A0A077ZHY3_TRITR Loading...

Histone H3

AlphaFold DB , UniProt , Accession A0A077ZHY3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 136 aa.

						>A0A077ZHY3_TRITR|A0A077ZHY3
MARTKQTARKSTGGKAPRKQLATKAARKSAPSTGGVKKPHRYRPGTVALREIRRYQKSTELLIRKLPFQRLVREIAQDFKTDLRFQSAAVGALQEAAEAYLVGLFEDTNLCAIHAKRVTIMPKDIQLARRIRGERA
					

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(Predicted Aligned Error values between residue pairs)

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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	48.3	Very low	64.4	Low	251 Å²	251	175.4 Å²	175.4	100%	1.236	90%	0.901	S	S	*	*				0	113.5	0	-81	178.4	174.3	0	0	109.1
2	A	61.2	Low	64.2	Low	103 Å²	103	171.2 Å²	171.2	85%	0.851	89%	0.89	S	S	*	*			trans	-89.4	117.6	177.2	0	0	0	0	0	110	T4	A2-T4 PolarHBondContact O-N 3.07Å
3	R	64.9	Low	63.4	Low	252 Å²	252	164.2 Å²	164.2	95%	0.951	89%	0.885	S	S	*	*			trans	-74.5	107.7	179.3	-120.4	-179.9	178.6	179.4	-0.1	109.6	K5	R3-K5 PolarHBondContact O-N 3.26Å
4	T	72.2	Confident	63.2	Low	135 Å²	135	157.6 Å²	157.6	83%	0.828	88%	0.875	S	S	*	*			trans	-75.8	115.3	168.2	37	0	0	0	0	109.6	A2 Q6	A2-T4 PolarHBondContact O-N 3.07Å; T4-Q6 PolarHBondContact O-N 3.5Å; T4-Q6 VanDerWaalsContact O-N 3.12Å
5	K	73.6	Confident	62.8	Low	203 Å²	203	161 Å²	161	88%	0.883	88%	0.877	S	S	*	*			trans	-76.1	95.2	176.8	-143.4	177	-172.1	179.5	0	108.3	R3 T7	R3-K5 PolarHBondContact O-N 3.26Å; K5-T7 PolarHBondContact O-N 3.37Å
6	Q	70.4	Confident	62.7	Low	191 Å²	191	156.9 Å²	156.9	89%	0.893	87%	0.872	S	S	*	*			trans	-63.9	117.1	167.8	-88	-174.8	-7.3	0	0	108.8	T4	T4-Q6 PolarHBondContact O-N 3.5Å; T4-Q6 VanDerWaalsContact O-N 3.12Å
7	T	67.5	Low	62.5	Low	127 Å²	127	155.5 Å²	155.5	78%	0.779	87%	0.871	S	S	*	*			trans	-85.7	122.3	167.6	46.5	0	0	0	0	109.1	K5 R9	K5-T7 PolarHBondContact O-N 3.37Å; T7-R9 PolarHBondContact O-N 3.34Å
8	A	65.5	Low	62.4	Low	105 Å²	105	160.7 Å²	160.7	87%	0.868	88%	0.875	S	S	*	*			trans	-65.9	111.7	177	0	0	0	0	0	110.3
9	R	62.8	Low	61.8	Low	246 Å²	246	163.3 Å²	163.3	93%	0.928	88%	0.877	S	S	*	*			trans	-82.8	117.9	166.2	-110.3	-179.3	168.8	-177.6	-2.1	108.4	T7 S11	T7-R9 PolarHBondContact O-N 3.34Å; R9-S11 PolarHBondContact O-N 3.44Å
10	K	60.1	Low	61.4	Low	196 Å²	196	164.4 Å²	164.4	85%	0.852	88%	0.876	S	S	*	*			trans	-55.9	132.3	171.4	-79.7	-179.7	176.8	-179.5	0	110.1	T12	K10-T12 VanDerWaalsContact C-N 3.27Å; K10-T12 PolarHBondContact O-N 3.18Å
11	S	62.4	Low	61.1	Low	120 Å²	120	164.8 Å²	164.8	84%	0.839	88%	0.878	S	S	*	*	S	Bend	trans	-77.7	3.1	-172.7	39.2	0	0	0	0	115.2	R9	R9-S11 PolarHBondContact O-N 3.44Å
12	T	61	Low	61.3	Low	125 Å²	125	157.3 Å²	157.3	77%	0.767	86%	0.856	S	S	*	*			trans	-134.3	88.1	-177.6	53.7	0	0	0	0	110.1	K10	K10-T12 VanDerWaalsContact C-N 3.27Å; K10-T12 PolarHBondContact O-N 3.18Å
13	G	54.2	Low	61.1	Low	81 Å²	81	158.9 Å²	158.9	84%	0.835	86%	0.855	S	S	*	*			trans	-130.7	49.2	-174.7	0	0	0	0	0	113
14	G	60.5	Low	60.9	Low	72 Å²	72	156.2 Å²	156.2	74%	0.742	85%	0.85	S	S	*	*	S	Bend	trans	-105.5	97.4	174	0	0	0	0	0	111.2
15	K	57.9	Low	60.3	Low	208 Å²	208	154.5 Å²	154.5	90%	0.904	85%	0.85	S	S	*	*			trans	84.4	112.2	174.4	-55.5	-172.8	176.5	179.8	0	116.6
16	A	60.3	Low	59.4	Low	96 Å²	96	149.1 Å²	149.1	79%	0.793	84%	0.843	S	S	*	*			trans	-70	135.4	160.2	0	0	0	0	0	109.8
17	P	60.4	Low	58.9	Low	132 Å²	132	150.9 Å²	150.9	86%	0.857	84%	0.842	S	S	*	*			trans	-77.2	122.2	176.5	29.2	-29.3	0	0	0	109.9
18	R	59.8	Low	58.4	Low	249 Å²	249	155.1 Å²	155.1	94%	0.94	85%	0.849	S	S	*	*			trans	-109.4	128.5	173.3	-129.3	179.1	-175.9	-177.5	0.2	109.5
19	K	52.2	Low	57.9	Low	211 Å²	211	155 Å²	155	92%	0.917	84%	0.842	S	S	*	*			trans	-55.7	147.2	177.2	-87	-179.6	171.6	-178.9	0	112.1
20	Q	51.9	Low	57.8	Low	185 Å²	185	146.4 Å²	146.4	86%	0.864	82%	0.823	S	S	*	*			trans	-54.8	131.9	-175.5	-67.4	168.2	-19.8	0	0	114.1
21	L	55.4	Low	57.7	Low	173 Å²	173	141.7 Å²	141.7	91%	0.906	81%	0.813	S	S	*	*			trans	-171.2	131.9	144.9	-98.5	137.4	0	0	0	108
22	A	54	Low	57.7	Low	93 Å²	93	141.9 Å²	141.9	77%	0.769	81%	0.814	S	S	*	*			trans	-46.5	141.1	-168	0	0	0	0	0	114.8
23	T	57.1	Low	57.5	Low	137 Å²	137	142 Å²	142	84%	0.84	82%	0.815	S	S	*	*			trans	-176.8	132.3	147.4	19.9	0	0	0	0	111.7
24	K	59.1	Low	57.8	Low	196 Å²	196	140.6 Å²	140.6	85%	0.852	80%	0.8	S	S	*	*			trans	1.7	134.2	160.2	-76.4	170.6	172.1	173.9	0	117	A26	K24-A26 VanDerWaalsContact C-N 3.29Å; K24-A26 PolarHBondContact O-N 2.85Å
25	A	59.8	Low	58.1	Low	99 Å²	99	140.9 Å²	140.9	82%	0.818	80%	0.804	S	S	*	*			trans	-47.6	85.4	170.8	0	0	0	0	0	112.9	R27	A25-R27 PolarHBondContact O-N 3.04Å
26	A	55.5	Low	58.7	Low	90 Å²	90	136.3 Å²	136.3	74%	0.744	79%	0.793	S	S	*	*			trans	-76.6	77	175	0	0	0	0	0	108	K24 K28	K24-A26 VanDerWaalsContact C-N 3.29Å; K24-A26 PolarHBondContact O-N 2.85Å; A26-K28 PolarHBondContact O-N 3.41Å
27	R	58.6	Low	59.4	Low	228 Å²	228	141 Å²	141	86%	0.86	80%	0.795	S	S	*	*			trans	-59.4	102.9	166.6	-70.1	-178.5	-177.1	174.4	1.6	107.4	A25 S29	A25-R27 PolarHBondContact O-N 3.04Å; R27-S29 PolarHBondContact O-N 3.43Å
28	K	57.1	Low	60.4	Low	216 Å²	216	144.2 Å²	144.2	94%	0.939	80%	0.796	S	S	*	*			trans	6.6	65.4	165.9	-74.9	-179.2	174.5	175.4	0	114.8	A26	A26-K28 PolarHBondContact O-N 3.41Å
29	S	55.5	Low	61.7	Low	102 Å²	102	137.7 Å²	137.7	71%	0.713	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-89.2	128.6	163	48.6	0	0	0	0	105.3	R27	R27-S29 PolarHBondContact O-N 3.43Å
30	A	60.5	Low	63.5	Low	65 Å²	65	134.8 Å²	134.8	54%	0.537	78%	0.775	S	S	.	*	P	Polyproline II helix	trans	-49.7	147.6	-174	0	0	0	0	0	111.8	S32	A30-S32 PolarHBondContact O-N 3.43Å
31	P	58.3	Low	65.4	Low	98 Å²	98	136.7 Å²	136.7	64%	0.636	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-53	131.5	174.7	22.5	-31.7	0	0	0	109.5	T33	P31-T33 PolarHBondContact O-N 3.39Å
32	S	62.1	Low	67.2	Low	123 Å²	123	134 Å²	134	86%	0.86	75%	0.753	S	S	*	*	S	Bend	trans	-69.8	2.2	-176.9	75.2	0	0	0	0	113.5	A30	A30-S32 PolarHBondContact O-N 3.43Å
33	T	57.7	Low	69.2	Low	127 Å²	127	139.3 Å²	139.3	78%	0.779	75%	0.753	S	S	*	*	S	Bend	trans	-146.4	87.4	-177.8	45.8	0	0	0	0	108.9	P31	P31-T33 PolarHBondContact O-N 3.39Å
34	G	61.3	Low	71.1	Confident	52 Å²	52	139 Å²	139	54%	0.536	75%	0.753	S	S	.	*	S	Bend	trans	148.5	120.8	178.1	0	0	0	0	0	111	V36	G34-V36 PolarHBondContact O-N 2.96Å
35	G	66.6	Low	72.9	Confident	79 Å²	79	131.6 Å²	131.6	81%	0.814	73%	0.733	S	S	*	*			trans	-37.6	123.9	-168.3	0	0	0	0	0	114.3	K37	G35-K37 PolarHBondContact O-N 3.47Å
36	V	69.9	Low	74.7	Confident	111 Å²	111	129.6 Å²	129.6	67%	0.673	71%	0.711	S	S	*	*			trans	-52.4	117.8	171.9	-179.7	0	0	0	0	107.4	G34 K38	G34-V36 PolarHBondContact O-N 2.96Å; V36-K38 PolarHBondContact O-N 3.13Å; V36-K38 VanDerWaalsContact O-N 3.13Å
37	K	74.9	Confident	76.7	Confident	194 Å²	194	127.7 Å²	127.7	84%	0.843	69%	0.69	S	S	*	*			trans	-50.1	126.6	171.4	-76.8	-171.1	176.3	-175	0	107.4	G35 P39	G35-K37 PolarHBondContact O-N 3.47Å; K37-P39 WeakPolarHBondContact O-CD 3.46Å; K37-P39 VanDerWaalsContact O-N 3.07Å
38	K	81.7	Confident	78.6	Confident	200 Å²	200	119 Å²	119	87%	0.87	67%	0.667	S	S	*	*			trans	-44.7	121.3	-179.8	-71.5	-175.8	178.8	-179.9	0	108.7	V36 H40	V36-K38 PolarHBondContact O-N 3.13Å; V36-K38 VanDerWaalsContact O-N 3.13Å; K38-H40 PolarHBondContact O-N 3.06Å
