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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. Component of the UAF (upstream activation factor) complex which interacts with the upstream element of the RNA polymerase I promoter and forms a stable preinitiation complex. Together with SPT15/TBP UAF seems to stimulate basal transcription to a fully activated level.

AlphaFold DB , UniProt , Accession P02309, Species YEAST (Saccharomyces cerevisiae (strain ATCC 204508 / S288c), Baker's yeast), Gene HHF1/HHF2, Length 103 aa.

						>H4_YEAST|P02309|HHF1/HHF2
MSGRGKGGKGLGKGGAKRHRKILRDNIQGITKPAIRRLARRGGVKRISGLIYEEVRAVLKSFLESVIRDSVTYTEHAKRKTVTSLDVVYALKRQGRTLYGFGG
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.8	Very low	59.2	Low	250 Å²	250	141.4 Å²	141.4	100%	1.232	86%	0.855	S	S	*	*				0	131.5	0	-82.8	177.4	166.2	0	0	109.4	G3	M1-G3 PolarHBondContact O-N 3.48Å
2	S	52.9	Low	59.3	Low	124 Å²	124	135.3 Å²	135.3	87%	0.867	84%	0.843	S	S	*	*			trans	-78.3	108.4	-175.9	53.8	0	0	0	0	112.3
3	G	59.9	Low	59.8	Low	79 Å²	79	140.8 Å²	140.8	81%	0.814	85%	0.847	S	S	*	*			trans	-95.7	79.2	167.8	0	0	0	0	0	110.8	M1 G5	M1-G3 PolarHBondContact O-N 3.48Å; G3-G5 VanDerWaalsContact C-N 3.3Å; G3-G5 PolarHBondContact O-N 2.94Å
4	R	62.9	Low	60	Low	242 Å²	242	135.9 Å²	135.9	91%	0.913	84%	0.84	S	S	*	*			trans	-70.4	85.3	174.5	-168.3	97.8	150.3	144.4	-3.9	108.4	K6	R4-K6 PolarHBondContact O-N 3.31Å
5	G	58.6	Low	60.5	Low	69 Å²	69	131.4 Å²	131.4	71%	0.711	83%	0.83	S	S	*	*			trans	-56.4	123.2	175.2	0	0	0	0	0	110.3	G3 G7	G3-G5 VanDerWaalsContact C-N 3.3Å; G3-G5 PolarHBondContact O-N 2.94Å; G5-G7 PolarHBondContact O-N 2.91Å
6	K	63.6	Low	61.1	Low	208 Å²	208	129.3 Å²	129.3	90%	0.904	83%	0.829	S	S	*	*			trans	-57.9	102.2	169.5	-85.3	178	173.1	172.9	0	107.6	R4 G8	R4-K6 PolarHBondContact O-N 3.31Å; K6-G8 PolarHBondContact O-N 3.42Å
7	G	58.5	Low	61.8	Low	74 Å²	74	132.6 Å²	132.6	76%	0.763	83%	0.827	S	S	*	*			trans	-53.1	108.9	167.5	0	0	0	0	0	107.8	G5 K9	G5-G7 PolarHBondContact O-N 2.91Å; G7-K9 PolarHBondContact O-N 3.18Å; G7-K9 VanDerWaalsContact O-N 3.13Å
8	G	60.2	Low	62.1	Low	72 Å²	72	138.9 Å²	138.9	74%	0.742	83%	0.833	S	S	*	*			trans	-53.3	123.1	177.9	0	0	0	0	0	108	K6 G10	K6-G8 PolarHBondContact O-N 3.42Å; G8-G10 PolarHBondContact O-N 3.33Å
9	K	64.3	Low	62.7	Low	201 Å²	201	140.3 Å²	140.3	87%	0.874	83%	0.829	S	S	*	*			trans	-65.1	87.5	174.8	-163.6	166.6	-174.1	173.6	0	106.2	G7 L11	G7-K9 PolarHBondContact O-N 3.18Å; G7-K9 VanDerWaalsContact O-N 3.13Å; K9-L11 PolarHBondContact O-N 3.29Å
10	G	59.4	Low	63.1	Low	68 Å²	68	144.4 Å²	144.4	70%	0.701	83%	0.83	S	S	*	*			trans	-53.1	112.7	-179.9	0	0	0	0	0	107.4	G8 G12	G8-G10 PolarHBondContact O-N 3.33Å; G10-G12 PolarHBondContact O-N 3.11Å
11	L	63.5	Low	63.6	Low	168 Å²	168	146.4 Å²	146.4	88%	0.88	83%	0.829	S	S	*	*			trans	-62	91.6	167.8	-67.5	171.6	0	0	0	105	K9 K13	K9-L11 PolarHBondContact O-N 3.29Å; L11-K13 PolarHBondContact O-N 3.05Å
12	G	59.7	Low	64.7	Low	69 Å²	69	139.5 Å²	139.5	71%	0.711	80%	0.796	S	S	*	*			trans	-50.3	114.6	177.3	0	0	0	0	0	106.4	G10 G14	G10-G12 PolarHBondContact O-N 3.11Å; G12-G14 PolarHBondContact O-N 3.34Å
13	K	65.7	Low	66	Low	207 Å²	207	141.5 Å²	141.5	90%	0.9	80%	0.796	S	S	*	*			trans	-49.1	106.8	177.4	-76.3	-179.2	174.1	179	0	106	L11 G15	L11-K13 PolarHBondContact O-N 3.05Å; K13-G15 PolarHBondContact O-N 2.73Å
14	G	62.7	Low	67.1	Low	72 Å²	72	145.6 Å²	145.6	74%	0.742	79%	0.787	S	S	*	*			trans	-50.3	113	-177.8	0	0	0	0	0	107.4	G12 A16	G12-G14 PolarHBondContact O-N 3.34Å; G14-A16 PolarHBondContact O-N 3.11Å; G14-A16 VanDerWaalsContact O-N 3.14Å
15	G	68.3	Low	68.2	Low	68 Å²	68	139.4 Å²	139.4	70%	0.701	77%	0.772	S	S	*	*			trans	-50.9	126	-176.5	0	0	0	0	0	108.1	K13 K17	K13-G15 PolarHBondContact O-N 2.73Å; G15-K17 PolarHBondContact O-N 3.49Å
16	A	70.3	Confident	69.6	Low	97 Å²	97	140.4 Å²	140.4	80%	0.802	76%	0.761	S	S	*	*			trans	-46.9	120.1	-176.1	0	0	0	0	0	109	G14 R18	G14-A16 PolarHBondContact O-N 3.11Å; G14-A16 VanDerWaalsContact O-N 3.14Å; A16-R18 PolarHBondContact O-N 2.86Å
17	K	73	Confident	71	Confident	186 Å²	186	132.4 Å²	132.4	81%	0.809	73%	0.728	S	S	*	*			trans	-53.5	110.6	179.8	-84.9	-177.1	176.9	177	0	107.9	G15 H19	G15-K17 PolarHBondContact O-N 3.49Å; K17-H19 PolarHBondContact O-N 3.48Å; K17-H19 PolarHBondContact O-ND1 3.09Å
18	R	66.9	Low	72.7	Confident	246 Å²	246	133.7 Å²	133.7	93%	0.928	71%	0.714	S	S	*	*			trans	-69.9	104.5	179.1	-165.5	176.4	-172.6	-178.3	1.9	107.4	A16 R20	A16-R18 PolarHBondContact O-N 2.86Å; R18-R20 PolarHBondContact O-N 3.49Å
19	H	73.8	Confident	74.3	Confident	165 Å²	165	133 Å²	133	76%	0.764	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-67	117.9	176	-70.4	73	0	0	0	108.2	K17 K21	K17-H19 PolarHBondContact O-N 3.48Å; K17-H19 PolarHBondContact O-ND1 3.09Å; H19-K21 PolarHBondContact O-N 3.12Å
20	R	69.2	Low	75.8	Confident	222 Å²	222	126.4 Å²	126.4	84%	0.838	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-67.6	120.8	173.4	-173.2	166	68.1	129.8	-2.2	108.1	R18 I22	R18-R20 PolarHBondContact O-N 3.49Å; R20-I22 PolarHBondContact O-N 3.1Å
21	K	73.6	Confident	77.7	Confident	187 Å²	187	126.1 Å²	126.1	81%	0.813	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-69.7	121.2	174.5	-65.7	-176	179	-178	0	108.3	H19	H19-K21 PolarHBondContact O-N 3.12Å
22	I	71.9	Confident	79.3	Confident	105 Å²	105	123.5 Å²	123.5	54%	0.538	65%	0.647	S	S	.	*			trans	-87.7	110.9	166.3	-58.1	177	0	0	0	106.2	R20 R24	R20-I22 PolarHBondContact O-N 3.1Å; I22-R24 HydrophobicContact CG2-CB 4.26Å; I22-R24 HydrophobicContact CG2-CG 3.89Å; I22-R24 PolarHBondContact O-N 3.37Å; I22-R24 VanDerWaalsContact O-N 3.09Å
23	L	79.8	Confident	81.2	Confident	167 Å²	167	123.5 Å²	123.5	87%	0.874	64%	0.635	S	S	*	*			trans	-76.8	92.2	174.3	-61.8	177.8	0	0	0	108
24	R	83.5	Confident	82.7	Confident	165 Å²	165	114.8 Å²	114.8	62%	0.623	60%	0.601	S	S	*	*	S	Bend	trans	-144.6	157.5	172.9	66.9	-178.8	-179.4	-171.3	-1.7	109.3	I22 N26	I22-R24 HydrophobicContact CG2-CB 4.26Å; I22-R24 HydrophobicContact CG2-CG 3.89Å; I22-R24 PolarHBondContact O-N 3.37Å; I22-R24 VanDerWaalsContact O-N 3.09Å; R24-N26 WeakPolarHBondContact CG-OD1 3.48Å; R24-N26 PolarHBondContact NE-OD1 2.79Å; R24-N26 PolarHBondContact O-N 3.22Å; R24-N26 PolarHBondContact O-ND2 3.09Å
