A0A077ZJD6_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 A0A077ZJD6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 136 aa.

						>A0A077ZJD6_TRITR|A0A077ZJD6
MARTKQTARKSTGGKAPRKQLATKAARKSAPSVGAIKKAHRYRPGTVALREIRRYQKSTELLIRRLPFQRLVREIAQDFKADLRFQMSAVLALQEATEAYLVGLFEDTNLCAIHARRVTIMAKDIQLARRIRGERV
					

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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	Very low	64.7	Low	250 Å²	250	175.5 Å²	175.5	100%	1.232	90%	0.901	S	S	*	*				0	112.4	0	-81.7	177.4	173.8	0	0	109
2	A	63.3	Low	64.6	Low	103 Å²	103	171 Å²	171	85%	0.851	89%	0.888	S	S	*	*			trans	-94.8	118.3	178.7	0	0	0	0	0	110.3	T4	A2-T4 PolarHBondContact O-N 3.21Å
3	R	63.3	Low	63.9	Low	253 Å²	253	164.6 Å²	164.6	96%	0.955	89%	0.889	S	S	*	*			trans	-72.7	113.4	178.7	-112.2	179.4	174.8	178.5	-1	110.1
4	T	73.1	Confident	63.9	Low	135 Å²	135	157.8 Å²	157.8	83%	0.828	88%	0.877	S	S	*	*			trans	-77.5	120.2	167.7	39.9	0	0	0	0	109.9	A2 Q6	A2-T4 PolarHBondContact O-N 3.21Å; T4-Q6 PolarHBondContact O-N 3.23Å; T4-Q6 VanDerWaalsContact O-N 3.15Å
5	K	73.4	Confident	63.7	Low	202 Å²	202	160.9 Å²	160.9	88%	0.878	88%	0.878	S	S	*	*			trans	-76.1	97.6	178.6	-151.8	177.3	-171.9	179.4	0	108.6	T7	K5-T7 PolarHBondContact O-N 3.29Å
6	Q	71.1	Confident	63.6	Low	192 Å²	192	156.6 Å²	156.6	90%	0.897	87%	0.87	S	S	*	*	P	Polyproline II helix	trans	-62.6	118.5	168.2	-88.7	-175.7	-7.4	0	0	109	T4	T4-Q6 PolarHBondContact O-N 3.23Å; T4-Q6 VanDerWaalsContact O-N 3.15Å
7	T	68.2	Low	63.5	Low	127 Å²	127	155.2 Å²	155.2	78%	0.779	87%	0.87	S	S	*	*	P	Polyproline II helix	trans	-87.6	124.8	168.1	47.5	0	0	0	0	109.3	K5 R9	K5-T7 PolarHBondContact O-N 3.29Å; T7-R9 PolarHBondContact O-N 3.04Å
8	A	64.3	Low	63.3	Low	104 Å²	104	160.4 Å²	160.4	86%	0.86	87%	0.874	S	S	*	*	P	Polyproline II helix	trans	-66.1	119	179.2	0	0	0	0	0	111.1
9	R	63.5	Low	62.8	Low	248 Å²	248	162.7 Å²	162.7	94%	0.936	87%	0.874	S	S	*	*	P	Polyproline II helix	trans	-84.2	121.7	165.6	-97	-178.1	165.9	-179.4	-2.8	109.1	T7	T7-R9 PolarHBondContact O-N 3.04Å
10	K	60.9	Low	62.2	Low	196 Å²	196	164.3 Å²	164.3	85%	0.852	88%	0.876	S	S	*	*	P	Polyproline II helix	trans	-60.2	137.9	172.8	-70.3	-177.5	177.5	-178.3	0	110.5	T12	K10-T12 VanDerWaalsContact C-N 3.28Å; K10-T12 PolarHBondContact O-N 2.7Å
11	S	64.1	Low	62	Low	120 Å²	120	164.5 Å²	164.5	84%	0.839	88%	0.876	S	S	*	*	S	Bend	trans	-77.2	3.2	-171.3	44.6	0	0	0	0	115.6
12	T	63.3	Low	62.7	Low	122 Å²	122	157.3 Å²	157.3	75%	0.748	86%	0.857	S	S	*	*			trans	-128.8	74.4	-176.6	43.1	0	0	0	0	111.3	K10 G14	K10-T12 VanDerWaalsContact C-N 3.28Å; K10-T12 PolarHBondContact O-N 2.7Å; T12-G14 VanDerWaalsContact C-N 3.27Å; T12-G14 PolarHBondContact O-N 2.69Å
13	G	55.3	Low	62	Low	88 Å²	88	159.5 Å²	159.5	91%	0.907	86%	0.86	S	S	*	*			trans	-81	61.6	175.6	0	0	0	0	0	113.3
14	G	63.8	Low	61.8	Low	69 Å²	69	157 Å²	157	71%	0.711	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-89.3	131.1	166.2	0	0	0	0	0	110	T12	T12-G14 VanDerWaalsContact C-N 3.27Å; T12-G14 PolarHBondContact O-N 2.69Å
15	K	61.5	Low	61.2	Low	205 Å²	205	155.2 Å²	155.2	89%	0.891	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-47.1	138.1	-171.8	-68.7	-177.4	175.9	-178.9	0	113.9
16	A	62.3	Low	60.3	Low	91 Å²	91	150.1 Å²	150.1	75%	0.752	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-56.7	138.4	174.4	0	0	0	0	0	112.2	R18	A16-R18 PolarHBondContact O-N 3.26Å
17	P	60.5	Low	59.7	Low	134 Å²	134	151.9 Å²	151.9	87%	0.87	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-75	122.2	178.8	29.7	-30.9	0	0	0	109.7
18	R	60.6	Low	59.2	Low	248 Å²	248	156.1 Å²	156.1	94%	0.936	86%	0.856	S	S	*	*			trans	-106.5	132.6	175.5	-136.2	176.9	-174.2	-179	0.6	109.7	A16	A16-R18 PolarHBondContact O-N 3.26Å
19	K	54.2	Low	58.7	Low	205 Å²	205	156.2 Å²	156.2	89%	0.891	85%	0.851	S	S	*	*			trans	-47.1	141.5	-179.7	-82.7	178.1	170.6	-179.2	0	113.2
20	Q	50.7	Low	58.6	Low	193 Å²	193	147.9 Å²	147.9	90%	0.902	84%	0.835	S	S	*	*			trans	-60.1	124.7	179.2	-66.1	173.1	-4.3	0	0	112.1
21	L	57.9	Low	58.4	Low	169 Å²	169	143.5 Å²	143.5	89%	0.885	83%	0.827	S	S	*	*			trans	-160	120.4	157.8	-98.5	127.4	0	0	0	109.1
22	A	60.9	Low	58.3	Low	99 Å²	99	143.7 Å²	143.7	82%	0.818	83%	0.828	S	S	*	*			trans	55	110.6	161.9	0	0	0	0	0	119.3	K24	A22-K24 PolarHBondContact O-N 2.78Å
23	T	50.1	Low	58	Low	150 Å²	150	144.2 Å²	144.2	92%	0.92	83%	0.831	S	S	*	*			trans	-56.5	104.3	166.8	44.5	0	0	0	0	113.2
24	K	58.2	Low	58.5	Low	199 Å²	199	142.3 Å²	142.3	87%	0.865	81%	0.811	S	S	*	*			trans	-134.8	123	152.1	-103.3	179.1	177.9	176	0	107.2	A22 A26	A22-K24 PolarHBondContact O-N 2.78Å; K24-A26 PolarHBondContact O-N 3.28Å
25	A	60.1	Low	58.7	Low	99 Å²	99	144 Å²	144	82%	0.818	82%	0.819	S	S	*	*			trans	-65.4	77.8	178.8	0	0	0	0	0	110.7	R27	A25-R27 PolarHBondContact O-N 3.41Å
26	A	54.2	Low	59.2	Low	94 Å²	94	141.2 Å²	141.2	78%	0.777	81%	0.812	S	S	*	*			trans	-76.6	72.9	174.7	0	0	0	0	0	109.3	K24 K28	K24-A26 PolarHBondContact O-N 3.28Å; A26-K28 PolarHBondContact O-N 2.98Å
27	R	58.6	Low	59.8	Low	230 Å²	230	146.1 Å²	146.1	87%	0.868	82%	0.816	S	S	*	*			trans	-64.9	101.1	166.7	-72.9	-176.9	-178.8	176.1	1.4	107.8	A25 S29	A25-R27 PolarHBondContact O-N 3.41Å; R27-S29 VanDerWaalsContact C-N 3.3Å; R27-S29 PolarHBondContact O-N 3.37Å
28	K	57.4	Low	60.9	Low	215 Å²	215	149.5 Å²	149.5	94%	0.935	82%	0.817	S	S	*	*			trans	9.1	68.2	163.3	-71.5	179.2	175.7	173.9	0	115.1	A26	A26-K28 PolarHBondContact O-N 2.98Å
29	S	54.2	Low	62.1	Low	107 Å²	107	142.1 Å²	142.1	75%	0.748	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-96.4	135.7	161	53.3	0	0	0	0	107	R27	R27-S29 VanDerWaalsContact C-N 3.3Å; R27-S29 PolarHBondContact O-N 3.37Å
30	A	61	Low	63.8	Low	73 Å²	73	139.6 Å²	139.6	60%	0.603	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-49.9	150.7	-166.3	0	0	0	0	0	114.1	S32	A30-S32 PolarHBondContact O-N 3.21Å
31	P	58.1	Low	65.8	Low	104 Å²	104	141 Å²	141	68%	0.675	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-57.3	127.5	169.9	25	-31.4	0	0	0	108.9	V33	P31-V33 PolarHBondContact O-N 2.97Å; P31-V33 VanDerWaalsContact O-N 3.08Å
32	S	61.1	Low	67.6	Low	123 Å²	123	138.7 Å²	138.7	86%	0.86	78%	0.778	S	S	*	*	S	Bend	trans	-68.4	-2.7	-176.8	58.5	0	0	0	0	114	A30	A30-S32 PolarHBondContact O-N 3.21Å
33	V	57.9	Low	69.2	Low	134 Å²	134	144 Å²	144	81%	0.812	78%	0.776	S	S	*	*	S	Bend	trans	-147.8	89.6	179.9	-168.2	0	0	0	0	108.3	P31	P31-V33 PolarHBondContact O-N 2.97Å; P31-V33 VanDerWaalsContact O-N 3.08Å
34	G	66.3	Low	71.5	Confident	48 Å²	48	143 Å²	143	50%	0.495	77%	0.772	S	S	.	*	S	Bend	trans	168.6	148	177.7	0	0	0	0	0	112.1	I36	G34-I36 PolarHBondContact O-N 3.13Å
35	A	67.7	Low	73.3	Confident	105 Å²	105	135.4 Å²	135.4	87%	0.868	75%	0.751	S	S	*	*			trans	-51.8	111.8	178.6	0	0	0	0	0	110.4	K37	A35-K37 PolarHBondContact O-N 3.4Å; A35-K37 VanDerWaalsContact O-N 3.08Å
36	I	70.7	Confident	75.1	Confident	145 Å²	145	133.4 Å²	133.4	74%	0.744	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-55.2	118.4	175.8	-61.7	170.5	0	0	0	106.8	G34 K38	G34-I36 PolarHBondContact O-N 3.13Å; I36-K38 PolarHBondContact O-N 3.48Å; I36-K38 VanDerWaalsContact O-N 3.12Å
37	K	76.2	Confident	77.1	Confident	194 Å²	194	131.2 Å²	131.2	84%	0.843	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-53	124.6	171.5	-77.2	-174.8	175.1	-176.6	0	107.5	A35 A39	A35-K37 PolarHBondContact O-N 3.4Å; A35-K37 VanDerWaalsContact O-N 3.08Å; K37-A39 PolarHBondContact O-N 2.99Å; K37-A39 VanDerWaalsContact O-N 3.14Å