39	P	86.3	Confident	80.5	Confident	112 Å²	112	113.4 Å²	113.4	73%	0.727	65%	0.647	S	S	*	*			trans	-52.6	133.5	178.7	-27.6	34.6	0	0	0	109.8	K37 R41	K37-P39 WeakPolarHBondContact O-CD 3.46Å; K37-P39 VanDerWaalsContact O-N 3.07Å; P39-R41 PolarHBondContact O-N 3.46Å
40	H	89.5	Confident	82.5	Confident	151 Å²	151	114 Å²	114	70%	0.699	63%	0.633	S	S	*	*			trans	-62.5	123	177.4	172.7	-84.2	0	0	0	109.4	K38 Y42	K38-H40 PolarHBondContact O-N 3.06Å; H40-Y42 AromaticContact CE1-CD1 3.84Å; H40-Y42 AromaticContact CE1-CE1 3.74Å; H40-Y42 AromaticContact CE1-CZ 3.91Å
41	R	92.5	Very high	84.3	Confident	224 Å²	224	115.1 Å²	115.1	85%	0.845	63%	0.628	S	S	*	*			trans	-120.4	126.6	176.2	-170.3	175.5	179.7	176.2	0.9	109.7	P39	P39-R41 PolarHBondContact O-N 3.46Å
42	Y	94.5	Very high	86.2	Confident	116 Å²	116	114.6 Å²	114.6	46%	0.455	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-64.3	146	171.4	-69.7	-74.9	0	0	0	110.7	H40 T46 V47	H40-Y42 AromaticContact CE1-CD1 3.84Å; H40-Y42 AromaticContact CE1-CE1 3.74Å; H40-Y42 AromaticContact CE1-CZ 3.91Å; Y42-T46 HydrophobicContact CD1-CG2 3.81Å; Y42-T46 HydrophobicContact CG-CG2 4.42Å; Y42-V47 HydrophobicContact CD2-CG2 3.94Å; Y42-V47 HydrophobicContact CG-CG2 4.02Å
43	R	95.7	Very high	87.9	Confident	206 Å²	206	116.7 Å²	116.7	78%	0.777	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-63.8	144.5	172.9	-60.6	-180	76.9	-171.3	3.7	109.7	G45 T46	R43-G45 PolarHBondContact O-N 3.35Å; R43-T46 VanDerWaalsContact O-CB 3.23Å; R43-T46 WeakPolarHBondContact O-CB 3.47Å; R43-T46 PolarHBondContact O-N 3.35Å; R43-T46 PolarHBondContact O-OG1 3.09Å
44	P	96.6	Very high	89.8	Confident	129 Å²	129	117.6 Å²	117.6	84%	0.838	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.6	139.6	172.2	-26	34.7	0	0	0	111.2	T46	P44-T46 VanDerWaalsContact C-N 3.3Å; P44-T46 PolarHBondContact O-N 3.15Å
45	G	96.4	Very high	91.6	Very high	42 Å²	42	119.7 Å²	119.7	43%	0.433	59%	0.589	S	S	.	*	T	Hydrogen-bonded Turn	trans	86.1	-26	-174.1	0	0	0	0	0	115.4	R43 V47 A48 L49	R43-G45 PolarHBondContact O-N 3.35Å; G45-V47 PolarHBondContact O-N 3.31Å; G45-A48 PolarHBondContact O-N 3.08Å; G45-L49 WeakPolarHBondContact O-CB 3.37Å; G45-L49 WeakPolarHBondContact O-CG 3.5Å; G45-L49 PolarHBondContact O-N 3.47Å
46	T	97.8	Very high	93	Very high	57 Å²	57	123.1 Å²	123.1	35%	0.35	58%	0.584	S	S	.	*	H	α-helix	trans	-62.9	-44	-179.4	-49.9	0	0	0	0	112	Y42 R43 P44 R50	Y42-T46 HydrophobicContact CD1-CG2 3.81Å; Y42-T46 HydrophobicContact CG-CG2 4.42Å; R43-T46 VanDerWaalsContact O-CB 3.23Å; R43-T46 WeakPolarHBondContact O-CB 3.47Å; R43-T46 PolarHBondContact O-N 3.35Å; R43-T46 PolarHBondContact O-OG1 3.09Å; P44-T46 VanDerWaalsContact C-N 3.3Å; P44-T46 PolarHBondContact O-N 3.15Å; T46-R50 PolarHBondContact O-N 3.29Å
47	V	97.6	Very high	94.4	Very high	50 Å²	50	126.8 Å²	126.8	30%	0.303	59%	0.59	S	S	.	*	H	α-helix	trans	-72.1	-42.8	179.7	-177.5	0	0	0	0	110.4	Y42 G45 L49 R50 E51	Y42-V47 HydrophobicContact CD2-CG2 3.94Å; Y42-V47 HydrophobicContact CG-CG2 4.02Å; G45-V47 PolarHBondContact O-N 3.31Å; V47-L49 PolarHBondContact O-N 3.27Å; V47-R50 WeakPolarHBondContact O-CB 3.37Å; V47-R50 PolarHBondContact O-N 2.99Å; V47-R50 VanDerWaalsContact O-N 3.09Å; V47-E51 HydrophobicContact CG1-CG 4.42Å; V47-E51 VanDerWaalsContact CG1-OE1 3.3Å; V47-E51 WeakPolarHBondContact CG1-OE1 3.19Å; V47-E51 WeakPolarHBondContact O-CG 3.24Å; V47-E51 PolarHBondContact O-N 2.96Å
48	A	97.5	Very high	95.4	Very high	46 Å²	46	119.5 Å²	119.5	38%	0.38	56%	0.564	S	S	.	*	H	α-helix	trans	-58.3	-46.8	177.5	0	0	0	0	0	112.1	G45 R50 E51 I52	G45-A48 PolarHBondContact O-N 3.08Å; A48-R50 VanDerWaalsContact C-N 3.27Å; A48-R50 PolarHBondContact O-N 3.31Å; A48-E51 PolarHBondContact O-N 3.03Å; A48-I52 VanDerWaalsContact O-CG1 3.29Å; A48-I52 WeakPolarHBondContact O-CG1 3.41Å; A48-I52 PolarHBondContact O-N 2.97Å
49	L	97.8	Very high	96.1	Very high	97 Å²	97	116.7 Å²	116.7	51%	0.508	56%	0.564	S	S	.	*	H	α-helix	trans	-63	-33.1	176.4	-73	174.8	0	0	0	112.9	G45 V47 R53	G45-L49 WeakPolarHBondContact O-CB 3.37Å; G45-L49 WeakPolarHBondContact O-CG 3.5Å; G45-L49 PolarHBondContact O-N 3.47Å; V47-L49 PolarHBondContact O-N 3.27Å; L49-R53 VanDerWaalsContact O-CG 3.28Å; L49-R53 WeakPolarHBondContact O-CG 3.36Å; L49-R53 PolarHBondContact O-N 3.14Å
50	R	98	Very high	96.6	Very high	114 Å²	114	116.3 Å²	116.3	43%	0.43	55%	0.552	S	S	.	*	H	α-helix	trans	-70.1	-40.3	175.3	-179.7	173.8	59.8	-127	3.3	111.4	T46 V47 A48 R54	T46-R50 PolarHBondContact O-N 3.29Å; V47-R50 WeakPolarHBondContact O-CB 3.37Å; V47-R50 PolarHBondContact O-N 2.99Å; V47-R50 VanDerWaalsContact O-N 3.09Å; A48-R50 VanDerWaalsContact C-N 3.27Å; A48-R50 PolarHBondContact O-N 3.31Å; R50-R54 WeakPolarHBondContact O-CB 3.3Å; R50-R54 PolarHBondContact O-N 3.36Å
51	E	97.9	Very high	97	Very high	90 Å²	90	111.2 Å²	111.2	42%	0.421	53%	0.53	S	S	.	.	H	α-helix	trans	-65.7	-46.2	176	-73.2	169.8	-174.7	0	0	111.4	V47 A48 R53 R54 Y55	V47-E51 HydrophobicContact CG1-CG 4.42Å; V47-E51 VanDerWaalsContact CG1-OE1 3.3Å; V47-E51 WeakPolarHBondContact CG1-OE1 3.19Å; V47-E51 WeakPolarHBondContact O-CG 3.24Å; V47-E51 PolarHBondContact O-N 2.96Å; A48-E51 PolarHBondContact O-N 3.03Å; E51-R53 VanDerWaalsContact C-N 3.35Å; E51-R53 PolarHBondContact O-N 3.21Å; E51-R54 WeakPolarHBondContact O-CB 3.49Å; E51-R54 PolarHBondContact O-N 3.05Å; E51-Y55 HydrophobicContact CB-CD2 4.29Å; E51-Y55 HydrophobicContact CB-CE2 4Å; E51-Y55 HydrophobicContact CG-CE2 4.49Å; E51-Y55 WeakPolarHBondContact O-CD2 3.45Å; E51-Y55 PolarHBondContact O-N 3.42Å
52	I	97.8	Very high	97.2	Very high	86 Å²	86	105.1 Å²	105.1	44%	0.441	51%	0.514	S	S	.	.	H	α-helix	trans	-54.4	-51	175.4	-68.5	164.3	0	0	0	110.5	A48 R54 Y55 Q56	A48-I52 VanDerWaalsContact O-CG1 3.29Å; A48-I52 WeakPolarHBondContact O-CG1 3.41Å; A48-I52 PolarHBondContact O-N 2.97Å; I52-R54 VanDerWaalsContact C-N 3.28Å; I52-R54 PolarHBondContact O-N 3.46Å; I52-Y55 PolarHBondContact O-N 3.45Å; I52-Q56 HydrophobicContact CG2-CG 4.38Å; I52-Q56 WeakPolarHBondContact O-CB 3.2Å; I52-Q56 VanDerWaalsContact O-CG 3.31Å; I52-Q56 WeakPolarHBondContact O-CG 3.41Å; I52-Q56 PolarHBondContact O-N 2.98Å
53	R	98	Very high	97.4	Very high	167 Å²	167	102.6 Å²	102.6	63%	0.63	51%	0.507	S	S	*	.	H	α-helix	trans	-64.4	-31.1	178.5	-70.1	174.2	-170.3	178.6	2.7	113.4	L49 E51 K57	L49-R53 VanDerWaalsContact O-CG 3.28Å; L49-R53 WeakPolarHBondContact O-CG 3.36Å; L49-R53 PolarHBondContact O-N 3.14Å; E51-R53 VanDerWaalsContact C-N 3.35Å; E51-R53 PolarHBondContact O-N 3.21Å; R53-K57 VanDerWaalsContact O-CG 3.29Å; R53-K57 WeakPolarHBondContact O-CG 3.39Å
54	R	98.1	Very high	97.5	Very high	147 Å²	147	102.4 Å²	102.4	56%	0.555	51%	0.507	S	S	*	.	H	α-helix	trans	-68.5	-53.5	176.2	176.6	-174.9	169.1	-174.1	-5.6	109.6	R50 E51 I52 Q56 K57 S58 E60	R50-R54 WeakPolarHBondContact O-CB 3.3Å; R50-R54 PolarHBondContact O-N 3.36Å; E51-R54 WeakPolarHBondContact O-CB 3.49Å; E51-R54 PolarHBondContact O-N 3.05Å; I52-R54 VanDerWaalsContact C-N 3.28Å; I52-R54 PolarHBondContact O-N 3.46Å; R54-Q56 PolarHBondContact O-N 3.26Å; R54-K57 PolarHBondContact O-N 2.9Å; R54-K57 VanDerWaalsContact O-N 3.15Å; R54-S58 PolarHBondContact O-N 3.24Å; R54-S58 PolarHBondContact O-OG 3.01Å; R54-E60 IonicContact NH2-OE1 3.84Å
