H4_ASPFU Loading...

Histone H4

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

AlphaFold DB (A0A1C1CEQ7), UniProt , Accession Q7LKT3, Species ASPFU (Aspergillus fumigatus (strain ATCC MYA-4609 / CBS 101355 / FGSC A1100 / Af293), Neosartorya fumigata), Gene hhfA, Length 103 aa.

						>H4_ASPFU|Q7LKT3|hhfA
MTGRGKGGKGLGKGGAKRHRKILRDNIQGITKPAIRRLARRGGVKRISAMIYEETRGVLKTFLEGVIRDAVTYTEHAKRKTVTSLDVVYALKRQGRTLYGFGG
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.1	Very low	58.5	Low	247 Å²	247	147.1 Å²	147.1	100%	1.217	88%	0.879	S	S	*	*				0	97.2	0	-66.9	-168.8	177.1	0	0	109.1
2	T	49.9	Very low	58.4	Low	144 Å²	144	141.8 Å²	141.8	88%	0.883	88%	0.878	S	S	*	*			trans	-105.3	99.5	-176.7	45.7	0	0	0	0	110.1	R4	T2-R4 PolarHBondContact O-N 3.18Å
3	G	57.4	Low	58.7	Low	82 Å²	82	147.1 Å²	147.1	85%	0.845	88%	0.88	S	S	*	*			trans	-73.8	103.1	175.6	0	0	0	0	0	111.3	G5	G3-G5 PolarHBondContact O-N 3.38Å
4	R	62.3	Low	58.8	Low	246 Å²	246	142 Å²	142	93%	0.928	87%	0.873	S	S	*	*			trans	-66.4	108.2	176.4	-169.7	165.5	175.2	118.3	-7.1	109.7	T2 K6	T2-R4 PolarHBondContact O-N 3.18Å; R4-K6 PolarHBondContact O-N 3.06Å
5	G	60.4	Low	59.2	Low	69 Å²	69	137.3 Å²	137.3	71%	0.711	86%	0.864	S	S	*	*			trans	-63.3	127.1	177.2	0	0	0	0	0	112.3	G3 G7	G3-G5 PolarHBondContact O-N 3.38Å; G5-G7 PolarHBondContact O-N 3.3Å
6	K	66.8	Low	59.6	Low	225 Å²	225	134.8 Å²	134.8	98%	0.978	86%	0.861	S	S	*	*			trans	-73.6	78.5	164	-81.2	179.8	174.5	175.1	0	108.5	R4	R4-K6 PolarHBondContact O-N 3.06Å
7	G	60.4	Low	60	Low	70 Å²	70	137.1 Å²	137.1	72%	0.722	86%	0.855	S	S	*	*			trans	-149.4	84.8	-175.2	0	0	0	0	0	112.9	G5	G5-G7 PolarHBondContact O-N 3.3Å
8	G	61.3	Low	60.2	Low	76 Å²	76	143.3 Å²	143.3	78%	0.784	86%	0.859	S	S	*	*			trans	88.6	103.2	153.6	0	0	0	0	0	118.1
9	K	57.7	Low	60.5	Low	216 Å²	216	142.5 Å²	142.5	94%	0.939	85%	0.845	S	S	*	*				-171.3	74.9	125.9	-112.9	179.5	176.9	179	0	107.8
10	G	59.6	Low	60.7	Low	76 Å²	76	146.3 Å²	146.3	78%	0.784	84%	0.844	S	S	*	*			trans	-99.1	114.1	172.3	0	0	0	0	0	109.3
11	L	62	Low	60.9	Low	167 Å²	167	149.4 Å²	149.4	87%	0.874	85%	0.848	S	S	*	*			trans	-56.2	143	175.7	-65.4	156.7	0	0	0	110.7	K13	L11-K13 PolarHBondContact O-N 2.77Å
12	G	56.7	Low	62.1	Low	84 Å²	84	142.1 Å²	142.1	87%	0.866	81%	0.813	S	S	*	*			trans	-44.2	124.3	-164.8	0	0	0	0	0	115.8
13	K	62.4	Low	63.3	Low	210 Å²	210	143.1 Å²	143.1	91%	0.913	81%	0.812	S	S	*	*			trans	-127.8	116.2	169.1	-73.3	-171.2	177.2	-175.2	0	110.4	L11	L11-K13 PolarHBondContact O-N 2.77Å
14	G	60.8	Low	64.1	Low	76 Å²	76	147.4 Å²	147.4	78%	0.784	80%	0.802	S	S	*	*			trans	113.9	84.1	163.3	0	0	0	0	0	114.4
15	G	64.5	Low	65	Low	71 Å²	71	140.8 Å²	140.8	73%	0.732	79%	0.786	S	S	*	*			trans	-52.1	145.2	165.3	0	0	0	0	0	111.2	K17	G15-K17 PolarHBondContact O-N 2.7Å
16	A	64.9	Low	66.3	Low	98 Å²	98	142.6 Å²	142.6	81%	0.81	78%	0.779	S	S	*	*			trans	-53.3	110.5	-178.6	0	0	0	0	0	110.4	R18	A16-R18 PolarHBondContact O-N 3.22Å
17	K	67.4	Low	67.6	Low	174 Å²	174	133.3 Å²	133.3	76%	0.757	74%	0.74	S	S	*	*			trans	-65.9	97.4	172.7	-71.1	-174.8	178	-177.5	0	108.4	G15 H19	G15-K17 PolarHBondContact O-N 2.7Å; K17-H19 VanDerWaalsContact C-N 3.31Å; K17-H19 WeakPolarHBondContact CD-NE2 3.47Å; K17-H19 PolarHBondContact O-N 2.67Å
18	R	62.8	Low	69	Low	248 Å²	248	134.4 Å²	134.4	94%	0.936	73%	0.726	S	S	*	*			trans	-69.8	91.5	164.6	-85	-174.4	172.1	-177.2	-1.6	108	A16	A16-R18 PolarHBondContact O-N 3.22Å
19	H	66.2	Low	70.5	Confident	129 Å²	129	133.4 Å²	133.4	60%	0.597	72%	0.716	S	S	*	*			trans	-89.4	135	166	-69.8	-61.9	0	0	0	109.6	K17 K21	K17-H19 VanDerWaalsContact C-N 3.31Å; K17-H19 WeakPolarHBondContact CD-NE2 3.47Å; K17-H19 PolarHBondContact O-N 2.67Å; H19-K21 PolarHBondContact O-N 3.48Å
20	R	64.5	Low	72.3	Confident	217 Å²	217	125.9 Å²	125.9	82%	0.819	69%	0.685	S	S	*	*			trans	-54.1	134.4	162.6	-170.1	171.6	82.8	175.2	4.4	107.5	I22	R20-I22 VanDerWaalsContact C-N 3.25Å; R20-I22 PolarHBondContact O-N 3.33Å
21	K	65.4	Low	74.1	Confident	212 Å²	212	125.4 Å²	125.4	92%	0.922	67%	0.667	S	S	*	*			trans	-64.6	89.1	174	-72	-178.3	179.4	178.4	0	108.6	H19	H19-K21 PolarHBondContact O-N 3.48Å
22	I	71.9	Confident	75.8	Confident	95 Å²	95	122.6 Å²	122.6	49%	0.487	65%	0.648	S	S	.	*			trans	-79.3	136.9	164.4	-60.2	173.4	0	0	0	105.9	R20 R24	R20-I22 VanDerWaalsContact C-N 3.25Å; R20-I22 PolarHBondContact O-N 3.33Å; I22-R24 HydrophobicContact CG2-CG 4.49Å; I22-R24 PolarHBondContact O-N 3.08Å
23	L	73.6	Confident	77.7	Confident	164 Å²	164	121 Å²	121	86%	0.859	62%	0.622	S	S	*	*			trans	-59.6	109.5	171.7	-67.6	174.3	0	0	0	108.4
24	R	75.6	Confident	79.4	Confident	172 Å²	172	112 Å²	112	65%	0.649	59%	0.587	S	S	*	*			trans	-125.2	176.1	172.5	-66.5	-176.5	179	-179.2	-1.3	107.6	I22 N26	I22-R24 HydrophobicContact CG2-CG 4.49Å; I22-R24 PolarHBondContact O-N 3.08Å; R24-N26 VanDerWaalsContact O-CG 3.25Å; R24-N26 PolarHBondContact O-N 2.74Å; R24-N26 PolarHBondContact O-ND2 3.42Å
25	D	79.7	Confident	81.2	Confident	108 Å²	108	108.5 Å²	108.5	58%	0.578	55%	0.55	S	S	*	*			trans	-63.4	90.8	166.9	-172.5	14	0	0	0	110.2	I27	D25-I27 PolarHBondContact O-N 3.38Å; D25-I27 WeakPolarHBondContact OD1-CG2 3.42Å; D25-I27 PolarHBondContact OD1-N 3.47Å; D25-I27 WeakPolarHBondContact OD2-CG2 3.38Å
26	N	88.9	Confident	82.8	Confident	107 Å²	107	109.6 Å²	109.6	57%	0.572	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-77.4	-3.3	-173.3	-69.8	-48.3	0	0	0	112.1	R24 Q28 G29	R24-N26 VanDerWaalsContact O-CG 3.25Å; R24-N26 PolarHBondContact O-N 2.74Å; R24-N26 PolarHBondContact O-ND2 3.42Å; N26-Q28 PolarHBondContact O-N 2.93Å; N26-Q28 VanDerWaalsContact O-N 3.17Å; N26-G29 WeakPolarHBondContact O-CA 3.44Å; N26-G29 PolarHBondContact O-N 2.97Å