25	D	86.1	Confident	84.4	Confident	111 Å²	111	111.6 Å²	111.6	59%	0.594	57%	0.567	S	S	*	*			trans	-65.6	119.6	168.7	-165.8	-11.8	0	0	0	109.1	I27	D25-I27 VanDerWaalsContact OD1-CB 3.26Å; D25-I27 WeakPolarHBondContact OD1-CB 3.2Å; D25-I27 WeakPolarHBondContact OD1-CG2 3.18Å; D25-I27 PolarHBondContact OD1-N 3.24Å
26	N	88.7	Confident	85.8	Confident	90 Å²	90	113 Å²	113	48%	0.481	55%	0.551	S	S	.	*			trans	-112.4	19	-179.7	-64.4	-67.9	0	0	0	111.5	R24 Q28 G29	R24-N26 WeakPolarHBondContact CG-OD1 3.48Å; R24-N26 PolarHBondContact NE-OD1 2.79Å; R24-N26 PolarHBondContact O-N 3.22Å; R24-N26 PolarHBondContact O-ND2 3.09Å; N26-Q28 PolarHBondContact O-N 2.71Å; N26-Q28 VanDerWaalsContact O-N 3.15Å; N26-G29 WeakPolarHBondContact O-CA 3.29Å; N26-G29 PolarHBondContact O-N 3.2Å
27	I	93	Very high	87.2	Confident	40 Å²	40	116 Å²	116	21%	0.205	54%	0.541	C	S	.	.	G	3₁₀ helix	trans	-57.5	-34.3	-174	-165.3	53.2	0	0	0	112.8	D25 G29 I30 R56 K60	D25-I27 VanDerWaalsContact OD1-CB 3.26Å; D25-I27 WeakPolarHBondContact OD1-CB 3.2Å; D25-I27 WeakPolarHBondContact OD1-CG2 3.18Å; D25-I27 PolarHBondContact OD1-N 3.24Å; I27-G29 PolarHBondContact O-N 2.81Å; I27-I30 PolarHBondContact O-N 3.48Å; I27-I30 VanDerWaalsContact O-N 3.16Å; I27-R56 HydrophobicContact CD1-CB 3.78Å; I27-R56 HydrophobicContact CD1-CG 4.23Å; I27-R56 HydrophobicContact CG1-CB 3.73Å; I27-R56 HydrophobicContact CG1-CG 4.18Å; I27-R56 WeakPolarHBondContact O-CD 3.39Å; I27-K60 HydrophobicContact CD1-CB 4.18Å
28	Q	94.2	Very high	88.3	Confident	102 Å²	102	112.4 Å²	112.4	48%	0.477	53%	0.53	S	S	.	.	G	3₁₀ helix	trans	-70.4	-12.8	175.4	-63	-58.7	-32.9	0	0	114	N26 I30 E53	N26-Q28 PolarHBondContact O-N 2.71Å; N26-Q28 VanDerWaalsContact O-N 3.15Å; Q28-I30 CarbonylContact O-C 3.56Å; Q28-I30 PolarHBondContact O-N 2.92Å; Q28-E53 PolarHBondContact NE2-OE2 3.38Å
29	G	93.8	Very high	89.8	Confident	58 Å²	58	101.6 Å²	101.6	60%	0.598	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-61.4	-22.3	169.1	0	0	0	0	0	112.7	N26 I27 T31	N26-G29 WeakPolarHBondContact O-CA 3.29Å; N26-G29 PolarHBondContact O-N 3.2Å; I27-G29 PolarHBondContact O-N 2.81Å; G29-T31 PolarHBondContact O-N 3.34Å; G29-T31 VanDerWaalsContact O-N 3.15Å
30	I	95.6	Very high	90.9	Very high	62 Å²	62	99 Å²	99	32%	0.318	48%	0.477	S	S	.	.	S	Bend	trans	-81.3	89.1	163.8	-52.4	-58.9	0	0	0	108	I27 Q28 I35 R56 L59	I27-I30 PolarHBondContact O-N 3.48Å; I27-I30 VanDerWaalsContact O-N 3.16Å; Q28-I30 CarbonylContact O-C 3.56Å; Q28-I30 PolarHBondContact O-N 2.92Å; I30-I35 HydrophobicContact CG2-CD1 4.22Å; I30-I35 HydrophobicContact CG2-CG1 3.9Å; I30-R56 HydrophobicContact CB-CG 4.35Å; I30-R56 HydrophobicContact CG2-CG 4.5Å; I30-R56 PolarHBondContact O-NE 3.47Å; I30-R56 PolarHBondContact O-NH2 3.44Å; I30-L59 HydrophobicContact CD1-CD2 4.12Å; I30-L59 HydrophobicContact CG1-CD2 3.79Å; I30-L59 HydrophobicContact CG2-CD2 4.35Å
31	T	98.1	Very high	92.3	Very high	62 Å²	62	98.9 Å²	98.9	38%	0.38	48%	0.477	S	S	.	.			trans	-76	158.1	-171.2	63.9	0	0	0	0	112.7	G29 P33 A34 I35	G29-T31 PolarHBondContact O-N 3.34Å; G29-T31 VanDerWaalsContact O-N 3.15Å; T31-P33 VanDerWaalsContact C-N 3.32Å; T31-A34 WeakPolarHBondContact O-CB 3.45Å; T31-A34 PolarHBondContact O-N 3.13Å; T31-I35 PolarHBondContact O-N 3.42Å; T31-I35 VanDerWaalsContact O-N 3.13Å
32	K	98.1	Very high	93.4	Very high	112 Å²	112	93 Å²	93	49%	0.487	47%	0.469	S	S	.	.	H	α-helix	trans	-53.3	-41.1	175.4	-62.4	-176.2	179.2	178	0	113.1	A34 I35 R36 Y52	K32-A34 PolarHBondContact O-N 3.32Å; K32-I35 PolarHBondContact O-N 2.95Å; K32-R36 WeakPolarHBondContact O-CB 3.46Å; K32-R36 PolarHBondContact O-N 2.85Å; K32-Y52 HydrophobicContact CB-CD1 3.95Å; K32-Y52 HydrophobicContact CB-CE1 3.93Å; K32-Y52 HydrophobicContact CD-CD1 4.47Å; K32-Y52 HydrophobicContact CD-CD2 4.23Å; K32-Y52 HydrophobicContact CD-CE2 4.42Å; K32-Y52 HydrophobicContact CD-CG 4.29Å; K32-Y52 HydrophobicContact CG-CD1 3.81Å; K32-Y52 HydrophobicContact CG-CD2 4.38Å; K32-Y52 HydrophobicContact CG-CE1 4.18Å; K32-Y52 HydrophobicContact CG-CG 3.94Å
33	P	98.3	Very high	94.6	Very high	70 Å²	70	91.1 Å²	91.1	46%	0.455	48%	0.476	S	S	.	.	H	α-helix	trans	-61	-37.8	172.8	-25.9	36.1	0	0	0	113.9	T31 R36 R37	T31-P33 VanDerWaalsContact C-N 3.32Å; P33-R36 PolarHBondContact O-N 3.45Å; P33-R37 WeakPolarHBondContact O-CG 3.46Å; P33-R37 PolarHBondContact O-N 3.44Å
34	A	98.3	Very high	95.5	Very high	23 Å²	23	86 Å²	86	19%	0.19	45%	0.452	C	S	.	.	H	α-helix	trans	-63.9	-46.9	177.4	0	0	0	0	0	111.6	T31 K32 R36 R37 L38	T31-A34 WeakPolarHBondContact O-CB 3.45Å; T31-A34 PolarHBondContact O-N 3.13Å; K32-A34 PolarHBondContact O-N 3.32Å; A34-R36 VanDerWaalsContact C-N 3.33Å; A34-R36 PolarHBondContact O-N 2.71Å; A34-R37 PolarHBondContact O-N 3.42Å; A34-L38 PolarHBondContact O-N 3.35Å
35	I	98.4	Very high	96.1	Very high	5 Å²	5	86.8 Å²	86.8	3%	0.026	46%	0.46	C	S	.	.	H	α-helix	trans	-61.3	-43.8	175.4	-62.8	170.3	0	0	0	110.4	I30 T31 K32 R37 L38 A39 Y52 V55 R56	I30-I35 HydrophobicContact CG2-CD1 4.22Å; I30-I35 HydrophobicContact CG2-CG1 3.9Å; T31-I35 PolarHBondContact O-N 3.42Å; T31-I35 VanDerWaalsContact O-N 3.13Å; K32-I35 PolarHBondContact O-N 2.95Å; I35-R37 VanDerWaalsContact C-N 3.34Å; I35-R37 PolarHBondContact O-N 3.09Å; I35-L38 PolarHBondContact O-N 3.31Å; I35-A39 WeakPolarHBondContact O-CB 3.4Å; I35-A39 PolarHBondContact O-N 2.98Å; I35-Y52 HydrophobicContact CB-CD1 4.17Å; I35-Y52 HydrophobicContact CD1-CD1 4.14Å; I35-Y52 WeakPolarHBondContact CD1-O 3.49Å; I35-Y52 HydrophobicContact CG2-CD1 4.03Å; I35-Y52 HydrophobicContact CG2-CE1 4.42Å; I35-V55 HydrophobicContact CD1-CB 4.42Å; I35-V55 HydrophobicContact CD1-CG1 4.32Å; I35-V55 HydrophobicContact CG1-CG1 4.17Å; I35-V55 HydrophobicContact CG2-CB 4.39Å; I35-V55 HydrophobicContact CG2-CG1 4.23Å; I35-V55 HydrophobicContact CG2-CG2 4.35Å; I35-R56 HydrophobicContact CD1-CG 4.24Å