55	Y	97.9	Very high	97.5	Very high	96 Å²	96	103 Å²	103	38%	0.376	50%	0.496	S	S	.	.	H	α-helix	trans	-69.7	-32.9	-174.6	-63.2	-50.3	0	0	0	112.9	E51 I52 K57 S58 L62	E51-Y55 HydrophobicContact CB-CD2 4.29Å; E51-Y55 HydrophobicContact CB-CE2 4Å; E51-Y55 HydrophobicContact CG-CE2 4.49Å; E51-Y55 WeakPolarHBondContact O-CD2 3.45Å; E51-Y55 PolarHBondContact O-N 3.42Å; I52-Y55 PolarHBondContact O-N 3.45Å; Y55-K57 PolarHBondContact O-N 3.03Å; Y55-S58 WeakPolarHBondContact CA-OG 3.29Å; Y55-S58 PolarHBondContact O-N 3.01Å; Y55-S58 PolarHBondContact O-OG 3.39Å; Y55-S58 VanDerWaalsContact O-OG 3.12Å; Y55-L62 HydrophobicContact CD1-CD2 3.74Å; Y55-L62 HydrophobicContact CE1-CD2 3.9Å; Y55-L62 HydrophobicContact CG-CD2 4.49Å
56	Q	97.5	Very high	97.5	Very high	150 Å²	150	105.6 Å²	105.6	70%	0.701	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-21.8	172.5	-75.4	-179.3	-29.1	0	0	114	I52 R54	I52-Q56 HydrophobicContact CG2-CG 4.38Å; I52-Q56 WeakPolarHBondContact O-CB 3.2Å; I52-Q56 VanDerWaalsContact O-CG 3.31Å; I52-Q56 WeakPolarHBondContact O-CG 3.41Å; I52-Q56 PolarHBondContact O-N 2.98Å; R54-Q56 PolarHBondContact O-N 3.26Å
57	K	98	Very high	97.5	Very high	188 Å²	188	106.3 Å²	106.3	82%	0.817	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-19.3	177.2	-73.8	-180	178.8	-167.3	0	113.3	R53 R54 Y55	R53-K57 VanDerWaalsContact O-CG 3.29Å; R53-K57 WeakPolarHBondContact O-CG 3.39Å; R54-K57 PolarHBondContact O-N 2.9Å; R54-K57 VanDerWaalsContact O-N 3.15Å; Y55-K57 PolarHBondContact O-N 3.03Å
58	S	96.7	Very high	97.6	Very high	41 Å²	41	104.9 Å²	104.9	29%	0.287	50%	0.495	S	S	.	.			trans	-100.5	159.9	-178.3	57.6	0	0	0	0	111.1	R54 Y55	R54-S58 PolarHBondContact O-N 3.24Å; R54-S58 PolarHBondContact O-OG 3.01Å; Y55-S58 WeakPolarHBondContact CA-OG 3.29Å; Y55-S58 PolarHBondContact O-N 3.01Å; Y55-S58 PolarHBondContact O-OG 3.39Å; Y55-S58 VanDerWaalsContact O-OG 3.12Å
59	T	96.8	Very high	97.6	Very high	141 Å²	141	106.2 Å²	106.2	87%	0.865	49%	0.493	S	S	*	.			trans	-120.1	22.3	172.9	62.6	0	0	0	0	111
60	E	96.6	Very high	97.5	Very high	105 Å²	105	109.5 Å²	109.5	49%	0.491	50%	0.499	S	S	.	.			trans	-75.6	139.4	179.1	65.7	-177.4	170.1	0	0	110.4	R54 L62	R54-E60 IonicContact NH2-OE1 3.84Å; E60-L62 HydrophobicContact CG-CD2 4.23Å; E60-L62 PolarHBondContact O-N 3.38Å
61	L	97.2	Very high	97.5	Very high	44 Å²	44	108 Å²	108	23%	0.23	50%	0.499	C	S	.	.			trans	-65.6	128.9	171.7	-67.9	173	0	0	0	110.2	Q94 E95 E98	L61-Q94 HydrophobicContact CD1-CB 4.48Å; L61-Q94 HydrophobicContact CD1-CG 4.1Å; L61-Q94 HydrophobicContact CD2-CG 4.27Å; L61-E95 HydrophobicContact CD2-CG 4.34Å; L61-E98 HydrophobicContact CD2-CB 4.44Å; L61-E98 HydrophobicContact CD2-CG 4.36Å
62	L	97.7	Very high	97.5	Very high	96 Å²	96	104.6 Å²	104.6	50%	0.503	48%	0.484	S	S	.	.			trans	-92.3	-26.9	-173.2	-56.8	-178.1	0	0	0	112.4	Y55 E60 E98	Y55-L62 HydrophobicContact CD1-CD2 3.74Å; Y55-L62 HydrophobicContact CE1-CD2 3.9Å; Y55-L62 HydrophobicContact CG-CD2 4.49Å; E60-L62 HydrophobicContact CG-CD2 4.23Å; E60-L62 PolarHBondContact O-N 3.38Å; L62-E98 PolarHBondContact N-OE1 3.44Å; L62-E98 PolarHBondContact N-OE2 2.99Å
63	I	97.7	Very high	97.5	Very high	62 Å²	62	105 Å²	105	32%	0.318	48%	0.48	S	S	.	.	S	Bend	trans	-80.7	135	176	-55.9	177	0	0	0	109.1	K65 F68 Q94 E98 L101	I63-K65 PolarHBondContact O-N 3.35Å; I63-F68 HydrophobicContact CG2-CB 3.96Å; I63-F68 HydrophobicContact CG2-CD2 4.18Å; I63-F68 HydrophobicContact CG2-CG 4.49Å; I63-Q94 PolarHBondContact O-NE2 3.29Å; I63-E98 HydrophobicContact CB-CG 4.49Å; I63-E98 VanDerWaalsContact CB-OE1 3.3Å; I63-E98 WeakPolarHBondContact CB-OE1 3.07Å; I63-E98 HydrophobicContact CD1-CG 3.74Å; I63-E98 HydrophobicContact CG1-CG 3.93Å; I63-E98 PolarHBondContact N-OE1 2.87Å; I63-L101 HydrophobicContact CD1-CD1 4.39Å
64	R	98.1	Very high	97.4	Very high	203 Å²	203	103.4 Å²	103.4	77%	0.766	48%	0.48	S	S	*	.			trans	-64.3	128.5	177.4	-66.1	-177.9	-179	-176.6	0.8	110.3	L66 P67 F68	R64-L66 PolarHBondContact O-N 3.3Å; R64-P67 HydrophobicContact CB-CG 3.93Å; R64-P67 WeakPolarHBondContact O-CD 3.32Å; R64-F68 PolarHBondContact O-N 3.36Å; R64-F68 VanDerWaalsContact O-N 3.15Å
65	K	96.3	Very high	97.4	Very high	142 Å²	142	100.4 Å²	100.4	62%	0.617	47%	0.474	S	S	*	.	H	α-helix	trans	-53.5	-47.8	-176.1	-66.9	-179.6	-180	-77.3	0	114.1	I63 F68 Q69	I63-K65 PolarHBondContact O-N 3.35Å; K65-F68 PolarHBondContact O-N 3.29Å; K65-Q69 WeakPolarHBondContact O-CB 3.37Å; K65-Q69 PolarHBondContact O-N 2.9Å
66	L	97.1	Very high	97.3	Very high	95 Å²	95	96.6 Å²	96.6	50%	0.497	46%	0.462	S	S	.	.	H	α-helix	trans	-68.1	-48.7	-175.6	176.1	65.8	0	0	0	113.3	R64 F68 Q69 R70	R64-L66 PolarHBondContact O-N 3.3Å; L66-F68 VanDerWaalsContact C-N 3.34Å; L66-F68 PolarHBondContact O-N 3.47Å; L66-Q69 PolarHBondContact O-N 2.98Å; L66-R70 WeakPolarHBondContact O-CG 3.36Å; L66-R70 PolarHBondContact O-N 3.23Å
67	P	98.2	Very high	97.3	Very high	72 Å²	72	94 Å²	94	47%	0.468	45%	0.45	S	S	.	.	H	α-helix	trans	-56.3	-43.8	171.3	-29.3	36.1	0	0	0	113.6	R64 Q69 R70 L71	R64-P67 HydrophobicContact CB-CG 3.93Å; R64-P67 WeakPolarHBondContact O-CD 3.32Å; P67-Q69 PolarHBondContact O-N 2.69Å; P67-R70 PolarHBondContact O-N 2.54Å; P67-L71 PolarHBondContact O-N 3.18Å; P67-L71 VanDerWaalsContact O-N 3.08Å
68	F	98.3	Very high	97.2	Very high	20 Å²	20	91.8 Å²	91.8	9%	0.088	45%	0.447	C	S	.	.	H	α-helix	trans	-61.1	-45.5	177.5	-174.8	-95.2	0	0	0	111.7	I63 R64 K65 L66 R70 L71 V72 V90 L93 Q94 A97	I63-F68 HydrophobicContact CG2-CB 3.96Å; I63-F68 HydrophobicContact CG2-CD2 4.18Å; I63-F68 HydrophobicContact CG2-CG 4.49Å; R64-F68 PolarHBondContact O-N 3.36Å; R64-F68 VanDerWaalsContact O-N 3.15Å; K65-F68 PolarHBondContact O-N 3.29Å; L66-F68 VanDerWaalsContact C-N 3.34Å; L66-F68 PolarHBondContact O-N 3.47Å; F68-R70 VanDerWaalsContact C-N 3.3Å; F68-R70 PolarHBondContact O-N 3.41Å; F68-L71 PolarHBondContact O-N 3.32Å; F68-V72 HydrophobicContact CD1-CG2 3.93Å; F68-V72 HydrophobicContact CE1-CG2 3.48Å; F68-V72 VanDerWaalsContact CE1-CG2 3.48Å; F68-V72 HydrophobicContact CZ-CG2 3.86Å; F68-V72 WeakPolarHBondContact O-CG2 3.05Å; F68-V72 PolarHBondContact O-N 2.7Å; F68-V90 HydrophobicContact CD1-CG1 4.27Å; F68-V90 HydrophobicContact CE1-CG1 4.49Å; F68-L93 HydrophobicContact CE1-CB 4.06Å; F68-L93 HydrophobicContact CZ-CB 4.2Å; F68-Q94 HydrophobicContact CD1-CB 3.71Å; F68-Q94 HydrophobicContact CD1-CG 3.88Å; F68-Q94 HydrophobicContact CD2-CG 4.33Å; F68-Q94 HydrophobicContact CE1-CB 3.46Å; F68-Q94 VanDerWaalsContact CE1-CB 3.46Å; F68-Q94 HydrophobicContact CE1-CG 4Å; F68-Q94 HydrophobicContact CE2-CG 4.43Å; F68-Q94 HydrophobicContact CG-CB 4.39Å; F68-Q94 HydrophobicContact CG-CG 4.07Å; F68-Q94 VanDerWaalsContact CZ-CA 3.4Å; F68-Q94 HydrophobicContact CZ-CB 3.94Å; F68-Q94 HydrophobicContact CZ-CG 4.29Å; F68-A97 HydrophobicContact CE2-CB 3.94Å; F68-A97 HydrophobicContact CZ-CB 4.07Å
69	Q	97	Very high	97.2	Very high	74 Å²	74	98 Å²	98	35%	0.346	47%	0.469	S	S	.	.	H	α-helix	trans	-59.6	-39.1	176	179.8	-177.3	-36.7	0	0	112.6	K65 L66 P67 R73 V90	K65-Q69 WeakPolarHBondContact O-CB 3.37Å; K65-Q69 PolarHBondContact O-N 2.9Å; L66-Q69 PolarHBondContact O-N 2.98Å; P67-Q69 PolarHBondContact O-N 2.69Å; Q69-R73 WeakPolarHBondContact O-CG 3.39Å; Q69-R73 PolarHBondContact O-N 3.03Å; Q69-R73 VanDerWaalsContact O-N 3.14Å; Q69-V90 HydrophobicContact CB-CG1 4.1Å; Q69-V90 HydrophobicContact CG-CG1 4.28Å