27	I	93.2	Very high	84.4	Confident	30 Å²	30	112.2 Å²	112.2	15%	0.154	52%	0.521	C	S	.	.	G	3₁₀ helix	trans	-60.1	-29.5	-179.3	-161.2	62	0	0	0	111.8	D25 G29 I30 R56 K60	D25-I27 PolarHBondContact O-N 3.38Å; D25-I27 WeakPolarHBondContact OD1-CG2 3.42Å; D25-I27 PolarHBondContact OD1-N 3.47Å; D25-I27 WeakPolarHBondContact OD2-CG2 3.38Å; I27-G29 PolarHBondContact O-N 3.22Å; I27-I30 HydrophobicContact CD1-CG1 4.46Å; I27-I30 WeakPolarHBondContact O-CB 3.44Å; I27-I30 PolarHBondContact O-N 3.04Å; I27-R56 HydrophobicContact CD1-CB 4.29Å; I27-R56 HydrophobicContact CG1-CB 3.69Å; I27-R56 HydrophobicContact CG1-CG 4.01Å; I27-R56 WeakPolarHBondContact O-CD 3.5Å; I27-R56 PolarHBondContact O-NE 3.27Å; I27-K60 HydrophobicContact CD1-CB 4.04Å
28	Q	91.3	Very high	85.9	Confident	93 Å²	93	108.7 Å²	108.7	44%	0.435	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-68.3	-16.9	175.3	-63.8	-56.6	-31.7	0	0	113.3	N26 I30 E53	N26-Q28 PolarHBondContact O-N 2.93Å; N26-Q28 VanDerWaalsContact O-N 3.17Å; Q28-I30 PolarHBondContact O-N 3.31Å; Q28-E53 PolarHBondContact NE2-OE2 3.42Å
29	G	92.6	Very high	87.5	Confident	55 Å²	55	97.8 Å²	97.8	57%	0.567	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-66.3	-18.1	170	0	0	0	0	0	113.5	N26 I27 T31	N26-G29 WeakPolarHBondContact O-CA 3.44Å; N26-G29 PolarHBondContact O-N 2.97Å; I27-G29 PolarHBondContact O-N 3.22Å; G29-T31 VanDerWaalsContact C-N 3.34Å; G29-T31 WeakPolarHBondContact O-CG2 3.34Å; G29-T31 PolarHBondContact O-N 3.46Å
30	I	95	Very high	89.1	Confident	58 Å²	58	97.4 Å²	97.4	30%	0.297	47%	0.466	S	S	.	.	S	Bend	trans	-77.6	89.9	168.5	-51.7	-59.7	0	0	0	107.9	I27 Q28 I35 R56 L59	I27-I30 HydrophobicContact CD1-CG1 4.46Å; I27-I30 WeakPolarHBondContact O-CB 3.44Å; I27-I30 PolarHBondContact O-N 3.04Å; Q28-I30 PolarHBondContact O-N 3.31Å; I30-I35 HydrophobicContact CG2-CD1 4.24Å; I30-I35 HydrophobicContact CG2-CG1 3.92Å; I30-R56 HydrophobicContact CB-CG 4.41Å; I30-R56 PolarHBondContact O-NE 3.26Å; I30-R56 PolarHBondContact O-NH2 2.89Å; I30-L59 HydrophobicContact CB-CD2 4.42Å; I30-L59 HydrophobicContact CD1-CD2 4.05Å; I30-L59 HydrophobicContact CG1-CD2 3.77Å; I30-L59 HydrophobicContact CG2-CD2 4Å
31	T	96.7	Very high	90.7	Very high	65 Å²	65	97.4 Å²	97.4	40%	0.399	47%	0.466	S	S	.	.			trans	-70.7	153	-168.7	66.8	0	0	0	0	113.1	G29 P33 A34 I35	G29-T31 VanDerWaalsContact C-N 3.34Å; G29-T31 WeakPolarHBondContact O-CG2 3.34Å; G29-T31 PolarHBondContact O-N 3.46Å; T31-P33 VanDerWaalsContact C-N 3.31Å; T31-A34 WeakPolarHBondContact O-CA 3.42Å; T31-A34 WeakPolarHBondContact O-CB 3.35Å; T31-A34 PolarHBondContact O-N 2.78Å; T31-A34 PolarHBondContact OG1-N 2.83Å; T31-I35 PolarHBondContact O-N 2.89Å; T31-I35 VanDerWaalsContact O-N 3.07Å
32	K	97.2	Very high	92.2	Very high	108 Å²	108	90.4 Å²	90.4	47%	0.47	45%	0.454	S	S	.	.	H	α-helix	trans	-51.9	-41.2	174	-62.3	-176.4	176.1	179.3	0	113.3	R36 Y52	K32-R36 WeakPolarHBondContact O-CB 3.41Å; K32-R36 PolarHBondContact O-N 3Å; K32-R36 PolarHBondContact O-NH1 3.5Å; K32-Y52 HydrophobicContact CB-CD1 3.96Å; K32-Y52 HydrophobicContact CB-CE1 3.93Å; K32-Y52 HydrophobicContact CB-CG 4.37Å; K32-Y52 HydrophobicContact CD-CD2 3.88Å; K32-Y52 HydrophobicContact CD-CE2 4.09Å; K32-Y52 HydrophobicContact CD-CG 4.16Å; K32-Y52 HydrophobicContact CG-CD1 3.9Å; K32-Y52 HydrophobicContact CG-CD2 4.06Å; K32-Y52 HydrophobicContact CG-CE1 4.26Å; K32-Y52 HydrophobicContact CG-CE2 4.44Å; K32-Y52 HydrophobicContact CG-CG 3.8Å
33	P	97.8	Very high	93.5	Very high	51 Å²	51	89 Å²	89	33%	0.331	46%	0.463	S	S	.	.	H	α-helix	trans	-61.5	-37.7	171.8	-24.8	35.5	0	0	0	114.5	T31 R36 R37	T31-P33 VanDerWaalsContact C-N 3.31Å; P33-R36 PolarHBondContact O-N 3.41Å; P33-R37 WeakPolarHBondContact O-CG 3.49Å; P33-R37 PolarHBondContact O-N 3.07Å
34	A	98	Very high	94.6	Very high	21 Å²	21	84.2 Å²	84.2	17%	0.174	44%	0.441	C	S	.	.	H	α-helix	trans	-64.9	-47.6	176.6	0	0	0	0	0	111.5	T31 R36 R37 L38	T31-A34 WeakPolarHBondContact O-CA 3.42Å; T31-A34 WeakPolarHBondContact O-CB 3.35Å; T31-A34 PolarHBondContact O-N 2.78Å; T31-A34 PolarHBondContact OG1-N 2.83Å; A34-R36 VanDerWaalsContact C-N 3.3Å; A34-R36 PolarHBondContact O-N 3.39Å; A34-R37 WeakPolarHBondContact O-CB 3.36Å; A34-R37 PolarHBondContact O-N 3.38Å; A34-R37 VanDerWaalsContact O-N 3.11Å; A34-L38 WeakPolarHBondContact O-CG 3.43Å; A34-L38 PolarHBondContact O-N 2.88Å
35	I	98.3	Very high	95.7	Very high	2 Å²	2	84.7 Å²	84.7	1%	0.01	45%	0.447	C	S	.	.	H	α-helix	trans	-59	-43.7	175.8	-64.7	169.9	0	0	0	110.6	I30 T31 R37 L38 A39 Y52 T55 R56	I30-I35 HydrophobicContact CG2-CD1 4.24Å; I30-I35 HydrophobicContact CG2-CG1 3.92Å; T31-I35 PolarHBondContact O-N 2.89Å; T31-I35 VanDerWaalsContact O-N 3.07Å; I35-R37 PolarHBondContact O-N 3.13Å; I35-L38 WeakPolarHBondContact O-CB 3.5Å; I35-L38 PolarHBondContact O-N 3.49Å; I35-A39 WeakPolarHBondContact O-CB 3.31Å; I35-A39 PolarHBondContact O-N 3.07Å; I35-Y52 HydrophobicContact CB-CD1 4.14Å; I35-Y52 HydrophobicContact CD1-CD1 4.26Å; I35-Y52 WeakPolarHBondContact CD1-O 3.23Å; I35-Y52 HydrophobicContact CG2-CD1 3.95Å; I35-Y52 HydrophobicContact CG2-CE1 4.43Å; I35-T55 HydrophobicContact CD1-CG2 4.4Å; I35-T55 HydrophobicContact CG1-CG2 4.13Å; I35-T55 HydrophobicContact CG2-CG2 3.99Å; I35-R56 HydrophobicContact CD1-CG 4.19Å
36	R	98	Very high	96.5	Very high	94 Å²	94	90 Å²	90	36%	0.355	46%	0.46	S	S	.	.	H	α-helix	trans	-62	-41.3	175.4	-178.2	171.8	59	-96.8	2.9	112.2	K32 P33 A34 L38 A39 R40 I47	K32-R36 WeakPolarHBondContact O-CB 3.41Å; K32-R36 PolarHBondContact O-N 3Å; K32-R36 PolarHBondContact O-NH1 3.5Å; P33-R36 PolarHBondContact O-N 3.41Å; A34-R36 VanDerWaalsContact C-N 3.3Å; A34-R36 PolarHBondContact O-N 3.39Å; R36-L38 VanDerWaalsContact C-N 3.33Å; R36-L38 PolarHBondContact O-N 2.95Å; R36-A39 PolarHBondContact O-N 3.4Å; R36-R40 HydrophobicContact CG-CG 4.21Å; R36-R40 WeakPolarHBondContact O-CB 3.2Å; R36-R40 WeakPolarHBondContact O-CG 3.3Å; R36-R40 PolarHBondContact O-N 2.87Å; R36-I47 HydrophobicContact CB-CD1 4.28Å; R36-I47 HydrophobicContact CG-CD1 4Å
37	R	98.4	Very high	96.9	Very high	154 Å²	154	86.8 Å²	86.8	58%	0.581	44%	0.442	S	S	*	.	H	α-helix	trans	-61.1	-41.5	175.1	-74.7	-173.6	-59.5	-94.2	5.1	111.8	P33 A34 I35 R41	P33-R37 WeakPolarHBondContact O-CG 3.49Å; P33-R37 PolarHBondContact O-N 3.07Å; A34-R37 WeakPolarHBondContact O-CB 3.36Å; A34-R37 PolarHBondContact O-N 3.38Å; A34-R37 VanDerWaalsContact O-N 3.11Å; I35-R37 PolarHBondContact O-N 3.13Å; R37-R41 WeakPolarHBondContact O-CB 3.31Å; R37-R41 PolarHBondContact O-N 3.47Å