36	R	97.9	Very high	96.7	Very high	97 Å²	97	92 Å²	92	37%	0.366	47%	0.471	S	S	.	.	H	α-helix	trans	-59.2	-44.3	176.9	-169.8	-177.3	-52.8	-64.9	-3	111.5	K32 P33 A34 L38 A39 R40 I47 Y52	K32-R36 WeakPolarHBondContact O-CB 3.46Å; K32-R36 PolarHBondContact O-N 2.85Å; P33-R36 PolarHBondContact O-N 3.45Å; A34-R36 VanDerWaalsContact C-N 3.33Å; A34-R36 PolarHBondContact O-N 2.71Å; R36-L38 VanDerWaalsContact C-N 3.33Å; R36-L38 PolarHBondContact O-N 3.46Å; R36-A39 PolarHBondContact O-N 3.35Å; R36-R40 HydrophobicContact CG-CG 4.28Å; R36-R40 VanDerWaalsContact O-CG 3.29Å; R36-R40 WeakPolarHBondContact O-CG 3.4Å; R36-R40 PolarHBondContact O-N 3.25Å; R36-I47 HydrophobicContact CG-CD1 4.22Å; R36-Y52 PolarHBondContact NH1-OH 2.83Å; R36-Y52 PolarHBondContact NH2-OH 3.13Å
37	R	98.3	Very high	97	Very high	160 Å²	160	89.4 Å²	89.4	60%	0.604	46%	0.456	S	S	*	.	H	α-helix	trans	-59.2	-42.9	177.8	-74.4	-173.5	-60.7	-94.6	6.5	112.1	P33 A34 I35 R41	P33-R37 WeakPolarHBondContact O-CG 3.46Å; P33-R37 PolarHBondContact O-N 3.44Å; A34-R37 PolarHBondContact O-N 3.42Å; I35-R37 VanDerWaalsContact C-N 3.34Å; I35-R37 PolarHBondContact O-N 3.09Å; R37-R41 PolarHBondContact O-N 2.95Å
38	L	97	Very high	97.2	Very high	111 Å²	111	91 Å²	91	58%	0.581	47%	0.471	S	S	*	.	H	α-helix	trans	-64	-48.1	175.5	-67.8	175	0	0	0	111.7	A34 I35 R36 R40 R41 G42	A34-L38 PolarHBondContact O-N 3.35Å; I35-L38 PolarHBondContact O-N 3.31Å; R36-L38 VanDerWaalsContact C-N 3.33Å; R36-L38 PolarHBondContact O-N 3.46Å; L38-R40 VanDerWaalsContact C-N 3.32Å; L38-R40 PolarHBondContact O-N 2.87Å; L38-R41 WeakPolarHBondContact O-CB 3.46Å; L38-R41 PolarHBondContact O-N 3.21Å; L38-R41 VanDerWaalsContact O-N 3.16Å; L38-G42 PolarHBondContact O-N 3.42Å
39	A	97.6	Very high	97.3	Very high	19 Å²	19	88.7 Å²	88.7	16%	0.157	48%	0.475	C	S	.	.	H	α-helix	trans	-61.2	-39.7	178.7	0	0	0	0	0	112.1	I35 R36 G42 G43 V44 I47	I35-A39 WeakPolarHBondContact O-CB 3.4Å; I35-A39 PolarHBondContact O-N 2.98Å; R36-A39 PolarHBondContact O-N 3.35Å; A39-G42 CarbonylContact O-C 3.46Å; A39-G42 PolarHBondContact O-N 3.26Å; A39-G43 PolarHBondContact O-N 3.32Å; A39-V44 HydrophobicContact CB-CB 4.01Å; A39-V44 HydrophobicContact CB-CG1 4.48Å; A39-V44 HydrophobicContact CB-CG2 4.17Å; A39-V44 VanDerWaalsContact O-CB 3.23Å; A39-V44 WeakPolarHBondContact O-CB 3.28Å; A39-V44 WeakPolarHBondContact O-CG2 3.39Å; A39-V44 PolarHBondContact O-N 2.88Å; A39-I47 HydrophobicContact CB-CD1 3.4Å; A39-I47 VanDerWaalsContact CB-CD1 3.4Å; A39-I47 HydrophobicContact CB-CG1 4.16Å
40	R	98.1	Very high	97.5	Very high	111 Å²	111	92.9 Å²	92.9	42%	0.419	48%	0.483	S	S	.	.	H	α-helix	trans	-64.8	-41	174.4	-66.6	-40	-177.2	-149.3	7.7	112.3	R36 L38 G42 G43 V44 K45	R36-R40 HydrophobicContact CG-CG 4.28Å; R36-R40 VanDerWaalsContact O-CG 3.29Å; R36-R40 WeakPolarHBondContact O-CG 3.4Å; R36-R40 PolarHBondContact O-N 3.25Å; L38-R40 VanDerWaalsContact C-N 3.32Å; L38-R40 PolarHBondContact O-N 2.87Å; R40-G42 PolarHBondContact O-N 3.34Å; R40-G43 PolarHBondContact O-N 3.46Å; R40-V44 WeakPolarHBondContact CD-O 3.47Å; R40-V44 PolarHBondContact NH1-O 3.34Å; R40-K45 PolarHBondContact NH1-O 2.7Å; R40-K45 PolarHBondContact NH2-O 2.98Å
41	R	98.1	Very high	97.6	Very high	219 Å²	219	93.4 Å²	93.4	83%	0.826	49%	0.486	S	S	*	.	H	α-helix	trans	-61	-33.7	173.1	-174.4	179.6	-65.8	168.4	-2.1	111.9	R37 L38 G43	R37-R41 PolarHBondContact O-N 2.95Å; L38-R41 WeakPolarHBondContact O-CB 3.46Å; L38-R41 PolarHBondContact O-N 3.21Å; L38-R41 VanDerWaalsContact O-N 3.16Å; R41-G43 VanDerWaalsContact C-N 3.26Å; R41-G43 PolarHBondContact O-N 3.46Å
42	G	97.3	Very high	97.6	Very high	63 Å²	63	91.4 Å²	91.4	65%	0.649	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	9.4	173.3	0	0	0	0	0	115.4	L38 A39 R40 V44	L38-G42 PolarHBondContact O-N 3.42Å; A39-G42 CarbonylContact O-C 3.46Å; A39-G42 PolarHBondContact O-N 3.26Å; R40-G42 PolarHBondContact O-N 3.34Å; G42-V44 VanDerWaalsContact C-N 3.3Å; G42-V44 PolarHBondContact O-N 2.66Å
43	G	97.8	Very high	97.5	Very high	66 Å²	66	90.7 Å²	90.7	68%	0.68	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	8.8	178	0	0	0	0	0	115.4	A39 R40 R41 K45	A39-G43 PolarHBondContact O-N 3.32Å; R40-G43 PolarHBondContact O-N 3.46Å; R41-G43 VanDerWaalsContact C-N 3.26Å; R41-G43 PolarHBondContact O-N 3.46Å; G43-K45 PolarHBondContact O-N 3.44Å
44	V	97.3	Very high	97.5	Very high	61 Å²	61	92.8 Å²	92.8	37%	0.37	47%	0.473	S	S	.	.			trans	-71.4	118	-179.5	-177.7	0	0	0	0	109.6	A39 R40 G42 R46 I47	A39-V44 HydrophobicContact CB-CB 4.01Å; A39-V44 HydrophobicContact CB-CG1 4.48Å; A39-V44 HydrophobicContact CB-CG2 4.17Å; A39-V44 VanDerWaalsContact O-CB 3.23Å; A39-V44 WeakPolarHBondContact O-CB 3.28Å; A39-V44 WeakPolarHBondContact O-CG2 3.39Å; A39-V44 PolarHBondContact O-N 2.88Å; R40-V44 WeakPolarHBondContact CD-O 3.47Å; R40-V44 PolarHBondContact NH1-O 3.34Å; G42-V44 VanDerWaalsContact C-N 3.3Å; G42-V44 PolarHBondContact O-N 2.66Å; V44-R46 WeakPolarHBondContact CG1-O 3.5Å; V44-I47 HydrophobicContact CG1-CG1 3.69Å
45	K	97.1	Very high	97.5	Very high	181 Å²	181	94.2 Å²	94.2	79%	0.787	48%	0.48	S	S	*	.	S	Bend	trans	-81.6	-42.1	-179.6	-170.8	173.9	-177	175.2	0	113.2	R40 G43	R40-K45 PolarHBondContact NH1-O 2.7Å; R40-K45 PolarHBondContact NH2-O 2.98Å; G43-K45 PolarHBondContact O-N 3.44Å
46	R	97.9	Very high	97.5	Very high	221 Å²	221	94.2 Å²	94.2	83%	0.834	48%	0.479	S	S	*	.			trans	-129.1	144	177.8	-66.5	-178	-179.4	-95.5	1.6	110	V44	V44-R46 WeakPolarHBondContact CG1-O 3.5Å
47	I	96.1	Very high	97.5	Very high	34 Å²	34	92.2 Å²	92.2	17%	0.174	48%	0.483	C	S	.	.			trans	-128	125.9	-176	-55.9	171.1	0	0	0	107.6	R36 A39 V44 I51 Y52	R36-I47 HydrophobicContact CG-CD1 4.22Å; A39-I47 HydrophobicContact CB-CD1 3.4Å; A39-I47 VanDerWaalsContact CB-CD1 3.4Å; A39-I47 HydrophobicContact CB-CG1 4.16Å; V44-I47 HydrophobicContact CG1-CG1 3.69Å; I47-I51 HydrophobicContact CG2-CB 3.98Å; I47-I51 HydrophobicContact CG2-CG2 4.03Å; I47-Y52 HydrophobicContact CG2-CE1 4.48Å
48	S	97.1	Very high	97.5	Very high	73 Å²	73	88.7 Å²	88.7	51%	0.51	48%	0.48	S	S	.	.			trans	-69.8	151.6	174.5	173.8	0	0	0	0	111.5	L50 I51	S48-L50 VanDerWaalsContact C-N 3.28Å; S48-L50 PolarHBondContact O-N 3.22Å; S48-I51 WeakPolarHBondContact O-CB 3.38Å; S48-I51 PolarHBondContact O-N 3.23Å
49	G	96.2	Very high	97.5	Very high	55 Å²	55	86.2 Å²	86.2	57%	0.567	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-34	179.5	0	0	0	0	0	113.8	I51 Y52	G49-I51 VanDerWaalsContact C-N 3.26Å; G49-I51 PolarHBondContact O-N 3.01Å; G49-Y52 VanDerWaalsContact O-CD2 3.24Å; G49-Y52 WeakPolarHBondContact O-CD2 3.45Å
