; A92-A96 PolarHBondContact O-N 3.05Å
93	L	96.7	Very high	96.2	Very high	82 Å²	82	74.2 Å²	74.2	43%	0.429	41%	0.413	S	S	.	.	H	α-helix	trans	-62.5	-39.1	173.5	-71.3	171.4	0	0	0	111.9	V72 A89 V90 L91 A97	V72-L93 HydrophobicContact CG1-CD1 3.64Å; V72-L93 HydrophobicContact CG2-CD1 4.12Å; A89-L93 WeakPolarHBondContact O-CG 3.28Å; A89-L93 PolarHBondContact O-N 2.89Å; V90-L93 PolarHBondContact O-N 3.4Å; L91-L93 VanDerWaalsContact C-N 3.34Å; L91-L93 PolarHBondContact O-N 3.04Å; L93-A97 WeakPolarHBondContact O-CB 3.48Å; L93-A97 PolarHBondContact O-N 3.4Å
94	Q	96.9	Very high	96.3	Very high	2 Å²	2	71.7 Å²	71.7	1%	0.009	40%	0.399	C	S	.	.	H	α-helix	trans	-63.1	-50.2	176.7	-176.8	161.3	7.3	0	0	111.9	M61 I63 L68 V90 L91 A92 A96 A97 E98	M61-Q94 HydrophobicContact SD-CG 3.93Å; I63-Q94 PolarHBondContact O-NE2 2.89Å; L68-Q94 HydrophobicContact CD2-CB 3.31Å; L68-Q94 HydrophobicContact CD2-CG 3.38Å; V90-Q94 WeakPolarHBondContact O-CB 3.3Å; V90-Q94 PolarHBondContact O-N 3.36Å; L91-Q94 WeakPolarHBondContact O-CB 3.49Å; L91-Q94 PolarHBondContact O-N 3.35Å; L91-Q94 VanDerWaalsContact O-N 3.16Å; A92-Q94 VanDerWaalsContact C-N 3.31Å; A92-Q94 PolarHBondContact O-N 2.95Å; Q94-A96 PolarHBondContact O-N 2.99Å; Q94-A97 PolarHBondContact O-N 3.31Å; Q94-E98 HydrophobicContact CG-CG 4.46Å; Q94-E98 WeakPolarHBondContact CG-OE1 3.39Å; Q94-E98 PolarHBondContact NE2-OE1 3.46Å; Q94-E98 WeakPolarHBondContact O-CG 3.49Å; Q94-E98 PolarHBondContact O-N 3.13Å
95	E	96.8	Very high	96.5	Very high	124 Å²	124	65 Å²	65	58%	0.579	38%	0.377	S	S	*	.	H	α-helix	trans	-59.8	-46.8	-179.9	-175	170.6	179.9	0	0	111.4	M61 L91 A92 A99	M61-E95 HydrophobicContact CE-CB 3.85Å; M61-E95 HydrophobicContact CE-CG 4.03Å; L91-E95 PolarHBondContact O-N 2.88Å; A92-E95 PolarHBondContact O-N 3.03Å; E95-A99 VanDerWaalsContact O-CB 3.27Å; E95-A99 WeakPolarHBondContact O-CB 3.49Å; E95-A99 PolarHBondContact O-N 3.48Å
96	A	97.2	Very high	96.6	Very high	63 Å²	63	67.7 Å²	67.7	52%	0.521	39%	0.391	S	S	.	.	H	α-helix	trans	-63.5	-43	177.3	0	0	0	0	0	112.6	A92 Q94 Y100	A92-A96 WeakPolarHBondContact O-CB 3.36Å; A92-A96 PolarHBondContact O-N 3.05Å; Q94-A96 PolarHBondContact O-N 2.99Å; A96-Y100 WeakPolarHBondContact O-CB 3.3Å; A96-Y100 PolarHBondContact O-N 2.91Å
97	A	97.1	Very high	96.7	Very high	36 Å²	36	62 Å²	62	30%	0.298	37%	0.368	S	S	.	.	H	α-helix	trans	-66.3	-44.6	-179.9	0	0	0	0	0	112.1	L93 Q94 Y100 L101	L93-A97 WeakPolarHBondContact O-CB 3.48Å; L93-A97 PolarHBondContact O-N 3.4Å; Q94-A97 PolarHBondContact O-N 3.31Å; A97-Y100 PolarHBondContact O-N 3.26Å; A97-L101 WeakPolarHBondContact O-CB 3.34Å; A97-L101 VanDerWaalsContact O-CG 3.3Å; A97-L101 WeakPolarHBondContact O-CG 3.5Å; A97-L101 PolarHBondContact O-N 2.77Å