38	K	82.2	Confident	79	Confident	205 Å²	205	122.5 Å²	122.5	89%	0.891	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-46.5	125.1	178.6	-69.9	-175.6	179.4	-179.4	0	109	I36 H40	I36-K38 PolarHBondContact O-N 3.48Å; I36-K38 VanDerWaalsContact O-N 3.12Å; K38-H40 PolarHBondContact O-N 3.25Å
39	A	87.4	Confident	80.9	Confident	93 Å²	93	117 Å²	117	77%	0.769	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-55.7	133.4	177.3	0	0	0	0	0	109	K37 R41	K37-A39 PolarHBondContact O-N 2.99Å; K37-A39 VanDerWaalsContact O-N 3.14Å; A39-R41 PolarHBondContact O-N 3.4Å
40	H	89.8	Confident	83	Confident	152 Å²	152	117.5 Å²	117.5	70%	0.704	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-63.5	122.7	178.2	174.3	-84.3	0	0	0	109.5	K38 Y42	K38-H40 PolarHBondContact O-N 3.25Å; H40-Y42 AromaticContact CE1-CD1 3.84Å; H40-Y42 AromaticContact CE1-CE1 3.73Å; H40-Y42 AromaticContact CE1-CZ 3.93Å
41	R	92.8	Very high	84.8	Confident	222 Å²	222	118.3 Å²	118.3	84%	0.838	64%	0.64	S	S	*	*			trans	-119.2	126.8	175.6	-172.1	175.1	179.5	173	0.9	109.7	A39	A39-R41 PolarHBondContact O-N 3.4Å
42	Y	94.5	Very high	86.6	Confident	122 Å²	122	117.5 Å²	117.5	48%	0.478	63%	0.629	S	S	.	*	P	Polyproline II helix	trans	-64.9	146.1	171.4	-69.3	-75.4	0	0	0	110.8	H40 T46 V47	H40-Y42 AromaticContact CE1-CD1 3.84Å; H40-Y42 AromaticContact CE1-CE1 3.73Å; H40-Y42 AromaticContact CE1-CZ 3.93Å; Y42-T46 HydrophobicContact CD1-CG2 3.81Å; Y42-T46 HydrophobicContact CG-CG2 4.41Å; Y42-V47 HydrophobicContact CD2-CG2 4.09Å; Y42-V47 HydrophobicContact CG-CG2 4.15Å
43	R	95.6	Very high	88.4	Confident	209 Å²	209	119.6 Å²	119.6	79%	0.789	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-64	145.6	173.5	-64.1	-176.5	176.9	-161	-1	110.1	G45 T46	R43-G45 PolarHBondContact O-N 3.07Å; R43-T46 WeakPolarHBondContact O-CB 3.38Å; R43-T46 PolarHBondContact O-N 3.39Å; R43-T46 PolarHBondContact O-OG1 3.05Å
44	P	96.6	Very high	90.3	Very high	129 Å²	129	120.1 Å²	120.1	84%	0.838	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.8	139.9	172.1	-25.8	34.6	0	0	0	111.1	T46	P44-T46 VanDerWaalsContact C-N 3.28Å; P44-T46 PolarHBondContact O-N 2.89Å
45	G	96.5	Very high	91.8	Very high	41 Å²	41	122.4 Å²	122.4	42%	0.423	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	85	-24.9	-174.1	0	0	0	0	0	115.4	R43 V47 A48 L49	R43-G45 PolarHBondContact O-N 3.07Å; G45-V47 PolarHBondContact O-N 3.43Å; G45-A48 PolarHBondContact O-N 3.31Å; G45-L49 WeakPolarHBondContact O-CG 3.35Å; G45-L49 PolarHBondContact O-N 3.4Å
46	T	97.8	Very high	93.2	Very high	56 Å²	56	124.6 Å²	124.6	34%	0.344	59%	0.592	S	S	.	*	H	α-helix	trans	-63.7	-44.5	-179.1	-50.5	0	0	0	0	112.1	Y42 R43 P44 R50	Y42-T46 HydrophobicContact CD1-CG2 3.81Å; Y42-T46 HydrophobicContact CG-CG2 4.41Å; R43-T46 WeakPolarHBondContact O-CB 3.38Å; R43-T46 PolarHBondContact O-N 3.39Å; R43-T46 PolarHBondContact O-OG1 3.05Å; P44-T46 VanDerWaalsContact C-N 3.28Å; P44-T46 PolarHBondContact O-N 2.89Å; T46-R50 PolarHBondContact O-N 3.37Å
47	V	97.6	Very high	94.5	Very high	49 Å²	49	126.4 Å²	126.4	30%	0.297	60%	0.595	S	S	.	*	H	α-helix	trans	-70.7	-43	178.8	-175	0	0	0	0	110	Y42 G45 L49 R50 E51	Y42-V47 HydrophobicContact CD2-CG2 4.09Å; Y42-V47 HydrophobicContact CG-CG2 4.15Å; G45-V47 PolarHBondContact O-N 3.43Å; V47-L49 PolarHBondContact O-N 2.87Å; V47-R50 WeakPolarHBondContact O-CB 3.29Å; V47-R50 PolarHBondContact O-N 3.43Å; V47-R50 VanDerWaalsContact O-N 3.09Å; V47-E51 HydrophobicContact CG1-CG 4.47Å; V47-E51 VanDerWaalsContact CG1-OE1 3.27Å; V47-E51 WeakPolarHBondContact CG1-OE1 3.28Å; V47-E51 WeakPolarHBondContact O-CG 3.05Å; V47-E51 PolarHBondContact O-N 3.34Å
48	A	97.4	Very high	95.5	Very high	47 Å²	47	119.1 Å²	119.1	39%	0.388	57%	0.568	S	S	.	*	H	α-helix	trans	-58.4	-47	178.2	0	0	0	0	0	112.2	G45 R50 E51 I52	G45-A48 PolarHBondContact O-N 3.31Å; A48-R50 VanDerWaalsContact C-N 3.27Å; A48-R50 PolarHBondContact O-N 2.99Å; A48-E51 PolarHBondContact O-N 3.05Å; A48-I52 VanDerWaalsContact O-CG1 3.28Å; A48-I52 WeakPolarHBondContact O-CG1 3.4Å; A48-I52 PolarHBondContact O-N 3.18Å
49	L	97.7	Very high	96.2	Very high	99 Å²	99	116.1 Å²	116.1	52%	0.518	57%	0.567	S	S	.	*	H	α-helix	trans	-62.9	-33.4	176.3	-72.4	173.9	0	0	0	112.9	G45 V47 R53	G45-L49 WeakPolarHBondContact O-CG 3.35Å; G45-L49 PolarHBondContact O-N 3.4Å; V47-L49 PolarHBondContact O-N 2.87Å; L49-R53 VanDerWaalsContact O-CG 3.29Å; L49-R53 WeakPolarHBondContact O-CG 3.42Å; L49-R53 PolarHBondContact O-N 2.99Å; L49-R53 VanDerWaalsContact O-N 3.15Å
50	R	98	Very high	96.6	Very high	117 Å²	117	116.5 Å²	116.5	44%	0.442	55%	0.553	S	S	.	*	H	α-helix	trans	-69.9	-40.3	175.5	-178.3	174.9	60.2	-126.7	1	111.5	T46 V47 A48 R54	T46-R50 PolarHBondContact O-N 3.37Å; V47-R50 WeakPolarHBondContact O-CB 3.29Å; V47-R50 PolarHBondContact O-N 3.43Å; V47-R50 VanDerWaalsContact O-N 3.09Å; A48-R50 VanDerWaalsContact C-N 3.27Å; A48-R50 PolarHBondContact O-N 2.99Å; R50-R54 WeakPolarHBondContact O-CB 3.37Å; R50-R54 PolarHBondContact O-N 3.48Å
51	E	97.9	Very high	96.9	Very high	91 Å²	91	111.2 Å²	111.2	43%	0.425	53%	0.53	S	S	.	.	H	α-helix	trans	-65.6	-46.2	175.7	-74	169.3	-170.9	0	0	111.4	V47 A48 R53 R54 Y55	V47-E51 HydrophobicContact CG1-CG 4.47Å; V47-E51 VanDerWaalsContact CG1-OE1 3.27Å; V47-E51 WeakPolarHBondContact CG1-OE1 3.28Å; V47-E51 WeakPolarHBondContact O-CG 3.05Å; V47-E51 PolarHBondContact O-N 3.34Å; A48-E51 PolarHBondContact O-N 3.05Å; E51-R53 PolarHBondContact O-N 2.98Å; E51-R54 WeakPolarHBondContact O-CB 3.36Å; E51-R54 PolarHBondContact O-N 3.47Å; E51-Y55 HydrophobicContact CB-CD2 4.26Å; E51-Y55 HydrophobicContact CB-CE2 3.97Å; E51-Y55 HydrophobicContact CG-CE2 4.43Å; E51-Y55 WeakPolarHBondContact O-CD2 3.36Å; E51-Y55 PolarHBondContact O-N 3.05Å
52	I	97.7	Very high	97.2	Very high	86 Å²	86	105.1 Å²	105.1	44%	0.441	51%	0.513	S	S	.	.	H	α-helix	trans	-54.4	-51.4	175.1	-68.3	164.3	0	0	0	110.4	A48 R54 Y55 Q56	A48-I52 VanDerWaalsContact O-CG1 3.28Å; A48-I52 WeakPolarHBondContact O-CG1 3.4Å; A48-I52 PolarHBondContact O-N 3.18Å; I52-R54 VanDerWaalsContact C-N 3.27Å; I52-R54 PolarHBondContact O-N 2.96Å; I52-Y55 PolarHBondContact O-N 3.43Å; I52-Q56 HydrophobicContact CG2-CG 4.35Å; I52-Q56 WeakPolarHBondContact O-CB 3.47Å; I52-Q56 VanDerWaalsContact O-CG 3.29Å; I52-Q56 WeakPolarHBondContact O-CG 3.3Å; I52-Q56 PolarHBondContact O-N 2.69Å
53	R	97.9	Very high	97.3	Very high	167 Å²	167	102.2 Å²	102.2	63%	0.63	51%	0.505	S	S	*	.	H	α-helix	trans	-64.4	-30.1	178.5	-70.2	176	-168.6	-171.5	2.9	113.5	L49 E51 K57	L49-R53 VanDerWaalsContact O-CG 3.29Å; L49-R53 WeakPolarHBondContact O-CG 3.42Å; L49-R53 PolarHBondContact O-N 2.99Å; L49-R53 VanDerWaalsContact O-N 3.15Å; E51-R53 PolarHBondContact O-N 2.98Å; R53-K57 WeakPolarHBondContact O-CD 3.36Å; R53-K57 VanDerWaalsContact O-CG 3.27Å; R53-K57 WeakPolarHBondContact O-CG 3.32Å
54	R	98	Very high	97.4	Very high	146 Å²	146	102 Å²	102	55%	0.551	50%	0.504	S	S	*	.	H	α-helix	trans	-69.5	-53.8	176.2	176.8	-174.4	168.3	-171.6	-6.2	109.6	R50 E51 I52 Q56 K57 S58 E60	R50-R54 WeakPolarHBondContact O-CB 3.37Å; R50-R54 PolarHBondContact O-N 3.48Å; E51-R54 WeakPolarHBondContact O-CB 3.36Å; E51-R54 PolarHBondContact O-N 3.47Å; I52-R54 VanDerWaalsContact C-N 3.27Å; I52-R54 PolarHBondContact O-N 2.96Å; R54-Q56 PolarHBondContact O-N 3.34Å; R54-K57 PolarHBondContact O-N 2.89Å; R54-K57 VanDerWaalsContact O-N 3.12Å; R54-S58 PolarHBondContact O-N 3.28Å; R54-S58 PolarHBondContact O-OG 3.26Å; R54-E60 IonicContact NH2-OE1 3.58Å