50	L	97.3	Very high	97.4	Very high	145 Å²	145	89.5 Å²	89.5	76%	0.759	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-23.9	-178.4	-61.5	177.8	0	0	0	113	S48 Y52 E53 E54	S48-L50 VanDerWaalsContact C-N 3.28Å; S48-L50 PolarHBondContact O-N 3.22Å; L50-Y52 PolarHBondContact O-N 3.44Å; L50-E53 PolarHBondContact O-N 2.93Å; L50-E54 PolarHBondContact O-N 3.15Å
51	I	97.3	Very high	97.3	Very high	73 Å²	73	87.8 Å²	87.8	37%	0.374	48%	0.482	S	S	.	.	H	α-helix	trans	-65.3	-25	-176.1	-61.7	-63.3	0	0	0	112.4	I47 S48 G49 V55	I47-I51 HydrophobicContact CG2-CB 3.98Å; I47-I51 HydrophobicContact CG2-CG2 4.03Å; S48-I51 WeakPolarHBondContact O-CB 3.38Å; S48-I51 PolarHBondContact O-N 3.23Å; G49-I51 VanDerWaalsContact C-N 3.26Å; G49-I51 PolarHBondContact O-N 3.01Å; I51-V55 HydrophobicContact CG2-CG2 3.73Å; I51-V55 WeakPolarHBondContact O-CB 3.3Å; I51-V55 WeakPolarHBondContact O-CG2 3.33Å; I51-V55 PolarHBondContact O-N 2.85Å
52	Y	97.8	Very high	97.3	Very high	20 Å²	20	81.7 Å²	81.7	8%	0.078	46%	0.462	C	S	.	.	H	α-helix	trans	-66.7	-40.9	-179	-60.6	-70.2	0	0	0	112.8	K32 I35 R36 I47 G49 L50 R56	K32-Y52 HydrophobicContact CB-CD1 3.95Å; K32-Y52 HydrophobicContact CB-CE1 3.93Å; K32-Y52 HydrophobicContact CD-CD1 4.47Å; K32-Y52 HydrophobicContact CD-CD2 4.23Å; K32-Y52 HydrophobicContact CD-CE2 4.42Å; K32-Y52 HydrophobicContact CD-CG 4.29Å; K32-Y52 HydrophobicContact CG-CD1 3.81Å; K32-Y52 HydrophobicContact CG-CD2 4.38Å; K32-Y52 HydrophobicContact CG-CE1 4.18Å; K32-Y52 HydrophobicContact CG-CG 3.94Å; I35-Y52 HydrophobicContact CB-CD1 4.17Å; I35-Y52 HydrophobicContact CD1-CD1 4.14Å; I35-Y52 WeakPolarHBondContact CD1-O 3.49Å; I35-Y52 HydrophobicContact CG2-CD1 4.03Å; I35-Y52 HydrophobicContact CG2-CE1 4.42Å; R36-Y52 PolarHBondContact NH1-OH 2.83Å; R36-Y52 PolarHBondContact NH2-OH 3.13Å; I47-Y52 HydrophobicContact CG2-CE1 4.48Å; G49-Y52 VanDerWaalsContact O-CD2 3.24Å; G49-Y52 WeakPolarHBondContact O-CD2 3.45Å; L50-Y52 PolarHBondContact O-N 3.44Å; Y52-R56 WeakPolarHBondContact O-CG 3.49Å; Y52-R56 PolarHBondContact O-NH1 2.75Å
53	E	97.3	Very high	97.2	Very high	98 Å²	98	82.5 Å²	82.5	46%	0.458	45%	0.451	S	S	.	.	H	α-helix	trans	-77.6	-37.8	176.3	-60.1	-53.1	149.2	0	0	111.1	Q28 L50 V55 R56 A57	Q28-E53 PolarHBondContact NE2-OE2 3.38Å; L50-E53 PolarHBondContact O-N 2.93Å; E53-V55 PolarHBondContact O-N 3.48Å; E53-R56 WeakPolarHBondContact O-CB 3.39Å; E53-R56 PolarHBondContact O-N 2.86Å; E53-R56 VanDerWaalsContact O-N 3.12Å; E53-R56 IonicContact OE1-CZ 3.81Å; E53-R56 IonicContact OE1-NH1 2.63Å; E53-R56 PolarHBondContact OE1-NH1 2.91Å; E53-R56 IonicContact OE2-CZ 3.88Å; E53-R56 IonicContact OE2-NH1 2.83Å; E53-R56 PolarHBondContact OE2-NH1 3.4Å; E53-A57 PolarHBondContact O-N 2.91Å
54	E	98	Very high	97.1	Very high	113 Å²	113	83.7 Å²	83.7	53%	0.528	44%	0.439	S	S	.	.	H	α-helix	trans	-58.2	-48.1	177.1	-174.9	58.5	-155.3	0	0	112.1	L50 R56 A57 V58	L50-E54 PolarHBondContact O-N 3.15Å; E54-R56 PolarHBondContact O-N 2.97Å; E54-A57 PolarHBondContact O-N 3.13Å; E54-A57 VanDerWaalsContact O-N 3.13Å; E54-V58 WeakPolarHBondContact O-CG2 3.41Å; E54-V58 PolarHBondContact O-N 2.87Å
55	V	98.2	Very high	97.1	Very high	53 Å²	53	82.7 Å²	82.7	32%	0.321	43%	0.434	S	S	.	.	H	α-helix	trans	-60.7	-35.2	178.2	168.7	0	0	0	0	111.6	I35 I51 E53 L59	I35-V55 HydrophobicContact CD1-CB 4.42Å; I35-V55 HydrophobicContact CD1-CG1 4.32Å; I35-V55 HydrophobicContact CG1-CG1 4.17Å; I35-V55 HydrophobicContact CG2-CB 4.39Å; I35-V55 HydrophobicContact CG2-CG1 4.23Å; I35-V55 HydrophobicContact CG2-CG2 4.35Å; I51-V55 HydrophobicContact CG2-CG2 3.73Å; I51-V55 WeakPolarHBondContact O-CB 3.3Å; I51-V55 WeakPolarHBondContact O-CG2 3.33Å; I51-V55 PolarHBondContact O-N 2.85Å; E53-V55 PolarHBondContact O-N 3.48Å; V55-L59 VanDerWaalsContact O-CB 3.28Å; V55-L59 WeakPolarHBondContact O-CB 3.27Å; V55-L59 PolarHBondContact O-N 3.14Å
56	R	98.1	Very high	97.1	Very high	6 Å²	6	74.6 Å²	74.6	2%	0.023	40%	0.4	C	S	.	.	H	α-helix	trans	-68.3	-43.4	176.2	-75.4	-176.3	-162.2	123.1	-17.4	111.7	I27 I30 I35 Y52 E53 E54 L59 K60	I27-R56 HydrophobicContact CD1-CB 3.78Å; I27-R56 HydrophobicContact CD1-CG 4.23Å; I27-R56 HydrophobicContact CG1-CB 3.73Å; I27-R56 HydrophobicContact CG1-CG 4.18Å; I27-R56 WeakPolarHBondContact O-CD 3.39Å; I30-R56 HydrophobicContact CB-CG 4.35Å; I30-R56 HydrophobicContact CG2-CG 4.5Å; I30-R56 PolarHBondContact O-NE 3.47Å; I30-R56 PolarHBondContact O-NH2 3.44Å; I35-R56 HydrophobicContact CD1-CG 4.24Å; Y52-R56 WeakPolarHBondContact O-CG 3.49Å; Y52-R56 PolarHBondContact O-NH1 2.75Å; E53-R56 WeakPolarHBondContact O-CB 3.39Å; E53-R56 PolarHBondContact O-N 2.86Å; E53-R56 VanDerWaalsContact O-N 3.12Å; E53-R56 IonicContact OE1-CZ 3.81Å; E53-R56 IonicContact OE1-NH1 2.63Å; E53-R56 PolarHBondContact OE1-NH1 2.91Å; E53-R56 IonicContact OE2-CZ 3.88Å; E53-R56 IonicContact OE2-NH1 2.83Å; E53-R56 PolarHBondContact OE2-NH1 3.4Å; E54-R56 PolarHBondContact O-N 2.97Å; R56-L59 PolarHBondContact O-N 2.8Å; R56-K60 WeakPolarHBondContact O-CB 3.31Å; R56-K60 PolarHBondContact O-N 2.89Å
57	A	97.4	Very high	97.1	Very high	54 Å²	54	68.8 Å²	68.8	45%	0.446	39%	0.385	S	S	.	.	H	α-helix	trans	-60.5	-47.4	176.6	0	0	0	0	0	111.5	E53 E54 L59 K60 S61	E53-A57 PolarHBondContact O-N 2.91Å; E54-A57 PolarHBondContact O-N 3.13Å; E54-A57 VanDerWaalsContact O-N 3.13Å; A57-L59 PolarHBondContact O-N 3.38Å; A57-K60 PolarHBondContact O-N 3.43Å; A57-S61 WeakPolarHBondContact O-CB 3.38Å; A57-S61 PolarHBondContact O-N 2.93Å
58	V	97.7	Very high	97.2	Very high	87 Å²	87	74.2 Å²	74.2	53%	0.527	40%	0.403	S	S	.	.	H	α-helix	trans	-59.9	-46.1	176.6	172.9	0	0	0	0	111.3	E54 K60 S61 F62	E54-V58 WeakPolarHBondContact O-CG2 3.41Å; E54-V58 PolarHBondContact O-N 2.87Å; V58-K60 PolarHBondContact O-N 3.45Å; V58-S61 PolarHBondContact O-N 3.06Å; V58-F62 WeakPolarHBondContact O-CB 3.46Å; V58-F62 PolarHBondContact O-N 2.95Å