98	E	97.4	Very high	96.9	Very high	20 Å²	20	56.5 Å²	56.5	9%	0.093	34%	0.335	C	S	.	.	H	α-helix	trans	-66	-43.2	177.9	-70.8	-169.9	-154.9	0	0	111.3	M61 L62 I63 Q94 Y100 L101 V102	M61-E98 WeakPolarHBondContact CA-OE2 3.26Å; L62-E98 PolarHBondContact N-OE1 3.37Å; L62-E98 PolarHBondContact N-OE2 3.3Å; I63-E98 HydrophobicContact CB-CG 4.43Å; I63-E98 WeakPolarHBondContact CB-OE1 3.06Å; I63-E98 HydrophobicContact CD1-CG 3.72Å; I63-E98 HydrophobicContact CG1-CG 3.9Å; I63-E98 PolarHBondContact N-OE1 3.01Å; Q94-E98 HydrophobicContact CG-CG 4.46Å; Q94-E98 WeakPolarHBondContact CG-OE1 3.39Å; Q94-E98 PolarHBondContact NE2-OE1 3.46Å; Q94-E98 WeakPolarHBondContact O-CG 3.49Å; Q94-E98 PolarHBondContact O-N 3.13Å; E98-Y100 PolarHBondContact O-N 3.31Å; E98-L101 PolarHBondContact O-N 2.69Å; E98-V102 VanDerWaalsContact O-CG2 3.28Å; E98-V102 WeakPolarHBondContact O-CG2 3.4Å; E98-V102 PolarHBondContact O-N 3.29Å
99	A	97.1	Very high	97	Very high	64 Å²	64	56.7 Å²	56.7	53%	0.529	33%	0.326	S	S	.	.	H	α-helix	trans	-59.9	-44.8	175.5	0	0	0	0	0	112.1	E95 V102 G103	E95-A99 VanDerWaalsContact O-CB 3.27Å; E95-A99 WeakPolarHBondContact O-CB 3.49Å; E95-A99 PolarHBondContact O-N 3.48Å; A99-V102 PolarHBondContact O-N 2.69Å; A99-G103 PolarHBondContact O-N 3.28Å
100	Y	96.6	Very high	97	Very high	96 Å²	96	60 Å²	60	38%	0.376	34%	0.337	S	S	.	.	H	α-helix	trans	-60.2	-47.4	176.4	172.1	-98.2	0	0	0	112	A96 A97 E98 G103 L104 E134	A96-Y100 WeakPolarHBondContact O-CB 3.3Å; A96-Y100 PolarHBondContact O-N 2.91Å; A97-Y100 PolarHBondContact O-N 3.26Å; E98-Y100 PolarHBondContact O-N 3.31Å; Y100-G103 PolarHBondContact O-N 3.31Å; Y100-L104 HydrophobicContact CE1-CD2 4.16Å; Y100-L104 WeakPolarHBondContact O-CB 3.41Å; Y100-L104 PolarHBondContact O-N 3.15Å; Y100-E134 WeakPolarHBondContact CE2-OE1 3.3Å; Y100-E134 WeakPolarHBondContact CE2-OE2 3.28Å; Y100-E134 PolarHBondContact OH-OE2 2.54Å
101	L	97	Very high	97.1	Very high	68 Å²	68	59.9 Å²	59.9	36%	0.356	34%	0.337	S	S	.	.	H	α-helix	trans	-65.4	-42.4	-179.6	-71.8	175.4	0	0	0	112	I63 A97 E98 L104 F105	I63-L101 HydrophobicContact CD1-CD1 4.21Å; A97-L101 WeakPolarHBondContact O-CB 3.34Å; A97-L101 VanDerWaalsContact O-CG 3.3Å; A97-L101 WeakPolarHBondContact O-CG 3.5Å; A97-L101 PolarHBondContact O-N 2.77Å; E98-L101 PolarHBondContact O-N 2.69Å; L101-L104 PolarHBondContact O-N 2.87Å; L101-F105 HydrophobicContact CB-CE2 4.43Å; L101-F105 WeakPolarHBondContact O-CD2 3.36Å; L101-F105 PolarHBondContact O-N 3.09Å
102	V	97.2	Very high	97.2	Very high	76 Å²	76	56.5 Å²	56.5	46%	0.461	32%	0.319	S	S	.	.	H	α-helix	trans	-58.9	-50.5	175.6	170.9	0	0	0	0	110	E98 A99 L104 F105 E106	E98-V102 VanDerWaalsContact O-CG2 3.28Å; E98-V102 WeakPolarHBondContact O-CG2 3.4Å; E98-V102 PolarHBondContact O-N 3.29Å; A99-V102 PolarHBondContact O-N 2.69Å; V102-L104 VanDerWaalsContact C-N 3.32Å; V102-L104 PolarHBondContact O-N 3.15Å; V102-F105 PolarHBondContact O-N 3.32Å; V102-F105 VanDerWaalsContact O-N 3.13Å; V102-E106 WeakPolarHBondContact O-CG 3.39Å; V102-E106 PolarHBondContact O-N 3.12Å
103	G	96.3	Very high	97.3	Very high	18 Å²	18	58.3 Å²	58.3	19%	0.186	32%	0.32	C	S	.	.	H	α-helix	trans	-59.4	-41.7	176.5	0	0	0	0	0	112.2	A99 Y100 F105 E106 D107 R132	A99-G103 PolarHBondContact O-N 3.28Å; Y100-G103 PolarHBondContact O-N 3.31Å; G103-F105 VanDerWaalsContact C-N 3.33Å; G103-F105 PolarHBondContact O-N 3.03Å; G103-E106 PolarHBondContact O-N 2.8Å; G103-D107 PolarHBondContact O-N 3.35Å; G103-R132 PolarHBondContact O-NH2 3.48Å