55	Y	97.8	Very high	97.3	Very high	96 Å²	96	103.9 Å²	103.9	38%	0.376	50%	0.495	S	S	.	.	H	α-helix	trans	-70.5	-30.5	-174.9	-62.4	-50.3	0	0	0	113.1	E51 I52 K57 S58 L62	E51-Y55 HydrophobicContact CB-CD2 4.26Å; E51-Y55 HydrophobicContact CB-CE2 3.97Å; E51-Y55 HydrophobicContact CG-CE2 4.43Å; E51-Y55 WeakPolarHBondContact O-CD2 3.36Å; E51-Y55 PolarHBondContact O-N 3.05Å; I52-Y55 PolarHBondContact O-N 3.43Å; Y55-K57 PolarHBondContact O-N 3.36Å; Y55-S58 WeakPolarHBondContact CA-OG 3.45Å; Y55-S58 PolarHBondContact O-N 3.46Å; Y55-S58 PolarHBondContact O-OG 3.45Å; Y55-L62 HydrophobicContact CD1-CD2 3.75Å; Y55-L62 HydrophobicContact CE1-CD2 3.9Å; Y55-L62 HydrophobicContact CG-CD2 4.49Å
56	Q	97.4	Very high	97.2	Very high	150 Å²	150	106.6 Å²	106.6	70%	0.701	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-20.7	171.5	-75.2	-179.4	-30.2	0	0	113.8	I52 R54	I52-Q56 HydrophobicContact CG2-CG 4.35Å; I52-Q56 WeakPolarHBondContact O-CB 3.47Å; I52-Q56 VanDerWaalsContact O-CG 3.29Å; I52-Q56 WeakPolarHBondContact O-CG 3.3Å; I52-Q56 PolarHBondContact O-N 2.69Å; R54-Q56 PolarHBondContact O-N 3.34Å
57	K	98	Very high	97.3	Very high	184 Å²	184	107.4 Å²	107.4	80%	0.8	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-22.5	177.7	-75.1	179.7	178.8	-167.4	0	113.3	R53 R54 Y55	R53-K57 WeakPolarHBondContact O-CD 3.36Å; R53-K57 VanDerWaalsContact O-CG 3.27Å; R53-K57 WeakPolarHBondContact O-CG 3.32Å; R54-K57 PolarHBondContact O-N 2.89Å; R54-K57 VanDerWaalsContact O-N 3.12Å; Y55-K57 PolarHBondContact O-N 3.36Å
58	S	96.5	Very high	97.3	Very high	41 Å²	41	105.8 Å²	105.8	29%	0.287	49%	0.494	S	S	.	.			trans	-98.9	160	-179.3	58.6	0	0	0	0	111.1	R54 Y55	R54-S58 PolarHBondContact O-N 3.28Å; R54-S58 PolarHBondContact O-OG 3.26Å; Y55-S58 WeakPolarHBondContact CA-OG 3.45Å; Y55-S58 PolarHBondContact O-N 3.46Å; Y55-S58 PolarHBondContact O-OG 3.45Å
59	T	96.5	Very high	97.2	Very high	142 Å²	142	106 Å²	106	87%	0.871	49%	0.487	S	S	*	.			trans	-119.9	23.9	173.2	62.9	0	0	0	0	110.8
60	E	96.3	Very high	97.2	Very high	101 Å²	101	109.3 Å²	109.3	47%	0.472	49%	0.493	S	S	.	.			trans	-74.8	138.7	178.7	65.7	-176.5	170.8	0	0	110.6	R54 L62	R54-E60 IonicContact NH2-OE1 3.58Å; E60-L62 HydrophobicContact CG-CD2 4.18Å; E60-L62 PolarHBondContact O-N 2.92Å
61	L	97	Very high	97.2	Very high	41 Å²	41	107.8 Å²	107.8	22%	0.215	49%	0.493	C	S	.	.			trans	-65	128	171.2	-67.9	174	0	0	0	110.3	Q94 E95 E98	L61-Q94 HydrophobicContact CD1-CB 4.48Å; L61-Q94 HydrophobicContact CD1-CG 4.11Å; L61-Q94 HydrophobicContact CD2-CG 4.26Å; L61-E95 HydrophobicContact CD2-CG 4.3Å; L61-E98 WeakPolarHBondContact CA-OE2 3.28Å; L61-E98 HydrophobicContact CD2-CB 4.44Å; L61-E98 HydrophobicContact CD2-CG 4.34Å
62	L	97.4	Very high	97.1	Very high	94 Å²	94	104.3 Å²	104.3	49%	0.492	48%	0.478	S	S	.	.			trans	-91.7	-27.1	-173.4	-56.7	-178.2	0	0	0	112.4	Y55 E60 E98	Y55-L62 HydrophobicContact CD1-CD2 3.75Å; Y55-L62 HydrophobicContact CE1-CD2 3.9Å; Y55-L62 HydrophobicContact CG-CD2 4.49Å; E60-L62 HydrophobicContact CG-CD2 4.18Å; E60-L62 PolarHBondContact O-N 2.92Å; L62-E98 PolarHBondContact N-OE1 3.29Å; L62-E98 PolarHBondContact N-OE2 3.22Å
63	I	97.3	Very high	97.1	Very high	61 Å²	61	104.7 Å²	104.7	31%	0.313	47%	0.474	S	S	.	.	S	Bend	trans	-80.7	135	176.6	-56.3	177.3	0	0	0	109	R65 F68 Q94 E98 L101	I63-R65 PolarHBondContact O-N 3.4Å; I63-F68 HydrophobicContact CG2-CB 3.96Å; I63-F68 HydrophobicContact CG2-CD2 4.2Å; I63-F68 HydrophobicContact CG2-CG 4.48Å; I63-Q94 PolarHBondContact O-NE2 3.23Å; I63-E98 VanDerWaalsContact CB-OE1 3.29Å; I63-E98 WeakPolarHBondContact CB-OE1 3.39Å; I63-E98 HydrophobicContact CD1-CG 3.76Å; I63-E98 HydrophobicContact CG1-CG 3.94Å; I63-E98 PolarHBondContact N-OE1 3.24Å; I63-L101 HydrophobicContact CD1-CD1 4.36Å
64	R	97.5	Very high	97	Very high	204 Å²	204	103 Å²	103	77%	0.77	47%	0.473	S	S	*	.			trans	-65.2	128.3	177.3	-65.4	-176.9	-178.1	-169.6	1.1	110.2	L66 P67 F68	R64-L66 PolarHBondContact O-N 2.96Å; R64-P67 HydrophobicContact CB-CG 3.97Å; R64-P67 WeakPolarHBondContact O-CD 3.41Å; R64-F68 PolarHBondContact O-N 3.37Å
65	R	94.1	Very high	96.9	Very high	169 Å²	169	100.1 Å²	100.1	64%	0.638	47%	0.468	S	S	*	.	H	α-helix	trans	-53.3	-47.4	-176.5	-66.9	-176.6	176.7	178.3	-1.5	114.3	I63 F68 Q69	I63-R65 PolarHBondContact O-N 3.4Å; R65-F68 PolarHBondContact O-N 3.04Å; R65-Q69 WeakPolarHBondContact O-CB 3.48Å; R65-Q69 PolarHBondContact O-N 3.46Å
66	L	96.3	Very high	96.9	Very high	97 Å²	97	96.1 Å²	96.1	51%	0.508	46%	0.455	S	S	.	.	H	α-helix	trans	-67.5	-49.1	-175.1	176.2	65.6	0	0	0	113.3	R64 F68 Q69 R70	R64-L66 PolarHBondContact O-N 2.96Å; L66-F68 VanDerWaalsContact C-N 3.34Å; L66-F68 PolarHBondContact O-N 3.45Å; L66-Q69 PolarHBondContact O-N 3.38Å; L66-R70 WeakPolarHBondContact O-CG 3.4Å; L66-R70 PolarHBondContact O-N 3.36Å
67	P	97.8	Very high	96.8	Very high	73 Å²	73	94 Å²	94	47%	0.474	44%	0.444	S	S	.	.	H	α-helix	trans	-56.6	-43.6	171.3	-28.9	35.8	0	0	0	113.6	R64 Q69 R70 L71	R64-P67 HydrophobicContact CB-CG 3.97Å; R64-P67 WeakPolarHBondContact O-CD 3.41Å; P67-Q69 PolarHBondContact O-N 3.16Å; P67-R70 PolarHBondContact O-N 3.37Å; P67-L71 PolarHBondContact O-N 3.01Å; P67-L71 VanDerWaalsContact O-N 3.08Å
68	F	98	Very high	96.7	Very high	15 Å²	15	91.7 Å²	91.7	7%	0.066	44%	0.441	C	S	.	.	H	α-helix	trans	-60.9	-45.9	177.9	-175.2	-96.1	0	0	0	111.7	I63 R64 R65 L66 R70 L71 V72 V90 L93 Q94 T97	I63-F68 HydrophobicContact CG2-CB 3.96Å; I63-F68 HydrophobicContact CG2-CD2 4.2Å; I63-F68 HydrophobicContact CG2-CG 4.48Å; R64-F68 PolarHBondContact O-N 3.37Å; R65-F68 PolarHBondContact O-N 3.04Å; L66-F68 VanDerWaalsContact C-N 3.34Å; L66-F68 PolarHBondContact O-N 3.45Å; F68-R70 VanDerWaalsContact C-N 3.3Å; F68-R70 PolarHBondContact O-N 3.08Å; F68-L71 PolarHBondContact O-N 3.21Å; F68-V72 HydrophobicContact CD1-CG2 3.95Å; F68-V72 HydrophobicContact CE1-CG2 3.5Å; F68-V72 HydrophobicContact CZ-CG2 3.82Å; F68-V72 WeakPolarHBondContact O-CG2 3.22Å; F68-V72 PolarHBondContact O-N 3.03Å; F68-V90 HydrophobicContact CD1-CG1 4.21Å; F68-V90 HydrophobicContact CE1-CG1 4.43Å; F68-L93 HydrophobicContact CE1-CB 4.06Å; F68-L93 HydrophobicContact CZ-CB 4.16Å; F68-Q94 HydrophobicContact CD1-CB 3.73Å; F68-Q94 HydrophobicContact CD1-CG 3.92Å; F68-Q94 HydrophobicContact CD2-CG 4.37Å; F68-Q94 VanDerWaalsContact CE1-CA 3.42Å; F68-Q94 HydrophobicContact CE1-CB 3.47Å; F68-Q94 VanDerWaalsContact CE1-CB 3.47Å; F68-Q94 HydrophobicContact CE1-CG 4.03Å; F68-Q94 HydrophobicContact CE2-CG 4.46Å; F68-Q94 HydrophobicContact CG-CB 4.41Å; F68-Q94 HydrophobicContact CG-CG 4.11Å; F68-Q94 VanDerWaalsContact CZ-CA 3.42Å; F68-Q94 HydrophobicContact CZ-CB 3.95Å; F68-Q94 HydrophobicContact CZ-CG 4.32Å; F68-T97 HydrophobicContact CE2-CG2 4.11Å
69	Q	96.6	Very high	96.7	Very high	53 Å²	53	98 Å²	98	25%	0.248	46%	0.464	C	S	.	.	H	α-helix	trans	-59.9	-38.9	176.2	179.4	-177.9	-30	0	0	112.7	R65 L66 P67 R73 V90	R65-Q69 WeakPolarHBondContact O-CB 3.48Å; R65-Q69 PolarHBondContact O-N 3.46Å; L66-Q69 PolarHBondContact O-N 3.38Å; P67-Q69 PolarHBondContact O-N 3.16Å; Q69-R73 WeakPolarHBondContact O-CG 3.5Å; Q69-R73 PolarHBondContact O-N 3.48Å; Q69-R73 VanDerWaalsContact O-N 3.13Å; Q69-V90 HydrophobicContact CB-CG1 4.08Å; Q69-V90 HydrophobicContact CG-CG1 4.3Å