38	L	98.1	Very high	97.1	Very high	99 Å²	99	88.5 Å²	88.5	52%	0.518	46%	0.456	S	S	.	.	H	α-helix	trans	-62.2	-51	175.3	-67.9	171.8	0	0	0	111.5	A34 I35 R36 R40 R41 G42	A34-L38 WeakPolarHBondContact O-CG 3.43Å; A34-L38 PolarHBondContact O-N 2.88Å; I35-L38 WeakPolarHBondContact O-CB 3.5Å; I35-L38 PolarHBondContact O-N 3.49Å; R36-L38 VanDerWaalsContact C-N 3.33Å; R36-L38 PolarHBondContact O-N 2.95Å; L38-R40 VanDerWaalsContact C-N 3.33Å; L38-R40 PolarHBondContact O-N 3.17Å; L38-R41 WeakPolarHBondContact O-CB 3.17Å; L38-R41 PolarHBondContact O-N 3.43Å; L38-R41 VanDerWaalsContact O-N 3.17Å; L38-G42 PolarHBondContact O-N 2.91Å
39	A	98	Very high	97.3	Very high	19 Å²	19	87.8 Å²	87.8	16%	0.157	47%	0.466	C	S	.	.	H	α-helix	trans	-60.9	-40	178.5	0	0	0	0	0	112.4	I35 R36 G42 G43 V44 I47	I35-A39 WeakPolarHBondContact O-CB 3.31Å; I35-A39 PolarHBondContact O-N 3.07Å; R36-A39 PolarHBondContact O-N 3.4Å; A39-G42 CarbonylContact O-C 3.55Å; A39-G42 PolarHBondContact O-N 3.46Å; A39-G43 PolarHBondContact O-N 3.38Å; A39-V44 HydrophobicContact CB-CB 4.06Å; A39-V44 HydrophobicContact CB-CG2 4.15Å; A39-V44 VanDerWaalsContact O-CB 3.28Å; A39-V44 WeakPolarHBondContact O-CB 3.33Å; A39-V44 WeakPolarHBondContact O-CG2 3.3Å; A39-V44 PolarHBondContact O-N 3.33Å; A39-I47 HydrophobicContact CB-CD1 3.49Å; A39-I47 VanDerWaalsContact CB-CD1 3.49Å; A39-I47 HydrophobicContact CB-CG1 4.22Å
40	R	98.2	Very high	97.5	Very high	122 Å²	122	92.2 Å²	92.2	46%	0.46	47%	0.474	S	S	.	.	H	α-helix	trans	-65	-40.3	175	-69.3	-62.8	-173.7	-123.1	9.7	112.3	R36 L38 G42 G43 V44 K45	R36-R40 HydrophobicContact CG-CG 4.21Å; R36-R40 WeakPolarHBondContact O-CB 3.2Å; R36-R40 WeakPolarHBondContact O-CG 3.3Å; R36-R40 PolarHBondContact O-N 2.87Å; L38-R40 VanDerWaalsContact C-N 3.33Å; L38-R40 PolarHBondContact O-N 3.17Å; R40-G42 PolarHBondContact O-N 2.97Å; R40-G43 PolarHBondContact O-N 2.84Å; R40-V44 WeakPolarHBondContact CD-O 3.42Å; R40-V44 PolarHBondContact NH1-O 3.49Å; R40-K45 VanDerWaalsContact CZ-O 3.27Å; R40-K45 PolarHBondContact NH1-O 3.26Å; R40-K45 PolarHBondContact NH2-O 2.89Å; R40-K45 VanDerWaalsContact NH2-O 3.09Å
41	R	98.2	Very high	97.7	Very high	216 Å²	216	92.9 Å²	92.9	82%	0.815	48%	0.477	S	S	*	.	H	α-helix	trans	-60.8	-34	172.6	-173.4	-179.4	-66.2	169.3	-3	111.7	R37 L38 G43	R37-R41 WeakPolarHBondContact O-CB 3.31Å; R37-R41 PolarHBondContact O-N 3.47Å; L38-R41 WeakPolarHBondContact O-CB 3.17Å; L38-R41 PolarHBondContact O-N 3.43Å; L38-R41 VanDerWaalsContact O-N 3.17Å; R41-G43 VanDerWaalsContact C-N 3.27Å; R41-G43 PolarHBondContact O-N 2.97Å
42	G	97.9	Very high	97.7	Very high	65 Å²	65	91.4 Å²	91.4	67%	0.67	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	7.7	172.4	0	0	0	0	0	115.7	L38 A39 R40 V44	L38-G42 PolarHBondContact O-N 2.91Å; A39-G42 CarbonylContact O-C 3.55Å; A39-G42 PolarHBondContact O-N 3.46Å; R40-G42 PolarHBondContact O-N 2.97Å; G42-V44 PolarHBondContact O-N 2.86Å
43	G	98.2	Very high	97.6	Very high	66 Å²	66	91 Å²	91	68%	0.68	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.9	8.7	177.2	0	0	0	0	0	115.8	A39 R40 R41 K45	A39-G43 PolarHBondContact O-N 3.38Å; R40-G43 PolarHBondContact O-N 2.84Å; R41-G43 VanDerWaalsContact C-N 3.27Å; R41-G43 PolarHBondContact O-N 2.97Å; G43-K45 PolarHBondContact O-N 2.98Å
44	V	97.8	Very high	97.6	Very high	63 Å²	63	94.4 Å²	94.4	38%	0.382	48%	0.476	S	S	.	.			trans	-69.7	123.6	179.5	-179.2	0	0	0	0	110.2	A39 R40 G42 R46 I47	A39-V44 HydrophobicContact CB-CB 4.06Å; A39-V44 HydrophobicContact CB-CG2 4.15Å; A39-V44 VanDerWaalsContact O-CB 3.28Å; A39-V44 WeakPolarHBondContact O-CB 3.33Å; A39-V44 WeakPolarHBondContact O-CG2 3.3Å; A39-V44 PolarHBondContact O-N 3.33Å; R40-V44 WeakPolarHBondContact CD-O 3.42Å; R40-V44 PolarHBondContact NH1-O 3.49Å; G42-V44 PolarHBondContact O-N 2.86Å; V44-R46 WeakPolarHBondContact CG1-O 3.47Å; V44-I47 HydrophobicContact CG1-CG1 3.76Å
45	K	97.5	Very high	97.6	Very high	182 Å²	182	95.5 Å²	95.5	79%	0.791	48%	0.481	S	S	*	.	S	Bend	trans	-84.7	-41.2	-178.5	-172.3	175.3	-176.8	174.2	0	114.1	R40 G43	R40-K45 VanDerWaalsContact CZ-O 3.27Å; R40-K45 PolarHBondContact NH1-O 3.26Å; R40-K45 PolarHBondContact NH2-O 2.89Å; R40-K45 VanDerWaalsContact NH2-O 3.09Å; G43-K45 PolarHBondContact O-N 2.98Å
46	R	97.3	Very high	97.6	Very high	221 Å²	221	96.1 Å²	96.1	83%	0.834	48%	0.483	S	S	*	.			trans	-129.8	144.6	176.7	-68.6	-175	180	-85.8	2	109.9	V44	V44-R46 WeakPolarHBondContact CG1-O 3.47Å
47	I	97	Very high	97.5	Very high	38 Å²	38	93.5 Å²	93.5	20%	0.195	49%	0.485	C	S	.	.			trans	-129.1	125.3	-175.8	-54.7	171.3	0	0	0	107.5	R36 A39 V44 I51	R36-I47 HydrophobicContact CB-CD1 4.28Å; R36-I47 HydrophobicContact CG-CD1 4Å; A39-I47 HydrophobicContact CB-CD1 3.49Å; A39-I47 VanDerWaalsContact CB-CD1 3.49Å; A39-I47 HydrophobicContact CB-CG1 4.22Å; V44-I47 HydrophobicContact CG1-CG1 3.76Å; I47-I51 HydrophobicContact CG2-CB 3.83Å; I47-I51 HydrophobicContact CG2-CG1 4.2Å; I47-I51 HydrophobicContact CG2-CG2 3.96Å
48	S	97.3	Very high	97.5	Very high	66 Å²	66	90.3 Å²	90.3	46%	0.462	48%	0.483	S	S	.	.			trans	-71.3	152.3	172.9	173.3	0	0	0	0	111.1	M50 I51	S48-M50 PolarHBondContact O-N 3.46Å; S48-I51 WeakPolarHBondContact O-CB 3.19Å; S48-I51 PolarHBondContact O-N 3.27Å
49	A	96.4	Very high	97.5	Very high	78 Å²	78	88 Å²	88	65%	0.645	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-29.3	178.7	0	0	0	0	0	113.2	I51 Y52	A49-I51 VanDerWaalsContact C-N 3.28Å; A49-I51 PolarHBondContact O-N 3.01Å; A49-Y52 WeakPolarHBondContact O-CD2 3.42Å
50	M	96.8	Very high	97.4	Very high	149 Å²	149	91.6 Å²	91.6	73%	0.734	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-23.1	-179.4	-61.8	-171.3	-66.7	0	0	113	S48 Y52 E53 E54	S48-M50 PolarHBondContact O-N 3.46Å; M50-Y52 PolarHBondContact O-N 3.08Å; M50-Y52 VanDerWaalsContact O-N 3.12Å; M50-E53 PolarHBondContact O-N 3.09Å; M50-E54 PolarHBondContact O-N 3.45Å