70	R	97.6	Very high	97.1	Very high	167 Å²	167	97.9 Å²	97.9	63%	0.63	46%	0.457	S	S	*	.	H	α-helix	trans	-63.5	-46.1	176.7	-72.1	176.5	-178	-176.5	-1.1	111	L66 P67 F68 V72 R73 E74	L66-R70 WeakPolarHBondContact O-CG 3.36Å; L66-R70 PolarHBondContact O-N 3.23Å; P67-R70 PolarHBondContact O-N 2.54Å; F68-R70 VanDerWaalsContact C-N 3.3Å; F68-R70 PolarHBondContact O-N 3.41Å; R70-V72 PolarHBondContact O-N 3.29Å; R70-R73 PolarHBondContact O-N 3.17Å; R70-E74 WeakPolarHBondContact O-CB 3.49Å; R70-E74 PolarHBondContact O-N 2.97Å
71	L	98	Very high	97	Very high	83 Å²	83	96.7 Å²	96.7	44%	0.435	46%	0.457	S	S	.	.	H	α-helix	trans	-60.5	-44.3	176.7	179.1	64	0	0	0	112.3	P67 F68 R73 E74 I75	P67-L71 PolarHBondContact O-N 3.18Å; P67-L71 VanDerWaalsContact O-N 3.08Å; F68-L71 PolarHBondContact O-N 3.32Å; L71-R73 VanDerWaalsContact C-N 3.28Å; L71-R73 PolarHBondContact O-N 2.93Å; L71-E74 WeakPolarHBondContact O-CB 3.33Å; L71-E74 PolarHBondContact O-N 2.97Å; L71-I75 HydrophobicContact CD1-CD1 3.92Å; L71-I75 HydrophobicContact CD1-CG1 4.22Å; L71-I75 HydrophobicContact CG-CD1 3.96Å; L71-I75 WeakPolarHBondContact O-CG1 3.39Å; L71-I75 PolarHBondContact O-N 3.46Å
72	V	97.5	Very high	96.8	Very high	18 Å²	18	101.3 Å²	101.3	11%	0.109	48%	0.482	C	S	.	.	H	α-helix	trans	-58.6	-42.1	176.6	168.4	0	0	0	0	111.2	F68 R70 A76 F85 L93	F68-V72 HydrophobicContact CD1-CG2 3.93Å; F68-V72 HydrophobicContact CE1-CG2 3.48Å; F68-V72 VanDerWaalsContact CE1-CG2 3.48Å; F68-V72 HydrophobicContact CZ-CG2 3.86Å; F68-V72 WeakPolarHBondContact O-CG2 3.05Å; F68-V72 PolarHBondContact O-N 2.7Å; R70-V72 PolarHBondContact O-N 3.29Å; V72-A76 VanDerWaalsContact O-CB 3.24Å; V72-A76 WeakPolarHBondContact O-CB 3.48Å; V72-A76 PolarHBondContact O-N 3.33Å; V72-F85 HydrophobicContact CG1-CD1 4.31Å; V72-F85 HydrophobicContact CG1-CE1 3.84Å; V72-F85 HydrophobicContact CG1-CZ 4.07Å; V72-L93 HydrophobicContact CG1-CD1 3.62Å; V72-L93 HydrophobicContact CG2-CD1 4.2Å
73	R	96.4	Very high	96.7	Very high	95 Å²	95	100 Å²	100	36%	0.358	48%	0.475	S	S	.	.	H	α-helix	trans	-71.3	-38.6	179.2	-71.4	177.2	-179.1	-79.5	0.3	112.5	Q69 R70 L71 A76 Q77 F85	Q69-R73 WeakPolarHBondContact O-CG 3.39Å; Q69-R73 PolarHBondContact O-N 3.03Å; Q69-R73 VanDerWaalsContact O-N 3.14Å; R70-R73 PolarHBondContact O-N 3.17Å; L71-R73 VanDerWaalsContact C-N 3.28Å; L71-R73 PolarHBondContact O-N 2.93Å; R73-A76 PolarHBondContact O-N 3.12Å; R73-Q77 WeakPolarHBondContact O-CB 3.42Å; R73-Q77 PolarHBondContact O-N 3.49Å; R73-F85 HydrophobicContact CG-CD2 4.29Å; R73-F85 HydrophobicContact CG-CE2 4.34Å
74	E	96.8	Very high	96.6	Very high	132 Å²	132	108.6 Å²	108.6	62%	0.617	50%	0.503	S	S	*	.	H	α-helix	trans	-57.6	-54.5	174.4	-176.3	-176.9	152.4	0	0	110.6	R70 L71 A76 Q77	R70-E74 WeakPolarHBondContact O-CB 3.49Å; R70-E74 PolarHBondContact O-N 2.97Å; L71-E74 WeakPolarHBondContact O-CB 3.33Å; L71-E74 PolarHBondContact O-N 2.97Å; E74-A76 VanDerWaalsContact C-N 3.34Å; E74-A76 PolarHBondContact O-N 3.33Å; E74-Q77 WeakPolarHBondContact O-CB 3.41Å; E74-Q77 PolarHBondContact O-N 3.41Å
75	I	97.4	Very high	96.5	Very high	85 Å²	85	101.5 Å²	101.5	44%	0.436	48%	0.478	S	S	.	.	H	α-helix	trans	-61.4	-42.5	178.8	-65.2	169.4	0	0	0	111.3	L71 Q77 D78 F79	L71-I75 HydrophobicContact CD1-CD1 3.92Å; L71-I75 HydrophobicContact CD1-CG1 4.22Å; L71-I75 HydrophobicContact CG-CD1 3.96Å; L71-I75 WeakPolarHBondContact O-CG1 3.39Å; L71-I75 PolarHBondContact O-N 3.46Å; I75-Q77 VanDerWaalsContact C-N 3.28Å; I75-Q77 PolarHBondContact O-N 3.12Å; I75-D78 PolarHBondContact O-N 2.72Å; I75-F79 HydrophobicContact CG2-CE2 3.93Å; I75-F79 WeakPolarHBondContact O-CD2 3.29Å
76	A	97	Very high	96.5	Very high	15 Å²	15	101.8 Å²	101.8	12%	0.124	48%	0.482	C	S	.	.	H	α-helix	trans	-66.6	-31.2	-178.4	0	0	0	0	0	113.3	V72 R73 E74 D78 F79 K80 L83 F85	V72-A76 VanDerWaalsContact O-CB 3.24Å; V72-A76 WeakPolarHBondContact O-CB 3.48Å; V72-A76 PolarHBondContact O-N 3.33Å; R73-A76 PolarHBondContact O-N 3.12Å; E74-A76 VanDerWaalsContact C-N 3.34Å; E74-A76 PolarHBondContact O-N 3.33Å; A76-D78 PolarHBondContact O-N 3.31Å; A76-F79 PolarHBondContact O-N 3.15Å; A76-F79 VanDerWaalsContact O-N 3.15Å; A76-K80 PolarHBondContact O-N 3.32Å; A76-K80 VanDerWaalsContact O-N 3.09Å; A76-L83 HydrophobicContact CB-CD1 4.07Å; A76-F85 HydrophobicContact CB-CE2 3.9Å; A76-F85 HydrophobicContact CB-CZ 3.49Å; A76-F85 VanDerWaalsContact CB-CZ 3.49Å
77	Q	96.1	Very high	96.4	Very high	97 Å²	97	102.6 Å²	102.6	45%	0.453	50%	0.495	S	S	.	.	H	α-helix	trans	-61.4	-32.9	178.3	-169.1	75.2	17.5	0	0	111.6	R73 E74 I75 F79	R73-Q77 WeakPolarHBondContact O-CB 3.42Å; R73-Q77 PolarHBondContact O-N 3.49Å; E74-Q77 WeakPolarHBondContact O-CB 3.41Å; E74-Q77 PolarHBondContact O-N 3.41Å; I75-Q77 VanDerWaalsContact C-N 3.28Å; I75-Q77 PolarHBondContact O-N 3.12Å; Q77-F79 PolarHBondContact O-N 3.45Å
78	D	96.6	Very high	96.4	Very high	140 Å²	140	102.3 Å²	102.3	75%	0.749	50%	0.499	S	S	*	.	H	α-helix	trans	-67	-24	178.2	-65.2	-22.5	0	0	0	113	I75 A76	I75-D78 PolarHBondContact O-N 2.72Å; A76-D78 PolarHBondContact O-N 3.31Å
79	F	96.1	Very high	96.3	Very high	173 Å²	173	103.1 Å²	103.1	76%	0.759	51%	0.509	S	S	*	.	H	α-helix	trans	-94.8	-41.2	178.9	-63.7	-83.3	0	0	0	112.6	I75 A76 Q77	I75-F79 HydrophobicContact CG2-CE2 3.93Å; I75-F79 WeakPolarHBondContact O-CD2 3.29Å; A76-F79 PolarHBondContact O-N 3.15Å; A76-F79 VanDerWaalsContact O-N 3.15Å; Q77-F79 PolarHBondContact O-N 3.45Å
80	K	95.7	Very high	96.3	Very high	137 Å²	137	100.2 Å²	100.2	60%	0.596	50%	0.497	S	S	*	.			trans	-156.4	124.7	179.6	-176.2	172.7	175.8	92.7	0	110.2	A76 L83	A76-K80 PolarHBondContact O-N 3.32Å; A76-K80 VanDerWaalsContact O-N 3.09Å; K80-L83 HydrophobicContact CB-CD1 4.02Å; K80-L83 HydrophobicContact CB-CD2 4.41Å; K80-L83 HydrophobicContact CB-CG 4.11Å; K80-L83 HydrophobicContact CD-CD2 3.9Å; K80-L83 HydrophobicContact CD-CG 4.46Å; K80-L83 HydrophobicContact CG-CD2 4.2Å; K80-L83 HydrophobicContact CG-CG 4.23Å; K80-L83 WeakPolarHBondContact O-CG 3.44Å
81	T	94.3	Very high	96.3	Very high	81 Å²	81	93.6 Å²	93.6	50%	0.497	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	155.7	174.5	65.9	0	0	0	0	111.2	L83	T81-L83 VanDerWaalsContact C-N 3.34Å; T81-L83 PolarHBondContact O-N 3.34Å
82	D	92.8	Very high	96.3	Very high	140 Å²	140	92.5 Å²	92.5	75%	0.749	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.7	28.1	171.8	-50	-55.4	0	0	0	115.7
83	L	94.9	Very high	96.4	Very high	69 Å²	69	95.5 Å²	95.5	36%	0.361	50%	0.498	S	S	.	.			trans	-72.4	133.5	173.8	-72.9	177.4	0	0	0	112.8	A76 K80 T81 F85	A76-L83 HydrophobicContact CB-CD1 4.07Å; K80-L83 HydrophobicContact CB-CD1 4.02Å; K80-L83 HydrophobicContact CB-CD2 4.41Å; K80-L83 HydrophobicContact CB-CG 4.11Å; K80-L83 HydrophobicContact CD-CD2 3.9Å; K80-L83 HydrophobicContact CD-CG 4.46Å; K80-L83 HydrophobicContact CG-CD2 4.2Å; K80-L83 HydrophobicContact CG-CG 4.23Å; K80-L83 WeakPolarHBondContact O-CG 3.44Å; T81-L83 VanDerWaalsContact C-N 3.34Å; T81-L83 PolarHBondContact O-N 3.34Å; L83-F85 HydrophobicContact CB-CE2 4.06Å
84	R	95.7	Very high	96.4	Very high	242 Å²	242	91.1 Å²	91.1	91%	0.913	48%	0.482	S	S	*	.			trans	-102.2	135.4	168.8	-61.3	-178.3	78.2	-170.5	4.9	109.4