59	L	97.2	Very high	97.2	Very high	59 Å²	59	71.6 Å²	71.6	31%	0.309	38%	0.383	S	S	.	.	H	α-helix	trans	-61.2	-44.6	178	175.9	62.5	0	0	0	111.9	I30 V55 R56 A57 F62 L63	I30-L59 HydrophobicContact CD1-CD2 4.12Å; I30-L59 HydrophobicContact CG1-CD2 3.79Å; I30-L59 HydrophobicContact CG2-CD2 4.35Å; V55-L59 VanDerWaalsContact O-CB 3.28Å; V55-L59 WeakPolarHBondContact O-CB 3.27Å; V55-L59 PolarHBondContact O-N 3.14Å; R56-L59 PolarHBondContact O-N 2.8Å; A57-L59 PolarHBondContact O-N 3.38Å; L59-F62 PolarHBondContact O-N 3.29Å; L59-L63 HydrophobicContact CD1-CD1 3.89Å; L59-L63 HydrophobicContact CD1-CG 4.12Å; L59-L63 HydrophobicContact CG-CD1 4.07Å; L59-L63 WeakPolarHBondContact O-CB 3.29Å; L59-L63 WeakPolarHBondContact O-CG 3.28Å; L59-L63 PolarHBondContact O-N 3.38Å
60	K	96.1	Very high	97.2	Very high	88 Å²	88	69.2 Å²	69.2	38%	0.383	36%	0.358	S	S	.	.	H	α-helix	trans	-62	-50.7	178.5	-179.6	173.1	176.7	177.1	0	110.9	I27 R56 A57 V58 F62 L63 E64	I27-K60 HydrophobicContact CD1-CB 4.18Å; R56-K60 WeakPolarHBondContact O-CB 3.31Å; R56-K60 PolarHBondContact O-N 2.89Å; A57-K60 PolarHBondContact O-N 3.43Å; V58-K60 PolarHBondContact O-N 3.45Å; K60-F62 VanDerWaalsContact C-N 3.32Å; K60-F62 PolarHBondContact O-N 2.88Å; K60-L63 PolarHBondContact O-N 3.47Å; K60-E64 WeakPolarHBondContact CE-OE1 3.42Å; K60-E64 HydrophobicContact CG-CG 4.32Å; K60-E64 VanDerWaalsContact CG-OE1 3.31Å; K60-E64 WeakPolarHBondContact CG-OE1 3.33Å; K60-E64 WeakPolarHBondContact O-CB 3.34Å; K60-E64 VanDerWaalsContact O-CG 3.29Å; K60-E64 WeakPolarHBondContact O-CG 3.35Å; K60-E64 PolarHBondContact O-N 3.22Å
61	S	96.7	Very high	97.3	Very high	75 Å²	75	64.8 Å²	64.8	52%	0.524	34%	0.337	S	S	.	.	H	α-helix	trans	-57.6	-44.4	178.3	177.5	0	0	0	0	112.1	A57 V58 E64 S65	A57-S61 WeakPolarHBondContact O-CB 3.38Å; A57-S61 PolarHBondContact O-N 2.93Å; V58-S61 PolarHBondContact O-N 3.06Å; S61-E64 PolarHBondContact O-N 2.76Å; S61-S65 PolarHBondContact O-N 3Å
62	F	96.6	Very high	97.3	Very high	91 Å²	91	65.1 Å²	65.1	40%	0.399	34%	0.342	S	S	.	.	H	α-helix	trans	-59.5	-51.5	175.8	174.5	-102.3	0	0	0	111.9	V58 L59 K60 E64 S65 V66 L91	V58-F62 WeakPolarHBondContact O-CB 3.46Å; V58-F62 PolarHBondContact O-N 2.95Å; L59-F62 PolarHBondContact O-N 3.29Å; K60-F62 VanDerWaalsContact C-N 3.32Å; K60-F62 PolarHBondContact O-N 2.88Å; F62-E64 PolarHBondContact O-N 3.02Å; F62-S65 PolarHBondContact O-N 2.94Å; F62-V66 HydrophobicContact CD2-CG2 4.49Å; F62-V66 HydrophobicContact CE1-CG2 4.28Å; F62-V66 HydrophobicContact CE2-CG2 4.02Å; F62-V66 HydrophobicContact CZ-CG2 3.91Å; F62-V66 WeakPolarHBondContact O-CG2 3.49Å; F62-V66 PolarHBondContact O-N 3.45Å; F62-V66 VanDerWaalsContact O-N 3.13Å; F62-L91 HydrophobicContact CZ-CD2 4.23Å
63	L	96.1	Very high	97.3	Very high	80 Å²	80	67.8 Å²	67.8	42%	0.419	35%	0.353	S	S	.	.	H	α-helix	trans	-64.6	-39.9	-179.2	-70.6	174.3	0	0	0	112.1	L59 K60 S65 V66 I67	L59-L63 HydrophobicContact CD1-CD1 3.89Å; L59-L63 HydrophobicContact CD1-CG 4.12Å; L59-L63 HydrophobicContact CG-CD1 4.07Å; L59-L63 WeakPolarHBondContact O-CB 3.29Å; L59-L63 WeakPolarHBondContact O-CG 3.28Å; L59-L63 PolarHBondContact O-N 3.38Å; K60-L63 PolarHBondContact O-N 3.47Å; L63-S65 VanDerWaalsContact C-N 3.32Å; L63-S65 PolarHBondContact O-N 3.47Å; L63-V66 PolarHBondContact O-N 2.92Å; L63-I67 HydrophobicContact CB-CD1 4.39Å; L63-I67 VanDerWaalsContact O-CB 3.28Å; L63-I67 WeakPolarHBondContact O-CB 3.41Å; L63-I67 WeakPolarHBondContact O-CD1 3.16Å; L63-I67 WeakPolarHBondContact O-CG1 3.44Å; L63-I67 PolarHBondContact O-N 2.85Å
64	E	96.4	Very high	97.3	Very high	90 Å²	90	63.4 Å²	63.4	42%	0.421	33%	0.333	S	S	.	.	H	α-helix	trans	-59.8	-43	176.3	-77	175.1	178.7	0	0	111.9	K60 S61 F62 R68	K60-E64 WeakPolarHBondContact CE-OE1 3.42Å; K60-E64 HydrophobicContact CG-CG 4.32Å; K60-E64 VanDerWaalsContact CG-OE1 3.31Å; K60-E64 WeakPolarHBondContact CG-OE1 3.33Å; K60-E64 WeakPolarHBondContact O-CB 3.34Å; K60-E64 VanDerWaalsContact O-CG 3.29Å; K60-E64 WeakPolarHBondContact O-CG 3.35Å; K60-E64 PolarHBondContact O-N 3.22Å; S61-E64 PolarHBondContact O-N 2.76Å; F62-E64 PolarHBondContact O-N 3.02Å; E64-R68 VanDerWaalsContact O-CB 3.3Å; E64-R68 WeakPolarHBondContact O-CB 2.91Å; E64-R68 PolarHBondContact O-N 2.99Å
65	S	97	Very high	97.3	Very high	40 Å²	40	64.2 Å²	64.2	28%	0.28	34%	0.336	S	S	.	.	H	α-helix	trans	-61	-50.9	176.5	-171.6	0	0	0	0	112	S61 F62 L63 R68 D69 Q94	S61-S65 PolarHBondContact O-N 3Å; F62-S65 PolarHBondContact O-N 2.94Å; L63-S65 VanDerWaalsContact C-N 3.32Å; L63-S65 PolarHBondContact O-N 3.47Å; S65-R68 PolarHBondContact O-N 3.31Å; S65-D69 PolarHBondContact O-N 3.02Å; S65-Q94 PolarHBondContact O-NE2 2.84Å; S65-Q94 PolarHBondContact OG-NE2 2.94Å
66	V	97.2	Very high	97.2	Very high	11 Å²	11	69.6 Å²	69.6	7%	0.067	36%	0.358	C	S	.	.	H	α-helix	trans	-65.5	-42	-178.7	176	0	0	0	0	111.6	F62 L63 S70 V87 A90 L91	F62-V66 HydrophobicContact CD2-CG2 4.49Å; F62-V66 HydrophobicContact CE1-CG2 4.28Å; F62-V66 HydrophobicContact CE2-CG2 4.02Å; F62-V66 HydrophobicContact CZ-CG2 3.91Å; F62-V66 WeakPolarHBondContact O-CG2 3.49Å; F62-V66 PolarHBondContact O-N 3.45Å; F62-V66 VanDerWaalsContact O-N 3.13Å; L63-V66 PolarHBondContact O-N 2.92Å; V66-S70 WeakPolarHBondContact O-CB 3.31Å; V66-S70 PolarHBondContact O-N 3Å; V66-S70 PolarHBondContact O-OG 3.22Å; V66-V87 HydrophobicContact CG1-CG1 4.23Å; V66-A90 HydrophobicContact CG1-CB 4.39Å; V66-L91 HydrophobicContact CG1-CD2 4.04Å; V66-L91 HydrophobicContact CG1-CG 4.16Å; V66-L91 HydrophobicContact CG2-CD2 3.78Å
67	I	97	Very high	97.2	Very high	99 Å²	99	71.5 Å²	71.5	51%	0.508	38%	0.375	S	S	.	.	H	α-helix	trans	-66.5	-40.6	-179.8	-69.8	167.2	0	0	0	110.7	L63 D69 S70 V71	L63-I67 HydrophobicContact CB-CD1 4.39Å; L63-I67 VanDerWaalsContact O-CB 3.28Å; L63-I67 WeakPolarHBondContact O-CB 3.41Å; L63-I67 WeakPolarHBondContact O-CD1 3.16Å; L63-I67 WeakPolarHBondContact O-CG1 3.44Å; L63-I67 PolarHBondContact O-N 2.85Å; I67-D69 PolarHBondContact O-N 3.23Å; I67-S70 PolarHBondContact O-N 3.09Å; I67-V71 HydrophobicContact CG2-CG2 4.17Å; I67-V71 WeakPolarHBondContact O-CG2 3.43Å; I67-V71 PolarHBondContact O-N 3.45Å
68	R	97.8	Very high	97.2	Very high	148 Å²	148	78.5 Å²	78.5	56%	0.558	40%	0.395	S	S	*	.	H	α-helix	trans	-56	-52.1	177.5	-173.4	-176.7	-59.5	106.9	1.5	111	E64 S65 S70 V71 T72	E64-R68 VanDerWaalsContact O-CB 3.3Å; E64-R68 WeakPolarHBondContact O-CB 2.91Å; E64-R68 PolarHBondContact O-N 2.99Å; S65-R68 PolarHBondContact O-N 3.31Å; R68-S70 VanDerWaalsContact C-N 3.34Å; R68-S70 PolarHBondContact O-N 3.34Å; R68-V71 PolarHBondContact O-N 3.48Å; R68-T72 PolarHBondContact O-N 3.29Å; R68-T72 VanDerWaalsContact O-N 3.09Å; R68-T72 PolarHBondContact O-OG1 3.13Å; R68-T72 VanDerWaalsContact O-OG1 3.11Å