104	L	96.8	Very high	97.3	Very high	14 Å²	14	62.2 Å²	62.2	7%	0.073	34%	0.336	C	S	.	.	H	α-helix	trans	-63.1	-38.6	176.8	-180	61.1	0	0	0	112	Y100 L101 V102 D107 T108 I125 A128 R129	Y100-L104 HydrophobicContact CE1-CD2 4.16Å; Y100-L104 WeakPolarHBondContact O-CB 3.41Å; Y100-L104 PolarHBondContact O-N 3.15Å; L101-L104 PolarHBondContact O-N 2.87Å; V102-L104 VanDerWaalsContact C-N 3.32Å; V102-L104 PolarHBondContact O-N 3.15Å; L104-D107 PolarHBondContact O-N 3.32Å; L104-T108 VanDerWaalsContact O-CB 3.29Å; L104-T108 WeakPolarHBondContact O-CB 3.28Å; L104-T108 PolarHBondContact O-N 3.33Å; L104-T108 PolarHBondContact O-OG1 3.27Å; L104-I125 HydrophobicContact CD2-CG2 4.14Å; L104-A128 HydrophobicContact CD1-CB 4.11Å; L104-R129 HydrophobicContact CD1-CG 3.86Å
105	F	97.9	Very high	97.4	Very high	101 Å²	101	64.4 Å²	64.4	44%	0.443	36%	0.355	S	S	.	.	H	α-helix	trans	-69.6	-31.1	176.7	-78.4	-58.1	0	0	0	113.1	L101 V102 G103 T108 N109 I120	L101-F105 HydrophobicContact CB-CE2 4.43Å; L101-F105 WeakPolarHBondContact O-CD2 3.36Å; L101-F105 PolarHBondContact O-N 3.09Å; V102-F105 PolarHBondContact O-N 3.32Å; V102-F105 VanDerWaalsContact O-N 3.13Å; G103-F105 VanDerWaalsContact C-N 3.33Å; G103-F105 PolarHBondContact O-N 3.03Å; F105-T108 PolarHBondContact O-N 3.48Å; F105-N109 VanDerWaalsContact O-CB 3.25Å; F105-N109 WeakPolarHBondContact O-CB 3.16Å; F105-N109 PolarHBondContact O-N 3.16Å; F105-I120 HydrophobicContact CD1-CD1 3.85Å; F105-I120 HydrophobicContact CE1-CD1 3.91Å
106	E	97.3	Very high	97.4	Very high	115 Å²	115	70 Å²	70	54%	0.537	37%	0.371	S	S	.	.	H	α-helix	trans	-61.1	-51.1	172.1	-70.9	177.1	178.5	0	0	111	V102 G103 T108 N109 L110	V102-E106 WeakPolarHBondContact O-CG 3.39Å; V102-E106 PolarHBondContact O-N 3.12Å; G103-E106 PolarHBondContact O-N 2.8Å; E106-T108 VanDerWaalsContact C-N 3.35Å; E106-T108 PolarHBondContact O-N 3.27Å; E106-N109 WeakPolarHBondContact O-CB 3.18Å; E106-N109 PolarHBondContact O-N 2.78Å; E106-L110 WeakPolarHBondContact O-CG 3.33Å; E106-L110 PolarHBondContact O-N 3.33Å
107	D	97.4	Very high	97.5	Very high	51 Å²	51	69.3 Å²	69.3	27%	0.273	35%	0.354	S	S	.	.	H	α-helix	trans	-64.4	-39.9	177.4	-72.9	4.1	0	0	0	112.4	G103 L104 N109 L110 C111 A128 R132	G103-D107 PolarHBondContact O-N 3.35Å; L104-D107 PolarHBondContact O-N 3.32Å; D107-N109 VanDerWaalsContact C-N 3.28Å; D107-N109 PolarHBondContact O-N 3.47Å; D107-L110 WeakPolarHBondContact O-CB 3.46Å; D107-L110 PolarHBondContact O-N 3.32Å; D107-C111 PolarHBondContact O-N 3.25Å; D107-C111 PolarHBondContact O-SG 2.83Å; D107-A128 HydrophobicContact CB-CB 3.85Å; D107-R132 IonicContact OD1-NH2 3.6Å; D107-R132 IonicContact OD2-CZ 3.1Å; D107-R132 IonicContact OD2-NE 2.69Å; D107-R132 PolarHBondContact OD2-NE 3.03Å; D107-R132 IonicContact OD2-NH2 2.69Å; D107-R132 PolarHBondContact OD2-NH2 3.34Å
