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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.

AlphaFold DB (P59259), UniProt , Accession Q6PMI5, Species CHEMJ (Chelidonium majus, Greater celandine), Gene n/a, Length 103 aa.

						>H4_CHEMJ|Q6PMI5
MSGRGKGGKGLGKGGAKRHRKVLRDNIQGITKPAIRRLARRGGVKRISGLIYEETRGVLKIFLENVIRDAVTYTEHARRKTVTAMDVVYALKRQGRTLYGFGG
					

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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	61.5	Low	63.1	Low	249 Å²	249	142.8 Å²	142.8	100%	1.227	86%	0.862	S	S	*	*				0	100.7	0	-168.4	-177.8	-166.4	0	0	108.3
2	S	56.2	Low	63.1	Low	117 Å²	117	136.4 Å²	136.4	82%	0.818	85%	0.847	S	S	*	*			trans	178.2	84.2	158.9	57.9	0	0	0	0	110.2	R4	S2-R4 PolarHBondContact O-N 2.98Å; S2-R4 VanDerWaalsContact O-N 3.12Å
3	G	62.6	Low	63.4	Low	84 Å²	84	142.2 Å²	142.2	87%	0.866	85%	0.853	S	S	*	*			trans	-70.8	99.3	166.3	0	0	0	0	0	109.1	G5	G3-G5 PolarHBondContact O-N 3.47Å
4	R	68.9	Low	63.6	Low	246 Å²	246	137.1 Å²	137.1	93%	0.928	84%	0.844	S	S	*	*			trans	-75.4	93.6	176.8	-161.8	161.3	177.2	110.5	-5.4	108.1	S2	S2-R4 PolarHBondContact O-N 2.98Å; S2-R4 VanDerWaalsContact O-N 3.12Å
5	G	64.6	Low	64.1	Low	68 Å²	68	132.7 Å²	132.7	70%	0.701	84%	0.836	S	S	*	*			trans	-55.5	135	-179.1	0	0	0	0	0	112.1	G3 G7	G3-G5 PolarHBondContact O-N 3.47Å; G5-G7 PolarHBondContact O-N 3.25Å; G5-G7 VanDerWaalsContact O-N 3.08Å
6	K	64.5	Low	64.7	Low	214 Å²	214	129.9 Å²	129.9	93%	0.93	83%	0.83	S	S	*	*			trans	-54.8	111.9	175.1	-83.1	175.8	172.5	172.1	0	109.4	G8	K6-G8 PolarHBondContact O-N 2.69Å
7	G	62.2	Low	65	Low	75 Å²	75	133.6 Å²	133.6	77%	0.773	83%	0.83	S	S	*	*			trans	-58	107.9	167.2	0	0	0	0	0	108.9	G5 K9	G5-G7 PolarHBondContact O-N 3.25Å; G5-G7 VanDerWaalsContact O-N 3.08Å; G7-K9 PolarHBondContact O-N 3.19Å; G7-K9 VanDerWaalsContact O-N 3.16Å
8	G	62	Low	65.4	Low	73 Å²	73	139.4 Å²	139.4	75%	0.753	83%	0.834	S	S	*	*			trans	-56.6	121	172.9	0	0	0	0	0	108.5	K6 G10	K6-G8 PolarHBondContact O-N 2.69Å; G8-G10 VanDerWaalsContact C-N 3.28Å; G8-G10 PolarHBondContact O-N 2.98Å
9	K	65.8	Low	65.9	Low	203 Å²	203	141.3 Å²	141.3	88%	0.883	83%	0.833	S	S	*	*			trans	-63.4	95.1	174.1	-153.4	173.3	-172.1	177.6	0	106	G7 L11	G7-K9 PolarHBondContact O-N 3.19Å; G7-K9 VanDerWaalsContact O-N 3.16Å; K9-L11 PolarHBondContact O-N 3.36Å; K9-L11 VanDerWaalsContact O-N 3.1Å
10	G	63.3	Low	66.1	Low	67 Å²	67	145.9 Å²	145.9	69%	0.691	84%	0.835	S	S	*	*			trans	-50.6	121.8	-178.6	0	0	0	0	0	108.2	G8 G12	G8-G10 VanDerWaalsContact C-N 3.28Å; G8-G10 PolarHBondContact O-N 2.98Å; G10-G12 VanDerWaalsContact C-N 3.26Å; G10-G12 PolarHBondContact O-N 3.41Å
11	L	62.2	Low	66.6	Low	175 Å²	175	147.1 Å²	147.1	92%	0.916	83%	0.831	S	S	*	*			trans	-58.3	98.9	173	-66.6	170.3	0	0	0	105.7	K9 K13	K9-L11 PolarHBondContact O-N 3.36Å; K9-L11 VanDerWaalsContact O-N 3.1Å; L11-K13 PolarHBondContact O-N 3Å
12	G	63.8	Low	67.4	Low	66 Å²	66	139.7 Å²	139.7	68%	0.68	80%	0.799	S	S	*	*			trans	-49.3	132.7	179.7	0	0	0	0	0	107.5	G10 G14	G10-G12 VanDerWaalsContact C-N 3.26Å; G10-G12 PolarHBondContact O-N 3.41Å; G12-G14 VanDerWaalsContact C-N 3.3Å; G12-G14 PolarHBondContact O-N 3.33Å
13	K	67	Low	68.7	Low	212 Å²	212	142.2 Å²	142.2	92%	0.922	80%	0.803	S	S	*	*			trans	-46.3	97.6	-178.2	-70.6	178.9	177.3	177.2	0	108.3	L11 G15	L11-K13 PolarHBondContact O-N 3Å; K13-G15 PolarHBondContact O-N 3.16Å
14	G	66.2	Low	69.9	Low	70 Å²	70	147 Å²	147	72%	0.722	79%	0.794	S	S	*	*			trans	-61.4	107.6	179.8	0	0	0	0	0	105.7	G12 A16	G12-G14 VanDerWaalsContact C-N 3.3Å; G12-G14 PolarHBondContact O-N 3.33Å; G14-A16 PolarHBondContact O-N 3.01Å
15	G	70.9	Confident	70.9	Confident	71 Å²	71	141.8 Å²	141.8	73%	0.732	79%	0.785	S	S	*	*			trans	-51.6	117.9	178.4	0	0	0	0	0	107.3	K13 K17	K13-G15 PolarHBondContact O-N 3.16Å; G15-K17 PolarHBondContact O-N 2.69Å
16	A	73.8	Confident	72.2	Confident	89 Å²	89	143.4 Å²	143.4	74%	0.736	78%	0.778	S	S	*	*			trans	-50.9	118	-175.6	0	0	0	0	0	108.5	G14 R18	G14-A16 PolarHBondContact O-N 3.01Å; A16-R18 PolarHBondContact O-N 3.39Å
17	K	70.3	Confident	73.6	Confident	193 Å²	193	135.2 Å²	135.2	84%	0.839	74%	0.744	S	S	*	*			trans	-57.9	103.2	175.4	-89.4	-176.3	176.8	177.2	0	107.4	G15 H19	G15-K17 PolarHBondContact O-N 2.69Å; K17-H19 PolarHBondContact O-N 2.87Å
18	R	72.1	Confident	75.2	Confident	238 Å²	238	136.7 Å²	136.7	90%	0.898	73%	0.73	S	S	*	*			trans	-74.5	107.1	172.8	-75.5	-176.9	177.1	178.8	-0.5	107.4	A16 R20	A16-R18 PolarHBondContact O-N 3.39Å; R18-R20 PolarHBondContact O-N 2.92Å
19	H	75.2	Confident	76.8	Confident	174 Å²	174	135.9 Å²	135.9	81%	0.806	72%	0.723	S	S	*	*			trans	-62.8	119.2	167.2	-68.4	-86.6	0	0	0	108.1	K17 K21	K17-H19 PolarHBondContact O-N 2.87Å; H19-K21 PolarHBondContact O-N 3.31Å
20	R	68.8	Low	78.3	Confident	234 Å²	234	129.2 Å²	129.2	88%	0.883	70%	0.696	S	S	*	*			trans	-58.5	110.4	174.8	-172.3	175.2	80.5	167	3.9	107.7	R18 V22	R18-R20 PolarHBondContact O-N 2.92Å; R20-V22 PolarHBondContact O-N 3.43Å
21	K	77.3	Confident	79.9	Confident	172 Å²	172	129 Å²	129	75%	0.748	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-65.9	121.9	178	-162.8	175	-176.2	-179.4	0	107.8	H19 L23	H19-K21 PolarHBondContact O-N 3.31Å; K21-L23 PolarHBondContact O-N 3.06Å
22	V	78.6	Confident	81.6	Confident	93 Å²	93	125.9 Å²	125.9	56%	0.564	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-64.5	124.8	170.7	179.3	0	0	0	0	107.2	R20 R24	R20-V22 PolarHBondContact O-N 3.43Å; V22-R24 HydrophobicContact CG1-CG 4.11Å; V22-R24 PolarHBondContact O-N 3.21Å
23	L	83.3	Confident	83.3	Confident	170 Å²	170	126.1 Å²	126.1	89%	0.89	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-67.5	120.7	174.1	-62	178.6	0	0	0	107.8	K21	K21-L23 PolarHBondContact O-N 3.06Å
24	R	86.7	Confident	84.8	Confident	183 Å²	183	117.1 Å²	117.1	69%	0.691	62%	0.615	S	S	*	*			trans	-132.2	149	176.2	-62	-177	-176.9	-174.2	-0.3	107.2	V22 N26	V22-R24 HydrophobicContact CG1-CG 4.11Å; V22-R24 PolarHBondContact O-N 3.21Å; R24-N26 PolarHBondContact O-N 3.15Å; R24-N26 PolarHBondContact O-ND2 3.26Å