85	F	96.2	Very high	96.5	Very high	55 Å²	55	90 Å²	90	24%	0.241	48%	0.477	C	S	.	.			trans	-108	133.7	177.9	-73.2	-95.3	0	0	0	110.1	V72 R73 A76 L83 V90	V72-F85 HydrophobicContact CG1-CD1 4.31Å; V72-F85 HydrophobicContact CG1-CE1 3.84Å; V72-F85 HydrophobicContact CG1-CZ 4.07Å; R73-F85 HydrophobicContact CG-CD2 4.29Å; R73-F85 HydrophobicContact CG-CE2 4.34Å; A76-F85 HydrophobicContact CB-CE2 3.9Å; A76-F85 HydrophobicContact CB-CZ 3.49Å; A76-F85 VanDerWaalsContact CB-CZ 3.49Å; L83-F85 HydrophobicContact CB-CE2 4.06Å; F85-V90 HydrophobicContact CB-CG2 3.81Å; F85-V90 HydrophobicContact CD1-CG2 4.26Å; F85-V90 HydrophobicContact CG-CG2 4.25Å
86	Q	97.3	Very high	96.5	Very high	147 Å²	147	89 Å²	89	69%	0.687	48%	0.481	S	S	*	.			trans	-65	149.3	161.6	-67.8	-179.8	-20	0	0	109.5	A88 A89 V90	Q86-A88 VanDerWaalsContact C-N 3.28Å; Q86-A88 PolarHBondContact O-N 2.79Å; Q86-A89 HydrophobicContact CB-CB 4.14Å; Q86-A89 WeakPolarHBondContact O-CB 3.33Å; Q86-A89 PolarHBondContact O-N 3.31Å; Q86-V90 PolarHBondContact O-N 2.92Å
87	S	95.1	Very high	96.6	Very high	113 Å²	113	89.8 Å²	89.8	79%	0.79	49%	0.487	S	S	*	.	H	α-helix	trans	-60.1	-40.8	175	53.8	0	0	0	0	111.8	A89 V90 G91	S87-A89 VanDerWaalsContact C-N 3.32Å; S87-A89 PolarHBondContact O-N 3.33Å; S87-V90 PolarHBondContact O-N 3.45Å; S87-G91 PolarHBondContact O-N 3.15Å; S87-G91 VanDerWaalsContact O-N 3.07Å
88	A	97.3	Very high	96.7	Very high	66 Å²	66	86 Å²	86	55%	0.545	47%	0.47	S	S	.	.	H	α-helix	trans	-62.7	-35.6	176.2	0	0	0	0	0	112.7	Q86 G91 A92	Q86-A88 VanDerWaalsContact C-N 3.28Å; Q86-A88 PolarHBondContact O-N 2.79Å; A88-G91 PolarHBondContact O-N 3.04Å; A88-A92 WeakPolarHBondContact O-CB 3.44Å; A88-A92 PolarHBondContact O-N 2.85Å
89	A	97.5	Very high	96.8	Very high	36 Å²	36	82.4 Å²	82.4	30%	0.298	46%	0.46	S	S	.	.	H	α-helix	trans	-64.5	-43.8	178	0	0	0	0	0	111.7	Q86 S87 G91 A92 L93	Q86-A89 HydrophobicContact CB-CB 4.14Å; Q86-A89 WeakPolarHBondContact O-CB 3.33Å; Q86-A89 PolarHBondContact O-N 3.31Å; S87-A89 VanDerWaalsContact C-N 3.32Å; S87-A89 PolarHBondContact O-N 3.33Å; A89-G91 VanDerWaalsContact C-N 3.32Å; A89-G91 PolarHBondContact O-N 3.34Å; A89-A92 PolarHBondContact O-N 3.48Å; A89-L93 WeakPolarHBondContact O-CG 3.44Å; A89-L93 PolarHBondContact O-N 3.23Å
90	V	96.9	Very high	96.8	Very high	14 Å²	14	78.8 Å²	78.8	9%	0.085	44%	0.441	C	S	.	.	H	α-helix	trans	-65.9	-38.2	175.1	-175	0	0	0	0	111	F68 Q69 F85 Q86 S87 L93 Q94	F68-V90 HydrophobicContact CD1-CG1 4.27Å; F68-V90 HydrophobicContact CE1-CG1 4.49Å; Q69-V90 HydrophobicContact CB-CG1 4.1Å; Q69-V90 HydrophobicContact CG-CG1 4.28Å; F85-V90 HydrophobicContact CB-CG2 3.81Å; F85-V90 HydrophobicContact CD1-CG2 4.26Å; F85-V90 HydrophobicContact CG-CG2 4.25Å; Q86-V90 PolarHBondContact O-N 2.92Å; S87-V90 PolarHBondContact O-N 3.45Å; V90-L93 PolarHBondContact O-N 3.35Å; V90-Q94 PolarHBondContact O-N 3.48Å
91	G	97.4	Very high	96.9	Very high	27 Å²	27	75.5 Å²	75.5	28%	0.278	43%	0.43	S	S	.	.	H	α-helix	trans	-60.1	-47.2	174	0	0	0	0	0	112.8	S87 A88 A89 L93 Q94 E95	S87-G91 PolarHBondContact O-N 3.15Å; S87-G91 VanDerWaalsContact O-N 3.07Å; A88-G91 PolarHBondContact O-N 3.04Å; A89-G91 VanDerWaalsContact C-N 3.32Å; A89-G91 PolarHBondContact O-N 3.34Å; G91-L93 PolarHBondContact O-N 3.46Å; G91-Q94 WeakPolarHBondContact O-CB 3.31Å; G91-Q94 PolarHBondContact O-N 2.95Å; G91-Q94 VanDerWaalsContact O-N 3.13Å; G91-E95 WeakPolarHBondContact O-CG 3.49Å; G91-E95 PolarHBondContact O-N 2.94Å
92	A	98.1	Very high	97.1	Very high	61 Å²	61	75.1 Å²	75.1	50%	0.504	43%	0.427	S	S	.	.	H	α-helix	trans	-62.5	-41.7	178.4	0	0	0	0	0	112.4	A88 A89 Q94 A96	A88-A92 WeakPolarHBondContact O-CB 3.44Å; A88-A92 PolarHBondContact O-N 2.85Å; A89-A92 PolarHBondContact O-N 3.48Å; A92-Q94 VanDerWaalsContact C-N 3.28Å; A92-Q94 PolarHBondContact O-N 2.95Å; A92-A96 WeakPolarHBondContact O-CB 3.36Å; A92-A96 PolarHBondContact O-N 3.44Å
93	L	98.1	Very high	97.3	Very high	80 Å²	80	69.2 Å²	69.2	42%	0.419	40%	0.4	S	S	.	.	H	α-helix	trans	-61.3	-38.9	173.7	-71.7	171.5	0	0	0	111.8	F68 V72 A89 V90 G91 A97	F68-L93 HydrophobicContact CE1-CB 4.06Å; F68-L93 HydrophobicContact CZ-CB 4.2Å; V72-L93 HydrophobicContact CG1-CD1 3.62Å; V72-L93 HydrophobicContact CG2-CD1 4.2Å; A89-L93 WeakPolarHBondContact O-CG 3.44Å; A89-L93 PolarHBondContact O-N 3.23Å; V90-L93 PolarHBondContact O-N 3.35Å; G91-L93 PolarHBondContact O-N 3.46Å; L93-A97 WeakPolarHBondContact O-CB 3.3Å; L93-A97 PolarHBondContact O-N 3.08Å
94	Q	98.1	Very high	97.4	Very high	4 Å²	4	66.6 Å²	66.6	2%	0.019	39%	0.386	C	S	.	.	H	α-helix	trans	-68.2	-49	179.7	-167.2	175.4	-15.4	0	0	111.9	L61 I63 F68 V90 G91 A92 A96 A97 E98	L61-Q94 HydrophobicContact CD1-CB 4.48Å; L61-Q94 HydrophobicContact CD1-CG 4.1Å; L61-Q94 HydrophobicContact CD2-CG 4.27Å; I63-Q94 PolarHBondContact O-NE2 3.29Å; F68-Q94 HydrophobicContact CD1-CB 3.71Å; F68-Q94 HydrophobicContact CD1-CG 3.88Å; F68-Q94 HydrophobicContact CD2-CG 4.33Å; F68-Q94 HydrophobicContact CE1-CB 3.46Å; F68-Q94 VanDerWaalsContact CE1-CB 3.46Å; F68-Q94 HydrophobicContact CE1-CG 4Å; F68-Q94 HydrophobicContact CE2-CG 4.43Å; F68-Q94 HydrophobicContact CG-CB 4.39Å; F68-Q94 HydrophobicContact CG-CG 4.07Å; F68-Q94 VanDerWaalsContact CZ-CA 3.4Å; F68-Q94 HydrophobicContact CZ-CB 3.94Å; F68-Q94 HydrophobicContact CZ-CG 4.29Å; V90-Q94 PolarHBondContact O-N 3.48Å; G91-Q94 WeakPolarHBondContact O-CB 3.31Å; G91-Q94 PolarHBondContact O-N 2.95Å; G91-Q94 VanDerWaalsContact O-N 3.13Å; A92-Q94 VanDerWaalsContact C-N 3.28Å; A92-Q94 PolarHBondContact O-N 2.95Å; Q94-A96 VanDerWaalsContact C-N 3.33Å; Q94-A96 PolarHBondContact O-N 3.01Å; Q94-A97 PolarHBondContact O-N 2.89Å; Q94-E98 HydrophobicContact CG-CG 4.49Å; Q94-E98 PolarHBondContact NE2-OE1 3.02Å; Q94-E98 WeakPolarHBondContact O-CG 3.41Å; Q94-E98 PolarHBondContact O-N 3.22Å
95	E	98	Very high	97.5	Very high	108 Å²	108	60 Å²	60	51%	0.505	36%	0.364	S	S	.	.	H	α-helix	trans	-55.5	-48.7	176.2	-69.5	-71	169	0	0	111.1	L61 G91 A99	L61-E95 HydrophobicContact CD2-CG 4.34Å; G91-E95 WeakPolarHBondContact O-CG 3.49Å; G91-E95 PolarHBondContact O-N 2.94Å; E95-A99 VanDerWaalsContact O-CB 3.3Å; E95-A99 WeakPolarHBondContact O-CB 3.5Å; E95-A99 PolarHBondContact O-N 3.17Å
96	A	98.1	Very high	97.6	Very high	63 Å²	63	62.9 Å²	62.9	52%	0.521	38%	0.379	S	S	.	.	H	α-helix	trans	-64.3	-42.8	179.8	0	0	0	0	0	112.7	A92 Q94 Y100	A92-A96 WeakPolarHBondContact O-CB 3.36Å; A92-A96 PolarHBondContact O-N 3.44Å; Q94-A96 VanDerWaalsContact C-N 3.33Å; Q94-A96 PolarHBondContact O-N 3.01Å; A96-Y100 WeakPolarHBondContact O-CB 3.42Å; A96-Y100 PolarHBondContact O-N 2.94Å
97	A	98.2	Very high	97.6	Very high	32 Å²	32	58.4 Å²	58.4	26%	0.264	36%	0.359	S	S	.	.	H	α-helix	trans	-65.6	-44.3	179.9	0	0	0	0	0	112	F68 L93 Q94 Y100 L101	F68-A97 HydrophobicContact CE2-CB 3.94Å; F68-A97 HydrophobicContact CZ-CB 4.07Å; L93-A97 WeakPolarHBondContact O-CB 3.3Å; L93-A97 PolarHBondContact O-N 3.08Å; Q94-A97 PolarHBondContact O-N 2.89Å; A97-Y100 PolarHBondContact O-N 3.44Å; A97-L101 VanDerWaalsContact O-CG 3.32Å; A97-L101 WeakPolarHBondContact O-CG 3.47Å; A97-L101 PolarHBondContact O-N 3.36Å