70	R	97.2	Very high	96.6	Very high	168 Å²	168	97.7 Å²	97.7	63%	0.634	45%	0.45	S	S	*	.	H	α-helix	trans	-63.6	-46.4	176.8	-72.2	176.7	-176.6	-174.8	-1.1	110.9	L66 P67 F68 V72 R73 E74	L66-R70 WeakPolarHBondContact O-CG 3.4Å; L66-R70 PolarHBondContact O-N 3.36Å; P67-R70 PolarHBondContact O-N 3.37Å; F68-R70 VanDerWaalsContact C-N 3.3Å; F68-R70 PolarHBondContact O-N 3.08Å; R70-V72 PolarHBondContact O-N 3.46Å; R70-R73 PolarHBondContact O-N 2.91Å; R70-E74 WeakPolarHBondContact O-CB 3.47Å; R70-E74 PolarHBondContact O-N 3.19Å
71	L	97.6	Very high	96.5	Very high	84 Å²	84	95.5 Å²	95.5	44%	0.44	45%	0.449	S	S	.	.	H	α-helix	trans	-60.4	-44.6	176.8	179.3	63.9	0	0	0	112.1	P67 F68 R73 E74 I75	P67-L71 PolarHBondContact O-N 3.01Å; P67-L71 VanDerWaalsContact O-N 3.08Å; F68-L71 PolarHBondContact O-N 3.21Å; L71-R73 VanDerWaalsContact C-N 3.28Å; L71-R73 PolarHBondContact O-N 3.48Å; L71-E74 PolarHBondContact O-N 3.03Å; L71-I75 HydrophobicContact CD1-CD1 3.93Å; L71-I75 HydrophobicContact CD1-CG1 4.24Å; L71-I75 HydrophobicContact CG-CD1 3.96Å; L71-I75 WeakPolarHBondContact O-CG1 3.33Å; L71-I75 PolarHBondContact O-N 2.67Å
72	V	97.1	Very high	96.2	Very high	19 Å²	19	100.6 Å²	100.6	12%	0.115	48%	0.477	C	S	.	.	H	α-helix	trans	-59	-41.9	177	169	0	0	0	0	111.2	F68 R70 A76 F85 L93	F68-V72 HydrophobicContact CD1-CG2 3.95Å; F68-V72 HydrophobicContact CE1-CG2 3.5Å; F68-V72 HydrophobicContact CZ-CG2 3.82Å; F68-V72 WeakPolarHBondContact O-CG2 3.22Å; F68-V72 PolarHBondContact O-N 3.03Å; R70-V72 PolarHBondContact O-N 3.46Å; V72-A76 WeakPolarHBondContact O-CB 3.49Å; V72-A76 PolarHBondContact O-N 3.35Å; V72-F85 HydrophobicContact CG1-CD1 4.36Å; V72-F85 HydrophobicContact CG1-CE1 3.92Å; V72-F85 HydrophobicContact CG1-CZ 4.17Å; V72-L93 HydrophobicContact CG1-CD1 3.63Å; V72-L93 HydrophobicContact CG2-CD1 4.24Å
73	R	96	Very high	96.1	Very high	94 Å²	94	99.4 Å²	99.4	36%	0.355	47%	0.47	S	S	.	.	H	α-helix	trans	-71.8	-37.6	179.3	-71.7	176.6	-179.2	-81.2	2	112.7	Q69 R70 L71 A76 Q77 F85	Q69-R73 WeakPolarHBondContact O-CG 3.5Å; Q69-R73 PolarHBondContact O-N 3.48Å; Q69-R73 VanDerWaalsContact O-N 3.13Å; R70-R73 PolarHBondContact O-N 2.91Å; L71-R73 VanDerWaalsContact C-N 3.28Å; L71-R73 PolarHBondContact O-N 3.48Å; R73-A76 PolarHBondContact O-N 3.3Å; R73-Q77 WeakPolarHBondContact O-CB 3.43Å; R73-Q77 PolarHBondContact O-N 3.5Å; R73-F85 HydrophobicContact CG-CD2 4.26Å; R73-F85 HydrophobicContact CG-CE2 4.36Å
74	E	96.3	Very high	96	Very high	131 Å²	131	108 Å²	108	61%	0.612	50%	0.499	S	S	*	.	H	α-helix	trans	-58.5	-54.3	174	-177.4	-177.2	158.6	0	0	110.5	R70 L71 A76 Q77	R70-E74 WeakPolarHBondContact O-CB 3.47Å; R70-E74 PolarHBondContact O-N 3.19Å; L71-E74 PolarHBondContact O-N 3.03Å; E74-A76 VanDerWaalsContact C-N 3.33Å; E74-A76 PolarHBondContact O-N 2.94Å; E74-Q77 WeakPolarHBondContact O-CB 3.28Å; E74-Q77 PolarHBondContact O-N 3.41Å
75	I	96.9	Very high	95.9	Very high	86 Å²	86	100.9 Å²	100.9	44%	0.441	47%	0.474	S	S	.	.	H	α-helix	trans	-61.4	-41.9	178.6	-65.1	169.4	0	0	0	111.2	L71 Q77 D78 F79	L71-I75 HydrophobicContact CD1-CD1 3.93Å; L71-I75 HydrophobicContact CD1-CG1 4.24Å; L71-I75 HydrophobicContact CG-CD1 3.96Å; L71-I75 WeakPolarHBondContact O-CG1 3.33Å; L71-I75 PolarHBondContact O-N 2.67Å; I75-Q77 VanDerWaalsContact C-N 3.28Å; I75-Q77 PolarHBondContact O-N 2.94Å; I75-D78 PolarHBondContact O-N 3.31Å; I75-F79 HydrophobicContact CG2-CE2 3.91Å; I75-F79 WeakPolarHBondContact O-CD2 3.48Å; I75-F79 WeakPolarHBondContact O-CE2 3.17Å
76	A	96.7	Very high	96	Very high	12 Å²	12	99.9 Å²	99.9	10%	0.099	48%	0.476	C	S	.	.	H	α-helix	trans	-65.7	-31.2	-179	0	0	0	0	0	113.4	V72 R73 E74 D78 F79 K80 L83 F85	V72-A76 WeakPolarHBondContact O-CB 3.49Å; V72-A76 PolarHBondContact O-N 3.35Å; R73-A76 PolarHBondContact O-N 3.3Å; E74-A76 VanDerWaalsContact C-N 3.33Å; E74-A76 PolarHBondContact O-N 2.94Å; A76-D78 PolarHBondContact O-N 2.88Å; A76-F79 PolarHBondContact O-N 3.37Å; A76-F79 VanDerWaalsContact O-N 3.16Å; A76-K80 PolarHBondContact O-N 2.93Å; A76-K80 VanDerWaalsContact O-N 3.08Å; A76-L83 HydrophobicContact CB-CD1 4.07Å; A76-F85 HydrophobicContact CB-CE2 3.82Å; A76-F85 HydrophobicContact CB-CZ 3.47Å; A76-F85 VanDerWaalsContact CB-CZ 3.47Å
77	Q	95.8	Very high	95.9	Very high	104 Å²	104	101.3 Å²	101.3	49%	0.486	48%	0.482	S	S	.	.	H	α-helix	trans	-62.6	-32.2	178.9	-171.5	69	19.7	0	0	111.8	R73 E74 I75 F79	R73-Q77 WeakPolarHBondContact O-CB 3.43Å; R73-Q77 PolarHBondContact O-N 3.5Å; E74-Q77 WeakPolarHBondContact O-CB 3.28Å; E74-Q77 PolarHBondContact O-N 3.41Å; I75-Q77 VanDerWaalsContact C-N 3.28Å; I75-Q77 PolarHBondContact O-N 2.94Å; Q77-F79 PolarHBondContact O-N 3.26Å
78	D	96.2	Very high	95.9	Very high	136 Å²	136	101.3 Å²	101.3	73%	0.727	48%	0.484	S	S	*	.	H	α-helix	trans	-66.7	-24.7	177.6	-65.3	-22.3	0	0	0	112.8	I75 A76	I75-D78 PolarHBondContact O-N 3.31Å; A76-D78 PolarHBondContact O-N 2.88Å
79	F	95.8	Very high	95.8	Very high	174 Å²	174	102.2 Å²	102.2	76%	0.763	49%	0.494	S	S	*	.	H	α-helix	trans	-94.7	-40.8	179.3	-63.1	-83.2	0	0	0	112.7	I75 A76 Q77	I75-F79 HydrophobicContact CG2-CE2 3.91Å; I75-F79 WeakPolarHBondContact O-CD2 3.48Å; I75-F79 WeakPolarHBondContact O-CE2 3.17Å; A76-F79 PolarHBondContact O-N 3.37Å; A76-F79 VanDerWaalsContact O-N 3.16Å; Q77-F79 PolarHBondContact O-N 3.26Å
80	K	95.2	Very high	95.8	Very high	136 Å²	136	100.1 Å²	100.1	59%	0.591	48%	0.484	S	S	*	.			trans	-157	123.5	179.6	-178.9	166.7	177.9	174.3	0	111	A76 L83	A76-K80 PolarHBondContact O-N 2.93Å; A76-K80 VanDerWaalsContact O-N 3.08Å; K80-L83 HydrophobicContact CB-CD1 3.96Å; K80-L83 HydrophobicContact CB-CD2 4.38Å; K80-L83 HydrophobicContact CB-CG 4.04Å; K80-L83 HydrophobicContact CD-CD2 3.97Å; K80-L83 HydrophobicContact CD-CG 4.49Å; K80-L83 HydrophobicContact CG-CD2 4.14Å; K80-L83 HydrophobicContact CG-CG 4.12Å; K80-L83 WeakPolarHBondContact O-CG 3.35Å
81	A	92.9	Very high	95.8	Very high	54 Å²	54	94.7 Å²	94.7	45%	0.446	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	152.8	173	0	0	0	0	0	112	L83	A81-L83 VanDerWaalsContact C-N 3.32Å; A81-L83 PolarHBondContact O-N 3.48Å
82	D	91.7	Very high	95.8	Very high	148 Å²	148	93.6 Å²	93.6	79%	0.791	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	27.7	172.2	-56	-44.6	0	0	0	115.9
83	L	94.6	Very high	95.9	Very high	69 Å²	69	96.3 Å²	96.3	36%	0.361	49%	0.485	S	S	.	.			trans	-69	131.4	173.6	-74.2	176.5	0	0	0	112.7	A76 K80 A81 F85	A76-L83 HydrophobicContact CB-CD1 4.07Å; K80-L83 HydrophobicContact CB-CD1 3.96Å; K80-L83 HydrophobicContact CB-CD2 4.38Å; K80-L83 HydrophobicContact CB-CG 4.04Å; K80-L83 HydrophobicContact CD-CD2 3.97Å; K80-L83 HydrophobicContact CD-CG 4.49Å; K80-L83 HydrophobicContact CG-CD2 4.14Å; K80-L83 HydrophobicContact CG-CG 4.12Å; K80-L83 WeakPolarHBondContact O-CG 3.35Å; A81-L83 VanDerWaalsContact C-N 3.32Å; A81-L83 PolarHBondContact O-N 3.48Å; L83-F85 HydrophobicContact CB-CE2 3.98Å
84	R	95.3	Very high	96	Very high	243 Å²	243	92 Å²	92	92%	0.917	47%	0.468	S	S	*	.			trans	-99.8	136.1	169.2	-67.4	-176.6	173.6	-172.6	-1.5	109.9
85	F	95.7	Very high	96	Very high	54 Å²	54	90.7 Å²	90.7	24%	0.237	46%	0.462	C	S	.	.			trans	-111.1	131.9	178.2	-73	-95.2	0	0	0	110.1	V72 R73 A76 L83 V90	V72-F85 HydrophobicContact CG1-CD1 4.36Å; V72-F85 HydrophobicContact CG1-CE1 3.92Å; V72-F85 HydrophobicContact CG1-CZ 4.17Å; R73-F85 HydrophobicContact CG-CD2 4.26Å; R73-F85 HydrophobicContact CG-CE2 4.36Å; A76-F85 HydrophobicContact CB-CE2 3.82Å; A76-F85 HydrophobicContact CB-CZ 3.47Å; A76-F85 VanDerWaalsContact CB-CZ 3.47Å; L83-F85 HydrophobicContact CB-CE2 3.98Å; F85-V90 HydrophobicContact CB-CG2 3.84Å; F85-V90 HydrophobicContact CD1-CG2 4.33Å; F85-V90 HydrophobicContact CG-CG2 4.31Å