25	D	89.6	Confident	86.3	Confident	137 Å²	137	114 Å²	114	73%	0.733	58%	0.582	S	S	*	*			trans	-64.2	122.3	165.9	-175.3	12.9	0	0	0	108.7	I27	D25-I27 WeakPolarHBondContact OD1-CB 3.25Å; D25-I27 WeakPolarHBondContact OD1-CG2 3.15Å; D25-I27 PolarHBondContact OD1-N 2.91Å; D25-I27 WeakPolarHBondContact OD2-CG2 3.3Å
26	N	91.8	Very high	87.6	Confident	102 Å²	102	115.4 Å²	115.4	55%	0.545	57%	0.565	S	S	.	*			trans	-118.5	15.6	-176.9	-63.8	-63.2	0	0	0	111.4	R24 Q28 G29	R24-N26 PolarHBondContact O-N 3.15Å; R24-N26 PolarHBondContact O-ND2 3.26Å; N26-Q28 PolarHBondContact O-N 2.65Å; N26-Q28 VanDerWaalsContact O-N 3.16Å; N26-G29 WeakPolarHBondContact O-CA 3.29Å; N26-G29 PolarHBondContact O-N 3.4Å
27	I	95	Very high	88.7	Confident	42 Å²	42	118.8 Å²	118.8	22%	0.215	56%	0.559	C	S	.	*	G	3₁₀ helix	trans	-58.9	-32.9	-173.4	-164.8	53.9	0	0	0	112.7	D25 G29 I30 R56 K60	D25-I27 WeakPolarHBondContact OD1-CB 3.25Å; D25-I27 WeakPolarHBondContact OD1-CG2 3.15Å; D25-I27 PolarHBondContact OD1-N 2.91Å; D25-I27 WeakPolarHBondContact OD2-CG2 3.3Å; I27-G29 PolarHBondContact O-N 3.5Å; I27-I30 PolarHBondContact O-N 3.34Å; I27-I30 VanDerWaalsContact O-N 3.16Å; I27-R56 HydrophobicContact CD1-CB 3.83Å; I27-R56 HydrophobicContact CD1-CG 4.22Å; I27-R56 HydrophobicContact CG1-CB 3.77Å; I27-R56 HydrophobicContact CG1-CG 4.15Å; I27-R56 WeakPolarHBondContact O-CD 3.42Å; I27-K60 HydrophobicContact CD1-CB 4.5Å
28	Q	95.6	Very high	90	Very high	106 Å²	106	114.9 Å²	114.9	50%	0.495	55%	0.546	S	S	.	.	G	3₁₀ helix	trans	-70.2	-14.2	174.9	-63.7	-57.6	-31.6	0	0	113.9	N26 I30	N26-Q28 PolarHBondContact O-N 2.65Å; N26-Q28 VanDerWaalsContact O-N 3.16Å; Q28-I30 CarbonylContact O-C 3.58Å; Q28-I30 PolarHBondContact O-N 3.35Å
29	G	95.5	Very high	91.2	Very high	57 Å²	57	104.4 Å²	104.4	59%	0.588	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-61.7	-21.9	168.9	0	0	0	0	0	112.9	N26 I27 T31	N26-G29 WeakPolarHBondContact O-CA 3.29Å; N26-G29 PolarHBondContact O-N 3.4Å; I27-G29 PolarHBondContact O-N 3.5Å; G29-T31 VanDerWaalsContact C-N 3.34Å; G29-T31 PolarHBondContact O-N 3.41Å; G29-T31 VanDerWaalsContact O-N 3.09Å
30	I	97.1	Very high	92.3	Very high	63 Å²	63	101.9 Å²	101.9	32%	0.323	49%	0.494	S	S	.	.	S	Bend	trans	-79.8	89.1	164.1	-51.8	-59.3	0	0	0	107.8	I27 Q28 I35 R56 L59	I27-I30 PolarHBondContact O-N 3.34Å; I27-I30 VanDerWaalsContact O-N 3.16Å; Q28-I30 CarbonylContact O-C 3.58Å; Q28-I30 PolarHBondContact O-N 3.35Å; I30-I35 HydrophobicContact CG2-CD1 4.11Å; I30-I35 HydrophobicContact CG2-CG1 3.87Å; I30-R56 HydrophobicContact CB-CG 4.32Å; I30-R56 HydrophobicContact CG2-CG 4.49Å; I30-R56 PolarHBondContact O-NE 3.23Å; I30-R56 PolarHBondContact O-NH2 3Å; I30-L59 HydrophobicContact CD1-CD2 3.94Å; I30-L59 HydrophobicContact CG1-CD2 3.68Å
31	T	98.2	Very high	93.7	Very high	62 Å²	62	100.7 Å²	100.7	38%	0.38	49%	0.49	S	S	.	.			trans	-75.4	155.2	-170.2	65.8	0	0	0	0	112.6	G29 P33 A34 I35	G29-T31 VanDerWaalsContact C-N 3.34Å; G29-T31 PolarHBondContact O-N 3.41Å; G29-T31 VanDerWaalsContact O-N 3.09Å; T31-P33 VanDerWaalsContact C-N 3.31Å; T31-A34 WeakPolarHBondContact O-CB 3.35Å; T31-A34 PolarHBondContact O-N 3.36Å; T31-A34 PolarHBondContact OG1-N 3.47Å; T31-I35 PolarHBondContact O-N 3.47Å; T31-I35 VanDerWaalsContact O-N 3.12Å
32	K	98	Very high	94.7	Very high	110 Å²	110	95.6 Å²	95.6	48%	0.478	49%	0.486	S	S	.	.	H	α-helix	trans	-53	-41.5	174.9	-61.6	-177.1	179.2	177.6	0	112.8	A34 I35 R36 Y52	K32-A34 PolarHBondContact O-N 2.92Å; K32-I35 PolarHBondContact O-N 3.12Å; K32-R36 WeakPolarHBondContact O-CB 3.49Å; K32-R36 PolarHBondContact O-N 2.97Å; K32-Y52 HydrophobicContact CB-CD1 3.93Å; K32-Y52 HydrophobicContact CB-CE1 3.92Å; K32-Y52 HydrophobicContact CD-CD2 4.23Å; K32-Y52 HydrophobicContact CD-CE2 4.41Å; K32-Y52 HydrophobicContact CD-CG 4.31Å; K32-Y52 HydrophobicContact CG-CD1 3.84Å; K32-Y52 HydrophobicContact CG-CD2 4.36Å; K32-Y52 HydrophobicContact CG-CE1 4.21Å; K32-Y52 HydrophobicContact CG-CG 3.93Å
33	P	98.1	Very high	95.6	Very high	70 Å²	70	93.8 Å²	93.8	46%	0.455	49%	0.486	S	S	.	.	H	α-helix	trans	-61.2	-38.4	173	-25.9	36.2	0	0	0	114.1	T31 R36 R37	T31-P33 VanDerWaalsContact C-N 3.31Å; P33-R36 PolarHBondContact O-N 3.48Å; P33-R37 WeakPolarHBondContact O-CG 3.43Å; P33-R37 PolarHBondContact O-N 3.28Å
34	A	98.3	Very high	96.3	Very high	24 Å²	24	88.6 Å²	88.6	20%	0.198	46%	0.462	C	S	.	.	H	α-helix	trans	-63.6	-46.8	177.6	0	0	0	0	0	111.7	T31 K32 R36 R37 L38	T31-A34 WeakPolarHBondContact O-CB 3.35Å; T31-A34 PolarHBondContact O-N 3.36Å; T31-A34 PolarHBondContact OG1-N 3.47Å; K32-A34 PolarHBondContact O-N 2.92Å; A34-R36 VanDerWaalsContact C-N 3.33Å; A34-R36 PolarHBondContact O-N 3.03Å; A34-R37 PolarHBondContact O-N 3.11Å; A34-L38 PolarHBondContact O-N 3.18Å; A34-L38 VanDerWaalsContact O-N 3.15Å
35	I	98.3	Very high	96.7	Very high	5 Å²	5	88.6 Å²	88.6	3%	0.026	47%	0.467	C	S	.	.	H	α-helix	trans	-60.9	-44.4	175.3	-62.2	170.7	0	0	0	110.3	I30 T31 K32 R37 L38 A39 Y52 T55 R56	I30-I35 HydrophobicContact CG2-CD1 4.11Å; I30-I35 HydrophobicContact CG2-CG1 3.87Å; T31-I35 PolarHBondContact O-N 3.47Å; T31-I35 VanDerWaalsContact O-N 3.12Å; K32-I35 PolarHBondContact O-N 3.12Å; I35-R37 PolarHBondContact O-N 3.49Å; I35-L38 PolarHBondContact O-N 3.46Å; I35-A39 WeakPolarHBondContact O-CB 3.45Å; I35-A39 PolarHBondContact O-N 2.88Å; I35-Y52 HydrophobicContact CB-CD1 4.26Å; I35-Y52 HydrophobicContact CD1-CD1 4.25Å; I35-Y52 WeakPolarHBondContact CD1-O 3.2Å; I35-Y52 HydrophobicContact CG2-CD1 4.13Å; I35-T55 HydrophobicContact CD1-CG2 4.29Å; I35-T55 HydrophobicContact CG1-CG2 4.16Å; I35-T55 HydrophobicContact CG2-CG2 4.21Å; I35-R56 HydrophobicContact CD1-CG 4.38Å