108	T	98.1	Very high	97.4	Very high	0 Å²	0	74 Å²	74	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-60.6	-41	175.6	-60.6	0	0	0	0	110.6	L104 F105 E106 C111 A112 I120 D124 I125	L104-T108 VanDerWaalsContact O-CB 3.29Å; L104-T108 WeakPolarHBondContact O-CB 3.28Å; L104-T108 PolarHBondContact O-N 3.33Å; L104-T108 PolarHBondContact O-OG1 3.27Å; F105-T108 PolarHBondContact O-N 3.48Å; E106-T108 VanDerWaalsContact C-N 3.35Å; E106-T108 PolarHBondContact O-N 3.27Å; T108-C111 WeakPolarHBondContact O-CB 3.36Å; T108-C111 PolarHBondContact O-N 2.92Å; T108-A112 PolarHBondContact O-N 3.11Å; T108-I120 HydrophobicContact CG2-CB 3.88Å; T108-I120 HydrophobicContact CG2-CG2 3.87Å; T108-D124 HydrophobicContact CG2-CB 3.61Å; T108-I125 HydrophobicContact CG2-CB 4.5Å; T108-I125 HydrophobicContact CG2-CG1 3.53Å
109	N	97.8	Very high	97.5	Very high	73 Å²	73	77.4 Å²	77.4	39%	0.39	40%	0.402	S	S	.	.	H	α-helix	trans	-65.2	-40.5	176.5	-174.5	48.6	0	0	0	111.5	F105 E106 D107 C111 A112 I113	F105-N109 VanDerWaalsContact O-CB 3.25Å; F105-N109 WeakPolarHBondContact O-CB 3.16Å; F105-N109 PolarHBondContact O-N 3.16Å; E106-N109 WeakPolarHBondContact O-CB 3.18Å; E106-N109 PolarHBondContact O-N 2.78Å; D107-N109 VanDerWaalsContact C-N 3.28Å; D107-N109 PolarHBondContact O-N 3.47Å; N109-C111 VanDerWaalsContact C-N 3.34Å; N109-C111 PolarHBondContact O-N 3.15Å; N109-A112 PolarHBondContact O-N 3.01Å; N109-I113 VanDerWaalsContact O-CG1 3.31Å; N109-I113 WeakPolarHBondContact O-CG1 3.32Å; N109-I113 PolarHBondContact O-N 2.9Å
110	L	97.7	Very high	97.5	Very high	111 Å²	111	77.8 Å²	77.8	58%	0.581	39%	0.394	S	S	*	.	H	α-helix	trans	-61.1	-41.4	173.1	-65.1	178.2	0	0	0	111.9	E106 D107 A112 I113 H114	E106-L110 WeakPolarHBondContact O-CG 3.33Å; E106-L110 PolarHBondContact O-N 3.33Å; D107-L110 WeakPolarHBondContact O-CB 3.46Å; D107-L110 PolarHBondContact O-N 3.32Å; L110-A112 PolarHBondContact O-N 3.46Å; L110-I113 PolarHBondContact O-N 3.33Å; L110-H114 WeakPolarHBondContact O-CB 3.19Å; L110-H114 PolarHBondContact O-N 3.26Å
111	C	97.6	Very high	97.6	Very high	15 Å²	15	77.1 Å²	77.1	10%	0.101	40%	0.395	C	S	.	.	H	α-helix	trans	-62.7	-40.3	175	-67.2	0	0	0	0	112.4	D107 T108 N109 H114 A115 D124 L127	D107-C111 PolarHBondContact O-N 3.25Å; D107-C111 PolarHBondContact O-SG 2.83Å; T108-C111 WeakPolarHBondContact O-CB 3.36Å; T108-C111 PolarHBondContact O-N 2.92Å; N109-C111 VanDerWaalsContact C-N 3.34Å; N109-C111 PolarHBondContact O-N 3.15Å; C111-H114 PolarHBondContact O-N 3.47Å; C111-A115 PolarHBondContact O-N 3.32Å; C111-D124 HydrophobicContact CB-CB 3.97Å; C111-L127 HydrophobicContact CB-CD2 4.22Å
112	A	98.1	Very high	97.6	Very high	0 Å²	0	77.2 Å²	77.2	0%	0	41%	0.406	C	S	.	.	H	α-helix	trans	-65.1	-44.7	176.5	0	0	0	0	0	111.8	T108 N109 L110 H114 A115 R116 R117 I120	T108-A112 PolarHBondContact O-N 3.11Å; N109-A112 PolarHBondContact O-N 3.01Å; L110-A112 PolarHBondContact O-N 3.46Å; A112-H114 VanDerWaalsContact C-N 3.35Å; A112-A115 CarbonylContact O-C 3.25Å; A112-A115 PolarHBondContact O-N 3.26Å; A112-A115 VanDerWaalsContact O-N 3.17Å; A112-R116 PolarHBondContact O-N 3.45Å; A112-R117 CarbonylContact C-O 3.46Å; A112-R117 VanDerWaalsContact C-O 3.25Å; A112-R117 PolarHBondContact O-N 3.23Å; A112-R117 VanDerWaalsContact O-O 3.07Å; A112-I120 HydrophobicContact CB-CG2 4.06Å