86	Q	96.9	Very high	96.1	Very high	147 Å²	147	89.5 Å²	89.5	69%	0.687	47%	0.465	S	S	*	.			trans	-65.5	149.6	162	-67.4	-179.9	-46.9	0	0	109.5	S88 A89 V90	Q86-S88 VanDerWaalsContact C-N 3.28Å; Q86-S88 PolarHBondContact O-N 3.28Å; Q86-A89 HydrophobicContact CB-CB 4.23Å; Q86-A89 WeakPolarHBondContact O-CB 3.47Å; Q86-A89 PolarHBondContact O-N 3.42Å; Q86-V90 PolarHBondContact O-N 3.12Å
87	M	93.9	Very high	96.1	Very high	128 Å²	128	91.3 Å²	91.3	63%	0.631	48%	0.475	S	S	*	.	H	α-helix	trans	-60.6	-40.5	175.9	-175.9	61	70	0	0	111.5	A89 V90 L91	M87-A89 VanDerWaalsContact C-N 3.3Å; M87-A89 PolarHBondContact O-N 3.26Å; M87-V90 PolarHBondContact O-N 3.38Å; M87-L91 HydrophobicContact CG-CD1 4.31Å; M87-L91 WeakPolarHBondContact O-CG 3.42Å; M87-L91 PolarHBondContact O-N 2.96Å
88	S	96.9	Very high	96.2	Very high	73 Å²	73	87.3 Å²	87.3	51%	0.51	46%	0.457	S	S	.	.	H	α-helix	trans	-60.5	-36.3	175.8	49.5	0	0	0	0	112.9	Q86 L91 A92	Q86-S88 VanDerWaalsContact C-N 3.28Å; Q86-S88 PolarHBondContact O-N 3.28Å; S88-L91 PolarHBondContact O-N 2.85Å; S88-A92 WeakPolarHBondContact O-CB 3.34Å; S88-A92 PolarHBondContact O-N 3.43Å
89	A	97.3	Very high	96.3	Very high	34 Å²	34	84 Å²	84	28%	0.281	45%	0.448	S	S	.	.	H	α-helix	trans	-65.3	-43.4	178.2	0	0	0	0	0	111.7	Q86 M87 A92 L93	Q86-A89 HydrophobicContact CB-CB 4.23Å; Q86-A89 WeakPolarHBondContact O-CB 3.47Å; Q86-A89 PolarHBondContact O-N 3.42Å; M87-A89 VanDerWaalsContact C-N 3.3Å; M87-A89 PolarHBondContact O-N 3.26Å; A89-A92 PolarHBondContact O-N 2.89Å; A89-L93 WeakPolarHBondContact O-CG 3.31Å; A89-L93 PolarHBondContact O-N 3.36Å
90	V	96.5	Very high	96.4	Very high	8 Å²	8	80.3 Å²	80.3	5%	0.048	43%	0.43	C	S	.	.	H	α-helix	trans	-65.9	-40	176.5	-176.7	0	0	0	0	111	F68 Q69 F85 Q86 M87 L93 Q94	F68-V90 HydrophobicContact CD1-CG1 4.21Å; F68-V90 HydrophobicContact CE1-CG1 4.43Å; Q69-V90 HydrophobicContact CB-CG1 4.08Å; Q69-V90 HydrophobicContact CG-CG1 4.3Å; F85-V90 HydrophobicContact CB-CG2 3.84Å; F85-V90 HydrophobicContact CD1-CG2 4.33Å; F85-V90 HydrophobicContact CG-CG2 4.31Å; Q86-V90 PolarHBondContact O-N 3.12Å; M87-V90 PolarHBondContact O-N 3.38Å; V90-L93 PolarHBondContact O-N 3.28Å; V90-Q94 PolarHBondContact O-N 2.78Å
91	L	96.9	Very high	96.5	Very high	54 Å²	54	76.7 Å²	76.7	28%	0.283	42%	0.417	S	S	.	.	H	α-helix	trans	-63.7	-44.2	175.6	-70.5	173.3	0	0	0	111.9	M87 S88 L93 Q94 E95	M87-L91 HydrophobicContact CG-CD1 4.31Å; M87-L91 WeakPolarHBondContact O-CG 3.42Å; M87-L91 PolarHBondContact O-N 2.96Å; S88-L91 PolarHBondContact O-N 2.85Å; L91-L93 VanDerWaalsContact C-N 3.33Å; L91-L93 PolarHBondContact O-N 2.91Å; L91-Q94 WeakPolarHBondContact O-CB 3.36Å; L91-Q94 PolarHBondContact O-N 3.29Å; L91-E95 WeakPolarHBondContact O-CG 3.29Å; L91-E95 PolarHBondContact O-N 3.13Å
92	A	97.8	Very high	96.7	Very high	62 Å²	62	77.7 Å²	77.7	51%	0.512	42%	0.417	S	S	.	.	H	α-helix	trans	-61	-41.8	177.4	0	0	0	0	0	112	S88 A89 Q94 A96	S88-A92 WeakPolarHBondContact O-CB 3.34Å; S88-A92 PolarHBondContact O-N 3.43Å; A89-A92 PolarHBondContact O-N 2.89Å; A92-Q94 VanDerWaalsContact C-N 3.29Å; A92-Q94 PolarHBondContact O-N 3.35Å; A92-A96 WeakPolarHBondContact O-CB 3.27Å; A92-A96 PolarHBondContact O-N 2.99Å
93	L	97.8	Very high	97	Very high	76 Å²	76	71.4 Å²	71.4	40%	0.398	39%	0.387	S	S	.	.	H	α-helix	trans	-61.7	-38.8	172.8	-71.4	170.7	0	0	0	111.8	F68 V72 A89 V90 L91 T97	F68-L93 HydrophobicContact CE1-CB 4.06Å; F68-L93 HydrophobicContact CZ-CB 4.16Å; V72-L93 HydrophobicContact CG1-CD1 3.63Å; V72-L93 HydrophobicContact CG2-CD1 4.24Å; A89-L93 WeakPolarHBondContact O-CG 3.31Å; A89-L93 PolarHBondContact O-N 3.36Å; V90-L93 PolarHBondContact O-N 3.28Å; L91-L93 VanDerWaalsContact C-N 3.33Å; L91-L93 PolarHBondContact O-N 2.91Å; L93-T97 VanDerWaalsContact O-CB 3.28Å; L93-T97 WeakPolarHBondContact O-CB 3.43Å; L93-T97 PolarHBondContact O-N 2.99Å; L93-T97 PolarHBondContact O-OG1 2.92Å
94	Q	97.9	Very high	97.1	Very high	2 Å²	2	68.8 Å²	68.8	1%	0.009	37%	0.374	C	S	.	.	H	α-helix	trans	-67.8	-49.8	-179.6	-167.9	174.2	-17.6	0	0	111.5	L61 I63 F68 V90 L91 A92 A96 T97 E98	L61-Q94 HydrophobicContact CD1-CB 4.48Å; L61-Q94 HydrophobicContact CD1-CG 4.11Å; L61-Q94 HydrophobicContact CD2-CG 4.26Å; I63-Q94 PolarHBondContact O-NE2 3.23Å; F68-Q94 HydrophobicContact CD1-CB 3.73Å; F68-Q94 HydrophobicContact CD1-CG 3.92Å; F68-Q94 HydrophobicContact CD2-CG 4.37Å; F68-Q94 VanDerWaalsContact CE1-CA 3.42Å; F68-Q94 HydrophobicContact CE1-CB 3.47Å; F68-Q94 VanDerWaalsContact CE1-CB 3.47Å; F68-Q94 HydrophobicContact CE1-CG 4.03Å; F68-Q94 HydrophobicContact CE2-CG 4.46Å; F68-Q94 HydrophobicContact CG-CB 4.41Å; F68-Q94 HydrophobicContact CG-CG 4.11Å; F68-Q94 VanDerWaalsContact CZ-CA 3.42Å; F68-Q94 HydrophobicContact CZ-CB 3.95Å; F68-Q94 HydrophobicContact CZ-CG 4.32Å; V90-Q94 PolarHBondContact O-N 2.78Å; L91-Q94 WeakPolarHBondContact O-CB 3.36Å; L91-Q94 PolarHBondContact O-N 3.29Å; A92-Q94 VanDerWaalsContact C-N 3.29Å; A92-Q94 PolarHBondContact O-N 3.35Å; Q94-A96 VanDerWaalsContact C-N 3.34Å; Q94-A96 PolarHBondContact O-N 3.12Å; Q94-T97 PolarHBondContact O-N 3.29Å; Q94-E98 HydrophobicContact CG-CG 4.47Å; Q94-E98 PolarHBondContact NE2-OE1 2.95Å; Q94-E98 WeakPolarHBondContact O-CG 3.48Å; Q94-E98 PolarHBondContact O-N 2.89Å
95	E	97.7	Very high	97.2	Very high	104 Å²	104	62 Å²	62	49%	0.486	35%	0.351	S	S	.	.	H	α-helix	trans	-55.5	-49	176.4	-69.1	-72.7	171	0	0	111	L61 L91 T97 E98 A99	L61-E95 HydrophobicContact CD2-CG 4.3Å; L91-E95 WeakPolarHBondContact O-CG 3.29Å; L91-E95 PolarHBondContact O-N 3.13Å; E95-T97 PolarHBondContact O-N 3.21Å; E95-E98 PolarHBondContact O-N 3.36Å; E95-A99 VanDerWaalsContact O-CB 3.3Å; E95-A99 WeakPolarHBondContact O-CB 3.36Å; E95-A99 PolarHBondContact O-N 3.45Å
96	A	98	Very high	97.3	Very high	61 Å²	61	64.9 Å²	64.9	50%	0.504	37%	0.365	S	S	.	.	H	α-helix	trans	-63.5	-42.2	179.2	0	0	0	0	0	112.5	A92 Q94 Y100	A92-A96 WeakPolarHBondContact O-CB 3.27Å; A92-A96 PolarHBondContact O-N 2.99Å; Q94-A96 VanDerWaalsContact C-N 3.34Å; Q94-A96 PolarHBondContact O-N 3.12Å; A96-Y100 VanDerWaalsContact O-CB 3.32Å; A96-Y100 WeakPolarHBondContact O-CB 3.49Å; A96-Y100 PolarHBondContact O-N 2.89Å
97	T	98	Very high	97.4	Very high	50 Å²	50	60.4 Å²	60.4	31%	0.307	35%	0.346	S	S	.	.	H	α-helix	trans	-65.6	-46.2	179.7	-58.2	0	0	0	0	111.4	F68 L93 Q94 E95 Y100 L101	F68-T97 HydrophobicContact CE2-CG2 4.11Å; L93-T97 VanDerWaalsContact O-CB 3.28Å; L93-T97 WeakPolarHBondContact O-CB 3.43Å; L93-T97 PolarHBondContact O-N 2.99Å; L93-T97 PolarHBondContact O-OG1 2.92Å; Q94-T97 PolarHBondContact O-N 3.29Å; E95-T97 PolarHBondContact O-N 3.21Å; T97-Y100 PolarHBondContact O-N 3.42Å; T97-L101 HydrophobicContact CG2-CD1 4.08Å; T97-L101 HydrophobicContact CG2-CG 4.43Å; T97-L101 WeakPolarHBondContact O-CG 3.29Å; T97-L101 PolarHBondContact O-N 2.91Å