36	R	97.8	Very high	97.1	Very high	99 Å²	99	93 Å²	93	37%	0.374	47%	0.473	S	S	.	.	H	α-helix	trans	-58.8	-45	176.9	-168.8	-174.1	-51.4	-70.1	-2.4	111.5	K32 P33 A34 L38 A39 R40 I47 Y52	K32-R36 WeakPolarHBondContact O-CB 3.49Å; K32-R36 PolarHBondContact O-N 2.97Å; P33-R36 PolarHBondContact O-N 3.48Å; A34-R36 VanDerWaalsContact C-N 3.33Å; A34-R36 PolarHBondContact O-N 3.03Å; R36-L38 VanDerWaalsContact C-N 3.33Å; R36-L38 PolarHBondContact O-N 3.34Å; R36-A39 PolarHBondContact O-N 3.28Å; R36-R40 HydrophobicContact CG-CG 4.36Å; R36-R40 VanDerWaalsContact O-CG 3.29Å; R36-R40 WeakPolarHBondContact O-CG 3.36Å; R36-R40 PolarHBondContact O-N 3.18Å; R36-I47 HydrophobicContact CG-CD1 4.05Å; R36-Y52 PolarHBondContact NH1-OH 3.39Å; R36-Y52 PolarHBondContact NH2-OH 3.14Å
37	R	97.9	Very high	97.4	Very high	160 Å²	160	89.9 Å²	89.9	60%	0.604	46%	0.456	S	S	*	.	H	α-helix	trans	-59.6	-42.4	177.9	-74.5	-171.3	-57.6	-93.5	5.5	111.9	P33 A34 I35 R41	P33-R37 WeakPolarHBondContact O-CG 3.43Å; P33-R37 PolarHBondContact O-N 3.28Å; A34-R37 PolarHBondContact O-N 3.11Å; I35-R37 PolarHBondContact O-N 3.49Å; R37-R41 WeakPolarHBondContact O-CB 3.19Å; R37-R41 PolarHBondContact O-N 3.44Å
38	L	97.2	Very high	97.5	Very high	111 Å²	111	91.2 Å²	91.2	58%	0.581	47%	0.469	S	S	*	.	H	α-helix	trans	-64.5	-48.1	175.5	-70.4	174.8	0	0	0	111.8	A34 I35 R36 R40 R41 G42	A34-L38 PolarHBondContact O-N 3.18Å; A34-L38 VanDerWaalsContact O-N 3.15Å; I35-L38 PolarHBondContact O-N 3.46Å; R36-L38 VanDerWaalsContact C-N 3.33Å; R36-L38 PolarHBondContact O-N 3.34Å; L38-R40 VanDerWaalsContact C-N 3.33Å; L38-R40 PolarHBondContact O-N 3.02Å; L38-R41 WeakPolarHBondContact O-CB 3.36Å; L38-R41 PolarHBondContact O-N 2.88Å; L38-R41 VanDerWaalsContact O-N 3.16Å; L38-G42 PolarHBondContact O-N 3.1Å
39	A	97.4	Very high	97.5	Very high	19 Å²	19	88.9 Å²	88.9	16%	0.157	47%	0.473	C	S	.	.	H	α-helix	trans	-60	-42	178.2	0	0	0	0	0	112.1	I35 R36 G42 G43 V44 I47	I35-A39 WeakPolarHBondContact O-CB 3.45Å; I35-A39 PolarHBondContact O-N 2.88Å; R36-A39 PolarHBondContact O-N 3.28Å; A39-G42 CarbonylContact O-C 3.49Å; A39-G42 PolarHBondContact O-N 2.96Å; A39-G43 PolarHBondContact O-N 2.87Å; A39-V44 HydrophobicContact CB-CB 4.07Å; A39-V44 HydrophobicContact CB-CG2 4.2Å; A39-V44 VanDerWaalsContact O-CB 3.25Å; A39-V44 WeakPolarHBondContact O-CB 3.43Å; A39-V44 WeakPolarHBondContact O-CG2 3.47Å; A39-V44 PolarHBondContact O-N 2.98Å; A39-I47 HydrophobicContact CB-CD1 3.57Å; A39-I47 HydrophobicContact CB-CG1 4.24Å
40	R	98	Very high	97.5	Very high	120 Å²	120	92.6 Å²	92.6	45%	0.453	48%	0.479	S	S	.	.	H	α-helix	trans	-64.5	-40.4	175	-65.5	-42.1	-176.8	176.4	3.2	112.3	R36 L38 G42 G43 V44 K45	R36-R40 HydrophobicContact CG-CG 4.36Å; R36-R40 VanDerWaalsContact O-CG 3.29Å; R36-R40 WeakPolarHBondContact O-CG 3.36Å; R36-R40 PolarHBondContact O-N 3.18Å; L38-R40 VanDerWaalsContact C-N 3.33Å; L38-R40 PolarHBondContact O-N 3.02Å; R40-G42 PolarHBondContact O-N 3.5Å; R40-G43 PolarHBondContact O-N 3.09Å; R40-V44 VanDerWaalsContact CD-O 3.3Å; R40-V44 WeakPolarHBondContact CD-O 3.22Å; R40-V44 PolarHBondContact NH1-O 3.33Å; R40-K45 VanDerWaalsContact NH1-CA 3.25Å; R40-K45 PolarHBondContact NH1-O 3.08Å
41	R	97.9	Very high	97.6	Very high	210 Å²	210	92.4 Å²	92.4	79%	0.792	48%	0.478	S	S	*	.	H	α-helix	trans	-60.5	-34.3	173.9	-175.2	179.9	-66	173.3	-3	111.9	R37 L38 G43	R37-R41 WeakPolarHBondContact O-CB 3.19Å; R37-R41 PolarHBondContact O-N 3.44Å; L38-R41 WeakPolarHBondContact O-CB 3.36Å; L38-R41 PolarHBondContact O-N 2.88Å; L38-R41 VanDerWaalsContact O-N 3.16Å; R41-G43 VanDerWaalsContact C-N 3.26Å; R41-G43 PolarHBondContact O-N 2.93Å
42	G	97.6	Very high	97.5	Very high	64 Å²	64	90.5 Å²	90.5	66%	0.66	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	7.7	172.9	0	0	0	0	0	115.3	L38 A39 R40 V44	L38-G42 PolarHBondContact O-N 3.1Å; A39-G42 CarbonylContact O-C 3.49Å; A39-G42 PolarHBondContact O-N 2.96Å; R40-G42 PolarHBondContact O-N 3.5Å; G42-V44 PolarHBondContact O-N 3.04Å
43	G	98	Very high	97.5	Very high	56 Å²	56	90.1 Å²	90.1	58%	0.577	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.1	7.3	177.6	0	0	0	0	0	115.6	A39 R40 R41 K45	A39-G43 PolarHBondContact O-N 2.87Å; R40-G43 PolarHBondContact O-N 3.09Å; R41-G43 VanDerWaalsContact C-N 3.26Å; R41-G43 PolarHBondContact O-N 2.93Å; G43-K45 PolarHBondContact O-N 3.31Å
44	V	97.8	Very high	97.5	Very high	61 Å²	61	92.5 Å²	92.5	37%	0.37	47%	0.469	S	S	.	.			trans	-68.6	119.5	179.9	-178.3	0	0	0	0	110	A39 R40 G42 R46 I47	A39-V44 HydrophobicContact CB-CB 4.07Å; A39-V44 HydrophobicContact CB-CG2 4.2Å; A39-V44 VanDerWaalsContact O-CB 3.25Å; A39-V44 WeakPolarHBondContact O-CB 3.43Å; A39-V44 WeakPolarHBondContact O-CG2 3.47Å; A39-V44 PolarHBondContact O-N 2.98Å; R40-V44 VanDerWaalsContact CD-O 3.3Å; R40-V44 WeakPolarHBondContact CD-O 3.22Å; R40-V44 PolarHBondContact NH1-O 3.33Å; G42-V44 PolarHBondContact O-N 3.04Å; V44-R46 WeakPolarHBondContact CG1-O 3.4Å; V44-I47 HydrophobicContact CG1-CG1 3.74Å
45	K	96.8	Very high	97.5	Very high	183 Å²	183	93.7 Å²	93.7	80%	0.796	47%	0.473	S	S	*	.	S	Bend	trans	-89	-30.9	-179.6	-69	-175.9	-178.3	177.8	0	114.3	R40 G43	R40-K45 VanDerWaalsContact NH1-CA 3.25Å; R40-K45 PolarHBondContact NH1-O 3.08Å; G43-K45 PolarHBondContact O-N 3.31Å
46	R	97.8	Very high	97.5	Very high	230 Å²	230	93.8 Å²	93.8	87%	0.868	47%	0.473	S	S	*	.			trans	-133.9	138	176.5	-64.9	-176.8	-177.6	-92	0.9	109	V44	V44-R46 WeakPolarHBondContact CG1-O 3.4Å
47	I	96.6	Very high	97.5	Very high	36 Å²	36	90.6 Å²	90.6	19%	0.185	47%	0.472	C	S	.	.			trans	-122.7	125.6	-175.4	-60.2	173	0	0	0	107.8	R36 A39 V44 I51 Y52	R36-I47 HydrophobicContact CG-CD1 4.05Å; A39-I47 HydrophobicContact CB-CD1 3.57Å; A39-I47 HydrophobicContact CB-CG1 4.24Å; V44-I47 HydrophobicContact CG1-CG1 3.74Å; I47-I51 HydrophobicContact CG2-CB 4.08Å; I47-I51 HydrophobicContact CG2-CG1 4.44Å; I47-I51 HydrophobicContact CG2-CG2 4.22Å; I47-Y52 HydrophobicContact CG2-CE1 4.5Å