113	I	98	Very high	97.6	Very high	95 Å²	95	79 Å²	79	49%	0.487	41%	0.407	S	S	.	.	H	α-helix	trans	-62.2	-42.7	176.5	-69.1	164.2	0	0	0	110.7	N109 L110 A115 R116 R117	N109-I113 VanDerWaalsContact O-CG1 3.31Å; N109-I113 WeakPolarHBondContact O-CG1 3.32Å; N109-I113 PolarHBondContact O-N 2.9Å; L110-I113 PolarHBondContact O-N 3.33Å; I113-A115 PolarHBondContact O-N 3.14Å; I113-R116 WeakPolarHBondContact O-CA 3.48Å; I113-R116 PolarHBondContact O-N 2.88Å; I113-R117 PolarHBondContact N-O 2.93Å
114	H	97.7	Very high	97.6	Very high	164 Å²	164	78.3 Å²	78.3	76%	0.759	40%	0.399	S	S	*	.	H	α-helix	trans	-56.8	-37.8	175.9	-177.3	75.9	0	0	0	111.8	L110 C111 A112 R116	L110-H114 WeakPolarHBondContact O-CB 3.19Å; L110-H114 PolarHBondContact O-N 3.26Å; C111-H114 PolarHBondContact O-N 3.47Å; A112-H114 VanDerWaalsContact C-N 3.35Å; H114-R116 VanDerWaalsContact C-N 3.26Å; H114-R116 PolarHBondContact O-N 2.97Å
115	A	97.7	Very high	97.6	Very high	49 Å²	49	80.2 Å²	80.2	41%	0.405	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	17.4	175.1	0	0	0	0	0	114.5	C111 A112 I113 R117	C111-A115 PolarHBondContact O-N 3.32Å; A112-A115 CarbonylContact O-C 3.25Å; A112-A115 PolarHBondContact O-N 3.26Å; A112-A115 VanDerWaalsContact O-N 3.17Å; I113-A115 PolarHBondContact O-N 3.14Å; A115-R117 VanDerWaalsContact C-N 3.27Å; A115-R117 PolarHBondContact O-N 3.47Å
116	R	97.9	Very high	97.5	Very high	242 Å²	242	81.8 Å²	81.8	91%	0.913	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	32.7	-179.1	-53.1	-176.8	-173.9	-155.4	1.2	114.3	A112 I113 H114	A112-R116 PolarHBondContact O-N 3.45Å; I113-R116 WeakPolarHBondContact O-CA 3.48Å; I113-R116 PolarHBondContact O-N 2.88Å; H114-R116 VanDerWaalsContact C-N 3.26Å; H114-R116 PolarHBondContact O-N 2.97Å
117	R	98	Very high	97.5	Very high	47 Å²	47	79.9 Å²	79.9	18%	0.177	41%	0.411	C	S	.	.			trans	-117.9	154.3	175.4	-71.1	176.4	-71.3	106.6	-1.7	110.6	A112 I113 A115 T119 D124	A112-R117 CarbonylContact C-O 3.46Å; A112-R117 VanDerWaalsContact C-O 3.25Å; A112-R117 PolarHBondContact O-N 3.23Å; A112-R117 VanDerWaalsContact O-O 3.07Å; I113-R117 PolarHBondContact N-O 2.93Å; A115-R117 VanDerWaalsContact C-N 3.27Å; A115-R117 PolarHBondContact O-N 3.47Å; R117-T119 PolarHBondContact NH1-O 3.21Å; R117-D124 IonicContact CZ-OD1 3.56Å; R117-D124 IonicContact CZ-OD2 3.59Å; R117-D124 IonicContact NH1-OD1 3.49Å; R117-D124 PolarHBondContact NH1-OD1 3.31Å; R117-D124 IonicContact NH1-OD2 2.75Å; R117-D124 PolarHBondContact NH1-OD2 3.37Å; R117-D124 IonicContact NH2-OD1 2.69Å; R117-D124 PolarHBondContact NH2-OD1 3.31Å; R117-D124 IonicContact NH2-OD2 3.49Å; R117-D124 PolarHBondContact NH2-OD2 3.39Å
118	V	96.7	Very high	97.4	Very high	134 Å²	134	77.5 Å²	77.5	81%	0.812	40%	0.399	S	S	*	.	S	Bend	trans	-105	-10.8	170.7	-68.5	0	0	0	0	112.7