98	E	98.1	Very high	97.6	Very high	21 Å²	21	54.3 Å²	54.3	10%	0.098	32%	0.316	C	S	.	.	H	α-helix	trans	-66.3	-42.3	179.8	-69.6	-165.7	-150.7	0	0	111.5	L61 L62 I63 Q94 E95 Y100 L101 V102	L61-E98 WeakPolarHBondContact CA-OE2 3.28Å; L61-E98 HydrophobicContact CD2-CB 4.44Å; L61-E98 HydrophobicContact CD2-CG 4.34Å; L62-E98 PolarHBondContact N-OE1 3.29Å; L62-E98 PolarHBondContact N-OE2 3.22Å; I63-E98 VanDerWaalsContact CB-OE1 3.29Å; I63-E98 WeakPolarHBondContact CB-OE1 3.39Å; I63-E98 HydrophobicContact CD1-CG 3.76Å; I63-E98 HydrophobicContact CG1-CG 3.94Å; I63-E98 PolarHBondContact N-OE1 3.24Å; Q94-E98 HydrophobicContact CG-CG 4.47Å; Q94-E98 PolarHBondContact NE2-OE1 2.95Å; Q94-E98 WeakPolarHBondContact O-CG 3.48Å; Q94-E98 PolarHBondContact O-N 2.89Å; E95-E98 PolarHBondContact O-N 3.36Å; E98-Y100 VanDerWaalsContact C-N 3.34Å; E98-Y100 PolarHBondContact O-N 3.48Å; E98-L101 PolarHBondContact O-N 3.22Å; E98-V102 WeakPolarHBondContact O-CB 3.44Å; E98-V102 VanDerWaalsContact O-CG2 3.27Å; E98-V102 WeakPolarHBondContact O-CG2 3.4Å; E98-V102 PolarHBondContact O-N 2.96Å
99	A	97.7	Very high	97.7	Very high	66 Å²	66	54.2 Å²	54.2	55%	0.545	31%	0.309	S	S	.	.	H	α-helix	trans	-58.8	-44.9	174.3	0	0	0	0	0	112	E95 V102 G103	E95-A99 VanDerWaalsContact O-CB 3.3Å; E95-A99 WeakPolarHBondContact O-CB 3.36Å; E95-A99 PolarHBondContact O-N 3.45Å; A99-V102 PolarHBondContact O-N 2.87Å; A99-G103 PolarHBondContact O-N 3.45Å
100	Y	97.3	Very high	97.7	Very high	96 Å²	96	57.8 Å²	57.8	38%	0.376	32%	0.323	S	S	.	.	H	α-helix	trans	-61.2	-46.8	176.5	170.9	-96.2	0	0	0	112.3	A96 T97 E98 G103 L104 E134	A96-Y100 VanDerWaalsContact O-CB 3.32Å; A96-Y100 WeakPolarHBondContact O-CB 3.49Å; A96-Y100 PolarHBondContact O-N 2.89Å; T97-Y100 PolarHBondContact O-N 3.42Å; E98-Y100 VanDerWaalsContact C-N 3.34Å; E98-Y100 PolarHBondContact O-N 3.48Å; Y100-G103 PolarHBondContact O-N 3.17Å; Y100-L104 HydrophobicContact CE1-CD2 4.25Å; Y100-L104 WeakPolarHBondContact O-CB 3.07Å; Y100-L104 PolarHBondContact O-N 2.77Å; Y100-E134 VanDerWaalsContact CE2-OE1 3.29Å; Y100-E134 WeakPolarHBondContact CE2-OE1 3.21Å; Y100-E134 VanDerWaalsContact OH-CD 3.23Å; Y100-E134 PolarHBondContact OH-OE1 3.26Å; Y100-E134 PolarHBondContact OH-OE2 2.97Å
101	L	97.6	Very high	97.8	Very high	61 Å²	61	58.1 Å²	58.1	32%	0.319	33%	0.326	S	S	.	.	H	α-helix	trans	-65.1	-41.6	179.7	-71.6	176.3	0	0	0	111.8	I63 T97 E98 L104 F105	I63-L101 HydrophobicContact CD1-CD1 4.36Å; T97-L101 HydrophobicContact CG2-CD1 4.08Å; T97-L101 HydrophobicContact CG2-CG 4.43Å; T97-L101 WeakPolarHBondContact O-CG 3.29Å; T97-L101 PolarHBondContact O-N 2.91Å; E98-L101 PolarHBondContact O-N 3.22Å; L101-L104 PolarHBondContact O-N 2.74Å; L101-F105 HydrophobicContact CB-CE2 4.49Å; L101-F105 WeakPolarHBondContact O-CD2 3.43Å; L101-F105 PolarHBondContact O-N 3.27Å
102	V	97.7	Very high	97.8	Very high	74 Å²	74	55.6 Å²	55.6	45%	0.448	31%	0.313	S	S	.	.	H	α-helix	trans	-59.1	-50.7	175.4	170.5	0	0	0	0	110.2	E98 A99 L104 F105 E106	E98-V102 WeakPolarHBondContact O-CB 3.44Å; E98-V102 VanDerWaalsContact O-CG2 3.27Å; E98-V102 WeakPolarHBondContact O-CG2 3.4Å; E98-V102 PolarHBondContact O-N 2.96Å; A99-V102 PolarHBondContact O-N 2.87Å; V102-L104 VanDerWaalsContact C-N 3.31Å; V102-L104 PolarHBondContact O-N 3.5Å; V102-F105 PolarHBondContact O-N 3.45Å; V102-F105 VanDerWaalsContact O-N 3.12Å; V102-E106 WeakPolarHBondContact O-CG 3.48Å; V102-E106 PolarHBondContact O-N 3.26Å
103	G	97.1	Very high	97.8	Very high	17 Å²	17	57.1 Å²	57.1	18%	0.175	31%	0.311	C	S	.	.	H	α-helix	trans	-60.1	-40.5	176.9	0	0	0	0	0	112.5	A99 Y100 F105 E106 D107 R132	A99-G103 PolarHBondContact O-N 3.45Å; Y100-G103 PolarHBondContact O-N 3.17Å; G103-F105 VanDerWaalsContact C-N 3.32Å; G103-F105 PolarHBondContact O-N 2.94Å; G103-E106 WeakPolarHBondContact O-CB 3.3Å; G103-E106 PolarHBondContact O-N 3.39Å; G103-D107 PolarHBondContact O-N 2.96Å; G103-R132 PolarHBondContact O-NH2 3.17Å
104	L	97.3	Very high	97.8	Very high	14 Å²	14	61.2 Å²	61.2	7%	0.073	33%	0.328	C	S	.	.	H	α-helix	trans	-63.3	-38.5	176.3	179.8	61	0	0	0	111.8	Y100 L101 V102 D107 T108 I125 A128 R129	Y100-L104 HydrophobicContact CE1-CD2 4.25Å; Y100-L104 WeakPolarHBondContact O-CB 3.07Å; Y100-L104 PolarHBondContact O-N 2.77Å; L101-L104 PolarHBondContact O-N 2.74Å; V102-L104 VanDerWaalsContact C-N 3.31Å; V102-L104 PolarHBondContact O-N 3.5Å; L104-D107 PolarHBondContact O-N 3.33Å; L104-T108 VanDerWaalsContact O-CB 3.28Å; L104-T108 WeakPolarHBondContact O-CB 3.37Å; L104-T108 PolarHBondContact O-N 3.34Å; L104-T108 PolarHBondContact O-OG1 3.44Å; L104-I125 HydrophobicContact CD1-CG2 4.49Å; L104-I125 HydrophobicContact CD2-CG2 4.14Å; L104-I125 HydrophobicContact CG-CG2 4.49Å; L104-A128 HydrophobicContact CD1-CB 4.12Å; L104-R129 HydrophobicContact CD1-CG 3.7Å; L104-R129 HydrophobicContact CD2-CG 4.41Å
105	F	98.1	Very high	97.8	Very high	100 Å²	100	63.4 Å²	63.4	44%	0.439	35%	0.346	S	S	.	.	H	α-helix	trans	-69.3	-32	176	-79.5	-58.4	0	0	0	113	L101 V102 G103 T108 N109 I120	L101-F105 HydrophobicContact CB-CE2 4.49Å; L101-F105 WeakPolarHBondContact O-CD2 3.43Å; L101-F105 PolarHBondContact O-N 3.27Å; V102-F105 PolarHBondContact O-N 3.45Å; V102-F105 VanDerWaalsContact O-N 3.12Å; G103-F105 VanDerWaalsContact C-N 3.32Å; G103-F105 PolarHBondContact O-N 2.94Å; F105-T108 PolarHBondContact O-N 3Å; F105-N109 VanDerWaalsContact O-CB 3.25Å; F105-N109 WeakPolarHBondContact O-CB 3.49Å; F105-N109 PolarHBondContact O-N 3.32Å; F105-I120 HydrophobicContact CD1-CD1 3.8Å; F105-I120 HydrophobicContact CE1-CD1 3.85Å
106	E	97.8	Very high	97.9	Very high	115 Å²	115	69.9 Å²	69.9	54%	0.537	37%	0.367	S	S	.	.	H	α-helix	trans	-60.9	-50.5	172.2	-70.4	176.3	176.7	0	0	110.9	V102 G103 T108 N109 L110	V102-E106 WeakPolarHBondContact O-CG 3.48Å; V102-E106 PolarHBondContact O-N 3.26Å; G103-E106 WeakPolarHBondContact O-CB 3.3Å; G103-E106 PolarHBondContact O-N 3.39Å; E106-T108 PolarHBondContact O-N 3.01Å; E106-N109 WeakPolarHBondContact O-CB 3.25Å; E106-N109 PolarHBondContact O-N 3.16Å; E106-L110 WeakPolarHBondContact O-CG 3.36Å; E106-L110 PolarHBondContact O-N 2.91Å
107	D	97.9	Very high	97.9	Very high	53 Å²	53	69.3 Å²	69.3	28%	0.283	35%	0.351	S	S	.	.	H	α-helix	trans	-64.7	-40	177.3	-70.4	-13.8	0	0	0	112.3	G103 L104 N109 L110 C111 A128 R132	G103-D107 PolarHBondContact O-N 2.96Å; L104-D107 PolarHBondContact O-N 3.33Å; D107-N109 VanDerWaalsContact C-N 3.28Å; D107-N109 PolarHBondContact O-N 3.05Å; D107-L110 WeakPolarHBondContact O-CB 3.32Å; D107-L110 PolarHBondContact O-N 2.88Å; D107-C111 PolarHBondContact O-N 3.3Å; D107-C111 PolarHBondContact O-SG 2.9Å; D107-A128 HydrophobicContact CB-CB 3.84Å; D107-R132 IonicContact OD2-CZ 3.98Å; D107-R132 IonicContact OD2-NE 3.28Å; D107-R132 PolarHBondContact OD2-NE 2.69Å; D107-R132 IonicContact OD2-NH2 3.26Å; D107-R132 PolarHBondContact OD2-NH2 3.47Å
108	T	98.3	Very high	97.8	Very high	0 Å²	0	73.3 Å²	73.3	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-60.4	-41	175.2	-60.9	0	0	0	0	110.8	L104 F105 E106 C111 A112 I120 D124 I125	L104-T108 VanDerWaalsContact O-CB 3.28Å; L104-T108 WeakPolarHBondContact O-CB 3.37Å; L104-T108 PolarHBondContact O-N 3.34Å; L104-T108 PolarHBondContact O-OG1 3.44Å; F105-T108 PolarHBondContact O-N 3Å; E106-T108 PolarHBondContact O-N 3.01Å; T108-C111 WeakPolarHBondContact O-CB 3.49Å; T108-C111 PolarHBondContact O-N 3.31Å; T108-A112 PolarHBondContact O-N 3.43Å; T108-I120 HydrophobicContact CG2-CB 3.87Å; T108-I120 HydrophobicContact CG2-CG2 3.87Å; T108-D124 HydrophobicContact CG2-CB 3.62Å; T108-I125 HydrophobicContact CG2-CG1 3.54Å