51	I	97.7	Very high	97.4	Very high	71 Å²	71	90.4 Å²	90.4	36%	0.364	49%	0.489	S	S	.	.	H	α-helix	trans	-62.5	-24	-177.9	-60.1	-58.3	0	0	0	112.3	I47 S48 A49 T55	I47-I51 HydrophobicContact CG2-CB 3.83Å; I47-I51 HydrophobicContact CG2-CG1 4.2Å; I47-I51 HydrophobicContact CG2-CG2 3.96Å; S48-I51 WeakPolarHBondContact O-CB 3.19Å; S48-I51 PolarHBondContact O-N 3.27Å; A49-I51 VanDerWaalsContact C-N 3.28Å; A49-I51 PolarHBondContact O-N 3.01Å; I51-T55 WeakPolarHBondContact CG2-OG1 3.44Å; I51-T55 VanDerWaalsContact O-CB 3.26Å; I51-T55 WeakPolarHBondContact O-CB 3.39Å; I51-T55 PolarHBondContact O-N 3.38Å; I51-T55 PolarHBondContact O-OG1 3.28Å
52	Y	97	Very high	97.3	Very high	35 Å²	35	83.3 Å²	83.3	14%	0.137	46%	0.464	C	S	.	.	H	α-helix	trans	-68	-39.8	-178.8	-57.6	-60.1	0	0	0	113.3	K32 I35 A49 M50 R56	K32-Y52 HydrophobicContact CB-CD1 3.96Å; K32-Y52 HydrophobicContact CB-CE1 3.93Å; K32-Y52 HydrophobicContact CB-CG 4.37Å; K32-Y52 HydrophobicContact CD-CD2 3.88Å; K32-Y52 HydrophobicContact CD-CE2 4.09Å; K32-Y52 HydrophobicContact CD-CG 4.16Å; K32-Y52 HydrophobicContact CG-CD1 3.9Å; K32-Y52 HydrophobicContact CG-CD2 4.06Å; K32-Y52 HydrophobicContact CG-CE1 4.26Å; K32-Y52 HydrophobicContact CG-CE2 4.44Å; K32-Y52 HydrophobicContact CG-CG 3.8Å; I35-Y52 HydrophobicContact CB-CD1 4.14Å; I35-Y52 HydrophobicContact CD1-CD1 4.26Å; I35-Y52 WeakPolarHBondContact CD1-O 3.23Å; I35-Y52 HydrophobicContact CG2-CD1 3.95Å; I35-Y52 HydrophobicContact CG2-CE1 4.43Å; A49-Y52 WeakPolarHBondContact O-CD2 3.42Å; M50-Y52 PolarHBondContact O-N 3.08Å; M50-Y52 VanDerWaalsContact O-N 3.12Å; Y52-R56 WeakPolarHBondContact O-CG 3.48Å; Y52-R56 PolarHBondContact O-NH1 3.39Å
53	E	96.4	Very high	97.3	Very high	98 Å²	98	83.8 Å²	83.8	46%	0.458	45%	0.451	S	S	.	.	H	α-helix	trans	-78.9	-38.3	175.4	-64.1	-49.7	136.4	0	0	110.7	Q28 M50 T55 R56 G57	Q28-E53 PolarHBondContact NE2-OE2 3.42Å; M50-E53 PolarHBondContact O-N 3.09Å; E53-T55 PolarHBondContact O-N 3.07Å; E53-R56 WeakPolarHBondContact O-CB 3.42Å; E53-R56 PolarHBondContact O-N 3.32Å; E53-R56 IonicContact OE1-CZ 3.63Å; E53-R56 IonicContact OE1-NH1 2.66Å; E53-R56 PolarHBondContact OE1-NH1 3.24Å; E53-R56 IonicContact OE1-NH2 3.59Å; E53-R56 IonicContact OE2-NH1 3.49Å; E53-R56 PolarHBondContact OE2-NH1 2.84Å; E53-G57 PolarHBondContact O-N 3.19Å
54	E	97.7	Very high	97.2	Very high	124 Å²	124	84.8 Å²	84.8	58%	0.579	44%	0.438	S	S	*	.	H	α-helix	trans	-57.2	-48.1	175.6	-171.7	60.3	-154.6	0	0	111.9	M50 R56 G57 V58	M50-E54 PolarHBondContact O-N 3.45Å; E54-R56 PolarHBondContact O-N 3.17Å; E54-G57 PolarHBondContact O-N 3.29Å; E54-G57 VanDerWaalsContact O-N 3.14Å; E54-V58 WeakPolarHBondContact O-CG2 3.43Å; E54-V58 PolarHBondContact O-N 3.21Å
55	T	98.1	Very high	97.2	Very high	43 Å²	43	82.6 Å²	82.6	26%	0.264	43%	0.428	S	S	.	.	H	α-helix	trans	-61.1	-34.1	178.2	-54.7	0	0	0	0	111.6	I35 I51 E53 L59	I35-T55 HydrophobicContact CD1-CG2 4.4Å; I35-T55 HydrophobicContact CG1-CG2 4.13Å; I35-T55 HydrophobicContact CG2-CG2 3.99Å; I51-T55 WeakPolarHBondContact CG2-OG1 3.44Å; I51-T55 VanDerWaalsContact O-CB 3.26Å; I51-T55 WeakPolarHBondContact O-CB 3.39Å; I51-T55 PolarHBondContact O-N 3.38Å; I51-T55 PolarHBondContact O-OG1 3.28Å; E53-T55 PolarHBondContact O-N 3.07Å; T55-L59 WeakPolarHBondContact O-CB 3.41Å; T55-L59 PolarHBondContact O-N 3.48Å
56	R	97.5	Very high	97.2	Very high	15 Å²	15	74.3 Å²	74.3	6%	0.057	39%	0.393	C	S	.	.	H	α-helix	trans	-69.1	-43.2	176.7	-79	-177.3	-166.9	116.1	-30.1	111.6	I27 I30 I35 Y52 E53 E54 L59 K60	I27-R56 HydrophobicContact CD1-CB 4.29Å; I27-R56 HydrophobicContact CG1-CB 3.69Å; I27-R56 HydrophobicContact CG1-CG 4.01Å; I27-R56 WeakPolarHBondContact O-CD 3.5Å; I27-R56 PolarHBondContact O-NE 3.27Å; I30-R56 HydrophobicContact CB-CG 4.41Å; I30-R56 PolarHBondContact O-NE 3.26Å; I30-R56 PolarHBondContact O-NH2 2.89Å; I35-R56 HydrophobicContact CD1-CG 4.19Å; Y52-R56 WeakPolarHBondContact O-CG 3.48Å; Y52-R56 PolarHBondContact O-NH1 3.39Å; E53-R56 WeakPolarHBondContact O-CB 3.42Å; E53-R56 PolarHBondContact O-N 3.32Å; E53-R56 IonicContact OE1-CZ 3.63Å; E53-R56 IonicContact OE1-NH1 2.66Å; E53-R56 PolarHBondContact OE1-NH1 3.24Å; E53-R56 IonicContact OE1-NH2 3.59Å; E53-R56 IonicContact OE2-NH1 3.49Å; E53-R56 PolarHBondContact OE2-NH1 2.84Å; E54-R56 PolarHBondContact O-N 3.17Å; R56-L59 PolarHBondContact O-N 3.47Å; R56-K60 WeakPolarHBondContact O-CB 3.46Å; R56-K60 PolarHBondContact O-N 3.43Å
57	G	97	Very high	97.2	Very high	39 Å²	39	68.4 Å²	68.4	40%	0.402	38%	0.376	S	S	.	.	H	α-helix	trans	-57	-52.6	173.7	0	0	0	0	0	111.6	E53 E54 L59 K60 T61	E53-G57 PolarHBondContact O-N 3.19Å; E54-G57 PolarHBondContact O-N 3.29Å; E54-G57 VanDerWaalsContact O-N 3.14Å; G57-L59 PolarHBondContact O-N 3.01Å; G57-K60 WeakPolarHBondContact O-CB 3.41Å; G57-K60 PolarHBondContact O-N 3.25Å; G57-T61 PolarHBondContact O-N 3.49Å; G57-T61 PolarHBondContact O-OG1 2.76Å
58	V	97.7	Very high	97.3	Very high	88 Å²	88	73.9 Å²	73.9	53%	0.533	40%	0.395	S	S	.	.	H	α-helix	trans	-59.6	-44.3	178.7	174.9	0	0	0	0	112	E54 K60 T61 F62	E54-V58 WeakPolarHBondContact O-CG2 3.43Å; E54-V58 PolarHBondContact O-N 3.21Å; V58-K60 VanDerWaalsContact C-N 3.34Å; V58-K60 PolarHBondContact O-N 2.86Å; V58-T61 PolarHBondContact O-N 3.07Å; V58-F62 WeakPolarHBondContact O-CB 3.41Å; V58-F62 PolarHBondContact O-N 3.44Å
59	L	97.6	Very high	97.3	Very high	49 Å²	49	71.8 Å²	71.8	26%	0.257	38%	0.378	S	S	.	.	H	α-helix	trans	-63.3	-40.4	178.2	177.3	61.5	0	0	0	111.9	I30 T55 R56 G57 F62 L63	I30-L59 HydrophobicContact CB-CD2 4.42Å; I30-L59 HydrophobicContact CD1-CD2 4.05Å; I30-L59 HydrophobicContact CG1-CD2 3.77Å; I30-L59 HydrophobicContact CG2-CD2 4Å; T55-L59 WeakPolarHBondContact O-CB 3.41Å; T55-L59 PolarHBondContact O-N 3.48Å; R56-L59 PolarHBondContact O-N 3.47Å; G57-L59 PolarHBondContact O-N 3.01Å; L59-F62 PolarHBondContact O-N 3.34Å; L59-L63 HydrophobicContact CD1-CD1 4Å; L59-L63 HydrophobicContact CD1-CG 4.12Å; L59-L63 HydrophobicContact CG-CD1 4.12Å; L59-L63 WeakPolarHBondContact O-CG 3.36Å; L59-L63 PolarHBondContact O-N 3.39Å