69	D	97.3	Very high	97.1	Very high	19 Å²	19	78.5 Å²	78.5	10%	0.102	39%	0.386	C	S	.	.	H	α-helix	trans	-62.5	-41.2	177.9	-70.6	-11	0	0	0	111.9	S65 I67 V71 T72 Y73 A90 R93 Q94	S65-D69 PolarHBondContact O-N 3.02Å; I67-D69 PolarHBondContact O-N 3.23Å; D69-V71 VanDerWaalsContact C-N 3.34Å; D69-V71 PolarHBondContact O-N 2.96Å; D69-T72 WeakPolarHBondContact O-CB 3.39Å; D69-T72 PolarHBondContact O-N 3.46Å; D69-Y73 WeakPolarHBondContact O-CD2 3.28Å; D69-Y73 PolarHBondContact O-N 2.96Å; D69-Y73 VanDerWaalsContact O-N 3.1Å; D69-A90 HydrophobicContact CB-CB 3.55Å; D69-R93 IonicContact OD1-CZ 3.62Å; D69-R93 IonicContact OD1-NH1 3.49Å; D69-R93 PolarHBondContact OD1-NH1 2.63Å; D69-R93 IonicContact OD2-CZ 3.64Å; D69-R93 IonicContact OD2-NH1 3.34Å; D69-R93 PolarHBondContact OD2-NH1 3.25Å; D69-Q94 PolarHBondContact OD2-NE2 2.92Å
70	S	97.7	Very high	97	Very high	4 Å²	4	85.9 Å²	85.9	3%	0.028	42%	0.415	C	S	.	.	H	α-helix	trans	-63.4	-39.4	179.6	-56.5	0	0	0	0	112.2	V66 I67 R68 Y73 T74 V87 A90	V66-S70 WeakPolarHBondContact O-CB 3.31Å; V66-S70 PolarHBondContact O-N 3Å; V66-S70 PolarHBondContact O-OG 3.22Å; I67-S70 PolarHBondContact O-N 3.09Å; R68-S70 VanDerWaalsContact C-N 3.34Å; R68-S70 PolarHBondContact O-N 3.34Å; S70-Y73 PolarHBondContact O-N 2.91Å; S70-T74 PolarHBondContact O-N 2.99Å; S70-T74 VanDerWaalsContact O-N 3.12Å; S70-T74 PolarHBondContact O-OG1 3Å; S70-V87 WeakPolarHBondContact OG-CA 3.39Å; S70-A90 WeakPolarHBondContact OG-CB 3.47Å
71	V	97.9	Very high	97	Very high	52 Å²	52	86.7 Å²	86.7	32%	0.315	43%	0.428	S	S	.	.	H	α-helix	trans	-66.1	-42.5	175.5	170.4	0	0	0	0	110.1	I67 R68 D69 Y73 T74 E75	I67-V71 HydrophobicContact CG2-CG2 4.17Å; I67-V71 WeakPolarHBondContact O-CG2 3.43Å; I67-V71 PolarHBondContact O-N 3.45Å; R68-V71 PolarHBondContact O-N 3.48Å; D69-V71 VanDerWaalsContact C-N 3.34Å; D69-V71 PolarHBondContact O-N 2.96Å; V71-Y73 VanDerWaalsContact C-N 3.35Å; V71-Y73 PolarHBondContact O-N 3.36Å; V71-T74 WeakPolarHBondContact O-CB 3.39Å; V71-T74 PolarHBondContact O-N 2.95Å; V71-T74 VanDerWaalsContact O-N 3.09Å; V71-E75 HydrophobicContact CG1-CG 4.11Å; V71-E75 WeakPolarHBondContact O-CG 3.2Å; V71-E75 PolarHBondContact O-N 3.25Å
72	T	98	Very high	96.9	Very high	80 Å²	80	86.3 Å²	86.3	49%	0.491	42%	0.422	S	S	.	.	H	α-helix	trans	-57.2	-44.3	176	-57.1	0	0	0	0	112.4	R68 D69 T74 E75 H76	R68-T72 PolarHBondContact O-N 3.29Å; R68-T72 VanDerWaalsContact O-N 3.09Å; R68-T72 PolarHBondContact O-OG1 3.13Å; R68-T72 VanDerWaalsContact O-OG1 3.11Å; D69-T72 WeakPolarHBondContact O-CB 3.39Å; D69-T72 PolarHBondContact O-N 3.46Å; T72-T74 VanDerWaalsContact C-N 3.35Å; T72-T74 PolarHBondContact O-N 2.81Å; T72-E75 PolarHBondContact O-N 3.12Å; T72-H76 VanDerWaalsContact O-CB 3.29Å; T72-H76 WeakPolarHBondContact O-CB 3.37Å; T72-H76 PolarHBondContact O-N 3.43Å
73	Y	96.8	Very high	96.8	Very high	77 Å²	77	84.5 Å²	84.5	30%	0.302	42%	0.418	S	S	.	.	H	α-helix	trans	-64.4	-38.9	175.3	-73.5	-62.1	0	0	0	113	D69 S70 V71 H76 A77 A90	D69-Y73 WeakPolarHBondContact O-CD2 3.28Å; D69-Y73 PolarHBondContact O-N 2.96Å; D69-Y73 VanDerWaalsContact O-N 3.1Å; S70-Y73 PolarHBondContact O-N 2.91Å; V71-Y73 VanDerWaalsContact C-N 3.35Å; V71-Y73 PolarHBondContact O-N 3.36Å; Y73-H76 PolarHBondContact O-N 2.96Å; Y73-A77 PolarHBondContact O-N 3.29Å; Y73-A77 VanDerWaalsContact O-N 3.11Å; Y73-A90 HydrophobicContact CD2-CB 4.5Å; Y73-A90 HydrophobicContact CE2-CB 4.44Å
74	T	98.1	Very high	96.7	Very high	6 Å²	6	84.2 Å²	84.2	4%	0.037	42%	0.423	C	S	.	.	H	α-helix	trans	-64.4	-45.8	178.8	-57.7	0	0	0	0	111.4	S70 V71 T72 A77 K78 R79 T81 V82 D86	S70-T74 PolarHBondContact O-N 2.99Å; S70-T74 VanDerWaalsContact O-N 3.12Å; S70-T74 PolarHBondContact O-OG1 3Å; V71-T74 WeakPolarHBondContact O-CB 3.39Å; V71-T74 PolarHBondContact O-N 2.95Å; V71-T74 VanDerWaalsContact O-N 3.09Å; T72-T74 VanDerWaalsContact C-N 3.35Å; T72-T74 PolarHBondContact O-N 2.81Å; T74-A77 PolarHBondContact O-N 3.41Å; T74-K78 PolarHBondContact O-N 2.83Å; T74-R79 HydrophobicContact CG2-CB 3.99Å; T74-R79 WeakPolarHBondContact CG2-O 3.26Å; T74-R79 PolarHBondContact O-N 3.15Å; T74-T81 WeakPolarHBondContact CG2-O 3.41Å; T74-V82 HydrophobicContact CG2-CG2 4.24Å; T74-V82 WeakPolarHBondContact OG1-CA 3.34Å; T74-D86 PolarHBondContact OG1-OD2 3.39Å
75	E	97.6	Very high	96.6	Very high	130 Å²	130	82.9 Å²	82.9	61%	0.607	42%	0.419	S	S	*	.	H	α-helix	trans	-66.9	-41.5	178.2	-71.9	178.3	162.7	0	0	111.5	V71 T72 A77 K78	V71-E75 HydrophobicContact CG1-CG 4.11Å; V71-E75 WeakPolarHBondContact O-CG 3.2Å; V71-E75 PolarHBondContact O-N 3.25Å; T72-E75 PolarHBondContact O-N 3.12Å; E75-A77 PolarHBondContact O-N 3.2Å; E75-K78 WeakPolarHBondContact O-CA 3.39Å; E75-K78 PolarHBondContact O-N 3.27Å
76	H	97.1	Very high	96.5	Very high	165 Å²	165	81.2 Å²	81.2	76%	0.764	41%	0.407	S	S	*	.	H	α-helix	trans	-57.8	-38	174.9	-177.5	70.1	0	0	0	112	T72 Y73 K78	T72-H76 VanDerWaalsContact O-CB 3.29Å; T72-H76 WeakPolarHBondContact O-CB 3.37Å; T72-H76 PolarHBondContact O-N 3.43Å; Y73-H76 PolarHBondContact O-N 2.96Å; H76-K78 PolarHBondContact O-N 3.25Å
77	A	96.7	Very high	96.5	Very high	47 Å²	47	83 Å²	83	39%	0.388	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	9.1	175.8	0	0	0	0	0	114.3	Y73 T74 E75 R79	Y73-A77 PolarHBondContact O-N 3.29Å; Y73-A77 VanDerWaalsContact O-N 3.11Å; T74-A77 PolarHBondContact O-N 3.41Å; E75-A77 PolarHBondContact O-N 3.2Å; A77-R79 HydrophobicContact CB-CG 4.44Å; A77-R79 VanDerWaalsContact CB-NE 3.31Å; A77-R79 PolarHBondContact O-N 2.82Å
78	K	97.5	Very high	96.4	Very high	200 Å²	200	79 Å²	79	87%	0.87	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	30.5	-178.2	-55.8	179.8	-178.5	178.2	0	113.6	T74 E75 H76	T74-K78 PolarHBondContact O-N 2.83Å; E75-K78 WeakPolarHBondContact O-CA 3.39Å; E75-K78 PolarHBondContact O-N 3.27Å; H76-K78 PolarHBondContact O-N 3.25Å