109	N	98.1	Very high	97.8	Very high	70 Å²	70	76.7 Å²	76.7	37%	0.374	40%	0.397	S	S	.	.	H	α-helix	trans	-65.8	-40.9	177	-175.4	51.7	0	0	0	111.4	F105 E106 D107 C111 A112 I113 I120	F105-N109 VanDerWaalsContact O-CB 3.25Å; F105-N109 WeakPolarHBondContact O-CB 3.49Å; F105-N109 PolarHBondContact O-N 3.32Å; E106-N109 WeakPolarHBondContact O-CB 3.25Å; E106-N109 PolarHBondContact O-N 3.16Å; D107-N109 VanDerWaalsContact C-N 3.28Å; D107-N109 PolarHBondContact O-N 3.05Å; N109-C111 VanDerWaalsContact C-N 3.33Å; N109-C111 PolarHBondContact O-N 3.48Å; N109-A112 PolarHBondContact O-N 2.93Å; N109-I113 VanDerWaalsContact O-CG1 3.3Å; N109-I113 WeakPolarHBondContact O-CG1 3.29Å; N109-I113 PolarHBondContact O-N 3.36Å; N109-I120 HydrophobicContact CB-CG2 4.47Å
110	L	98	Very high	97.8	Very high	109 Å²	109	76.8 Å²	76.8	57%	0.571	39%	0.388	S	S	*	.	H	α-helix	trans	-60.3	-41.7	172.8	-65.3	177.3	0	0	0	111.8	E106 D107 A112 I113 H114	E106-L110 WeakPolarHBondContact O-CG 3.36Å; E106-L110 PolarHBondContact O-N 2.91Å; D107-L110 WeakPolarHBondContact O-CB 3.32Å; D107-L110 PolarHBondContact O-N 2.88Å; L110-A112 PolarHBondContact O-N 3.4Å; L110-I113 PolarHBondContact O-N 3.43Å; L110-H114 WeakPolarHBondContact O-CB 3.49Å; L110-H114 PolarHBondContact O-N 2.72Å
111	C	97.9	Very high	97.9	Very high	16 Å²	16	76.1 Å²	76.1	11%	0.108	39%	0.389	C	S	.	.	H	α-helix	trans	-63	-40.5	175.2	-67.4	0	0	0	0	112.5	D107 T108 N109 H114 A115 D124 L127	D107-C111 PolarHBondContact O-N 3.3Å; D107-C111 PolarHBondContact O-SG 2.9Å; T108-C111 WeakPolarHBondContact O-CB 3.49Å; T108-C111 PolarHBondContact O-N 3.31Å; N109-C111 VanDerWaalsContact C-N 3.33Å; N109-C111 PolarHBondContact O-N 3.48Å; 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 4.23Å
112	A	98.3	Very high	97.9	Very high	0 Å²	0	76.5 Å²	76.5	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-64.6	-45	176.1	0	0	0	0	0	111.8	T108 N109 L110 H114 A115 R116 R117 I120	T108-A112 PolarHBondContact O-N 3.43Å; N109-A112 PolarHBondContact O-N 2.93Å; L110-A112 PolarHBondContact O-N 3.4Å; A112-H114 VanDerWaalsContact C-N 3.35Å; A112-A115 CarbonylContact O-C 3.46Å; A112-A115 PolarHBondContact O-N 3.15Å; A112-A115 VanDerWaalsContact O-N 3.17Å; A112-R116 PolarHBondContact O-N 3.38Å; A112-R117 CarbonylContact C-O 3.25Å; A112-R117 VanDerWaalsContact C-O 3.25Å; A112-R117 PolarHBondContact O-N 2.88Å; A112-R117 VanDerWaalsContact O-O 3.07Å; A112-I120 HydrophobicContact CB-CG2 4.05Å
113	I	98.2	Very high	97.8	Very high	95 Å²	95	78.4 Å²	78.4	49%	0.487	40%	0.404	S	S	.	.	H	α-helix	trans	-62.1	-43	176.8	-68.8	167	0	0	0	110.6	N109 L110 A115 R116 R117	N109-I113 VanDerWaalsContact O-CG1 3.3Å; N109-I113 WeakPolarHBondContact O-CG1 3.29Å; N109-I113 PolarHBondContact O-N 3.36Å; L110-I113 PolarHBondContact O-N 3.43Å; I113-A115 PolarHBondContact O-N 3.37Å; I113-R116 WeakPolarHBondContact O-CA 3.27Å; I113-R116 PolarHBondContact O-N 3.17Å; I113-R117 PolarHBondContact N-O 3.48Å
114	H	97.8	Very high	97.9	Very high	161 Å²	161	77.9 Å²	77.9	75%	0.745	40%	0.397	S	S	*	.	H	α-helix	trans	-56.5	-38.2	175.9	-177.5	75.6	0	0	0	111.8	L110 C111 A112 R116	L110-H114 WeakPolarHBondContact O-CB 3.49Å; L110-H114 PolarHBondContact O-N 2.72Å; C111-H114 PolarHBondContact O-N 3.47Å; A112-H114 VanDerWaalsContact C-N 3.35Å; H114-R116 VanDerWaalsContact C-N 3.25Å; H114-R116 PolarHBondContact O-N 3.08Å
115	A	97.9	Very high	97.9	Very high	48 Å²	48	79.8 Å²	79.8	40%	0.397	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	17.9	175.3	0	0	0	0	0	114.5	C111 A112 I113 R117	C111-A115 PolarHBondContact O-N 3.32Å; A112-A115 CarbonylContact O-C 3.46Å; A112-A115 PolarHBondContact O-N 3.15Å; A112-A115 VanDerWaalsContact O-N 3.17Å; I113-A115 PolarHBondContact O-N 3.37Å; A115-R117 VanDerWaalsContact C-N 3.27Å; A115-R117 PolarHBondContact O-N 3.22Å
116	R	98	Very high	97.8	Very high	241 Å²	241	81.4 Å²	81.4	91%	0.909	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	32.5	-179.4	-53.9	-177	-175.4	-152.9	0.8	114.4	A112 I113 H114	A112-R116 PolarHBondContact O-N 3.38Å; I113-R116 WeakPolarHBondContact O-CA 3.27Å; I113-R116 PolarHBondContact O-N 3.17Å; H114-R116 VanDerWaalsContact C-N 3.25Å; H114-R116 PolarHBondContact O-N 3.08Å
117	R	98.1	Very high	97.7	Very high	48 Å²	48	79.5 Å²	79.5	18%	0.181	41%	0.408	C	S	.	.			trans	-117.7	154.4	175.3	-71.3	176	-71.3	106.1	-2	110.6	A112 I113 A115 T119 K123 D124	A112-R117 CarbonylContact C-O 3.25Å; A112-R117 VanDerWaalsContact C-O 3.25Å; A112-R117 PolarHBondContact O-N 2.88Å; A112-R117 VanDerWaalsContact O-O 3.07Å; I113-R117 PolarHBondContact N-O 3.48Å; A115-R117 VanDerWaalsContact C-N 3.27Å; A115-R117 PolarHBondContact O-N 3.22Å; R117-T119 PolarHBondContact NH1-O 3.29Å; R117-T119 VanDerWaalsContact NH1-O 3.07Å; R117-K123 VanDerWaalsContact NH2-CE 3.33Å; R117-D124 IonicContact CZ-OD1 3.54Å; R117-D124 IonicContact CZ-OD2 3.5Å; R117-D124 IonicContact NH1-OD1 3.47Å; R117-D124 PolarHBondContact NH1-OD1 3.32Å; R117-D124 IonicContact NH1-OD2 3.59Å; R117-D124 PolarHBondContact NH1-OD2 3.44Å; R117-D124 IonicContact NH2-OD1 2.69Å; R117-D124 PolarHBondContact NH2-OD1 3.06Å; R117-D124 IonicContact NH2-OD2 2.69Å; R117-D124 PolarHBondContact NH2-OD2 2.94Å
118	V	96.9	Very high	97.6	Very high	134 Å²	134	77.1 Å²	77.1	81%	0.812	40%	0.396	S	S	*	.	S	Bend	trans	-103.7	-15	170.3	-63.7	0	0	0	0	112.5
119	T	98.2	Very high	97.5	Very high	92 Å²	92	80.6 Å²	80.6	56%	0.564	41%	0.409	S	S	*	.	S	Bend	trans	-97.6	119.6	178.5	-51.7	0	0	0	0	109	R117	R117-T119 PolarHBondContact NH1-O 3.29Å; R117-T119 VanDerWaalsContact NH1-O 3.07Å
120	I	97.9	Very high	97.4	Very high	69 Å²	69	87.3 Å²	87.3	35%	0.354	43%	0.429	S	S	.	.			trans	-67.1	144.6	172.3	60.1	171.8	0	0	0	110.9	F105 T108 N109 A112	F105-I120 HydrophobicContact CD1-CD1 3.8Å; F105-I120 HydrophobicContact CE1-CD1 3.85Å; T108-I120 HydrophobicContact CG2-CB 3.87Å; T108-I120 HydrophobicContact CG2-CG2 3.87Å; N109-I120 HydrophobicContact CB-CG2 4.47Å; A112-I120 HydrophobicContact CB-CG2 4.05Å
121	M	98.3	Very high	97.3	Very high	81 Å²	81	88.1 Å²	88.1	40%	0.399	43%	0.433	S	S	.	.			trans	-132	161.7	-178.9	-62.7	178.6	175.4	0	0	110	K123 D124 I125	M121-K123 HydrophobicContact CB-CG 3.97Å; M121-K123 PolarHBondContact O-N 3.07Å; M121-K123 VanDerWaalsContact O-N 3.16Å; M121-K123 VanDerWaalsContact SD-CE 3.53Å; M121-D124 WeakPolarHBondContact CB-OD2 3.43Å; M121-D124 PolarHBondContact N-OD2 3.37Å; M121-D124 VanDerWaalsContact O-CB 3.32Å; M121-D124 WeakPolarHBondContact O-CB 3.17Å; M121-D124 PolarHBondContact O-N 3.18Å; M121-I125 PolarHBondContact O-N 3.45Å
122	A	97.7	Very high	97.1	Very high	69 Å²	69	91.6 Å²	91.6	57%	0.57	44%	0.444	S	S	*	.	H	α-helix	trans	-55.5	-35.3	178.7	0	0	0	0	0	113.3	D124 I125 Q126	A122-D124 VanDerWaalsContact C-N 3.25Å; A122-D124 PolarHBondContact O-N 2.9Å; A122-I125 PolarHBondContact O-N 2.81Å; A122-Q126 WeakPolarHBondContact O-CG 3.35Å; A122-Q126 PolarHBondContact O-N 3.01Å
123	K	97	Very high	96.9	Very high	115 Å²	115	94.2 Å²	94.2	50%	0.5	47%	0.471	S	S	.	.	H	α-helix	trans	-62.5	-29.4	175.2	63.4	176.9	178.3	-179.6	0	113.8	R117 M121 L127	R117-K123 VanDerWaalsContact NH2-CE 3.33Å; M121-K123 HydrophobicContact CB-CG 3.97Å; M121-K123 PolarHBondContact O-N 3.07Å; M121-K123 VanDerWaalsContact O-N 3.16Å; M121-K123 VanDerWaalsContact SD-CE 3.53Å; K123-L127 WeakPolarHBondContact O-CB 3.42Å; K123-L127 PolarHBondContact O-N 3.45Å