48	S	96.8	Very high	97.5	Very high	70 Å²	70	87.4 Å²	87.4	49%	0.49	47%	0.47	S	S	.	.			trans	-70.6	150.7	172.4	173.7	0	0	0	0	111.2	L50 I51	S48-L50 VanDerWaalsContact C-N 3.26Å; S48-L50 PolarHBondContact O-N 3.35Å; S48-L50 PolarHBondContact OG-N 3.34Å; S48-I51 PolarHBondContact O-N 3.43Å
49	G	96	Very high	97.5	Very high	56 Å²	56	84.9 Å²	84.9	58%	0.577	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-31.1	177.4	0	0	0	0	0	113.9	I51 Y52	G49-I51 VanDerWaalsContact C-N 3.29Å; G49-I51 PolarHBondContact O-N 2.96Å; G49-Y52 WeakPolarHBondContact O-CD2 3.4Å
50	L	96.9	Very high	97.5	Very high	135 Å²	135	89.3 Å²	89.3	71%	0.707	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-24.8	-177.7	-62.3	177.2	0	0	0	113.2	S48 Y52 E53 E54	S48-L50 VanDerWaalsContact C-N 3.26Å; S48-L50 PolarHBondContact O-N 3.35Å; S48-L50 PolarHBondContact OG-N 3.34Å; L50-Y52 PolarHBondContact O-N 3.42Å; L50-Y52 VanDerWaalsContact O-N 3.11Å; L50-E53 PolarHBondContact O-N 3.06Å; L50-E54 PolarHBondContact O-N 3.34Å; L50-E54 VanDerWaalsContact O-N 3.14Å
51	I	97.5	Very high	97.4	Very high	59 Å²	59	88.2 Å²	88.2	30%	0.303	47%	0.474	S	S	.	.	H	α-helix	trans	-60.1	-28.4	-176.6	-64.4	-63.4	0	0	0	112.3	I47 S48 G49 T55	I47-I51 HydrophobicContact CG2-CB 4.08Å; I47-I51 HydrophobicContact CG2-CG1 4.44Å; I47-I51 HydrophobicContact CG2-CG2 4.22Å; S48-I51 PolarHBondContact O-N 3.43Å; G49-I51 VanDerWaalsContact C-N 3.29Å; G49-I51 PolarHBondContact O-N 2.96Å; I51-T55 WeakPolarHBondContact O-CB 3.34Å; I51-T55 PolarHBondContact O-N 2.99Å; I51-T55 PolarHBondContact O-OG1 2.95Å
52	Y	97.7	Very high	97.4	Very high	23 Å²	23	82.3 Å²	82.3	9%	0.09	46%	0.455	C	S	.	.	H	α-helix	trans	-66.5	-43.8	-178	-56.9	-66.1	0	0	0	112.4	K32 I35 R36 I47 G49 L50 R56	K32-Y52 HydrophobicContact CB-CD1 3.93Å; K32-Y52 HydrophobicContact CB-CE1 3.92Å; K32-Y52 HydrophobicContact CD-CD2 4.23Å; K32-Y52 HydrophobicContact CD-CE2 4.41Å; K32-Y52 HydrophobicContact CD-CG 4.31Å; K32-Y52 HydrophobicContact CG-CD1 3.84Å; K32-Y52 HydrophobicContact CG-CD2 4.36Å; K32-Y52 HydrophobicContact CG-CE1 4.21Å; K32-Y52 HydrophobicContact CG-CG 3.93Å; I35-Y52 HydrophobicContact CB-CD1 4.26Å; I35-Y52 HydrophobicContact CD1-CD1 4.25Å; I35-Y52 WeakPolarHBondContact CD1-O 3.2Å; I35-Y52 HydrophobicContact CG2-CD1 4.13Å; R36-Y52 PolarHBondContact NH1-OH 3.39Å; R36-Y52 PolarHBondContact NH2-OH 3.14Å; I47-Y52 HydrophobicContact CG2-CE1 4.5Å; G49-Y52 WeakPolarHBondContact O-CD2 3.4Å; L50-Y52 PolarHBondContact O-N 3.42Å; L50-Y52 VanDerWaalsContact O-N 3.11Å; Y52-R56 WeakPolarHBondContact O-CG 3.45Å; Y52-R56 PolarHBondContact O-NH1 3.4Å
53	E	97.4	Very high	97.3	Very high	102 Å²	102	83.1 Å²	83.1	48%	0.477	44%	0.443	S	S	.	.	H	α-helix	trans	-78.2	-37.7	177.6	-58.8	-50	147.5	0	0	111.2	L50 T55 R56 G57	L50-E53 PolarHBondContact O-N 3.06Å; E53-T55 PolarHBondContact O-N 3.23Å; E53-R56 WeakPolarHBondContact O-CB 3.49Å; E53-R56 PolarHBondContact O-N 3.39Å; E53-R56 IonicContact OE1-CZ 3.98Å; E53-R56 IonicContact OE1-NH1 3.24Å; E53-R56 PolarHBondContact OE1-NH1 3.45Å; E53-R56 IonicContact OE2-CZ 2.79Å; E53-R56 IonicContact OE2-NH1 2.84Å; E53-R56 PolarHBondContact OE2-NH1 2.91Å; E53-G57 PolarHBondContact O-N 2.9Å
54	E	97.8	Very high	97.3	Very high	119 Å²	119	84.4 Å²	84.4	56%	0.556	43%	0.434	S	S	*	.	H	α-helix	trans	-60.2	-45.3	176.2	-173.7	173.2	-163.5	0	0	112	L50 R56 G57 V58	L50-E54 PolarHBondContact O-N 3.34Å; L50-E54 VanDerWaalsContact O-N 3.14Å; E54-R56 VanDerWaalsContact C-N 3.25Å; E54-R56 PolarHBondContact O-N 3.43Å; E54-G57 PolarHBondContact O-N 3.08Å; E54-G57 VanDerWaalsContact O-N 3.1Å; E54-V58 WeakPolarHBondContact O-CG2 3.5Å; E54-V58 PolarHBondContact O-N 3.33Å
55	T	98.2	Very high	97.3	Very high	49 Å²	49	84.3 Å²	84.3	30%	0.301	43%	0.432	S	S	.	.	H	α-helix	trans	-59.6	-38.3	177.4	-59	0	0	0	0	111.6	I35 I51 E53 L59	I35-T55 HydrophobicContact CD1-CG2 4.29Å; I35-T55 HydrophobicContact CG1-CG2 4.16Å; I35-T55 HydrophobicContact CG2-CG2 4.21Å; I51-T55 WeakPolarHBondContact O-CB 3.34Å; I51-T55 PolarHBondContact O-N 2.99Å; I51-T55 PolarHBondContact O-OG1 2.95Å; E53-T55 PolarHBondContact O-N 3.23Å; T55-L59 WeakPolarHBondContact O-CB 3.41Å; T55-L59 PolarHBondContact O-N 3.45Å
56	R	98.1	Very high	97.3	Very high	7 Å²	7	76.2 Å²	76.2	3%	0.026	40%	0.397	C	S	.	.	H	α-helix	trans	-67.7	-41.7	176.3	-74.4	-179.7	-165.6	127.8	-15.7	111.7	I27 I30 I35 Y52 E53 E54 L59 K60	I27-R56 HydrophobicContact CD1-CB 3.83Å; I27-R56 HydrophobicContact CD1-CG 4.22Å; I27-R56 HydrophobicContact CG1-CB 3.77Å; I27-R56 HydrophobicContact CG1-CG 4.15Å; I27-R56 WeakPolarHBondContact O-CD 3.42Å; I30-R56 HydrophobicContact CB-CG 4.32Å; I30-R56 HydrophobicContact CG2-CG 4.49Å; I30-R56 PolarHBondContact O-NE 3.23Å; I30-R56 PolarHBondContact O-NH2 3Å; I35-R56 HydrophobicContact CD1-CG 4.38Å; Y52-R56 WeakPolarHBondContact O-CG 3.45Å; Y52-R56 PolarHBondContact O-NH1 3.4Å; E53-R56 WeakPolarHBondContact O-CB 3.49Å; E53-R56 PolarHBondContact O-N 3.39Å; E53-R56 IonicContact OE1-CZ 3.98Å; E53-R56 IonicContact OE1-NH1 3.24Å; E53-R56 PolarHBondContact OE1-NH1 3.45Å; E53-R56 IonicContact OE2-CZ 2.79Å; E53-R56 IonicContact OE2-NH1 2.84Å; E53-R56 PolarHBondContact OE2-NH1 2.91Å; E54-R56 VanDerWaalsContact C-N 3.25Å; E54-R56 PolarHBondContact O-N 3.43Å; R56-L59 PolarHBondContact O-N 3.45Å; R56-K60 WeakPolarHBondContact O-CB 3.38Å; R56-K60 PolarHBondContact O-N 2.94Å
57	G	97.8	Very high	97.3	Very high	33 Å²	33	70 Å²	70	34%	0.34	38%	0.38	S	S	.	.	H	α-helix	trans	-58.2	-49.6	174	0	0	0	0	0	112.1	E53 E54 L59 K60 I61	E53-G57 PolarHBondContact O-N 2.9Å; E54-G57 PolarHBondContact O-N 3.08Å; E54-G57 VanDerWaalsContact O-N 3.1Å; G57-L59 VanDerWaalsContact C-N 3.35Å; G57-L59 PolarHBondContact O-N 3.21Å; G57-K60 PolarHBondContact O-N 3.43Å; G57-I61 WeakPolarHBondContact O-CG1 3.35Å; G57-I61 PolarHBondContact O-N 2.87Å