60	K	96.4	Very high	97.4	Very high	96 Å²	96	68.2 Å²	68.2	42%	0.417	35%	0.349	S	S	.	.	H	α-helix	trans	-61.9	-52.2	177.3	-175.6	177.6	176.2	180	0	110.7	I27 R56 G57 V58 F62 L63 E64	I27-K60 HydrophobicContact CD1-CB 4.04Å; R56-K60 WeakPolarHBondContact O-CB 3.46Å; R56-K60 PolarHBondContact O-N 3.43Å; G57-K60 WeakPolarHBondContact O-CB 3.41Å; G57-K60 PolarHBondContact O-N 3.25Å; V58-K60 VanDerWaalsContact C-N 3.34Å; V58-K60 PolarHBondContact O-N 2.86Å; K60-F62 VanDerWaalsContact C-N 3.28Å; K60-F62 PolarHBondContact O-N 3.17Å; K60-L63 PolarHBondContact O-N 2.92Å; K60-E64 WeakPolarHBondContact CE-OE1 3.48Å; K60-E64 HydrophobicContact CG-CG 4.44Å; K60-E64 WeakPolarHBondContact CG-OE1 3.37Å; K60-E64 WeakPolarHBondContact O-CG 3.37Å; K60-E64 PolarHBondContact O-N 3.07Å
61	T	97	Very high	97.4	Very high	97 Å²	97	63.8 Å²	63.8	60%	0.595	33%	0.33	S	S	*	.	H	α-helix	trans	-58	-41.4	178	-55.6	0	0	0	0	112	G57 V58 G65	G57-T61 PolarHBondContact O-N 3.49Å; G57-T61 PolarHBondContact O-OG1 2.76Å; V58-T61 PolarHBondContact O-N 3.07Å; T61-G65 PolarHBondContact O-N 2.95Å
62	F	97.1	Very high	97.4	Very high	66 Å²	66	64.1 Å²	64.1	29%	0.289	34%	0.336	S	S	.	.	H	α-helix	trans	-61.1	-50	176.3	173	-110	0	0	0	112.2	V58 L59 K60 G65 V66 L91 R96	V58-F62 WeakPolarHBondContact O-CB 3.41Å; V58-F62 PolarHBondContact O-N 3.44Å; L59-F62 PolarHBondContact O-N 3.34Å; K60-F62 VanDerWaalsContact C-N 3.28Å; K60-F62 PolarHBondContact O-N 3.17Å; F62-G65 PolarHBondContact O-N 3.11Å; F62-V66 HydrophobicContact CD2-CG2 4.25Å; F62-V66 HydrophobicContact CE1-CG2 4.32Å; F62-V66 HydrophobicContact CE2-CG2 3.64Å; F62-V66 HydrophobicContact CZ-CG2 3.71Å; F62-V66 WeakPolarHBondContact O-CG2 3.47Å; F62-V66 PolarHBondContact O-N 3.39Å; F62-V66 VanDerWaalsContact O-N 3.17Å; F62-L91 HydrophobicContact CZ-CD2 4.13Å; F62-R96 VanDerWaalsContact CE2-CZ 3.48Å
63	L	97.3	Very high	97.5	Very high	75 Å²	75	66.3 Å²	66.3	39%	0.393	34%	0.344	S	S	.	.	H	α-helix	trans	-67	-37.5	-179.2	-71.2	175	0	0	0	112.2	L59 K60 G65 V66 I67	L59-L63 HydrophobicContact CD1-CD1 4Å; L59-L63 HydrophobicContact CD1-CG 4.12Å; L59-L63 HydrophobicContact CG-CD1 4.12Å; L59-L63 WeakPolarHBondContact O-CG 3.36Å; L59-L63 PolarHBondContact O-N 3.39Å; K60-L63 PolarHBondContact O-N 2.92Å; L63-G65 VanDerWaalsContact C-N 3.31Å; L63-G65 PolarHBondContact O-N 2.92Å; L63-V66 PolarHBondContact O-N 3Å; L63-I67 HydrophobicContact CB-CD1 4.18Å; L63-I67 VanDerWaalsContact O-CB 3.23Å; L63-I67 WeakPolarHBondContact O-CB 3.21Å; L63-I67 WeakPolarHBondContact O-CG1 3.39Å; L63-I67 PolarHBondContact O-N 3.44Å
64	E	97	Very high	97.6	Very high	88 Å²	88	62 Å²	62	41%	0.411	33%	0.325	S	S	.	.	H	α-helix	trans	-58.6	-42.9	175.2	-76.8	176.1	180	0	0	111.8	K60 R68	K60-E64 WeakPolarHBondContact CE-OE1 3.48Å; K60-E64 HydrophobicContact CG-CG 4.44Å; K60-E64 WeakPolarHBondContact CG-OE1 3.37Å; K60-E64 WeakPolarHBondContact O-CG 3.37Å; K60-E64 PolarHBondContact O-N 3.07Å; E64-R68 WeakPolarHBondContact O-CB 3.5Å; E64-R68 PolarHBondContact O-N 3Å; E64-R68 VanDerWaalsContact O-N 3.07Å
65	G	97.1	Very high	97.6	Very high	16 Å²	16	62.6 Å²	62.6	17%	0.165	33%	0.327	C	S	.	.	H	α-helix	trans	-62.6	-51.9	175.8	0	0	0	0	0	112.6	T61 F62 L63 D69 Q94	T61-G65 PolarHBondContact O-N 2.95Å; F62-G65 PolarHBondContact O-N 3.11Å; L63-G65 VanDerWaalsContact C-N 3.31Å; L63-G65 PolarHBondContact O-N 2.92Å; G65-D69 PolarHBondContact O-N 3.37Å; G65-Q94 PolarHBondContact O-NE2 3.45Å
66	V	97.8	Very high	97.6	Very high	9 Å²	9	68.2 Å²	68.2	6%	0.055	35%	0.35	C	S	.	.	H	α-helix	trans	-65	-44.1	-177.7	176.4	0	0	0	0	111.8	F62 L63 D69 A70 V87 A90 L91	F62-V66 HydrophobicContact CD2-CG2 4.25Å; F62-V66 HydrophobicContact CE1-CG2 4.32Å; F62-V66 HydrophobicContact CE2-CG2 3.64Å; F62-V66 HydrophobicContact CZ-CG2 3.71Å; F62-V66 WeakPolarHBondContact O-CG2 3.47Å; F62-V66 PolarHBondContact O-N 3.39Å; F62-V66 VanDerWaalsContact O-N 3.17Å; L63-V66 PolarHBondContact O-N 3Å; V66-D69 PolarHBondContact O-N 3.17Å; V66-A70 WeakPolarHBondContact O-CB 3.2Å; V66-A70 PolarHBondContact O-N 2.89Å; V66-V87 HydrophobicContact CG1-CG1 4.24Å; V66-A90 HydrophobicContact CG1-CB 4.37Å; V66-A90 WeakPolarHBondContact O-CB 3.49Å; V66-L91 HydrophobicContact CG1-CD2 3.96Å; V66-L91 HydrophobicContact CG1-CG 4.04Å; V66-L91 HydrophobicContact CG2-CD2 3.71Å
67	I	97.7	Very high	97.6	Very high	96 Å²	96	69.6 Å²	69.6	49%	0.492	37%	0.365	S	S	.	.	H	α-helix	trans	-69	-37.8	-177.5	-67	169.1	0	0	0	110.7	L63 D69 A70 V71	L63-I67 HydrophobicContact CB-CD1 4.18Å; L63-I67 VanDerWaalsContact O-CB 3.23Å; L63-I67 WeakPolarHBondContact O-CB 3.21Å; L63-I67 WeakPolarHBondContact O-CG1 3.39Å; L63-I67 PolarHBondContact O-N 3.44Å; I67-D69 PolarHBondContact O-N 3.42Å; I67-A70 PolarHBondContact O-N 3.32Å; I67-V71 HydrophobicContact CG2-CG2 4.1Å; I67-V71 WeakPolarHBondContact O-CB 3.37Å; I67-V71 VanDerWaalsContact O-CG2 3.3Å; I67-V71 WeakPolarHBondContact O-CG2 3.45Å; I67-V71 PolarHBondContact O-N 3.38Å
68	R	98	Very high	97.6	Very high	154 Å²	154	77.4 Å²	77.4	58%	0.581	39%	0.388	S	S	*	.	H	α-helix	trans	-55.8	-51.4	175.6	-175.5	-176.8	-59.4	120.5	2.9	111	E64 A70 V71 T72	E64-R68 WeakPolarHBondContact O-CB 3.5Å; E64-R68 PolarHBondContact O-N 3Å; E64-R68 VanDerWaalsContact O-N 3.07Å; R68-A70 PolarHBondContact O-N 2.99Å; R68-V71 PolarHBondContact O-N 3.02Å; R68-T72 PolarHBondContact O-N 3.19Å; R68-T72 VanDerWaalsContact O-N 3.09Å; R68-T72 PolarHBondContact O-OG1 3.45Å; R68-T72 VanDerWaalsContact O-OG1 3.08Å