98	E	98.3	Very high	97.8	Very high	18 Å²	18	53 Å²	53	8%	0.084	32%	0.322	C	S	.	.	H	α-helix	trans	-67.1	-42.9	178.2	-69.8	-165.3	-147.4	0	0	111.6	L61 L62 I63 Q94 Y100 L101 V102	L61-E98 HydrophobicContact CD2-CB 4.44Å; L61-E98 HydrophobicContact CD2-CG 4.36Å; L62-E98 PolarHBondContact N-OE1 3.44Å; L62-E98 PolarHBondContact N-OE2 2.99Å; I63-E98 HydrophobicContact CB-CG 4.49Å; I63-E98 VanDerWaalsContact CB-OE1 3.3Å; I63-E98 WeakPolarHBondContact CB-OE1 3.07Å; I63-E98 HydrophobicContact CD1-CG 3.74Å; I63-E98 HydrophobicContact CG1-CG 3.93Å; I63-E98 PolarHBondContact N-OE1 2.87Å; Q94-E98 HydrophobicContact CG-CG 4.49Å; Q94-E98 PolarHBondContact NE2-OE1 3.02Å; Q94-E98 WeakPolarHBondContact O-CG 3.41Å; Q94-E98 PolarHBondContact O-N 3.22Å; E98-Y100 VanDerWaalsContact C-N 3.34Å; E98-Y100 PolarHBondContact O-N 3.29Å; E98-L101 PolarHBondContact O-N 3.49Å; E98-V102 VanDerWaalsContact O-CG2 3.29Å; E98-V102 WeakPolarHBondContact O-CG2 3.26Å; E98-V102 PolarHBondContact O-N 3.49Å
99	A	97.9	Very high	97.8	Very high	65 Å²	65	53.2 Å²	53.2	54%	0.537	31%	0.314	S	S	.	.	H	α-helix	trans	-59	-44.2	175	0	0	0	0	0	112.2	E95 V102 G103	E95-A99 VanDerWaalsContact O-CB 3.3Å; E95-A99 WeakPolarHBondContact O-CB 3.5Å; E95-A99 PolarHBondContact O-N 3.17Å; A99-V102 PolarHBondContact O-N 3.11Å; A99-G103 PolarHBondContact O-N 2.89Å
100	Y	97.5	Very high	97.9	Very high	96 Å²	96	56.6 Å²	56.6	38%	0.376	33%	0.326	S	S	.	.	H	α-helix	trans	-60.5	-47.1	175.9	170.4	-96.4	0	0	0	112	A96 A97 E98 G103 L104 E134	A96-Y100 WeakPolarHBondContact O-CB 3.42Å; A96-Y100 PolarHBondContact O-N 2.94Å; A97-Y100 PolarHBondContact O-N 3.44Å; E98-Y100 VanDerWaalsContact C-N 3.34Å; E98-Y100 PolarHBondContact O-N 3.29Å; Y100-G103 PolarHBondContact O-N 2.88Å; Y100-L104 HydrophobicContact CE1-CD2 4.16Å; Y100-L104 WeakPolarHBondContact O-CB 3.35Å; Y100-L104 PolarHBondContact O-N 2.67Å; Y100-E134 WeakPolarHBondContact CE2-OE1 3.49Å; Y100-E134 PolarHBondContact OH-OE2 3.01Å
101	L	97.7	Very high	97.9	Very high	68 Å²	68	56.7 Å²	56.7	36%	0.356	33%	0.327	S	S	.	.	H	α-helix	trans	-64.8	-41.7	179.8	-72.1	175.1	0	0	0	112.1	I63 A97 E98 L104 F105	I63-L101 HydrophobicContact CD1-CD1 4.39Å; A97-L101 VanDerWaalsContact O-CG 3.32Å; A97-L101 WeakPolarHBondContact O-CG 3.47Å; A97-L101 PolarHBondContact O-N 3.36Å; E98-L101 PolarHBondContact O-N 3.49Å; L101-L104 PolarHBondContact O-N 2.92Å; L101-F105 HydrophobicContact CB-CE2 4.48Å; L101-F105 WeakPolarHBondContact O-CD2 3.39Å; L101-F105 PolarHBondContact O-N 3.35Å
102	V	97.7	Very high	97.9	Very high	73 Å²	73	55.4 Å²	55.4	44%	0.442	31%	0.314	S	S	.	.	H	α-helix	trans	-59.2	-51.1	175.9	171.1	0	0	0	0	110.2	E98 A99 L104 F105 E106	E98-V102 VanDerWaalsContact O-CG2 3.29Å; E98-V102 WeakPolarHBondContact O-CG2 3.26Å; E98-V102 PolarHBondContact O-N 3.49Å; A99-V102 PolarHBondContact O-N 3.11Å; V102-L104 VanDerWaalsContact C-N 3.31Å; V102-L104 PolarHBondContact O-N 2.91Å; V102-F105 PolarHBondContact O-N 3.33Å; V102-F105 VanDerWaalsContact O-N 3.11Å; V102-E106 WeakPolarHBondContact O-CG 3.3Å; V102-E106 PolarHBondContact O-N 3.01Å
103	G	97.1	Very high	97.9	Very high	17 Å²	17	57.2 Å²	57.2	18%	0.175	31%	0.314	C	S	.	.	H	α-helix	trans	-60.4	-39.8	177.2	0	0	0	0	0	112.6	A99 Y100 F105 E106 D107 R132	A99-G103 PolarHBondContact O-N 2.89Å; Y100-G103 PolarHBondContact O-N 2.88Å; G103-F105 VanDerWaalsContact C-N 3.33Å; G103-F105 PolarHBondContact O-N 3.24Å; G103-E106 WeakPolarHBondContact O-CB 3.44Å; G103-E106 PolarHBondContact O-N 3.42Å; G103-D107 PolarHBondContact O-N 3.24Å; G103-R132 PolarHBondContact O-NH2 3.5Å
104	L	97.5	Very high	97.9	Very high	14 Å²	14	61.2 Å²	61.2	7%	0.073	33%	0.33	C	S	.	.	H	α-helix	trans	-64	-37.8	176	179.4	61.4	0	0	0	112	Y100 L101 V102 D107 T108 I125 A128 R129	Y100-L104 HydrophobicContact CE1-CD2 4.16Å; Y100-L104 WeakPolarHBondContact O-CB 3.35Å; Y100-L104 PolarHBondContact O-N 2.67Å; L101-L104 PolarHBondContact O-N 2.92Å; V102-L104 VanDerWaalsContact C-N 3.31Å; V102-L104 PolarHBondContact O-N 2.91Å; L104-D107 PolarHBondContact O-N 3.33Å; L104-T108 VanDerWaalsContact O-CB 3.28Å; L104-T108 WeakPolarHBondContact O-CB 3.43Å; L104-T108 PolarHBondContact O-N 3.19Å; L104-T108 PolarHBondContact O-OG1 3.38Å; L104-I125 HydrophobicContact CD2-CG2 4.15Å; L104-A128 HydrophobicContact CD1-CB 4.1Å; L104-R129 HydrophobicContact CD1-CG 3.77Å; L104-R129 HydrophobicContact CD2-CG 4.42Å
105	F	98.2	Very high	97.9	Very high	103 Å²	103	63.3 Å²	63.3	45%	0.452	35%	0.348	S	S	.	.	H	α-helix	trans	-69.7	-31.7	176	-80.1	-58.2	0	0	0	112.9	L101 V102 G103 T108 N109 I120	L101-F105 HydrophobicContact CB-CE2 4.48Å; L101-F105 WeakPolarHBondContact O-CD2 3.39Å; L101-F105 PolarHBondContact O-N 3.35Å; V102-F105 PolarHBondContact O-N 3.33Å; V102-F105 VanDerWaalsContact O-N 3.11Å; G103-F105 VanDerWaalsContact C-N 3.33Å; G103-F105 PolarHBondContact O-N 3.24Å; F105-T108 PolarHBondContact O-N 3.43Å; F105-N109 VanDerWaalsContact O-CB 3.26Å; F105-N109 WeakPolarHBondContact O-CB 3.28Å; F105-N109 PolarHBondContact O-N 2.98Å; F105-I120 HydrophobicContact CD1-CD1 3.83Å; F105-I120 HydrophobicContact CE1-CD1 3.87Å
106	E	97.8	Very high	97.9	Very high	115 Å²	115	67.8 Å²	67.8	54%	0.537	37%	0.366	S	S	.	.	H	α-helix	trans	-61.1	-51	172	-70.3	176.6	175.9	0	0	110.9	V102 G103 T108 N109 L110	V102-E106 WeakPolarHBondContact O-CG 3.3Å; V102-E106 PolarHBondContact O-N 3.01Å; G103-E106 WeakPolarHBondContact O-CB 3.44Å; G103-E106 PolarHBondContact O-N 3.42Å; E106-T108 VanDerWaalsContact C-N 3.35Å; E106-T108 PolarHBondContact O-N 3.36Å; E106-N109 WeakPolarHBondContact O-CB 3.45Å; E106-N109 PolarHBondContact O-N 2.9Å; E106-N109 VanDerWaalsContact O-N 3.17Å; E106-L110 WeakPolarHBondContact O-CG 3.38Å; E106-L110 PolarHBondContact O-N 3.02Å
107	D	97.9	Very high	97.9	Very high	53 Å²	53	67 Å²	67	28%	0.283	35%	0.35	S	S	.	.	H	α-helix	trans	-64.2	-40	177.3	-69.6	-16.5	0	0	0	112.4	G103 L104 N109 L110 C111 A128 R132	G103-D107 PolarHBondContact O-N 3.24Å; L104-D107 PolarHBondContact O-N 3.33Å; D107-N109 VanDerWaalsContact C-N 3.28Å; D107-N109 PolarHBondContact O-N 2.89Å; D107-L110 WeakPolarHBondContact O-CB 3.28Å; D107-L110 PolarHBondContact O-N 2.96Å; D107-C111 PolarHBondContact O-N 3.49Å; D107-C111 PolarHBondContact O-SG 3.06Å; D107-A128 HydrophobicContact CB-CB 3.84Å; D107-R132 IonicContact OD2-CZ 3.11Å; D107-R132 IonicContact OD2-NE 2.69Å; D107-R132 PolarHBondContact OD2-NE 3.12Å; D107-R132 IonicContact OD2-NH2 2.7Å; D107-R132 PolarHBondContact OD2-NH2 3.26Å
108	T	98.3	Very high	97.9	Very high	0 Å²	0	72 Å²	72	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-60.8	-40.8	175.3	-61.2	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 3.43Å; L104-T108 PolarHBondContact O-N 3.19Å; L104-T108 PolarHBondContact O-OG1 3.38Å; F105-T108 PolarHBondContact O-N 3.43Å; E106-T108 VanDerWaalsContact C-N 3.35Å; E106-T108 PolarHBondContact O-N 3.36Å; T108-C111 WeakPolarHBondContact O-CB 3.43Å; T108-C111 PolarHBondContact O-N 3.29Å; T108-A112 PolarHBondContact O-N 3.09Å; T108-I120 HydrophobicContact CG2-CB 3.88Å; T108-I120 HydrophobicContact CG2-CG2 3.87Å; T108-D124 HydrophobicContact CG2-CB 3.64Å; T108-I125 HydrophobicContact CG2-CB 4.5Å; T108-I125 HydrophobicContact CG2-CG1 3.53Å