58	V	97.8	Very high	97.3	Very high	93 Å²	93	74.7 Å²	74.7	56%	0.564	40%	0.396	S	S	*	.	H	α-helix	trans	-60.1	-44.7	177.6	175.6	0	0	0	0	111.4	E54 K60 I61 F62	E54-V58 WeakPolarHBondContact O-CG2 3.5Å; E54-V58 PolarHBondContact O-N 3.33Å; V58-K60 VanDerWaalsContact C-N 3.33Å; V58-K60 PolarHBondContact O-N 3.37Å; V58-I61 PolarHBondContact O-N 2.66Å; V58-F62 WeakPolarHBondContact O-CB 3.49Å; V58-F62 PolarHBondContact O-N 3.2Å
59	L	97.4	Very high	97.4	Very high	58 Å²	58	72.2 Å²	72.2	30%	0.304	38%	0.377	S	S	.	.	H	α-helix	trans	-61	-43.2	177.4	178.3	64.9	0	0	0	111.8	I30 T55 R56 G57 F62 L63	I30-L59 HydrophobicContact CD1-CD2 3.94Å; I30-L59 HydrophobicContact CG1-CD2 3.68Å; T55-L59 WeakPolarHBondContact O-CB 3.41Å; T55-L59 PolarHBondContact O-N 3.45Å; R56-L59 PolarHBondContact O-N 3.45Å; G57-L59 VanDerWaalsContact C-N 3.35Å; G57-L59 PolarHBondContact O-N 3.21Å; L59-F62 PolarHBondContact O-N 2.97Å; L59-L63 HydrophobicContact CD1-CD1 4.03Å; L59-L63 HydrophobicContact CD1-CG 4.19Å; L59-L63 HydrophobicContact CG-CD1 4.06Å; L59-L63 WeakPolarHBondContact O-CG 3.46Å; L59-L63 PolarHBondContact O-N 3.31Å
60	K	96.8	Very high	97.5	Very high	112 Å²	112	69.7 Å²	69.7	49%	0.487	35%	0.351	S	S	.	.	H	α-helix	trans	-60.8	-51.4	178.5	-180	176.1	173.2	179.4	0	110.9	I27 R56 G57 V58 F62 L63 E64	I27-K60 HydrophobicContact CD1-CB 4.5Å; R56-K60 WeakPolarHBondContact O-CB 3.38Å; R56-K60 PolarHBondContact O-N 2.94Å; G57-K60 PolarHBondContact O-N 3.43Å; V58-K60 VanDerWaalsContact C-N 3.33Å; V58-K60 PolarHBondContact O-N 3.37Å; K60-F62 VanDerWaalsContact C-N 3.31Å; K60-F62 PolarHBondContact O-N 3.16Å; K60-L63 PolarHBondContact O-N 3.26Å; K60-E64 WeakPolarHBondContact CE-OE1 3.41Å; K60-E64 HydrophobicContact CG-CG 4.36Å; K60-E64 WeakPolarHBondContact CG-OE1 3.47Å; K60-E64 IonicContact NZ-OE1 2.73Å; K60-E64 WeakPolarHBondContact O-CB 3.44Å; K60-E64 VanDerWaalsContact O-CG 3.3Å; K60-E64 WeakPolarHBondContact O-CG 3.31Å; K60-E64 PolarHBondContact O-N 2.83Å
61	I	97.4	Very high	97.5	Very high	96 Å²	96	65.7 Å²	65.7	49%	0.492	33%	0.332	S	S	.	.	H	α-helix	trans	-59.7	-44	179.6	-66.5	165.4	0	0	0	110.9	G57 V58 E64 N65	G57-I61 WeakPolarHBondContact O-CG1 3.35Å; G57-I61 PolarHBondContact O-N 2.87Å; V58-I61 PolarHBondContact O-N 2.66Å; I61-E64 PolarHBondContact O-N 3.45Å; I61-N65 VanDerWaalsContact O-CG 3.28Å; I61-N65 PolarHBondContact O-N 2.87Å; I61-N65 PolarHBondContact O-ND2 2.95Å
62	F	97	Very high	97.5	Very high	87 Å²	87	66.7 Å²	66.7	38%	0.382	34%	0.341	S	S	.	.	H	α-helix	trans	-58	-51.2	177	173.2	-101.9	0	0	0	111.6	V58 L59 K60 N65 V66 L91	V58-F62 WeakPolarHBondContact O-CB 3.49Å; V58-F62 PolarHBondContact O-N 3.2Å; L59-F62 PolarHBondContact O-N 2.97Å; K60-F62 VanDerWaalsContact C-N 3.31Å; K60-F62 PolarHBondContact O-N 3.16Å; F62-N65 PolarHBondContact O-N 3.16Å; F62-V66 HydrophobicContact CD2-CG2 4.4Å; F62-V66 HydrophobicContact CE1-CG2 4.19Å; F62-V66 HydrophobicContact CE2-CG2 3.93Å; F62-V66 HydrophobicContact CZ-CG2 3.82Å; F62-V66 WeakPolarHBondContact O-CG2 3.08Å; F62-V66 PolarHBondContact O-N 3.3Å; F62-V66 VanDerWaalsContact O-N 3.08Å; F62-L91 HydrophobicContact CZ-CD2 4.14Å
63	L	96.6	Very high	97.5	Very high	80 Å²	80	69.4 Å²	69.4	42%	0.419	35%	0.351	S	S	.	.	H	α-helix	trans	-65.1	-40.6	-179.8	-70.5	175.1	0	0	0	112.1	L59 K60 N65 V66 I67	L59-L63 HydrophobicContact CD1-CD1 4.03Å; L59-L63 HydrophobicContact CD1-CG 4.19Å; L59-L63 HydrophobicContact CG-CD1 4.06Å; L59-L63 WeakPolarHBondContact O-CG 3.46Å; L59-L63 PolarHBondContact O-N 3.31Å; K60-L63 PolarHBondContact O-N 3.26Å; L63-N65 VanDerWaalsContact C-N 3.3Å; L63-N65 PolarHBondContact O-N 2.84Å; L63-V66 PolarHBondContact O-N 3.3Å; L63-I67 HydrophobicContact CB-CD1 4.34Å; L63-I67 VanDerWaalsContact O-CB 3.26Å; L63-I67 WeakPolarHBondContact O-CB 3.41Å; L63-I67 WeakPolarHBondContact O-CD1 3.35Å; L63-I67 WeakPolarHBondContact O-CG1 3.36Å; L63-I67 PolarHBondContact O-N 3Å
64	E	96.8	Very high	97.6	Very high	83 Å²	83	64.9 Å²	64.9	39%	0.388	33%	0.331	S	S	.	.	H	α-helix	trans	-58	-43.3	176.3	-76.7	173.7	173.3	0	0	111.8	K60 I61 R68	K60-E64 WeakPolarHBondContact CE-OE1 3.41Å; K60-E64 HydrophobicContact CG-CG 4.36Å; K60-E64 WeakPolarHBondContact CG-OE1 3.47Å; K60-E64 IonicContact NZ-OE1 2.73Å; K60-E64 WeakPolarHBondContact O-CB 3.44Å; K60-E64 VanDerWaalsContact O-CG 3.3Å; K60-E64 WeakPolarHBondContact O-CG 3.31Å; K60-E64 PolarHBondContact O-N 2.83Å; I61-E64 PolarHBondContact O-N 3.45Å; E64-R68 VanDerWaalsContact O-CB 3.27Å; E64-R68 WeakPolarHBondContact O-CB 3.33Å; E64-R68 PolarHBondContact O-N 2.79Å
65	N	97.2	Very high	97.6	Very high	60 Å²	60	65.5 Å²	65.5	32%	0.321	33%	0.334	S	S	.	.	H	α-helix	trans	-66.9	-47	178.5	-69.3	-21.5	0	0	0	112.2	I61 F62 L63 R68 D69 Q94	I61-N65 VanDerWaalsContact O-CG 3.28Å; I61-N65 PolarHBondContact O-N 2.87Å; I61-N65 PolarHBondContact O-ND2 2.95Å; F62-N65 PolarHBondContact O-N 3.16Å; L63-N65 VanDerWaalsContact C-N 3.3Å; L63-N65 PolarHBondContact O-N 2.84Å; N65-R68 PolarHBondContact O-N 2.77Å; N65-R68 PolarHBondContact OD1-NH1 3.47Å; N65-D69 PolarHBondContact O-N 3.28Å; N65-Q94 VanDerWaalsContact C-NE2 3.34Å; N65-Q94 PolarHBondContact O-NE2 3.1Å
66	V	97.5	Very high	97.5	Very high	12 Å²	12	71 Å²	71	7%	0.073	36%	0.356	C	S	.	.	H	α-helix	trans	-63.1	-43.1	177.9	175.7	0	0	0	0	111.3	F62 L63 D69 A70 V87 A90 L91 Q94	F62-V66 HydrophobicContact CD2-CG2 4.4Å; F62-V66 HydrophobicContact CE1-CG2 4.19Å; F62-V66 HydrophobicContact CE2-CG2 3.93Å; F62-V66 HydrophobicContact CZ-CG2 3.82Å; F62-V66 WeakPolarHBondContact O-CG2 3.08Å; F62-V66 PolarHBondContact O-N 3.3Å; F62-V66 VanDerWaalsContact O-N 3.08Å; L63-V66 PolarHBondContact O-N 3.3Å; V66-D69 PolarHBondContact O-N 3.48Å; V66-A70 WeakPolarHBondContact O-CB 3.48Å; V66-A70 PolarHBondContact O-N 2.85Å; V66-V87 HydrophobicContact CG1-CG1 4.38Å; V66-A90 HydrophobicContact CG1-CB 4.25Å; V66-A90 WeakPolarHBondContact O-CB 3.39Å; V66-L91 HydrophobicContact CG1-CD2 4.05Å; V66-L91 HydrophobicContact CG1-CG 4.26Å; V66-L91 HydrophobicContact CG2-CD2 3.84Å; V66-Q94 VanDerWaalsContact CG2-OE1 3.31Å