124	D	97.9	Very high	96.2	Very high	5 Å²	5	92.1 Å²	92.1	3%	0.027	46%	0.459	C	S	.	.	H	α-helix	trans	-73	-39.3	179.2	-56.1	-39.6	0	0	0	109.8	T108 C111 R117 M121 A122 L127 A128	T108-D124 HydrophobicContact CG2-CB 3.62Å; C111-D124 HydrophobicContact CB-CB 3.97Å; R117-D124 IonicContact CZ-OD1 3.54Å; R117-D124 IonicContact CZ-OD2 3.5Å; R117-D124 IonicContact NH1-OD1 3.47Å; R117-D124 PolarHBondContact NH1-OD1 3.32Å; R117-D124 IonicContact NH1-OD2 3.59Å; R117-D124 PolarHBondContact NH1-OD2 3.44Å; R117-D124 IonicContact NH2-OD1 2.69Å; R117-D124 PolarHBondContact NH2-OD1 3.06Å; R117-D124 IonicContact NH2-OD2 2.69Å; R117-D124 PolarHBondContact NH2-OD2 2.94Å; M121-D124 WeakPolarHBondContact CB-OD2 3.43Å; M121-D124 PolarHBondContact N-OD2 3.37Å; M121-D124 VanDerWaalsContact O-CB 3.32Å; M121-D124 WeakPolarHBondContact O-CB 3.17Å; M121-D124 PolarHBondContact O-N 3.18Å; A122-D124 VanDerWaalsContact C-N 3.25Å; A122-D124 PolarHBondContact O-N 2.9Å; D124-L127 PolarHBondContact O-N 3.32Å; D124-A128 WeakPolarHBondContact O-CB 3.32Å; D124-A128 PolarHBondContact O-N 3.09Å
125	I	96.9	Very high	94.8	Very high	55 Å²	55	95.7 Å²	95.7	28%	0.282	47%	0.466	S	S	.	.	H	α-helix	trans	-63.7	-48	173.6	-59.7	174.8	0	0	0	109.7	L104 T108 M121 A122 L127 A128 R129	L104-I125 HydrophobicContact CD1-CG2 4.49Å; L104-I125 HydrophobicContact CD2-CG2 4.14Å; L104-I125 HydrophobicContact CG-CG2 4.49Å; T108-I125 HydrophobicContact CG2-CG1 3.54Å; M121-I125 PolarHBondContact O-N 3.45Å; A122-I125 PolarHBondContact O-N 2.81Å; I125-L127 VanDerWaalsContact C-N 3.3Å; I125-L127 PolarHBondContact O-N 3.33Å; I125-A128 PolarHBondContact O-N 3.23Å; I125-R129 HydrophobicContact CG2-CG 4.3Å; I125-R129 VanDerWaalsContact O-CG 3.31Å; I125-R129 WeakPolarHBondContact O-CG 3.4Å; I125-R129 PolarHBondContact O-N 3.34Å
126	Q	96.2	Very high	92.7	Very high	134 Å²	134	101.9 Å²	101.9	63%	0.626	50%	0.499	S	S	*	.	H	α-helix	trans	-58.7	-42.2	178.2	-70.8	170.1	-5.7	0	0	111.8	A122 R130	A122-Q126 WeakPolarHBondContact O-CG 3.35Å; A122-Q126 PolarHBondContact O-N 3.01Å; Q126-R130 VanDerWaalsContact O-CB 3.28Å; Q126-R130 WeakPolarHBondContact O-CB 3.39Å; Q126-R130 PolarHBondContact O-N 3.32Å
127	L	96.1	Very high	92.5	Very high	74 Å²	74	95 Å²	95	39%	0.387	48%	0.478	S	S	.	.	H	α-helix	trans	-64.2	-47.5	176.2	-179.6	60.1	0	0	0	111.7	C111 K123 D124 I125 R129 R130 I131	C111-L127 HydrophobicContact CB-CD2 4.23Å; K123-L127 WeakPolarHBondContact O-CB 3.42Å; K123-L127 PolarHBondContact O-N 3.45Å; D124-L127 PolarHBondContact O-N 3.32Å; I125-L127 VanDerWaalsContact C-N 3.3Å; I125-L127 PolarHBondContact O-N 3.33Å; L127-R129 PolarHBondContact O-N 3.14Å; L127-R130 PolarHBondContact O-N 3.01Å; L127-I131 HydrophobicContact CD1-CD1 3.95Å; L127-I131 HydrophobicContact CD1-CG1 4.27Å; L127-I131 HydrophobicContact CG-CD1 3.97Å; L127-I131 WeakPolarHBondContact O-CG1 3.28Å; L127-I131 PolarHBondContact O-N 2.77Å
128	A	96.4	Very high	92.2	Very high	3 Å²	3	97.4 Å²	97.4	3%	0.025	49%	0.494	C	S	.	.	H	α-helix	trans	-57.9	-49.3	178	0	0	0	0	0	111.6	L104 D107 D124 I125 R130 I131 R132	L104-A128 HydrophobicContact CD1-CB 4.12Å; D107-A128 HydrophobicContact CB-CB 3.84Å; D124-A128 WeakPolarHBondContact O-CB 3.32Å; D124-A128 PolarHBondContact O-N 3.09Å; I125-A128 PolarHBondContact O-N 3.23Å; A128-R130 VanDerWaalsContact C-N 3.33Å; A128-R130 PolarHBondContact O-N 3.28Å; A128-I131 PolarHBondContact O-N 2.9Å; A128-R132 WeakPolarHBondContact O-CG 3.48Å; A128-R132 PolarHBondContact O-N 3.12Å
129	R	96.1	Very high	91.9	Very high	73 Å²	73	95.4 Å²	95.4	28%	0.275	48%	0.476	S	S	.	.	H	α-helix	trans	-61.4	-40	177.5	-66.2	-172.1	66.3	-148.4	-8.6	112.6	L104 I125 L127 R132 G133 E134	L104-R129 HydrophobicContact CD1-CG 3.7Å; L104-R129 HydrophobicContact CD2-CG 4.41Å; I125-R129 HydrophobicContact CG2-CG 4.3Å; I125-R129 VanDerWaalsContact O-CG 3.31Å; I125-R129 WeakPolarHBondContact O-CG 3.4Å; I125-R129 PolarHBondContact O-N 3.34Å; L127-R129 PolarHBondContact O-N 3.14Å; R129-R132 PolarHBondContact O-N 3.08Å; R129-G133 PolarHBondContact O-N 2.72Å; R129-E134 HydrophobicContact CB-CB 4.41Å; R129-E134 WeakPolarHBondContact CG-OE2 3.27Å; R129-E134 IonicContact NE-OE2 2.74Å; R129-E134 PolarHBondContact NE-OE2 3.21Å; R129-E134 PolarHBondContact O-N 3.06Å; R129-E134 VanDerWaalsContact O-N 3.13Å
130	R	95.6	Very high	91.5	Very high	211 Å²	211	95.6 Å²	95.6	80%	0.796	47%	0.471	S	S	*	.	H	α-helix	trans	-62.1	-43	175.9	-178.9	174.3	-179.4	159	1.2	112	Q126 L127 A128 G133	Q126-R130 VanDerWaalsContact O-CB 3.28Å; Q126-R130 WeakPolarHBondContact O-CB 3.39Å; Q126-R130 PolarHBondContact O-N 3.32Å; L127-R130 PolarHBondContact O-N 3.01Å; A128-R130 VanDerWaalsContact C-N 3.33Å; A128-R130 PolarHBondContact O-N 3.28Å; R130-G133 PolarHBondContact O-N 3.15Å
131	I	94.9	Very high	91.1	Very high	127 Å²	127	97.3 Å²	97.3	65%	0.651	48%	0.478	S	S	*	.	H	α-helix	trans	-68.1	-38.7	178.7	-67.5	168.7	0	0	0	110.9	L127 A128 G133	L127-I131 HydrophobicContact CD1-CD1 3.95Å; L127-I131 HydrophobicContact CD1-CG1 4.27Å; L127-I131 HydrophobicContact CG-CD1 3.97Å; L127-I131 WeakPolarHBondContact O-CG1 3.28Å; L127-I131 PolarHBondContact O-N 2.77Å; A128-I131 PolarHBondContact O-N 2.9Å; I131-G133 PolarHBondContact O-N 3.27Å
132	R	94.7	Very high	90.7	Very high	89 Å²	89	98.3 Å²	98.3	34%	0.336	48%	0.484	S	S	.	.	H	α-helix	trans	-64.9	-16.4	175	-72.5	-177.4	175.1	-162.8	-7.3	114.3	G103 D107 A128 R129 E134	G103-R132 PolarHBondContact O-NH2 3.17Å; D107-R132 IonicContact OD2-CZ 3.98Å; D107-R132 IonicContact OD2-NE 3.28Å; D107-R132 PolarHBondContact OD2-NE 2.69Å; D107-R132 IonicContact OD2-NH2 3.26Å; D107-R132 PolarHBondContact OD2-NH2 3.47Å; A128-R132 WeakPolarHBondContact O-CG 3.48Å; A128-R132 PolarHBondContact O-N 3.12Å; R129-R132 PolarHBondContact O-N 3.08Å; R132-E134 VanDerWaalsContact C-N 3.28Å; R132-E134 HydrophobicContact CB-CG 3.95Å; R132-E134 WeakPolarHBondContact CD-OE1 3.39Å; R132-E134 IonicContact NE-OE1 3.11Å; R132-E134 IonicContact NH1-OE1 2.7Å; R132-E134 PolarHBondContact NH1-OE1 3.45Å
133	G	93.3	Very high	90.1	Very high	55 Å²	55	100.4 Å²	100.4	57%	0.567	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.6	14.9	-173.9	0	0	0	0	0	113.6	R129 R130 I131 R135	R129-G133 PolarHBondContact O-N 2.72Å; R130-G133 PolarHBondContact O-N 3.15Å; I131-G133 PolarHBondContact O-N 3.27Å; G133-R135 PolarHBondContact O-N 3.39Å
134	E	84.7	Confident	89.6	Confident	51 Å²	51	99.3 Å²	99.3	24%	0.238	48%	0.476	C	S	.	.			trans	-72.9	97.3	174.3	-67.8	170.3	-169.3	0	0	109	Y100 R129 R132 V136	Y100-E134 VanDerWaalsContact CE2-OE1 3.29Å; Y100-E134 WeakPolarHBondContact CE2-OE1 3.21Å; Y100-E134 VanDerWaalsContact OH-CD 3.23Å; Y100-E134 PolarHBondContact OH-OE1 3.26Å; Y100-E134 PolarHBondContact OH-OE2 2.97Å; R129-E134 HydrophobicContact CB-CB 4.41Å; R129-E134 WeakPolarHBondContact CG-OE2 3.27Å; R129-E134 IonicContact NE-OE2 2.74Å; R129-E134 PolarHBondContact NE-OE2 3.21Å; R129-E134 PolarHBondContact O-N 3.06Å; R129-E134 VanDerWaalsContact O-N 3.13Å; R132-E134 VanDerWaalsContact C-N 3.28Å; R132-E134 HydrophobicContact CB-CG 3.95Å; R132-E134 WeakPolarHBondContact CD-OE1 3.39Å; R132-E134 IonicContact NE-OE1 3.11Å; R132-E134 IonicContact NH1-OE1 2.7Å; R132-E134 PolarHBondContact NH1-OE1 3.45Å; E134-V136 PolarHBondContact O-N 3.08Å
135	R	68.2	Low	88.9	Confident	235 Å²	235	107.2 Å²	107.2	89%	0.887	51%	0.513	S	S	*	.			trans	-70.1	128.9	172.9	-61.9	-177	-177.4	-174	0.4	108.9	G133	G133-R135 PolarHBondContact O-N 3.39Å
136	V	53.9	Low	88.2	Confident	179 Å²	179	111.9 Å²	111.9	100%	1.085	53%	0.534	S	S	*	.			trans	-81.1	0	146.6	-175.3	0	0	0	0	106.3	E134	E134-V136 PolarHBondContact O-N 3.08Å

Retrieved 136 of 136 residues in 256.4 ms (Link to these results)

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