109	N	98.1	Very high	97.9	Very high	70 Å²	70	75.5 Å²	75.5	37%	0.374	40%	0.399	S	S	.	.	H	α-helix	trans	-65.5	-41.5	176.8	-176.3	52	0	0	0	111.3	F105 E106 D107 C111 A112 I113	F105-N109 VanDerWaalsContact O-CB 3.26Å; F105-N109 WeakPolarHBondContact O-CB 3.28Å; F105-N109 PolarHBondContact O-N 2.98Å; E106-N109 WeakPolarHBondContact O-CB 3.45Å; E106-N109 PolarHBondContact O-N 2.9Å; E106-N109 VanDerWaalsContact O-N 3.17Å; D107-N109 VanDerWaalsContact C-N 3.28Å; D107-N109 PolarHBondContact O-N 2.89Å; N109-C111 VanDerWaalsContact C-N 3.32Å; N109-C111 PolarHBondContact O-N 2.88Å; N109-A112 PolarHBondContact O-N 3.25Å; N109-I113 VanDerWaalsContact O-CG1 3.32Å; N109-I113 WeakPolarHBondContact O-CG1 3.46Å; N109-I113 PolarHBondContact O-N 3.32Å
110	L	98.1	Very high	97.9	Very high	108 Å²	108	75.8 Å²	75.8	57%	0.565	39%	0.391	S	S	*	.	H	α-helix	trans	-60	-41.7	172.9	-65.3	177.1	0	0	0	111.8	E106 D107 A112 I113 H114	E106-L110 WeakPolarHBondContact O-CG 3.38Å; E106-L110 PolarHBondContact O-N 3.02Å; D107-L110 WeakPolarHBondContact O-CB 3.28Å; D107-L110 PolarHBondContact O-N 2.96Å; L110-A112 PolarHBondContact O-N 3.45Å; L110-I113 PolarHBondContact O-N 3.22Å; L110-H114 WeakPolarHBondContact O-CB 3.17Å; L110-H114 PolarHBondContact O-N 2.97Å
111	C	97.9	Very high	97.9	Very high	16 Å²	16	74.7 Å²	74.7	11%	0.108	39%	0.39	C	S	.	.	H	α-helix	trans	-62.9	-40.1	175.3	-67.8	0	0	0	0	112.5	D107 T108 N109 H114 A115 D124 L127	D107-C111 PolarHBondContact O-N 3.49Å; D107-C111 PolarHBondContact O-SG 3.06Å; T108-C111 WeakPolarHBondContact O-CB 3.43Å; T108-C111 PolarHBondContact O-N 3.29Å; N109-C111 VanDerWaalsContact C-N 3.32Å; N109-C111 PolarHBondContact O-N 2.88Å; C111-H114 PolarHBondContact O-N 2.96Å; C111-A115 PolarHBondContact O-N 3.48Å; C111-D124 HydrophobicContact CB-CB 3.95Å; C111-L127 HydrophobicContact CB-CD2 4.21Å
112	A	98.3	Very high	97.9	Very high	0 Å²	0	76 Å²	76	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-65	-45	176	0	0	0	0	0	111.8	T108 N109 L110 H114 A115 K116 R117 I120	T108-A112 PolarHBondContact O-N 3.09Å; N109-A112 PolarHBondContact O-N 3.25Å; L110-A112 PolarHBondContact O-N 3.45Å; A112-H114 VanDerWaalsContact C-N 3.35Å; A112-A115 CarbonylContact O-C 3.26Å; A112-A115 PolarHBondContact O-N 2.74Å; A112-A115 VanDerWaalsContact O-N 3.16Å; A112-K116 PolarHBondContact O-N 3.16Å; A112-R117 CarbonylContact C-O 3.46Å; A112-R117 VanDerWaalsContact C-O 3.26Å; A112-R117 PolarHBondContact O-N 3.2Å; A112-R117 VanDerWaalsContact O-O 3.07Å; A112-I120 HydrophobicContact CB-CG2 4.06Å
113	I	98.2	Very high	97.9	Very high	99 Å²	99	78 Å²	78	51%	0.508	41%	0.405	S	S	.	.	H	α-helix	trans	-62.3	-43.1	177.1	-68.8	167.2	0	0	0	110.6	N109 L110 A115 K116 R117	N109-I113 VanDerWaalsContact O-CG1 3.32Å; N109-I113 WeakPolarHBondContact O-CG1 3.46Å; N109-I113 PolarHBondContact O-N 3.32Å; L110-I113 PolarHBondContact O-N 3.22Å; I113-A115 PolarHBondContact O-N 2.69Å; I113-K116 WeakPolarHBondContact O-CA 3.32Å; I113-K116 PolarHBondContact O-N 2.9Å; I113-R117 PolarHBondContact N-O 3.48Å
114	H	97.8	Very high	97.9	Very high	163 Å²	163	77.4 Å²	77.4	76%	0.755	40%	0.398	S	S	*	.	H	α-helix	trans	-56.3	-37.7	175.9	-177.7	75.6	0	0	0	111.8	L110 C111 A112 K116	L110-H114 WeakPolarHBondContact O-CB 3.17Å; L110-H114 PolarHBondContact O-N 2.97Å; C111-H114 PolarHBondContact O-N 2.96Å; A112-H114 VanDerWaalsContact C-N 3.35Å; H114-K116 PolarHBondContact O-N 3.42Å
115	A	97.9	Very high	97.9	Very high	48 Å²	48	79.2 Å²	79.2	40%	0.397	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	18.8	175.3	0	0	0	0	0	114.4	C111 A112 I113 R117	C111-A115 PolarHBondContact O-N 3.48Å; A112-A115 CarbonylContact O-C 3.26Å; A112-A115 PolarHBondContact O-N 2.74Å; A112-A115 VanDerWaalsContact O-N 3.16Å; I113-A115 PolarHBondContact O-N 2.69Å; A115-R117 VanDerWaalsContact C-N 3.26Å; A115-R117 PolarHBondContact O-N 3.49Å
116	K	98.1	Very high	97.8	Very high	203 Å²	203	79 Å²	79	88%	0.883	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	32.2	-179.5	-56	-179.9	-178.4	177.9	0	114.2	A112 I113 H114	A112-K116 PolarHBondContact O-N 3.16Å; I113-K116 WeakPolarHBondContact O-CA 3.32Å; I113-K116 PolarHBondContact O-N 2.9Å; H114-K116 PolarHBondContact O-N 3.42Å
117	R	98.1	Very high	97.7	Very high	47 Å²	47	77 Å²	77	18%	0.177	40%	0.401	C	S	.	.			trans	-118.2	155.4	175.8	-71.5	176.4	-71.1	106.8	-1.9	110.7	A112 I113 A115 T119 D124	A112-R117 CarbonylContact C-O 3.46Å; A112-R117 VanDerWaalsContact C-O 3.26Å; A112-R117 PolarHBondContact O-N 3.2Å; A112-R117 VanDerWaalsContact O-O 3.07Å; I113-R117 PolarHBondContact N-O 3.48Å; A115-R117 VanDerWaalsContact C-N 3.26Å; A115-R117 PolarHBondContact O-N 3.49Å; R117-T119 PolarHBondContact NH1-O 3.35Å; R117-D124 IonicContact CZ-OD1 3.55Å; R117-D124 IonicContact CZ-OD2 3.58Å; R117-D124 IonicContact NH1-OD1 3.49Å; R117-D124 PolarHBondContact NH1-OD1 3.18Å; R117-D124 IonicContact NH1-OD2 2.74Å; R117-D124 PolarHBondContact NH1-OD2 3.39Å; R117-D124 IonicContact NH2-OD1 2.69Å; R117-D124 PolarHBondContact NH2-OD1 2.91Å; R117-D124 IonicContact NH2-OD2 3.48Å; R117-D124 PolarHBondContact NH2-OD2 3.05Å
118	V	97	Very high	97.7	Very high	135 Å²	135	74.6 Å²	74.6	82%	0.818	39%	0.388	S	S	*	.	S	Bend	trans	-105.4	-13.3	170.8	-63.2	0	0	0	0	112.7
119	T	98.2	Very high	97.6	Very high	93 Å²	93	79.4 Å²	79.4	57%	0.571	41%	0.406	S	S	*	.	S	Bend	trans	-99.5	120	178.5	-51.6	0	0	0	0	109	R117	R117-T119 PolarHBondContact NH1-O 3.35Å
120	I	97.9	Very high	97.5	Very high	70 Å²	70	84.6 Å²	84.6	36%	0.359	42%	0.421	S	S	.	.			trans	-67.3	144	172.7	60.4	172.2	0	0	0	110.8	F105 T108 A112	F105-I120 HydrophobicContact CD1-CD1 3.83Å; F105-I120 HydrophobicContact CE1-CD1 3.87Å; T108-I120 HydrophobicContact CG2-CB 3.88Å; T108-I120 HydrophobicContact CG2-CG2 3.87Å; A112-I120 HydrophobicContact CB-CG2 4.06Å
121	M	98.3	Very high	97.3	Very high	74 Å²	74	85.6 Å²	85.6	37%	0.365	43%	0.425	S	S	.	.			trans	-131.5	159	-179.3	-65.3	179.3	177.1	0	0	110	K123 D124 I125	M121-K123 HydrophobicContact CB-CG 3.98Å; M121-K123 PolarHBondContact O-N 3.32Å; M121-K123 VanDerWaalsContact O-N 3.09Å; M121-K123 VanDerWaalsContact SD-CE 3.58Å; M121-D124 PolarHBondContact N-OD2 3.33Å; M121-D124 VanDerWaalsContact O-CB 3.3Å; M121-D124 WeakPolarHBondContact O-CB 3.3Å; M121-D124 PolarHBondContact O-N 3.09Å; M121-I125 PolarHBondContact O-N 2.78Å
122	P	97.9	Very high	97.2	Very high	96 Å²	96	89 Å²	89	62%	0.623	44%	0.436	S	S	*	.	H	α-helix	trans	-53.9	-32.9	177.8	-29.1	36.3	0	0	0	114.4	D124 I125 Q126	P122-D124 VanDerWaalsContact C-N 3.25Å; P122-D124 PolarHBondContact O-N 2.94Å; P122-I125 PolarHBondContact O-N 3.26Å; P122-Q126 WeakPolarHBondContact O-CG 3.33Å; P122-Q126 PolarHBondContact O-N 3.42Å
123	K	97.1	Very high	97	Very high	113 Å²	113	91.9 Å²	91.9	49%	0.491	47%	0.466	S	S	.	.	H	α-helix	trans	-62.7	-29.7	175.2	66.8	-176.3	-177.5	-175.7	0	113.6	M121 L127	M121-K123 HydrophobicContact CB-CG 3.98Å; M121-K123 PolarHBondContact O-N 3.32Å; M121-K123 VanDerWaalsContact O-N 3.09Å; M121-K123 VanDerWaalsContact SD-CE 3.58Å; K123-L127 WeakPolarHBondContact O-CB 3.4Å; K123-L127 PolarHBondContact O-N 2.8Å