79	R	96.3	Very high	96.2	Very high	87 Å²	87	77.4 Å²	77.4	33%	0.328	39%	0.393	S	S	.	.			trans	-101.6	155.1	178.2	-72.2	178.4	-73.9	105.5	-5.6	110.6	T74 A77 T81 D86	T74-R79 HydrophobicContact CG2-CB 3.99Å; T74-R79 WeakPolarHBondContact CG2-O 3.26Å; T74-R79 PolarHBondContact O-N 3.15Å; A77-R79 HydrophobicContact CB-CG 4.44Å; A77-R79 VanDerWaalsContact CB-NE 3.31Å; A77-R79 PolarHBondContact O-N 2.82Å; R79-T81 PolarHBondContact NH1-O 3.16Å; R79-D86 IonicContact CZ-OD1 3.91Å; R79-D86 IonicContact CZ-OD2 2.71Å; R79-D86 IonicContact NH1-OD1 3.85Å; R79-D86 IonicContact NH1-OD2 2.83Å; R79-D86 PolarHBondContact NH1-OD2 3.16Å; R79-D86 IonicContact NH2-OD1 2.71Å; R79-D86 PolarHBondContact NH2-OD1 2.92Å; R79-D86 IonicContact NH2-OD2 2.73Å; R79-D86 PolarHBondContact NH2-OD2 3.26Å
80	K	95.3	Very high	96.2	Very high	215 Å²	215	76.5 Å²	76.5	94%	0.935	39%	0.388	S	S	*	.	S	Bend	trans	-104.6	-1.5	173.5	-62.9	-177.2	-179.3	179.3	0	113.3
81	T	95.6	Very high	96.1	Very high	104 Å²	104	77.2 Å²	77.2	64%	0.638	39%	0.391	S	S	*	.	S	Bend	trans	-124.7	120.2	-177.5	-57.3	0	0	0	0	108.5	T74 R79 T83	T74-T81 WeakPolarHBondContact CG2-O 3.41Å; R79-T81 PolarHBondContact NH1-O 3.16Å; T81-T83 PolarHBondContact O-N 3.37Å
82	V	95.3	Very high	96	Very high	68 Å²	68	81 Å²	81	41%	0.412	40%	0.403	S	S	.	.			trans	-66.7	129.1	172.4	-174.5	0	0	0	0	108.5	T74 D86 V87	T74-V82 HydrophobicContact CG2-CG2 4.24Å; T74-V82 WeakPolarHBondContact OG1-CA 3.34Å; V82-D86 HydrophobicContact CG1-CB 3.97Å; V82-V87 HydrophobicContact CG1-CG2 4.01Å
83	T	94.6	Very high	95.8	Very high	52 Å²	52	84.9 Å²	84.9	32%	0.319	41%	0.409	S	S	.	.			trans	-98.4	165.3	176.1	66.4	0	0	0	0	110.4	T81 L85 D86	T81-T83 PolarHBondContact O-N 3.37Å; T83-L85 PolarHBondContact O-N 3.19Å; T83-D86 WeakPolarHBondContact CB-OD2 3.44Å; T83-D86 PolarHBondContact N-OD2 3.06Å; T83-D86 PolarHBondContact O-N 2.98Å; T83-D86 VanDerWaalsContact OG1-CG 3.27Å; T83-D86 PolarHBondContact OG1-N 3.4Å; T83-D86 PolarHBondContact OG1-OD2 3.36Å
84	S	93.6	Very high	95.6	Very high	74 Å²	74	84 Å²	84	52%	0.517	41%	0.407	S	S	.	.	H	α-helix	trans	-57.7	-37.2	172.9	46.5	0	0	0	0	112	D86 V87 V88	S84-D86 VanDerWaalsContact C-N 3.35Å; S84-D86 PolarHBondContact O-N 3.29Å; S84-V87 PolarHBondContact O-N 2.91Å; S84-V88 VanDerWaalsContact O-CG2 3.27Å; S84-V88 WeakPolarHBondContact O-CG2 3.42Å; S84-V88 PolarHBondContact O-N 3.46Å
85	L	94.1	Very high	95.4	Very high	63 Å²	63	86.7 Å²	86.7	33%	0.33	44%	0.437	S	S	.	.	H	α-helix	trans	-63.5	-38.8	179.2	-67.7	178.3	0	0	0	112.3	T83 V87 V88 Y89	T83-L85 PolarHBondContact O-N 3.19Å; L85-V87 VanDerWaalsContact C-N 3.27Å; L85-V87 PolarHBondContact O-N 3.37Å; L85-V88 PolarHBondContact O-N 3.4Å; L85-Y89 HydrophobicContact CB-CE2 4.09Å; L85-Y89 WeakPolarHBondContact O-CB 3.46Å; L85-Y89 WeakPolarHBondContact O-CD2 3.44Å; L85-Y89 PolarHBondContact O-N 3.18Å
86	D	95.6	Very high	95.2	Very high	4 Å²	4	88.8 Å²	88.8	2%	0.021	44%	0.439	C	S	.	.	H	α-helix	trans	-60.4	-40.2	177.2	-57.8	-52.4	0	0	0	111.4	T74 R79 V82 T83 S84 A90	T74-D86 PolarHBondContact OG1-OD2 3.39Å; R79-D86 IonicContact CZ-OD1 3.91Å; R79-D86 IonicContact CZ-OD2 2.71Å; R79-D86 IonicContact NH1-OD1 3.85Å; R79-D86 IonicContact NH1-OD2 2.83Å; R79-D86 PolarHBondContact NH1-OD2 3.16Å; R79-D86 IonicContact NH2-OD1 2.71Å; R79-D86 PolarHBondContact NH2-OD1 2.92Å; R79-D86 IonicContact NH2-OD2 2.73Å; R79-D86 PolarHBondContact NH2-OD2 3.26Å; V82-D86 HydrophobicContact CG1-CB 3.97Å; T83-D86 WeakPolarHBondContact CB-OD2 3.44Å; T83-D86 PolarHBondContact N-OD2 3.06Å; T83-D86 PolarHBondContact O-N 2.98Å; T83-D86 VanDerWaalsContact OG1-CG 3.27Å; T83-D86 PolarHBondContact OG1-N 3.4Å; T83-D86 PolarHBondContact OG1-OD2 3.36Å; S84-D86 VanDerWaalsContact C-N 3.35Å; S84-D86 PolarHBondContact O-N 3.29Å; D86-A90 WeakPolarHBondContact O-CB 3.37Å; D86-A90 PolarHBondContact O-N 3.44Å
87	V	95.8	Very high	94.9	Very high	50 Å²	50	83.8 Å²	83.8	30%	0.303	42%	0.42	S	S	.	.	H	α-helix	trans	-69.6	-41.3	176.9	-178.2	0	0	0	0	111.4	V66 S70 V82 S84 L85 Y89 A90 L91	V66-V87 HydrophobicContact CG1-CG1 4.23Å; S70-V87 WeakPolarHBondContact OG-CA 3.39Å; V82-V87 HydrophobicContact CG1-CG2 4.01Å; S84-V87 PolarHBondContact O-N 2.91Å; L85-V87 VanDerWaalsContact C-N 3.27Å; L85-V87 PolarHBondContact O-N 3.37Å; V87-Y89 VanDerWaalsContact C-N 3.31Å; V87-Y89 PolarHBondContact O-N 3.43Å; V87-A90 PolarHBondContact O-N 3.25Å; V87-L91 HydrophobicContact CG1-CD1 4.1Å; V87-L91 HydrophobicContact CG1-CG 4.43Å; V87-L91 WeakPolarHBondContact O-CB 3.14Å; V87-L91 VanDerWaalsContact O-CG 3.31Å; V87-L91 WeakPolarHBondContact O-CG 3.23Å; V87-L91 PolarHBondContact O-N 3.4Å
88	V	95.4	Very high	94.6	Very high	14 Å²	14	85.2 Å²	85.2	9%	0.085	42%	0.421	C	S	.	.	H	α-helix	trans	-62.2	-41.3	176.5	172.2	0	0	0	0	110.7	S84 L85 L91 K92 F101	S84-V88 VanDerWaalsContact O-CG2 3.27Å; S84-V88 WeakPolarHBondContact O-CG2 3.42Å; S84-V88 PolarHBondContact O-N 3.46Å; L85-V88 PolarHBondContact O-N 3.4Å; V88-L91 PolarHBondContact O-N 3.24Å; V88-K92 VanDerWaalsContact O-CB 3.28Å; V88-K92 WeakPolarHBondContact O-CB 3.33Å; V88-K92 PolarHBondContact O-N 3.21Å; V88-F101 HydrophobicContact CG2-CB 3.43Å; V88-F101 VanDerWaalsContact CG2-CB 3.43Å; V88-F101 HydrophobicContact CG2-CG 3.98Å
89	Y	94.4	Very high	94.3	Very high	115 Å²	115	84.8 Å²	84.8	45%	0.451	42%	0.415	S	S	.	.	H	α-helix	trans	-68.3	-42	176.3	-62.8	-31.5	0	0	0	112.4	L85 V87 L91 K92 R93	L85-Y89 HydrophobicContact CB-CE2 4.09Å; L85-Y89 WeakPolarHBondContact O-CB 3.46Å; L85-Y89 WeakPolarHBondContact O-CD2 3.44Å; L85-Y89 PolarHBondContact O-N 3.18Å; V87-Y89 VanDerWaalsContact C-N 3.31Å; V87-Y89 PolarHBondContact O-N 3.43Å; Y89-L91 VanDerWaalsContact C-N 3.34Å; Y89-L91 PolarHBondContact O-N 3.13Å; Y89-K92 PolarHBondContact O-N 3.36Å; Y89-R93 WeakPolarHBondContact O-CB 3.29Å; Y89-R93 PolarHBondContact O-N 3.35Å
90	A	96.3	Very high	93.9	Very high	0 Å²	0	84.6 Å²	84.6	0%	0	44%	0.441	C	S	.	.	H	α-helix	trans	-56.2	-47.7	172.2	0	0	0	0	0	111.9	V66 D69 S70 Y73 D86 V87 R93 Q94	V66-A90 HydrophobicContact CG1-CB 4.39Å; D69-A90 HydrophobicContact CB-CB 3.55Å; S70-A90 WeakPolarHBondContact OG-CB 3.47Å; Y73-A90 HydrophobicContact CD2-CB 4.5Å; Y73-A90 HydrophobicContact CE2-CB 4.44Å; D86-A90 WeakPolarHBondContact O-CB 3.37Å; D86-A90 PolarHBondContact O-N 3.44Å; V87-A90 PolarHBondContact O-N 3.25Å; A90-R93 PolarHBondContact O-N 2.96Å; A90-Q94 WeakPolarHBondContact O-CG 3.35Å; A90-Q94 PolarHBondContact O-N 3.03Å