119	T	98.1	Very high	97.3	Very high	93 Å²	93	81.5 Å²	81.5	57%	0.571	41%	0.414	S	S	*	.	S	Bend	trans	-102	119.6	178	-53.3	0	0	0	0	109	R117	R117-T119 PolarHBondContact NH1-O 3.21Å
120	I	97.7	Very high	97.1	Very high	71 Å²	71	88 Å²	88	36%	0.364	43%	0.433	S	S	.	.			trans	-67.1	144.6	172.7	60.3	172.4	0	0	0	110.8	F105 T108 A112	F105-I120 HydrophobicContact CD1-CD1 3.85Å; F105-I120 HydrophobicContact CE1-CD1 3.91Å; T108-I120 HydrophobicContact CG2-CB 3.88Å; T108-I120 HydrophobicContact CG2-CG2 3.87Å; A112-I120 HydrophobicContact CB-CG2 4.06Å
121	M	98.2	Very high	97	Very high	83 Å²	83	88.8 Å²	88.8	41%	0.409	44%	0.436	S	S	.	.			trans	-131.7	162	-179	-64.3	178.1	176.7	0	0	109.9	K123 D124 I125	M121-K123 HydrophobicContact CB-CG 4.01Å; M121-K123 PolarHBondContact O-N 3.05Å; M121-K123 VanDerWaalsContact O-N 3.15Å; M121-K123 VanDerWaalsContact SD-CE 3.57Å; M121-D124 PolarHBondContact N-OD2 3.35Å; M121-D124 WeakPolarHBondContact O-CB 3.38Å; M121-D124 PolarHBondContact O-N 3.44Å; M121-I125 PolarHBondContact O-N 3.45Å
122	A	97.5	Very high	96.8	Very high	70 Å²	70	91.7 Å²	91.7	58%	0.579	45%	0.445	S	S	*	.	H	α-helix	trans	-55.2	-35.4	178.3	0	0	0	0	0	113.3	D124 I125 Q126	A122-D124 VanDerWaalsContact C-N 3.26Å; A122-D124 PolarHBondContact O-N 3.03Å; A122-I125 PolarHBondContact O-N 3.18Å; A122-Q126 WeakPolarHBondContact O-CG 3.38Å; A122-Q126 PolarHBondContact O-N 3.37Å
123	K	96.7	Very high	96.2	Very high	112 Å²	112	95.6 Å²	95.6	49%	0.487	48%	0.477	S	S	.	.	H	α-helix	trans	-62.8	-29.3	175.7	68.6	-174.9	-177.3	-175.6	0	113.8	M121 L127	M121-K123 HydrophobicContact CB-CG 4.01Å; M121-K123 PolarHBondContact O-N 3.05Å; M121-K123 VanDerWaalsContact O-N 3.15Å; M121-K123 VanDerWaalsContact SD-CE 3.57Å; K123-L127 WeakPolarHBondContact O-CB 3.4Å; K123-L127 PolarHBondContact O-N 2.96Å
124	D	97.7	Very high	95.3	Very high	5 Å²	5	94 Å²	94	3%	0.027	47%	0.468	C	S	.	.	H	α-helix	trans	-72.8	-39.4	178.9	-56.3	-39.4	0	0	0	109.9	T108 C111 R117 M121 A122 L127 A128	T108-D124 HydrophobicContact CG2-CB 3.61Å; C111-D124 HydrophobicContact CB-CB 3.97Å; R117-D124 IonicContact CZ-OD1 3.56Å; R117-D124 IonicContact CZ-OD2 3.59Å; R117-D124 IonicContact NH1-OD1 3.49Å; R117-D124 PolarHBondContact NH1-OD1 3.31Å; R117-D124 IonicContact NH1-OD2 2.75Å; R117-D124 PolarHBondContact NH1-OD2 3.37Å; R117-D124 IonicContact NH2-OD1 2.69Å; R117-D124 PolarHBondContact NH2-OD1 3.31Å; R117-D124 IonicContact NH2-OD2 3.49Å; R117-D124 PolarHBondContact NH2-OD2 3.39Å; M121-D124 PolarHBondContact N-OD2 3.35Å; M121-D124 WeakPolarHBondContact O-CB 3.38Å; M121-D124 PolarHBondContact O-N 3.44Å; A122-D124 VanDerWaalsContact C-N 3.26Å; A122-D124 PolarHBondContact O-N 3.03Å; D124-L127 PolarHBondContact O-N 3.28Å; D124-A128 WeakPolarHBondContact O-CB 3.46Å; D124-A128 PolarHBondContact O-N 2.95Å