69	D	97.7	Very high	97.6	Very high	21 Å²	21	77.5 Å²	77.5	11%	0.112	38%	0.379	C	S	.	.	H	α-helix	trans	-64.7	-40.4	179.2	-72	-3.9	0	0	0	111.7	G65 V66 I67 V71 T72 Y73 A90 R93 Q94	G65-D69 PolarHBondContact O-N 3.37Å; V66-D69 PolarHBondContact O-N 3.17Å; I67-D69 PolarHBondContact O-N 3.42Å; D69-V71 PolarHBondContact O-N 3.48Å; D69-T72 WeakPolarHBondContact O-CB 3.49Å; D69-T72 PolarHBondContact O-N 2.87Å; D69-Y73 WeakPolarHBondContact O-CD2 3.41Å; D69-Y73 PolarHBondContact O-N 2.9Å; D69-Y73 VanDerWaalsContact O-N 3.13Å; D69-A90 HydrophobicContact CB-CB 3.6Å; D69-R93 VanDerWaalsContact CG-NH1 3.31Å; D69-R93 IonicContact OD1-NH1 3.99Å; D69-R93 PolarHBondContact OD1-NH1 3.34Å; D69-R93 VanDerWaalsContact OD1-NH1 3.17Å; D69-R93 IonicContact OD2-CZ 3.17Å; D69-R93 IonicContact OD2-NH1 3.54Å; D69-R93 PolarHBondContact OD2-NH1 3.19Å; D69-Q94 PolarHBondContact OD2-NE2 3.3Å
70	A	98.2	Very high	97.6	Very high	4 Å²	4	85.4 Å²	85.4	3%	0.033	41%	0.411	C	S	.	.	H	α-helix	trans	-65.6	-38.1	178.8	0	0	0	0	0	112.7	V66 I67 R68 Y73 T74 V82 D86 V87 A90	V66-A70 WeakPolarHBondContact O-CB 3.2Å; V66-A70 PolarHBondContact O-N 2.89Å; I67-A70 PolarHBondContact O-N 3.32Å; R68-A70 PolarHBondContact O-N 2.99Å; A70-Y73 PolarHBondContact O-N 3.17Å; A70-T74 PolarHBondContact O-N 2.99Å; A70-T74 PolarHBondContact O-OG1 3.33Å; A70-V82 HydrophobicContact CB-CG1 4.28Å; A70-D86 HydrophobicContact CB-CB 4.34Å; A70-V87 HydrophobicContact CB-CG2 4.28Å; A70-A90 HydrophobicContact CB-CB 4.03Å
71	V	98.1	Very high	97.7	Very high	55 Å²	55	85.7 Å²	85.7	33%	0.333	42%	0.421	S	S	.	.	H	α-helix	trans	-65.2	-40.6	173.9	170.9	0	0	0	0	110.3	I67 R68 D69 Y73 T74 E75	I67-V71 HydrophobicContact CG2-CG2 4.1Å; I67-V71 WeakPolarHBondContact O-CB 3.37Å; I67-V71 VanDerWaalsContact O-CG2 3.3Å; I67-V71 WeakPolarHBondContact O-CG2 3.45Å; I67-V71 PolarHBondContact O-N 3.38Å; R68-V71 PolarHBondContact O-N 3.02Å; D69-V71 PolarHBondContact O-N 3.48Å; V71-Y73 VanDerWaalsContact C-N 3.34Å; V71-Y73 PolarHBondContact O-N 2.83Å; V71-T74 WeakPolarHBondContact O-CA 3.17Å; V71-T74 WeakPolarHBondContact O-CB 3.4Å; V71-T74 PolarHBondContact O-N 3.38Å; V71-E75 HydrophobicContact CG1-CG 4.2Å; V71-E75 WeakPolarHBondContact O-CG 3.37Å; V71-E75 PolarHBondContact O-N 2.98Å
72	T	98	Very high	97.7	Very high	79 Å²	79	84.5 Å²	84.5	49%	0.485	41%	0.414	S	S	.	.	H	α-helix	trans	-58.1	-43.1	174.8	-57	0	0	0	0	112.5	R68 D69 T74 H76	R68-T72 PolarHBondContact O-N 3.19Å; R68-T72 VanDerWaalsContact O-N 3.09Å; R68-T72 PolarHBondContact O-OG1 3.45Å; R68-T72 VanDerWaalsContact O-OG1 3.08Å; D69-T72 WeakPolarHBondContact O-CB 3.49Å; D69-T72 PolarHBondContact O-N 2.87Å; T72-T74 VanDerWaalsContact C-N 3.34Å; T72-T74 PolarHBondContact O-N 3.42Å; T72-H76 VanDerWaalsContact O-CB 3.31Å; T72-H76 WeakPolarHBondContact O-CB 3.17Å; T72-H76 PolarHBondContact O-N 3.4Å
73	Y	97.6	Very high	97.7	Very high	81 Å²	81	83.6 Å²	83.6	32%	0.318	41%	0.413	S	S	.	.	H	α-helix	trans	-64.4	-38.4	174.1	-74.4	-64.5	0	0	0	112.8	D69 A70 V71 H76 A77 D86	D69-Y73 WeakPolarHBondContact O-CD2 3.41Å; D69-Y73 PolarHBondContact O-N 2.9Å; D69-Y73 VanDerWaalsContact O-N 3.13Å; A70-Y73 PolarHBondContact O-N 3.17Å; V71-Y73 VanDerWaalsContact C-N 3.34Å; V71-Y73 PolarHBondContact O-N 2.83Å; Y73-H76 PolarHBondContact O-N 3.17Å; Y73-A77 WeakPolarHBondContact O-CB 3.36Å; Y73-A77 PolarHBondContact O-N 3.02Å; Y73-D86 WeakPolarHBondContact CB-OD1 3.48Å
74	T	98.3	Very high	97.7	Very high	7 Å²	7	82.6 Å²	82.6	4%	0.043	41%	0.412	C	S	.	.	H	α-helix	trans	-63.6	-46.4	178.3	-56.2	0	0	0	0	111.4	A70 V71 T72 A77 K78 R79 T81 V82 D86	A70-T74 PolarHBondContact O-N 2.99Å; A70-T74 PolarHBondContact O-OG1 3.33Å; V71-T74 WeakPolarHBondContact O-CA 3.17Å; V71-T74 WeakPolarHBondContact O-CB 3.4Å; V71-T74 PolarHBondContact O-N 3.38Å; T72-T74 VanDerWaalsContact C-N 3.34Å; T72-T74 PolarHBondContact O-N 3.42Å; T74-A77 PolarHBondContact O-N 3.07Å; T74-K78 PolarHBondContact O-N 3.46Å; T74-R79 HydrophobicContact CG2-CB 4.08Å; T74-R79 WeakPolarHBondContact CG2-O 3.38Å; T74-R79 PolarHBondContact O-N 2.97Å; T74-T81 WeakPolarHBondContact CG2-O 3.35Å; T74-V82 HydrophobicContact CG2-CG2 4.24Å; T74-D86 PolarHBondContact OG1-OD2 3.46Å
75	E	98	Very high	97.7	Very high	136 Å²	136	81.5 Å²	81.5	64%	0.636	41%	0.409	S	S	*	.	H	α-helix	trans	-64.8	-44.7	177	-71.1	176.1	157.2	0	0	111.5	V71 A77 K78	V71-E75 HydrophobicContact CG1-CG 4.2Å; V71-E75 WeakPolarHBondContact O-CG 3.37Å; V71-E75 PolarHBondContact O-N 2.98Å; E75-A77 VanDerWaalsContact C-N 3.25Å; E75-A77 PolarHBondContact O-N 3.34Å; E75-K78 PolarHBondContact O-N 3.19Å
76	H	97.8	Very high	97.7	Very high	161 Å²	161	80.9 Å²	80.9	75%	0.745	40%	0.402	S	S	*	.	H	α-helix	trans	-57.7	-39.3	176.6	-179.8	69.6	0	0	0	112.1	T72 Y73 K78	T72-H76 VanDerWaalsContact O-CB 3.31Å; T72-H76 WeakPolarHBondContact O-CB 3.17Å; T72-H76 PolarHBondContact O-N 3.4Å; Y73-H76 PolarHBondContact O-N 3.17Å; H76-K78 PolarHBondContact O-N 3.41Å
77	A	97.6	Very high	97.7	Very high	45 Å²	45	82.9 Å²	82.9	37%	0.372	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	5.9	176.7	0	0	0	0	0	114.2	Y73 T74 E75 R79	Y73-A77 WeakPolarHBondContact O-CB 3.36Å; Y73-A77 PolarHBondContact O-N 3.02Å; T74-A77 PolarHBondContact O-N 3.07Å; E75-A77 VanDerWaalsContact C-N 3.25Å; E75-A77 PolarHBondContact O-N 3.34Å; A77-R79 HydrophobicContact CB-CG 4.33Å; A77-R79 VanDerWaalsContact CB-NH2 3.26Å; A77-R79 PolarHBondContact O-N 2.97Å
78	K	98	Very high	97.7	Very high	202 Å²	202	79.5 Å²	79.5	88%	0.878	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	30.3	-176.8	-57.5	177.7	-179.6	177.2	0	113.2	T74 E75 H76	T74-K78 PolarHBondContact O-N 3.46Å; E75-K78 PolarHBondContact O-N 3.19Å; H76-K78 PolarHBondContact O-N 3.41Å
79	R	98.1	Very high	97.6	Very high	90 Å²	90	77.3 Å²	77.3	34%	0.34	39%	0.391	S	S	.	.			trans	-98.7	155.1	178.1	-74.1	-177.3	-78.5	97.2	-5	110.5	T74 A77 T81 D86	T74-R79 HydrophobicContact CG2-CB 4.08Å; T74-R79 WeakPolarHBondContact CG2-O 3.38Å; T74-R79 PolarHBondContact O-N 2.97Å; A77-R79 HydrophobicContact CB-CG 4.33Å; A77-R79 VanDerWaalsContact CB-NH2 3.26Å; A77-R79 PolarHBondContact O-N 2.97Å; R79-T81 PolarHBondContact NH1-O 3.14Å; R79-T81 VanDerWaalsContact NH1-O 3.08Å; R79-D86 IonicContact CZ-OD1 3.45Å; R79-D86 IonicContact CZ-OD2 2.74Å; R79-D86 IonicContact NH1-OD1 2.7Å; R79-D86 IonicContact NH1-OD2 3.89Å; R79-D86 PolarHBondContact NH1-OD2 3.03Å; R79-D86 IonicContact NH2-OD1 3.33Å; R79-D86 PolarHBondContact NH2-OD1 2.97Å; R79-D86 IonicContact NH2-OD2 2.83Å; R79-D86 PolarHBondContact NH2-OD2 3.47Å