67	I	97.4	Very high	97.5	Very high	99 Å²	99	72.9 Å²	72.9	51%	0.508	37%	0.373	S	S	.	.	H	α-helix	trans	-66.8	-40.8	180	-69	166.4	0	0	0	110.7	L63 D69 A70 V71	L63-I67 HydrophobicContact CB-CD1 4.34Å; L63-I67 VanDerWaalsContact O-CB 3.26Å; L63-I67 WeakPolarHBondContact O-CB 3.41Å; L63-I67 WeakPolarHBondContact O-CD1 3.35Å; L63-I67 WeakPolarHBondContact O-CG1 3.36Å; L63-I67 PolarHBondContact O-N 3Å; I67-D69 PolarHBondContact O-N 3.22Å; I67-A70 PolarHBondContact O-N 3.37Å; I67-V71 HydrophobicContact CG2-CG2 4.1Å; I67-V71 WeakPolarHBondContact O-CB 3.33Å; I67-V71 VanDerWaalsContact O-CG2 3.27Å; I67-V71 WeakPolarHBondContact O-CG2 3.47Å; I67-V71 PolarHBondContact O-N 2.94Å
68	R	97.7	Very high	97.5	Very high	136 Å²	136	82.7 Å²	82.7	51%	0.513	40%	0.4	S	S	.	.	H	α-helix	trans	-56.2	-51.5	176.7	-173.2	-176.9	-58.5	108.8	2.3	111.1	E64 N65 A70 V71 T72	E64-R68 VanDerWaalsContact O-CB 3.27Å; E64-R68 WeakPolarHBondContact O-CB 3.33Å; E64-R68 PolarHBondContact O-N 2.79Å; N65-R68 PolarHBondContact O-N 2.77Å; N65-R68 PolarHBondContact OD1-NH1 3.47Å; R68-A70 PolarHBondContact O-N 3.4Å; R68-V71 PolarHBondContact O-N 2.86Å; R68-T72 PolarHBondContact O-N 3.5Å; R68-T72 PolarHBondContact O-OG1 3.27Å; R68-T72 VanDerWaalsContact O-OG1 3.08Å
69	D	97.6	Very high	97.5	Very high	18 Å²	18	82.5 Å²	82.5	10%	0.096	39%	0.389	C	S	.	.	H	α-helix	trans	-62.9	-42.3	179.1	-69.6	-12.4	0	0	0	111.6	N65 V66 I67 V71 T72 Y73 A90 R93 Q94	N65-D69 PolarHBondContact O-N 3.28Å; V66-D69 PolarHBondContact O-N 3.48Å; I67-D69 PolarHBondContact O-N 3.22Å; D69-V71 PolarHBondContact O-N 3.47Å; D69-T72 WeakPolarHBondContact O-CB 3.42Å; D69-T72 PolarHBondContact O-N 3.43Å; D69-Y73 WeakPolarHBondContact O-CD2 3.42Å; D69-Y73 PolarHBondContact O-N 3.06Å; D69-Y73 VanDerWaalsContact O-N 3.17Å; D69-A90 HydrophobicContact CB-CB 3.61Å; D69-R93 IonicContact OD1-CZ 2.87Å; D69-R93 IonicContact OD1-NH1 2.66Å; D69-R93 PolarHBondContact OD1-NH1 2.85Å; D69-R93 IonicContact OD2-CZ 3.92Å; D69-R93 IonicContact OD2-NH1 3.89Å; D69-R93 PolarHBondContact OD2-NH1 2.98Å; D69-Q94 PolarHBondContact OD2-NE2 2.99Å; D69-Q94 VanDerWaalsContact OD2-NE2 3.08Å
70	A	98.1	Very high	97.4	Very high	3 Å²	3	89.8 Å²	89.8	3%	0.025	42%	0.418	C	S	.	.	H	α-helix	trans	-65	-38	178.5	0	0	0	0	0	112.7	V66 I67 R68 Y73 T74 V82 D86 V87 A90	V66-A70 WeakPolarHBondContact O-CB 3.48Å; V66-A70 PolarHBondContact O-N 2.85Å; I67-A70 PolarHBondContact O-N 3.37Å; R68-A70 PolarHBondContact O-N 3.4Å; A70-Y73 PolarHBondContact O-N 3.31Å; A70-T74 WeakPolarHBondContact O-CB 3.3Å; A70-T74 PolarHBondContact O-N 3.17Å; A70-T74 VanDerWaalsContact O-N 3.09Å; A70-T74 PolarHBondContact O-OG1 3.45Å; A70-V82 HydrophobicContact CB-CG1 4.07Å; A70-D86 HydrophobicContact CB-CB 4.32Å; A70-V87 HydrophobicContact CB-CG2 4.3Å; A70-A90 HydrophobicContact CB-CB 4.05Å
71	V	98.1	Very high	97.3	Very high	51 Å²	51	89.3 Å²	89.3	31%	0.309	43%	0.425	S	S	.	.	H	α-helix	trans	-64.9	-42.5	174.3	169.4	0	0	0	0	110.2	I67 R68 D69 Y73 T74 E75 V82	I67-V71 HydrophobicContact CG2-CG2 4.1Å; I67-V71 WeakPolarHBondContact O-CB 3.33Å; I67-V71 VanDerWaalsContact O-CG2 3.27Å; I67-V71 WeakPolarHBondContact O-CG2 3.47Å; I67-V71 PolarHBondContact O-N 2.94Å; R68-V71 PolarHBondContact O-N 2.86Å; D69-V71 PolarHBondContact O-N 3.47Å; V71-Y73 VanDerWaalsContact C-N 3.35Å; V71-Y73 PolarHBondContact O-N 2.88Å; V71-T74 WeakPolarHBondContact O-CB 3.38Å; V71-T74 PolarHBondContact O-N 3.35Å; V71-T74 VanDerWaalsContact O-N 3.08Å; V71-E75 HydrophobicContact CG1-CG 4.06Å; V71-E75 WeakPolarHBondContact O-CG 3.27Å; V71-E75 PolarHBondContact O-N 3.2Å; V71-V82 HydrophobicContact CG2-CG2 4.44Å
72	T	98	Very high	97.3	Very high	80 Å²	80	87.9 Å²	87.9	49%	0.491	42%	0.42	S	S	.	.	H	α-helix	trans	-56.9	-45.1	175.8	-57.6	0	0	0	0	112.4	R68 D69 T74 H76	R68-T72 PolarHBondContact O-N 3.5Å; R68-T72 PolarHBondContact O-OG1 3.27Å; R68-T72 VanDerWaalsContact O-OG1 3.08Å; D69-T72 WeakPolarHBondContact O-CB 3.42Å; D69-T72 PolarHBondContact O-N 3.43Å; T72-T74 VanDerWaalsContact C-N 3.33Å; T72-T74 PolarHBondContact O-N 3.41Å; T72-H76 VanDerWaalsContact O-CB 3.28Å; T72-H76 WeakPolarHBondContact O-CB 3.15Å; T72-H76 PolarHBondContact O-N 3.45Å
73	Y	97.3	Very high	97.2	Very high	79 Å²	79	86.3 Å²	86.3	31%	0.31	42%	0.418	S	S	.	.	H	α-helix	trans	-64.5	-37.7	175.6	-67.2	-59.8	0	0	0	112.8	D69 A70 V71 A77 D86 A90	D69-Y73 WeakPolarHBondContact O-CD2 3.42Å; D69-Y73 PolarHBondContact O-N 3.06Å; D69-Y73 VanDerWaalsContact O-N 3.17Å; A70-Y73 PolarHBondContact O-N 3.31Å; V71-Y73 VanDerWaalsContact C-N 3.35Å; V71-Y73 PolarHBondContact O-N 2.88Å; Y73-A77 WeakPolarHBondContact O-CB 2.86Å; Y73-A77 PolarHBondContact O-N 3.25Å; Y73-A77 VanDerWaalsContact O-N 3.1Å; Y73-D86 WeakPolarHBondContact CB-OD1 3.26Å; Y73-A90 HydrophobicContact CE2-CB 4.43Å
74	T	98.2	Very high	97.1	Very high	8 Å²	8	85.2 Å²	85.2	5%	0.049	42%	0.42	C	S	.	.	H	α-helix	trans	-65.6	-46.6	179.1	-59.2	0	0	0	0	111.6	A70 V71 T72 A77 R78 R79 V82 D86	A70-T74 WeakPolarHBondContact O-CB 3.3Å; A70-T74 PolarHBondContact O-N 3.17Å; A70-T74 VanDerWaalsContact O-N 3.09Å; A70-T74 PolarHBondContact O-OG1 3.45Å; V71-T74 WeakPolarHBondContact O-CB 3.38Å; V71-T74 PolarHBondContact O-N 3.35Å; V71-T74 VanDerWaalsContact O-N 3.08Å; T72-T74 VanDerWaalsContact C-N 3.33Å; T72-T74 PolarHBondContact O-N 3.41Å; T74-A77 PolarHBondContact O-N 3.26Å; T74-R78 PolarHBondContact O-N 3.08Å; T74-R79 HydrophobicContact CG2-CB 4.03Å; T74-R79 WeakPolarHBondContact CG2-O 3.49Å; T74-R79 PolarHBondContact O-N 3.04Å; T74-V82 HydrophobicContact CG2-CG2 4.23Å; T74-V82 WeakPolarHBondContact OG1-CA 3.45Å; T74-V82 WeakPolarHBondContact OG1-CG2 3.43Å; T74-D86 PolarHBondContact OG1-OD2 2.76Å