125	I	96.4	Very high	93.7	Very high	54 Å²	54	97.3 Å²	97.3	28%	0.277	47%	0.474	S	S	.	.	H	α-helix	trans	-64.6	-45.9	174.4	-60.2	174.8	0	0	0	110.1	L104 T108 M121 A122 L127 A128 R129	L104-I125 HydrophobicContact CD2-CG2 4.14Å; T108-I125 HydrophobicContact CG2-CB 4.5Å; T108-I125 HydrophobicContact CG2-CG1 3.53Å; M121-I125 PolarHBondContact O-N 3.45Å; A122-I125 PolarHBondContact O-N 3.18Å; I125-L127 VanDerWaalsContact C-N 3.31Å; I125-L127 PolarHBondContact O-N 3.16Å; I125-A128 PolarHBondContact O-N 3.48Å; I125-R129 HydrophobicContact CG2-CG 4.46Å; I125-R129 WeakPolarHBondContact O-CG 3.45Å; I125-R129 PolarHBondContact O-N 3.45Å
126	Q	95.9	Very high	91.6	Very high	134 Å²	134	102.2 Å²	102.2	63%	0.626	51%	0.514	S	S	*	.	H	α-helix	trans	-60.2	-42.5	177.4	-71.3	170.9	-11.4	0	0	111.6	A122 R130	A122-Q126 WeakPolarHBondContact O-CG 3.38Å; A122-Q126 PolarHBondContact O-N 3.37Å; Q126-R130 VanDerWaalsContact O-CB 3.31Å; Q126-R130 WeakPolarHBondContact O-CB 3.45Å; Q126-R130 PolarHBondContact O-N 2.99Å
127	L	95.8	Very high	91.3	Very high	74 Å²	74	95.3 Å²	95.3	39%	0.387	49%	0.494	S	S	.	.	H	α-helix	trans	-64	-47	176.1	-179.3	59.7	0	0	0	111.7	C111 K123 D124 I125 R129 R130 I131	C111-L127 HydrophobicContact CB-CD2 4.22Å; K123-L127 WeakPolarHBondContact O-CB 3.4Å; K123-L127 PolarHBondContact O-N 2.96Å; D124-L127 PolarHBondContact O-N 3.28Å; I125-L127 VanDerWaalsContact C-N 3.31Å; I125-L127 PolarHBondContact O-N 3.16Å; L127-R129 PolarHBondContact O-N 3.35Å; L127-R130 WeakPolarHBondContact O-CB 3.27Å; L127-R130 PolarHBondContact O-N 2.96Å; L127-I131 HydrophobicContact CD1-CD1 3.99Å; L127-I131 HydrophobicContact CD1-CG1 4.3Å; L127-I131 HydrophobicContact CG-CD1 3.99Å; L127-I131 WeakPolarHBondContact O-CG1 3.42Å; L127-I131 PolarHBondContact O-N 3.47Å
128	A	95.8	Very high	91	Very high	2 Å²	2	97.8 Å²	97.8	2%	0.017	51%	0.511	C	S	.	.	H	α-helix	trans	-58.4	-49	177.7	0	0	0	0	0	111.7	L104 D107 D124 I125 R130 I131 R132	L104-A128 HydrophobicContact CD1-CB 4.11Å; D107-A128 HydrophobicContact CB-CB 3.85Å; D124-A128 WeakPolarHBondContact O-CB 3.46Å; D124-A128 PolarHBondContact O-N 2.95Å; I125-A128 PolarHBondContact O-N 3.48Å; A128-R130 VanDerWaalsContact C-N 3.32Å; A128-R130 PolarHBondContact O-N 2.92Å; A128-I131 PolarHBondContact O-N 3.37Å; A128-R132 WeakPolarHBondContact O-CG 3.37Å; A128-R132 PolarHBondContact O-N 3.46Å
129	R	95.6	Very high	90.7	Very high	84 Å²	84	95.8 Å²	95.8	32%	0.317	49%	0.494	S	S	.	.	H	α-helix	trans	-60.5	-40.2	176.5	-71.8	-176.4	65	-159.7	-2.9	112.6	L104 I125 L127 R132 A133 E134 R135	L104-R129 HydrophobicContact CD1-CG 3.86Å; I125-R129 HydrophobicContact CG2-CG 4.46Å; I125-R129 WeakPolarHBondContact O-CG 3.45Å; I125-R129 PolarHBondContact O-N 3.45Å; L127-R129 PolarHBondContact O-N 3.35Å; R129-R132 PolarHBondContact O-N 3.02Å; R129-A133 PolarHBondContact O-N 3.37Å; R129-E134 PolarHBondContact O-N 3.41Å; R129-E134 VanDerWaalsContact O-N 3.12Å; R129-R135 PolarHBondContact NH2-O 3.19Å
130	R	95.1	Very high	90.2	Very high	209 Å²	209	95.9 Å²	95.9	79%	0.789	49%	0.49	S	S	*	.	H	α-helix	trans	-62.1	-42.6	176.6	-177	176.3	-180	174.1	0.6	111.9	Q126 L127 A128 A133	Q126-R130 VanDerWaalsContact O-CB 3.31Å; Q126-R130 WeakPolarHBondContact O-CB 3.45Å; Q126-R130 PolarHBondContact O-N 2.99Å; L127-R130 WeakPolarHBondContact O-CB 3.27Å; L127-R130 PolarHBondContact O-N 2.96Å; A128-R130 VanDerWaalsContact C-N 3.32Å; A128-R130 PolarHBondContact O-N 2.92Å; R130-A133 PolarHBondContact O-N 3.29Å