80	K	97.1	Very high	97.6	Very high	215 Å²	215	76.3 Å²	76.3	94%	0.935	39%	0.385	S	S	*	.	S	Bend	trans	-104.1	-0.2	171.4	-64.5	-177.5	179.4	179.4	0	112.9
81	T	97.9	Very high	97.6	Very high	102 Å²	102	77 Å²	77	63%	0.626	39%	0.388	S	S	*	.	S	Bend	trans	-123.4	120.6	-177.1	-53.5	0	0	0	0	108.6	T74 R79 T83	T74-T81 WeakPolarHBondContact CG2-O 3.35Å; R79-T81 PolarHBondContact NH1-O 3.14Å; R79-T81 VanDerWaalsContact NH1-O 3.08Å; T81-T83 PolarHBondContact O-N 2.93Å
82	V	97.6	Very high	97.6	Very high	73 Å²	73	80.7 Å²	80.7	44%	0.442	40%	0.4	S	S	.	.			trans	-68.7	126.1	171.4	-176.2	0	0	0	0	108.3	A70 T74 D86 V87	A70-V82 HydrophobicContact CB-CG1 4.28Å; T74-V82 HydrophobicContact CG2-CG2 4.24Å; V82-D86 HydrophobicContact CG1-CB 4.1Å; V82-V87 HydrophobicContact CG1-CG2 4.14Å
83	T	97.4	Very high	97.5	Very high	46 Å²	46	84.9 Å²	84.9	28%	0.282	41%	0.407	S	S	.	.			trans	-96.3	165.2	179	65.2	0	0	0	0	111.1	T81 L85 D86	T81-T83 PolarHBondContact O-N 2.93Å; T83-L85 PolarHBondContact O-N 3.41Å; T83-D86 WeakPolarHBondContact CB-OD2 3.26Å; T83-D86 PolarHBondContact N-OD2 3.18Å; T83-D86 PolarHBondContact O-N 3.06Å; T83-D86 PolarHBondContact OG1-N 2.98Å; T83-D86 PolarHBondContact OG1-OD2 3.39Å
84	S	96.7	Very high	97.3	Very high	54 Å²	54	84.1 Å²	84.1	38%	0.378	41%	0.406	S	S	.	.	H	α-helix	trans	-55.4	-41.3	170.1	46	0	0	0	0	111.8	D86 V87 V88 F101	S84-D86 PolarHBondContact O-N 3.24Å; S84-V87 PolarHBondContact O-N 2.91Å; S84-V88 WeakPolarHBondContact O-CG2 3.48Å; S84-V88 PolarHBondContact O-N 3.23Å; S84-F101 WeakPolarHBondContact CB-O 3.49Å; S84-F101 PolarHBondContact OG-O 2.66Å
85	L	96.9	Very high	97.3	Very high	65 Å²	65	87 Å²	87	34%	0.34	44%	0.437	S	S	.	.	H	α-helix	trans	-63.4	-38.8	179.7	-67.7	177.9	0	0	0	112.7	T83 V87 V88 Y89	T83-L85 PolarHBondContact O-N 3.41Å; L85-V87 VanDerWaalsContact C-N 3.25Å; L85-V87 PolarHBondContact O-N 2.98Å; L85-V88 PolarHBondContact O-N 2.79Å; L85-V88 VanDerWaalsContact O-N 3.17Å; L85-Y89 HydrophobicContact CB-CD2 4.44Å; L85-Y89 HydrophobicContact CB-CE2 4Å; L85-Y89 WeakPolarHBondContact O-CB 3.04Å; L85-Y89 WeakPolarHBondContact O-CD2 3.48Å; L85-Y89 VanDerWaalsContact O-CG 3.25Å; L85-Y89 PolarHBondContact O-N 2.96Å
86	D	97.6	Very high	97.2	Very high	4 Å²	4	87.3 Å²	87.3	2%	0.021	43%	0.432	C	S	.	.	H	α-helix	trans	-59.5	-40.1	176.5	-59.9	-47.2	0	0	0	111.3	A70 Y73 T74 R79 V82 T83 S84 A90	A70-D86 HydrophobicContact CB-CB 4.34Å; Y73-D86 WeakPolarHBondContact CB-OD1 3.48Å; T74-D86 PolarHBondContact OG1-OD2 3.46Å; R79-D86 IonicContact CZ-OD1 3.45Å; R79-D86 IonicContact CZ-OD2 2.74Å; R79-D86 IonicContact NH1-OD1 2.7Å; R79-D86 IonicContact NH1-OD2 3.89Å; R79-D86 PolarHBondContact NH1-OD2 3.03Å; R79-D86 IonicContact NH2-OD1 3.33Å; R79-D86 PolarHBondContact NH2-OD1 2.97Å; R79-D86 IonicContact NH2-OD2 2.83Å; R79-D86 PolarHBondContact NH2-OD2 3.47Å; V82-D86 HydrophobicContact CG1-CB 4.1Å; T83-D86 WeakPolarHBondContact CB-OD2 3.26Å; T83-D86 PolarHBondContact N-OD2 3.18Å; T83-D86 PolarHBondContact O-N 3.06Å; T83-D86 PolarHBondContact OG1-N 2.98Å; T83-D86 PolarHBondContact OG1-OD2 3.39Å; S84-D86 PolarHBondContact O-N 3.24Å; D86-A90 VanDerWaalsContact O-CB 3.31Å; D86-A90 WeakPolarHBondContact O-CB 3.48Å; D86-A90 PolarHBondContact O-N 3.19Å
87	V	97.7	Very high	97	Very high	51 Å²	51	83.3 Å²	83.3	31%	0.309	42%	0.419	S	S	.	.	H	α-helix	trans	-70	-42.3	176.4	-175.4	0	0	0	0	111	V66 A70 V82 S84 L85 Y89 A90 L91	V66-V87 HydrophobicContact CG1-CG1 4.24Å; A70-V87 HydrophobicContact CB-CG2 4.28Å; V82-V87 HydrophobicContact CG1-CG2 4.14Å; S84-V87 PolarHBondContact O-N 2.91Å; L85-V87 VanDerWaalsContact C-N 3.25Å; L85-V87 PolarHBondContact O-N 2.98Å; V87-Y89 VanDerWaalsContact C-N 3.33Å; V87-Y89 PolarHBondContact O-N 3.19Å; V87-A90 PolarHBondContact O-N 2.65Å; V87-L91 HydrophobicContact CG1-CD1 4Å; V87-L91 HydrophobicContact CG1-CG 4.41Å; V87-L91 WeakPolarHBondContact O-CB 3.41Å; V87-L91 VanDerWaalsContact O-CG 3.3Å; V87-L91 WeakPolarHBondContact O-CG 3.46Å; V87-L91 PolarHBondContact O-N 3.09Å
88	V	97.6	Very high	96.9	Very high	24 Å²	24	84.6 Å²	84.6	15%	0.145	42%	0.42	C	S	.	.	H	α-helix	trans	-61.3	-42.4	177	171.2	0	0	0	0	110.8	S84 L85 L91 K92 F101	S84-V88 WeakPolarHBondContact O-CG2 3.48Å; S84-V88 PolarHBondContact O-N 3.23Å; L85-V88 PolarHBondContact O-N 2.79Å; L85-V88 VanDerWaalsContact O-N 3.17Å; V88-L91 PolarHBondContact O-N 2.98Å; V88-K92 WeakPolarHBondContact O-CB 3.36Å; V88-K92 PolarHBondContact O-N 3.29Å; V88-F101 HydrophobicContact CG2-CB 3.7Å
89	Y	96.8	Very high	96.8	Very high	109 Å²	109	84.4 Å²	84.4	43%	0.427	41%	0.414	S	S	.	.	H	α-helix	trans	-68.6	-42.6	177	-63.1	-36.5	0	0	0	112.5	L85 V87 L91 K92 R93	L85-Y89 HydrophobicContact CB-CD2 4.44Å; L85-Y89 HydrophobicContact CB-CE2 4Å; L85-Y89 WeakPolarHBondContact O-CB 3.04Å; L85-Y89 WeakPolarHBondContact O-CD2 3.48Å; L85-Y89 VanDerWaalsContact O-CG 3.25Å; L85-Y89 PolarHBondContact O-N 2.96Å; V87-Y89 VanDerWaalsContact C-N 3.33Å; V87-Y89 PolarHBondContact O-N 3.19Å; Y89-L91 VanDerWaalsContact C-N 3.33Å; Y89-L91 PolarHBondContact O-N 3.46Å; Y89-K92 PolarHBondContact O-N 3.49Å; Y89-R93 WeakPolarHBondContact O-CB 3.11Å; Y89-R93 PolarHBondContact O-N 3.4Å
90	A	97.7	Very high	96.7	Very high	0 Å²	0	84 Å²	84	0%	0	44%	0.438	C	S	.	.	H	α-helix	trans	-56.6	-46.6	172.7	0	0	0	0	0	112.1	V66 D69 A70 D86 V87 R93 Q94	V66-A90 HydrophobicContact CG1-CB 4.37Å; V66-A90 WeakPolarHBondContact O-CB 3.49Å; D69-A90 HydrophobicContact CB-CB 3.6Å; A70-A90 HydrophobicContact CB-CB 4.03Å; D86-A90 VanDerWaalsContact O-CB 3.31Å; D86-A90 WeakPolarHBondContact O-CB 3.48Å; D86-A90 PolarHBondContact O-N 3.19Å; V87-A90 PolarHBondContact O-N 2.65Å; A90-R93 PolarHBondContact O-N 3.32Å; A90-Q94 WeakPolarHBondContact O-CG 3.28Å; A90-Q94 PolarHBondContact O-N 3.35Å