91	L	96.4	Very high	93.2	Very high	18 Å²	18	79.7 Å²	79.7	9%	0.094	42%	0.419	C	S	.	.	H	α-helix	trans	-65.4	-43	177.7	-75.5	174.7	0	0	0	112.6	F62 V66 V87 V88 Y89 R93 Q94 G95 R96 L98	F62-L91 HydrophobicContact CZ-CD2 4.23Å; V66-L91 HydrophobicContact CG1-CD2 4.04Å; V66-L91 HydrophobicContact CG1-CG 4.16Å; V66-L91 HydrophobicContact CG2-CD2 3.78Å; V87-L91 HydrophobicContact CG1-CD1 4.1Å; V87-L91 HydrophobicContact CG1-CG 4.43Å; V87-L91 WeakPolarHBondContact O-CB 3.14Å; V87-L91 VanDerWaalsContact O-CG 3.31Å; V87-L91 WeakPolarHBondContact O-CG 3.23Å; V87-L91 PolarHBondContact O-N 3.4Å; V88-L91 PolarHBondContact O-N 3.24Å; Y89-L91 VanDerWaalsContact C-N 3.34Å; Y89-L91 PolarHBondContact O-N 3.13Å; L91-R93 VanDerWaalsContact C-N 3.32Å; L91-R93 PolarHBondContact O-N 3.47Å; L91-Q94 PolarHBondContact O-N 3.31Å; L91-Q94 VanDerWaalsContact O-N 3.13Å; L91-G95 PolarHBondContact O-N 3.24Å; L91-R96 HydrophobicContact CB-CB 4.48Å; L91-R96 WeakPolarHBondContact CB-O 3.37Å; L91-R96 HydrophobicContact CD2-CB 4.12Å; L91-R96 CarbonylContact O-C 3.47Å; L91-R96 WeakPolarHBondContact O-CA 3.39Å; L91-R96 PolarHBondContact O-N 2.82Å; L91-L98 HydrophobicContact CD1-CB 3.98Å; L91-L98 HydrophobicContact CD1-CD2 4.1Å
92	K	94.5	Very high	91.9	Very high	132 Å²	132	78 Å²	78	57%	0.574	42%	0.423	S	S	*	.	H	α-helix	trans	-60.3	-41.4	177.2	-172.2	178.2	178.4	178.1	0	111.4	V88 Y89 Q94 G95	V88-K92 VanDerWaalsContact O-CB 3.28Å; V88-K92 WeakPolarHBondContact O-CB 3.33Å; V88-K92 PolarHBondContact O-N 3.21Å; Y89-K92 PolarHBondContact O-N 3.36Å; K92-Q94 VanDerWaalsContact C-N 3.26Å; K92-Q94 PolarHBondContact O-N 2.93Å; K92-G95 PolarHBondContact O-N 3.29Å; K92-G95 VanDerWaalsContact O-N 3.09Å
93	R	94.2	Very high	90	Very high	162 Å²	162	81.8 Å²	81.8	61%	0.611	48%	0.476	S	S	*	.	H	α-helix	trans	-60.1	-34.5	175.6	178.7	178.7	169.2	-100	4.9	112.7	D69 Y89 A90 L91 G95	D69-R93 IonicContact OD1-CZ 3.62Å; D69-R93 IonicContact OD1-NH1 3.49Å; D69-R93 PolarHBondContact OD1-NH1 2.63Å; D69-R93 IonicContact OD2-CZ 3.64Å; D69-R93 IonicContact OD2-NH1 3.34Å; D69-R93 PolarHBondContact OD2-NH1 3.25Å; Y89-R93 WeakPolarHBondContact O-CB 3.29Å; Y89-R93 PolarHBondContact O-N 3.35Å; A90-R93 PolarHBondContact O-N 2.96Å; L91-R93 VanDerWaalsContact C-N 3.32Å; L91-R93 PolarHBondContact O-N 3.47Å; R93-G95 VanDerWaalsContact C-N 3.27Å; R93-G95 PolarHBondContact O-N 3.15Å
94	Q	93	Very high	89.8	Confident	58 Å²	58	83.3 Å²	83.3	27%	0.271	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	9.1	178.1	-61.8	-177.9	11.2	0	0	113.6	S65 D69 A90 L91 K92 R96	S65-Q94 PolarHBondContact O-NE2 2.84Å; S65-Q94 PolarHBondContact OG-NE2 2.94Å; D69-Q94 PolarHBondContact OD2-NE2 2.92Å; A90-Q94 WeakPolarHBondContact O-CG 3.35Å; A90-Q94 PolarHBondContact O-N 3.03Å; L91-Q94 PolarHBondContact O-N 3.31Å; L91-Q94 VanDerWaalsContact O-N 3.13Å; K92-Q94 VanDerWaalsContact C-N 3.26Å; K92-Q94 PolarHBondContact O-N 2.93Å; Q94-R96 VanDerWaalsContact C-N 3.26Å; Q94-R96 PolarHBondContact O-N 2.65Å
95	G	93.9	Very high	89.6	Confident	63 Å²	63	83.8 Å²	83.8	65%	0.649	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	20.7	-176.2	0	0	0	0	0	113.8	L91 K92 R93	L91-G95 PolarHBondContact O-N 3.24Å; K92-G95 PolarHBondContact O-N 3.29Å; K92-G95 VanDerWaalsContact O-N 3.09Å; R93-G95 VanDerWaalsContact C-N 3.27Å; R93-G95 PolarHBondContact O-N 3.15Å
96	R	92.8	Very high	89.3	Confident	173 Å²	173	84.9 Å²	84.9	65%	0.653	49%	0.49	S	S	*	.			trans	-113.9	48.6	-178.6	-60.8	-58.8	-175	-179.6	-0.9	111.6	L91 Q94 L98	L91-R96 HydrophobicContact CB-CB 4.48Å; L91-R96 WeakPolarHBondContact CB-O 3.37Å; L91-R96 HydrophobicContact CD2-CB 4.12Å; L91-R96 CarbonylContact O-C 3.47Å; L91-R96 WeakPolarHBondContact O-CA 3.39Å; L91-R96 PolarHBondContact O-N 2.82Å; Q94-R96 VanDerWaalsContact C-N 3.26Å; Q94-R96 PolarHBondContact O-N 2.65Å; R96-L98 PolarHBondContact O-N 3.26Å; R96-L98 VanDerWaalsContact O-N 3.15Å
97	T	91.5	Very high	89	Confident	61 Å²	61	89.7 Å²	89.7	37%	0.374	52%	0.518	S	S	.	.			trans	-51.6	120.6	-176.8	-55.2	0	0	0	0	111.9	Y99	T97-Y99 HydrophobicContact CG2-CD1 4.25Å; T97-Y99 HydrophobicContact CG2-CE1 3.85Å
98	L	90.9	Very high	88.5	Confident	77 Å²	77	92.2 Å²	92.2	40%	0.403	53%	0.531	S	S	.	.			trans	-97	113	174.9	-174.3	64.6	0	0	0	109.1	L91 R96 F101	L91-L98 HydrophobicContact CD1-CB 3.98Å; L91-L98 HydrophobicContact CD1-CD2 4.1Å; R96-L98 PolarHBondContact O-N 3.26Å; R96-L98 VanDerWaalsContact O-N 3.15Å; L98-F101 HydrophobicContact CD1-CE2 4.29Å; L98-F101 HydrophobicContact CD2-CD2 3.63Å; L98-F101 HydrophobicContact CD2-CE2 3.41Å; L98-F101 VanDerWaalsContact CD2-CE2 3.41Å; L98-F101 HydrophobicContact CD2-CG 4.45Å; L98-F101 HydrophobicContact CD2-CZ 4.05Å; L98-F101 HydrophobicContact CG-CD2 3.61Å; L98-F101 HydrophobicContact CG-CE2 3.63Å
99	Y	89.9	Confident	88.1	Confident	190 Å²	190	97.4 Å²	97.4	75%	0.745	56%	0.561	S	S	*	*	S	Bend	trans	-81.6	162.2	179.5	-56.4	-78.5	0	0	0	112	T97 F101	T97-Y99 HydrophobicContact CG2-CD1 4.25Å; T97-Y99 HydrophobicContact CG2-CE1 3.85Å; Y99-F101 VanDerWaalsContact C-N 3.28Å; Y99-F101 WeakPolarHBondContact O-CD2 3.24Å
100	G	89.2	Confident	87.6	Confident	84 Å²	84	96.1 Å²	96.1	87%	0.866	57%	0.569	S	S	*	*	S	Bend	trans	79.8	10.5	-178.5	0	0	0	0	0	114
101	F	81	Confident	87	Confident	112 Å²	112	103.5 Å²	103.5	49%	0.491	61%	0.612	S	S	.	*			trans	-123	119.6	173.4	-64.6	-96.7	0	0	0	109.2	V88 L98 Y99	V88-F101 HydrophobicContact CG2-CB 3.43Å; V88-F101 VanDerWaalsContact CG2-CB 3.43Å; V88-F101 HydrophobicContact CG2-CG 3.98Å; L98-F101 HydrophobicContact CD1-CE2 4.29Å; L98-F101 HydrophobicContact CD2-CD2 3.63Å; L98-F101 HydrophobicContact CD2-CE2 3.41Å; L98-F101 VanDerWaalsContact CD2-CE2 3.41Å; L98-F101 HydrophobicContact CD2-CG 4.45Å; L98-F101 HydrophobicContact CD2-CZ 4.05Å; L98-F101 HydrophobicContact CG-CD2 3.61Å; L98-F101 HydrophobicContact CG-CE2 3.63Å; Y99-F101 VanDerWaalsContact C-N 3.28Å; Y99-F101 WeakPolarHBondContact O-CD2 3.24Å
102	G	67.9	Low	86.2	Confident	69 Å²	69	110.7 Å²	110.7	71%	0.711	66%	0.655	S	S	*	*			trans	154.9	91.7	-172.9	0	0	0	0	0	106.4
103	G	55.5	Low	85.4	Confident	147 Å²	147	108.7 Å²	108.7	100%	1.515	66%	0.663	S	S	*	*			trans	-95.8	0	172.4	0	0	0	0	0	110.1

Retrieved 103 of 103 residues in 504.5 ms (Link to these results)

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