75	E	97.9	Very high	97.1	Very high	132 Å²	132	84 Å²	84	62%	0.617	42%	0.415	S	S	*	.	H	α-helix	trans	-66.6	-42.2	178.3	-71.8	178.2	162.2	0	0	111.3	V71 A77 R78	V71-E75 HydrophobicContact CG1-CG 4.06Å; V71-E75 WeakPolarHBondContact O-CG 3.27Å; V71-E75 PolarHBondContact O-N 3.2Å; E75-A77 VanDerWaalsContact C-N 3.25Å; E75-A77 PolarHBondContact O-N 3.37Å; E75-R78 WeakPolarHBondContact O-CA 3.21Å; E75-R78 PolarHBondContact O-N 2.96Å
76	H	97.7	Very high	97	Very high	164 Å²	164	81.3 Å²	81.3	76%	0.759	40%	0.401	S	S	*	.	H	α-helix	trans	-57.4	-40.2	174.8	-177.9	71.8	0	0	0	111.9	T72 R78	T72-H76 VanDerWaalsContact O-CB 3.28Å; T72-H76 WeakPolarHBondContact O-CB 3.15Å; T72-H76 PolarHBondContact O-N 3.45Å; H76-R78 PolarHBondContact O-N 3.46Å
77	A	97	Very high	97	Very high	47 Å²	47	83.2 Å²	83.2	39%	0.388	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	6.9	175.8	0	0	0	0	0	114.2	Y73 T74 E75 R79	Y73-A77 WeakPolarHBondContact O-CB 2.86Å; Y73-A77 PolarHBondContact O-N 3.25Å; Y73-A77 VanDerWaalsContact O-N 3.1Å; T74-A77 PolarHBondContact O-N 3.26Å; E75-A77 VanDerWaalsContact C-N 3.25Å; E75-A77 PolarHBondContact O-N 3.37Å; A77-R79 HydrophobicContact CB-CG 4.4Å; A77-R79 PolarHBondContact O-N 3.48Å; A77-R79 VanDerWaalsContact O-N 3.17Å
78	R	97.8	Very high	96.9	Very high	239 Å²	239	79.4 Å²	79.4	90%	0.902	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	30	-177.6	-54.3	-179	-176.9	-174.2	0.2	113.5	T74 E75 H76	T74-R78 PolarHBondContact O-N 3.08Å; E75-R78 WeakPolarHBondContact O-CA 3.21Å; E75-R78 PolarHBondContact O-N 2.96Å; H76-R78 PolarHBondContact O-N 3.46Å
79	R	97.4	Very high	96.8	Very high	88 Å²	88	78.2 Å²	78.2	33%	0.332	39%	0.39	S	S	.	.			trans	-97.4	151.4	177.3	-73.2	-178.1	-76	101.5	-4.5	110.5	T74 A77 T81 D86	T74-R79 HydrophobicContact CG2-CB 4.03Å; T74-R79 WeakPolarHBondContact CG2-O 3.49Å; T74-R79 PolarHBondContact O-N 3.04Å; A77-R79 HydrophobicContact CB-CG 4.4Å; A77-R79 PolarHBondContact O-N 3.48Å; A77-R79 VanDerWaalsContact O-N 3.17Å; R79-T81 PolarHBondContact NH1-O 3.34Å; R79-T81 VanDerWaalsContact NH1-O 3.09Å; R79-D86 IonicContact CZ-OD1 3.67Å; R79-D86 IonicContact CZ-OD2 3.41Å; R79-D86 IonicContact NH1-OD1 3.68Å; R79-D86 IonicContact NH1-OD2 2.7Å; R79-D86 PolarHBondContact NH1-OD2 2.7Å; R79-D86 IonicContact NH2-OD1 3.75Å; R79-D86 PolarHBondContact NH2-OD1 2.85Å; R79-D86 IonicContact NH2-OD2 3.9Å; R79-D86 PolarHBondContact NH2-OD2 3.08Å
80	K	95.4	Very high	96.8	Very high	212 Å²	212	77.4 Å²	77.4	92%	0.922	39%	0.386	S	S	*	.	S	Bend	trans	-98.8	3.8	173.1	-65.2	-179.6	179.9	178.7	0	112.9
81	T	95.8	Very high	96.7	Very high	102 Å²	102	78.2 Å²	78.2	63%	0.626	39%	0.39	S	S	*	.	S	Bend	trans	-136.9	121.3	-174.6	-60.3	0	0	0	0	108.8	R79 T83	R79-T81 PolarHBondContact NH1-O 3.34Å; R79-T81 VanDerWaalsContact NH1-O 3.09Å; T81-T83 PolarHBondContact O-N 2.85Å
82	V	96.5	Very high	96.5	Very high	66 Å²	66	82.9 Å²	82.9	40%	0.4	41%	0.406	S	S	.	.			trans	-66.1	128.2	172.7	-176	0	0	0	0	108.2	A70 V71 T74 D86 V87	A70-V82 HydrophobicContact CB-CG1 4.07Å; V71-V82 HydrophobicContact CG2-CG2 4.44Å; T74-V82 HydrophobicContact CG2-CG2 4.23Å; T74-V82 WeakPolarHBondContact OG1-CA 3.45Å; T74-V82 WeakPolarHBondContact OG1-CG2 3.43Å; V82-D86 HydrophobicContact CG1-CB 3.92Å; V82-V87 HydrophobicContact CG1-CG2 4.02Å
83	T	95.5	Very high	96.3	Very high	53 Å²	53	86.9 Å²	86.9	33%	0.325	41%	0.412	S	S	.	.			trans	-97.4	166.4	177	65.8	0	0	0	0	110.4	T81 M85 D86 V87	T81-T83 PolarHBondContact O-N 2.85Å; T83-M85 PolarHBondContact O-N 3.24Å; T83-D86 WeakPolarHBondContact CB-OD2 3.47Å; T83-D86 PolarHBondContact N-OD2 2.8Å; T83-D86 PolarHBondContact O-N 2.73Å; T83-D86 VanDerWaalsContact OG1-CG 3.27Å; T83-D86 PolarHBondContact OG1-N 3.17Å; T83-D86 PolarHBondContact OG1-OD2 3.09Å; T83-V87 PolarHBondContact O-N 3.1Å
84	A	94.8	Very high	96.2	Very high	57 Å²	57	86 Å²	86	47%	0.471	41%	0.411	S	S	.	.	H	α-helix	trans	-57.7	-37.1	173.3	0	0	0	0	0	111.9	D86 V87 V88 F101	A84-D86 PolarHBondContact O-N 2.67Å; A84-V87 WeakPolarHBondContact O-CB 3.42Å; A84-V87 PolarHBondContact O-N 3.48Å; A84-V88 WeakPolarHBondContact O-CG2 3.47Å; A84-V88 PolarHBondContact O-N 3.28Å; A84-F101 HydrophobicContact CB-CD1 4.42Å; A84-F101 HydrophobicContact CB-CE1 4.5Å
85	M	95.5	Very high	96	Very high	57 Å²	57	88.7 Å²	88.7	28%	0.281	44%	0.44	S	S	.	.	H	α-helix	trans	-65.5	-36.9	180	-65.5	-50.2	-62.4	0	0	112.8	T83 V87 V88 Y89	T83-M85 PolarHBondContact O-N 3.24Å; M85-V87 PolarHBondContact O-N 3.09Å; M85-V88 PolarHBondContact O-N 3.26Å; M85-Y89 HydrophobicContact CB-CE2 4.09Å; M85-Y89 HydrophobicContact CE-CE1 3.77Å; M85-Y89 HydrophobicContact CE-CE2 4.38Å; M85-Y89 WeakPolarHBondContact CE-OH 3.41Å; M85-Y89 WeakPolarHBondContact O-CB 3.28Å; M85-Y89 WeakPolarHBondContact O-CD2 3.45Å; M85-Y89 PolarHBondContact O-N 2.91Å
86	D	96.3	Very high	95.8	Very high	4 Å²	4	90.2 Å²	90.2	2%	0.021	44%	0.44	C	S	.	.	H	α-helix	trans	-60.8	-38.7	175.7	-57.6	-51.7	0	0	0	111.2	A70 Y73 T74 R79 V82 T83 A84 A90	A70-D86 HydrophobicContact CB-CB 4.32Å; Y73-D86 WeakPolarHBondContact CB-OD1 3.26Å; T74-D86 PolarHBondContact OG1-OD2 2.76Å; R79-D86 IonicContact CZ-OD1 3.67Å; R79-D86 IonicContact CZ-OD2 3.41Å; R79-D86 IonicContact NH1-OD1 3.68Å; R79-D86 IonicContact NH1-OD2 2.7Å; R79-D86 PolarHBondContact NH1-OD2 2.7Å; R79-D86 IonicContact NH2-OD1 3.75Å; R79-D86 PolarHBondContact NH2-OD1 2.85Å; R79-D86 IonicContact NH2-OD2 3.9Å; R79-D86 PolarHBondContact NH2-OD2 3.08Å; V82-D86 HydrophobicContact CG1-CB 3.92Å; T83-D86 WeakPolarHBondContact CB-OD2 3.47Å; T83-D86 PolarHBondContact N-OD2 2.8Å; T83-D86 PolarHBondContact O-N 2.73Å; T83-D86 VanDerWaalsContact OG1-CG 3.27Å; T83-D86 PolarHBondContact OG1-N 3.17Å; T83-D86 PolarHBondContact OG1-OD2 3.09Å; A84-D86 PolarHBondContact O-N 2.67Å; D86-A90 WeakPolarHBondContact O-CB 3.43Å; D86-A90 PolarHBondContact O-N 3.37Å