91	L	97.8	Very high	96.5	Very high	17 Å²	17	79 Å²	79	9%	0.089	42%	0.417	C	S	.	.	H	α-helix	trans	-65.5	-42.5	177.5	-75.8	172.2	0	0	0	112.3	F62 V66 V87 V88 Y89 R93 Q94 G95 R96 L98	F62-L91 HydrophobicContact CZ-CD2 4.13Å; V66-L91 HydrophobicContact CG1-CD2 3.96Å; V66-L91 HydrophobicContact CG1-CG 4.04Å; V66-L91 HydrophobicContact CG2-CD2 3.71Å; V87-L91 HydrophobicContact CG1-CD1 4Å; V87-L91 HydrophobicContact CG1-CG 4.41Å; V87-L91 WeakPolarHBondContact O-CB 3.41Å; V87-L91 VanDerWaalsContact O-CG 3.3Å; V87-L91 WeakPolarHBondContact O-CG 3.46Å; V87-L91 PolarHBondContact O-N 3.09Å; V88-L91 PolarHBondContact O-N 2.98Å; Y89-L91 VanDerWaalsContact C-N 3.33Å; Y89-L91 PolarHBondContact O-N 3.46Å; L91-R93 VanDerWaalsContact C-N 3.34Å; L91-R93 PolarHBondContact O-N 3.2Å; L91-Q94 CarbonylContact O-C 3.51Å; L91-Q94 PolarHBondContact O-N 3.43Å; L91-Q94 VanDerWaalsContact O-N 3.17Å; L91-G95 PolarHBondContact O-N 2.66Å; L91-R96 WeakPolarHBondContact CB-O 3.45Å; L91-R96 HydrophobicContact CD2-CB 4.22Å; L91-R96 CarbonylContact O-C 3.45Å; L91-R96 WeakPolarHBondContact O-CA 3.44Å; L91-R96 PolarHBondContact O-N 2.87Å; L91-L98 HydrophobicContact CD1-CB 3.93Å; L91-L98 HydrophobicContact CD1-CD2 3.71Å; L91-L98 HydrophobicContact CD1-CG 4.46Å
92	K	96.8	Very high	95.9	Very high	133 Å²	133	77.2 Å²	77.2	58%	0.578	42%	0.419	S	S	*	.	H	α-helix	trans	-60.7	-42.7	175.9	-173	176.6	-178.5	179.5	0	111.4	V88 Y89 Q94 G95	V88-K92 WeakPolarHBondContact O-CB 3.36Å; V88-K92 PolarHBondContact O-N 3.29Å; Y89-K92 PolarHBondContact O-N 3.49Å; K92-Q94 PolarHBondContact O-N 3.12Å; K92-G95 PolarHBondContact O-N 3.39Å; K92-G95 VanDerWaalsContact O-N 3.07Å
93	R	96.1	Very high	95.1	Very high	168 Å²	168	80 Å²	80	63%	0.634	46%	0.463	S	S	*	.	H	α-helix	trans	-59.3	-34.9	175.4	-177.7	-178.6	178.5	-92	-3.6	112.4	D69 Y89 A90 L91 G95	D69-R93 VanDerWaalsContact CG-NH1 3.31Å; D69-R93 IonicContact OD1-NH1 3.99Å; D69-R93 PolarHBondContact OD1-NH1 3.34Å; D69-R93 VanDerWaalsContact OD1-NH1 3.17Å; D69-R93 IonicContact OD2-CZ 3.17Å; D69-R93 IonicContact OD2-NH1 3.54Å; D69-R93 PolarHBondContact OD2-NH1 3.19Å; Y89-R93 WeakPolarHBondContact O-CB 3.11Å; Y89-R93 PolarHBondContact O-N 3.4Å; A90-R93 PolarHBondContact O-N 3.32Å; L91-R93 VanDerWaalsContact C-N 3.34Å; L91-R93 PolarHBondContact O-N 3.2Å; R93-G95 VanDerWaalsContact C-N 3.29Å; R93-G95 PolarHBondContact O-N 3.24Å
94	Q	94.6	Very high	95	Very high	64 Å²	64	81.8 Å²	81.8	30%	0.299	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	11.2	177.8	-65	178.5	11.7	0	0	113.9	G65 D69 A90 L91 K92 R96	G65-Q94 PolarHBondContact O-NE2 3.45Å; D69-Q94 PolarHBondContact OD2-NE2 3.3Å; A90-Q94 WeakPolarHBondContact O-CG 3.28Å; A90-Q94 PolarHBondContact O-N 3.35Å; L91-Q94 CarbonylContact O-C 3.51Å; L91-Q94 PolarHBondContact O-N 3.43Å; L91-Q94 VanDerWaalsContact O-N 3.17Å; K92-Q94 PolarHBondContact O-N 3.12Å; Q94-R96 VanDerWaalsContact C-N 3.34Å; Q94-R96 PolarHBondContact O-N 3.23Å
95	G	96.8	Very high	94.9	Very high	67 Å²	67	83.2 Å²	83.2	69%	0.691	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.8	20.4	179.6	0	0	0	0	0	114.5	L91 K92 R93	L91-G95 PolarHBondContact O-N 2.66Å; K92-G95 PolarHBondContact O-N 3.39Å; K92-G95 VanDerWaalsContact O-N 3.07Å; R93-G95 VanDerWaalsContact C-N 3.29Å; R93-G95 PolarHBondContact O-N 3.24Å
96	R	95.9	Very high	94.8	Very high	143 Å²	143	84.2 Å²	84.2	54%	0.54	48%	0.484	S	S	.	.			trans	-120.6	57.2	-176.2	-62.2	-176.3	-176.8	-148.1	0.9	112	F62 L91 Q94 L98	F62-R96 VanDerWaalsContact CE2-CZ 3.48Å; L91-R96 WeakPolarHBondContact CB-O 3.45Å; L91-R96 HydrophobicContact CD2-CB 4.22Å; L91-R96 CarbonylContact O-C 3.45Å; L91-R96 WeakPolarHBondContact O-CA 3.44Å; L91-R96 PolarHBondContact O-N 2.87Å; Q94-R96 VanDerWaalsContact C-N 3.34Å; Q94-R96 PolarHBondContact O-N 3.23Å; R96-L98 PolarHBondContact O-N 3.28Å
97	T	95	Very high	94.6	Very high	77 Å²	77	88.9 Å²	88.9	47%	0.472	51%	0.511	S	S	.	.			trans	-52.5	126.3	-178.2	-55.6	0	0	0	0	112.2	Y99	T97-Y99 HydrophobicContact CG2-CE1 4.19Å; T97-Y99 HydrophobicContact CG2-CE2 4.42Å
98	L	96.1	Very high	94.5	Very high	73 Å²	73	91.3 Å²	91.3	38%	0.382	52%	0.524	S	S	.	.			trans	-114.7	128.8	-179.8	-176.7	65.4	0	0	0	110.4	L91 R96 F101	L91-L98 HydrophobicContact CD1-CB 3.93Å; L91-L98 HydrophobicContact CD1-CD2 3.71Å; L91-L98 HydrophobicContact CD1-CG 4.46Å; R96-L98 PolarHBondContact O-N 3.28Å; L98-F101 HydrophobicContact CD1-CD2 4.48Å; L98-F101 HydrophobicContact CD1-CE2 4.16Å; L98-F101 HydrophobicContact CD2-CD2 3.61Å; L98-F101 HydrophobicContact CD2-CE2 3.63Å; L98-F101 HydrophobicContact CD2-CG 4.4Å; L98-F101 HydrophobicContact CD2-CZ 4.42Å; L98-F101 HydrophobicContact CG-CD2 3.72Å; L98-F101 HydrophobicContact CG-CE2 3.85Å
99	Y	94.9	Very high	94.2	Very high	197 Å²	197	95.8 Å²	95.8	77%	0.773	55%	0.549	S	S	*	.			trans	-98.6	155.1	178.8	-59.8	-74.5	0	0	0	111.8	T97 F101	T97-Y99 HydrophobicContact CG2-CE1 4.19Å; T97-Y99 HydrophobicContact CG2-CE2 4.42Å; Y99-F101 WeakPolarHBondContact O-CD2 3.18Å
100	G	95.9	Very high	94.1	Very high	81 Å²	81	94.9 Å²	94.9	84%	0.835	56%	0.558	S	S	*	*	S	Bend	trans	92.9	9.2	173	0	0	0	0	0	116.4
101	F	93.2	Very high	93.8	Very high	111 Å²	111	102.2 Å²	102.2	49%	0.487	60%	0.601	S	S	.	*			trans	-124.7	18.7	-175.2	-67.3	-90.4	0	0	0	114.4	S84 V88 L98 Y99	S84-F101 WeakPolarHBondContact CB-O 3.49Å; S84-F101 PolarHBondContact OG-O 2.66Å; V88-F101 HydrophobicContact CG2-CB 3.7Å; L98-F101 HydrophobicContact CD1-CD2 4.48Å; L98-F101 HydrophobicContact CD1-CE2 4.16Å; L98-F101 HydrophobicContact CD2-CD2 3.61Å; L98-F101 HydrophobicContact CD2-CE2 3.63Å; L98-F101 HydrophobicContact CD2-CG 4.4Å; L98-F101 HydrophobicContact CD2-CZ 4.42Å; L98-F101 HydrophobicContact CG-CD2 3.72Å; L98-F101 HydrophobicContact CG-CE2 3.85Å; Y99-F101 WeakPolarHBondContact O-CD2 3.18Å
102	G	85.2	Confident	93.4	Very high	65 Å²	65	109.3 Å²	109.3	67%	0.67	64%	0.643	S	S	*	*			trans	-94.5	8.5	179.9	0	0	0	0	0	115.4
103	G	81	Confident	93.1	Very high	132 Å²	132	107.1 Å²	107.1	100%	1.361	65%	0.649	S	S	*	*			trans	-84.9	0	177.3	0	0	0	0	0	113.5

Retrieved 103 of 103 residues in 148 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).