131	I	94.2	Very high	89.7	Confident	127 Å²	127	97.5 Å²	97.5	65%	0.651	50%	0.497	S	S	*	.	H	α-helix	trans	-68.6	-38.5	178.4	-67.1	168.3	0	0	0	110.9	L127 A128 A133	L127-I131 HydrophobicContact CD1-CD1 3.99Å; L127-I131 HydrophobicContact CD1-CG1 4.3Å; L127-I131 HydrophobicContact CG-CD1 3.99Å; L127-I131 WeakPolarHBondContact O-CG1 3.42Å; L127-I131 PolarHBondContact O-N 3.47Å; A128-I131 PolarHBondContact O-N 3.37Å; I131-A133 PolarHBondContact O-N 3.07Å; I131-A133 VanDerWaalsContact O-N 3.15Å
132	R	93.4	Very high	89.2	Confident	76 Å²	76	98.5 Å²	98.5	29%	0.287	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-7.6	175.1	-72.5	-174.8	176.9	-171.1	-5.9	114.8	G103 D107 A128 R129 E134	G103-R132 PolarHBondContact O-NH2 3.48Å; D107-R132 IonicContact OD1-NH2 3.6Å; D107-R132 IonicContact OD2-CZ 3.1Å; D107-R132 IonicContact OD2-NE 2.69Å; D107-R132 PolarHBondContact OD2-NE 3.03Å; D107-R132 IonicContact OD2-NH2 2.69Å; D107-R132 PolarHBondContact OD2-NH2 3.34Å; A128-R132 WeakPolarHBondContact O-CG 3.37Å; A128-R132 PolarHBondContact O-N 3.46Å; R129-R132 PolarHBondContact O-N 3.02Å; R132-E134 HydrophobicContact CB-CB 4.42Å; R132-E134 HydrophobicContact CB-CG 3.89Å; R132-E134 VanDerWaalsContact CD-OE1 3.3Å; R132-E134 WeakPolarHBondContact CD-OE1 3.47Å; R132-E134 IonicContact NH1-OE1 3.91Å; R132-E134 PolarHBondContact O-N 3.11Å
133	A	87.2	Confident	88.6	Confident	82 Å²	82	100.5 Å²	100.5	68%	0.678	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	23	-169.9	0	0	0	0	0	114	R129 R130 I131 R135	R129-A133 PolarHBondContact O-N 3.37Å; R130-A133 PolarHBondContact O-N 3.29Å; I131-A133 PolarHBondContact O-N 3.07Å; I131-A133 VanDerWaalsContact O-N 3.15Å; A133-R135 PolarHBondContact O-N 2.93Å; A133-R135 VanDerWaalsContact O-N 3.15Å
134	E	78.7	Confident	88	Confident	62 Å²	62	99.6 Å²	99.6	29%	0.29	50%	0.499	S	S	.	.			trans	-79.3	97.8	172.6	-70.9	172.6	-170.1	0	0	108.2	Y100 R129 R132	Y100-E134 WeakPolarHBondContact CE2-OE1 3.3Å; Y100-E134 WeakPolarHBondContact CE2-OE2 3.28Å; Y100-E134 PolarHBondContact OH-OE2 2.54Å; R129-E134 PolarHBondContact O-N 3.41Å; R129-E134 VanDerWaalsContact O-N 3.12Å; R132-E134 HydrophobicContact CB-CB 4.42Å; R132-E134 HydrophobicContact CB-CG 3.89Å; R132-E134 VanDerWaalsContact CD-OE1 3.3Å; R132-E134 WeakPolarHBondContact CD-OE1 3.47Å; R132-E134 IonicContact NH1-OE1 3.91Å; R132-E134 PolarHBondContact O-N 3.11Å
135	R	64.2	Low	87.2	Confident	234 Å²	234	107.5 Å²	107.5	88%	0.883	54%	0.538	S	S	*	.			trans	-59.3	142.9	178.3	-71.6	-176.4	177.8	-179.9	-0.5	110.4	R129 A133	R129-R135 PolarHBondContact NH2-O 3.19Å; A133-R135 PolarHBondContact O-N 2.93Å; A133-R135 VanDerWaalsContact O-N 3.15Å
136	A	53.8	Low	86.3	Confident	152 Å²	152	112.4 Å²	112.4	100%	1.256	56%	0.562	S	S	*	*			trans	-66.3	0	165.5	0	0	0	0	0	110.3

Retrieved 136 of 136 residues in 57 ms (Link to these results)

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