124	D	98	Very high	96.4	Very high	5 Å²	5	90 Å²	90	3%	0.027	46%	0.455	C	S	.	.	H	α-helix	trans	-73.1	-40.6	178.9	-55.2	-38.8	0	0	0	109.9	T108 C111 R117 M121 P122 L127 A128	T108-D124 HydrophobicContact CG2-CB 3.64Å; C111-D124 HydrophobicContact CB-CB 3.95Å; R117-D124 IonicContact CZ-OD1 3.55Å; R117-D124 IonicContact CZ-OD2 3.58Å; R117-D124 IonicContact NH1-OD1 3.49Å; R117-D124 PolarHBondContact NH1-OD1 3.18Å; R117-D124 IonicContact NH1-OD2 2.74Å; R117-D124 PolarHBondContact NH1-OD2 3.39Å; R117-D124 IonicContact NH2-OD1 2.69Å; R117-D124 PolarHBondContact NH2-OD1 2.91Å; R117-D124 IonicContact NH2-OD2 3.48Å; R117-D124 PolarHBondContact NH2-OD2 3.05Å; M121-D124 PolarHBondContact N-OD2 3.33Å; M121-D124 VanDerWaalsContact O-CB 3.3Å; M121-D124 WeakPolarHBondContact O-CB 3.3Å; M121-D124 PolarHBondContact O-N 3.09Å; P122-D124 VanDerWaalsContact C-N 3.25Å; P122-D124 PolarHBondContact O-N 2.94Å; D124-L127 PolarHBondContact O-N 3.44Å; D124-A128 WeakPolarHBondContact O-CB 3.45Å; D124-A128 PolarHBondContact O-N 3.35Å
125	I	97	Very high	94.9	Very high	53 Å²	53	88.9 Å²	88.9	27%	0.272	44%	0.444	S	S	.	.	H	α-helix	trans	-63	-45.4	173.7	-60.2	175.6	0	0	0	110	L104 T108 M121 P122 L127 A128 R129	L104-I125 HydrophobicContact CD2-CG2 4.15Å; T108-I125 HydrophobicContact CG2-CB 4.5Å; T108-I125 HydrophobicContact CG2-CG1 3.53Å; M121-I125 PolarHBondContact O-N 2.78Å; P122-I125 PolarHBondContact O-N 3.26Å; I125-L127 VanDerWaalsContact C-N 3.3Å; I125-L127 PolarHBondContact O-N 3.01Å; I125-A128 PolarHBondContact O-N 3.45Å; I125-R129 HydrophobicContact CG2-CG 4.42Å; I125-R129 WeakPolarHBondContact O-CB 3.29Å; I125-R129 WeakPolarHBondContact O-CG 3.3Å; I125-R129 PolarHBondContact O-N 3.29Å
126	Q	96.4	Very high	92.7	Very high	97 Å²	97	94.6 Å²	94.6	45%	0.453	49%	0.492	S	S	.	.	H	α-helix	trans	-62.1	-39.1	178.3	-70.7	174	14.2	0	0	112.2	P122 R130	P122-Q126 WeakPolarHBondContact O-CG 3.33Å; P122-Q126 PolarHBondContact O-N 3.42Å; Q126-R130 VanDerWaalsContact O-CB 3.3Å; Q126-R130 WeakPolarHBondContact O-CB 3.47Å; Q126-R130 PolarHBondContact O-N 3.3Å
127	L	96.3	Very high	92.4	Very high	74 Å²	74	89.2 Å²	89.2	39%	0.387	47%	0.472	S	S	.	.	H	α-helix	trans	-66.2	-48.2	175.6	179.6	60.4	0	0	0	111.2	C111 K123 D124 I125 R129 R130 I131	C111-L127 HydrophobicContact CB-CD2 4.21Å; K123-L127 WeakPolarHBondContact O-CB 3.4Å; K123-L127 PolarHBondContact O-N 2.8Å; D124-L127 PolarHBondContact O-N 3.44Å; I125-L127 VanDerWaalsContact C-N 3.3Å; I125-L127 PolarHBondContact O-N 3.01Å; L127-R129 PolarHBondContact O-N 3.22Å; L127-R130 WeakPolarHBondContact O-CB 3.5Å; L127-R130 PolarHBondContact O-N 2.66Å; L127-R130 VanDerWaalsContact O-N 3.17Å; L127-I131 HydrophobicContact CD1-CD1 4Å; L127-I131 HydrophobicContact CD1-CG1 4.31Å; L127-I131 HydrophobicContact CG-CD1 4.01Å; L127-I131 WeakPolarHBondContact O-CG1 3.4Å; L127-I131 PolarHBondContact O-N 3.18Å
128	A	96.5	Very high	92.1	Very high	3 Å²	3	91.4 Å²	91.4	3%	0.025	49%	0.488	C	S	.	.	H	α-helix	trans	-56.9	-50.2	177.3	0	0	0	0	0	111.6	L104 D107 D124 I125 R130 I131 R132	L104-A128 HydrophobicContact CD1-CB 4.1Å; D107-A128 HydrophobicContact CB-CB 3.84Å; D124-A128 WeakPolarHBondContact O-CB 3.45Å; D124-A128 PolarHBondContact O-N 3.35Å; I125-A128 PolarHBondContact O-N 3.45Å; A128-R130 VanDerWaalsContact C-N 3.29Å; A128-R130 PolarHBondContact O-N 3.43Å; A128-I131 PolarHBondContact O-N 2.97Å; A128-R132 WeakPolarHBondContact O-CG 3.23Å; A128-R132 PolarHBondContact O-N 2.69Å
129	R	96.4	Very high	91.8	Very high	100 Å²	100	89 Å²	89	38%	0.377	47%	0.469	S	S	.	.	H	α-helix	trans	-61.7	-35.3	176.9	-70.9	-172.8	63.4	-154.6	-7.5	113.2	L104 I125 L127 G133 E134	L104-R129 HydrophobicContact CD1-CG 3.77Å; L104-R129 HydrophobicContact CD2-CG 4.42Å; I125-R129 HydrophobicContact CG2-CG 4.42Å; I125-R129 WeakPolarHBondContact O-CB 3.29Å; I125-R129 WeakPolarHBondContact O-CG 3.3Å; I125-R129 PolarHBondContact O-N 3.29Å; L127-R129 PolarHBondContact O-N 3.22Å; R129-G133 PolarHBondContact O-N 3.3Å; R129-E134 IonicContact NE-OE2 3.29Å; R129-E134 PolarHBondContact NH2-O 3.43Å; R129-E134 VanDerWaalsContact NH2-O 3.12Å; R129-E134 PolarHBondContact O-N 3.32Å; R129-E134 VanDerWaalsContact O-N 3.08Å
130	R	95.9	Very high	91.4	Very high	180 Å²	180	88.8 Å²	88.8	68%	0.679	46%	0.463	S	S	*	.	H	α-helix	trans	-65.5	-43.8	175.5	-177.2	179	-177.4	174.6	1.6	111.3	Q126 L127 A128 R132 G133	Q126-R130 VanDerWaalsContact O-CB 3.3Å; Q126-R130 WeakPolarHBondContact O-CB 3.47Å; Q126-R130 PolarHBondContact O-N 3.3Å; L127-R130 WeakPolarHBondContact O-CB 3.5Å; L127-R130 PolarHBondContact O-N 2.66Å; L127-R130 VanDerWaalsContact O-N 3.17Å; A128-R130 VanDerWaalsContact C-N 3.29Å; A128-R130 PolarHBondContact O-N 3.43Å; R130-R132 VanDerWaalsContact C-N 3.34Å; R130-G133 PolarHBondContact O-N 3.06Å
131	I	95	Very high	91	Very high	128 Å²	128	89.9 Å²	89.9	66%	0.656	47%	0.47	S	S	*	.	H	α-helix	trans	-67	-38	178.8	-66.7	168.6	0	0	0	110.8	L127 A128 G133	L127-I131 HydrophobicContact CD1-CD1 4Å; L127-I131 HydrophobicContact CD1-CG1 4.31Å; L127-I131 HydrophobicContact CG-CD1 4.01Å; L127-I131 WeakPolarHBondContact O-CG1 3.4Å; L127-I131 PolarHBondContact O-N 3.18Å; A128-I131 PolarHBondContact O-N 2.97Å; I131-G133 PolarHBondContact O-N 2.89Å
132	R	94.8	Very high	90.5	Very high	88 Å²	88	91 Å²	91	33%	0.332	48%	0.477	S	S	.	.	H	α-helix	trans	-68	-15.8	175.7	-71	-173.4	176.4	-161.8	-7.4	114.9	G103 D107 A128 R130 E134	G103-R132 PolarHBondContact O-NH2 3.5Å; D107-R132 IonicContact OD2-CZ 3.11Å; D107-R132 IonicContact OD2-NE 2.69Å; D107-R132 PolarHBondContact OD2-NE 3.12Å; D107-R132 IonicContact OD2-NH2 2.7Å; D107-R132 PolarHBondContact OD2-NH2 3.26Å; A128-R132 WeakPolarHBondContact O-CG 3.23Å; A128-R132 PolarHBondContact O-N 2.69Å; R130-R132 VanDerWaalsContact C-N 3.34Å; R132-E134 HydrophobicContact CB-CG 3.87Å; R132-E134 WeakPolarHBondContact CD-OE1 3.47Å; R132-E134 IonicContact NE-OE1 3.99Å; R132-E134 IonicContact NH1-OE1 3.69Å; R132-E134 PolarHBondContact NH1-OE1 3.3Å
133	G	93.8	Very high	90	Very high	61 Å²	61	90.6 Å²	90.6	63%	0.629	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.8	18.9	-174.3	0	0	0	0	0	114.4	R129 R130 I131 R135	R129-G133 PolarHBondContact O-N 3.3Å; R130-G133 PolarHBondContact O-N 3.06Å; I131-G133 PolarHBondContact O-N 2.89Å; G133-R135 VanDerWaalsContact C-N 3.28Å; G133-R135 PolarHBondContact O-N 3.13Å
134	E	85.6	Confident	89.5	Confident	60 Å²	60	88.9 Å²	88.9	28%	0.28	46%	0.464	S	S	.	.			trans	-88.1	6.3	-179.2	-64.1	173.5	-173.1	0	0	113.6	Y100 R129 R132	Y100-E134 WeakPolarHBondContact CE2-OE1 3.49Å; Y100-E134 PolarHBondContact OH-OE2 3.01Å; R129-E134 IonicContact NE-OE2 3.29Å; R129-E134 PolarHBondContact NH2-O 3.43Å; R129-E134 VanDerWaalsContact NH2-O 3.12Å; R129-E134 PolarHBondContact O-N 3.32Å; R129-E134 VanDerWaalsContact O-N 3.08Å; R132-E134 HydrophobicContact CB-CG 3.87Å; R132-E134 WeakPolarHBondContact CD-OE1 3.47Å; R132-E134 IonicContact NE-OE1 3.99Å; R132-E134 IonicContact NH1-OE1 3.69Å; R132-E134 PolarHBondContact NH1-OE1 3.3Å
135	R	67	Low	88.8	Confident	138 Å²	138	95.9 Å²	95.9	52%	0.521	50%	0.501	S	S	.	.			trans	-95.9	113.6	174.6	-133.7	175.6	-178.4	164.9	-2.1	107	G133	G133-R135 VanDerWaalsContact C-N 3.28Å; G133-R135 PolarHBondContact O-N 3.13Å
136	A	50.5	Low	88	Confident	169 Å²	169	99.8 Å²	99.8	100%	1.397	52%	0.522	S	S	*	.			trans	-60.2	0	158	0	0	0	0	0	109.8

Retrieved 136 of 136 residues in 554.5 ms (Link to these results)

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