87	V	96.5	Very high	95.5	Very high	52 Å²	52	87 Å²	87	32%	0.315	43%	0.432	S	S	.	.	H	α-helix	trans	-70	-42.3	176.1	-179	0	0	0	0	111.1	V66 A70 V82 T83 A84 M85 Y89 A90 L91	V66-V87 HydrophobicContact CG1-CG1 4.38Å; A70-V87 HydrophobicContact CB-CG2 4.3Å; V82-V87 HydrophobicContact CG1-CG2 4.02Å; T83-V87 PolarHBondContact O-N 3.1Å; A84-V87 WeakPolarHBondContact O-CB 3.42Å; A84-V87 PolarHBondContact O-N 3.48Å; M85-V87 PolarHBondContact O-N 3.09Å; V87-Y89 VanDerWaalsContact C-N 3.32Å; V87-Y89 PolarHBondContact O-N 3.32Å; V87-A90 PolarHBondContact O-N 3.17Å; V87-L91 HydrophobicContact CG1-CD1 4.07Å; V87-L91 HydrophobicContact CG1-CG 4.43Å; V87-L91 WeakPolarHBondContact O-CB 3.27Å; V87-L91 VanDerWaalsContact O-CG 3.31Å; V87-L91 WeakPolarHBondContact O-CG 3.37Å; V87-L91 PolarHBondContact O-N 3.35Å
88	V	96.3	Very high	95.2	Very high	19 Å²	19	88.2 Å²	88.2	12%	0.115	43%	0.432	C	S	.	.	H	α-helix	trans	-60.6	-43.1	176.5	172.4	0	0	0	0	110.8	A84 M85 L91 K92 L98 F101	A84-V88 WeakPolarHBondContact O-CG2 3.47Å; A84-V88 PolarHBondContact O-N 3.28Å; M85-V88 PolarHBondContact O-N 3.26Å; V88-L91 PolarHBondContact O-N 3.04Å; V88-K92 WeakPolarHBondContact O-CB 3.44Å; V88-K92 PolarHBondContact O-N 3.32Å; V88-L98 HydrophobicContact CG2-CD2 4.45Å; V88-F101 HydrophobicContact CG2-CB 3.51Å; V88-F101 HydrophobicContact CG2-CD1 4.16Å; V88-F101 HydrophobicContact CG2-CG 3.93Å
89	Y	95.3	Very high	94.9	Very high	112 Å²	112	86.3 Å²	86.3	44%	0.439	43%	0.426	S	S	.	.	H	α-helix	trans	-68.8	-38.4	176.9	-61.8	-30.7	0	0	0	112.8	M85 V87 K92 R93	M85-Y89 HydrophobicContact CB-CE2 4.09Å; M85-Y89 HydrophobicContact CE-CE1 3.77Å; M85-Y89 HydrophobicContact CE-CE2 4.38Å; M85-Y89 WeakPolarHBondContact CE-OH 3.41Å; M85-Y89 WeakPolarHBondContact O-CB 3.28Å; M85-Y89 WeakPolarHBondContact O-CD2 3.45Å; M85-Y89 PolarHBondContact O-N 2.91Å; V87-Y89 VanDerWaalsContact C-N 3.32Å; V87-Y89 PolarHBondContact O-N 3.32Å; Y89-K92 PolarHBondContact O-N 2.97Å; Y89-R93 WeakPolarHBondContact O-CB 3.43Å; Y89-R93 PolarHBondContact O-N 3.22Å
90	A	96.8	Very high	94.7	Very high	0 Å²	0	86.1 Å²	86.1	0%	0	45%	0.451	C	S	.	.	H	α-helix	trans	-59.8	-46.6	172.6	0	0	0	0	0	112	V66 D69 A70 Y73 D86 V87 R93 Q94	V66-A90 HydrophobicContact CG1-CB 4.25Å; V66-A90 WeakPolarHBondContact O-CB 3.39Å; D69-A90 HydrophobicContact CB-CB 3.61Å; A70-A90 HydrophobicContact CB-CB 4.05Å; Y73-A90 HydrophobicContact CE2-CB 4.43Å; D86-A90 WeakPolarHBondContact O-CB 3.43Å; D86-A90 PolarHBondContact O-N 3.37Å; V87-A90 PolarHBondContact O-N 3.17Å; A90-R93 PolarHBondContact O-N 3.22Å; A90-Q94 WeakPolarHBondContact O-CG 3.48Å; A90-Q94 PolarHBondContact O-N 2.99Å
91	L	96.3	Very high	94.3	Very high	21 Å²	21	80.5 Å²	80.5	11%	0.11	43%	0.427	C	S	.	.	H	α-helix	trans	-64.1	-45.6	176.8	-69.8	170.5	0	0	0	111.3	F62 V66 V87 V88 R93 Q94 G95 R96 L98	F62-L91 HydrophobicContact CZ-CD2 4.14Å; V66-L91 HydrophobicContact CG1-CD2 4.05Å; V66-L91 HydrophobicContact CG1-CG 4.26Å; V66-L91 HydrophobicContact CG2-CD2 3.84Å; V87-L91 HydrophobicContact CG1-CD1 4.07Å; V87-L91 HydrophobicContact CG1-CG 4.43Å; V87-L91 WeakPolarHBondContact O-CB 3.27Å; V87-L91 VanDerWaalsContact O-CG 3.31Å; V87-L91 WeakPolarHBondContact O-CG 3.37Å; V87-L91 PolarHBondContact O-N 3.35Å; V88-L91 PolarHBondContact O-N 3.04Å; L91-R93 VanDerWaalsContact C-N 3.29Å; L91-R93 PolarHBondContact O-N 3.19Å; L91-Q94 CarbonylContact O-C 2.92Å; L91-Q94 WeakPolarHBondContact O-CA 3.5Å; L91-Q94 PolarHBondContact O-N 2.89Å; L91-G95 PolarHBondContact O-N 3.03Å; L91-R96 CarbonylContact C-O 3.51Å; L91-R96 HydrophobicContact CB-CB 4.22Å; L91-R96 WeakPolarHBondContact CB-O 3.47Å; L91-R96 HydrophobicContact CD2-CB 4.27Å; L91-R96 CarbonylContact O-C 3.59Å; L91-R96 WeakPolarHBondContact O-CA 3.46Å; L91-R96 PolarHBondContact O-N 3.16Å; L91-L98 HydrophobicContact CD1-CB 4Å; L91-L98 HydrophobicContact CD1-CD2 4.07Å; L91-L98 HydrophobicContact CD1-CG 4.5Å
92	K	94.6	Very high	93.3	Very high	149 Å²	149	79.4 Å²	79.4	65%	0.648	44%	0.436	S	S	*	.	H	α-helix	trans	-59.2	-40.8	179	-171.8	177.4	-179.2	179.5	0	111.7	V88 Y89 Q94 G95 R96	V88-K92 WeakPolarHBondContact O-CB 3.44Å; V88-K92 PolarHBondContact O-N 3.32Å; Y89-K92 PolarHBondContact O-N 2.97Å; K92-Q94 PolarHBondContact O-N 2.68Å; K92-G95 PolarHBondContact O-N 2.76Å; K92-R96 PolarHBondContact N-O 3.08Å
93	R	94.5	Very high	91.5	Very high	164 Å²	164	82.5 Å²	82.5	62%	0.619	48%	0.481	S	S	*	.	H	α-helix	trans	-59.6	-32.7	174.9	-178.6	177.8	174.6	-94.2	2.4	112.6	D69 Y89 A90 L91 G95	D69-R93 IonicContact OD1-CZ 2.87Å; D69-R93 IonicContact OD1-NH1 2.66Å; D69-R93 PolarHBondContact OD1-NH1 2.85Å; D69-R93 IonicContact OD2-CZ 3.92Å; D69-R93 IonicContact OD2-NH1 3.89Å; D69-R93 PolarHBondContact OD2-NH1 2.98Å; Y89-R93 WeakPolarHBondContact O-CB 3.43Å; Y89-R93 PolarHBondContact O-N 3.22Å; A90-R93 PolarHBondContact O-N 3.22Å; L91-R93 VanDerWaalsContact C-N 3.29Å; L91-R93 PolarHBondContact O-N 3.19Å; R93-G95 VanDerWaalsContact C-N 3.28Å; R93-G95 PolarHBondContact O-N 2.82Å
94	Q	93.5	Very high	91.3	Very high	61 Å²	61	84 Å²	84	29%	0.285	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	12.2	177	-62.4	177.9	8.1	0	0	113.4	N65 V66 D69 A90 L91 K92 R96	N65-Q94 VanDerWaalsContact C-NE2 3.34Å; N65-Q94 PolarHBondContact O-NE2 3.1Å; V66-Q94 VanDerWaalsContact CG2-OE1 3.31Å; D69-Q94 PolarHBondContact OD2-NE2 2.99Å; D69-Q94 VanDerWaalsContact OD2-NE2 3.08Å; A90-Q94 WeakPolarHBondContact O-CG 3.48Å; A90-Q94 PolarHBondContact O-N 2.99Å; L91-Q94 CarbonylContact O-C 2.92Å; L91-Q94 WeakPolarHBondContact O-CA 3.5Å; L91-Q94 PolarHBondContact O-N 2.89Å; K92-Q94 PolarHBondContact O-N 2.68Å; Q94-R96 VanDerWaalsContact C-N 3.26Å; Q94-R96 PolarHBondContact O-N 3.26Å
95	G	94.4	Very high	91.1	Very high	64 Å²	64	85.4 Å²	85.4	66%	0.66	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.6	19.9	-177.4	0	0	0	0	0	113.8	L91 K92 R93	L91-G95 PolarHBondContact O-N 3.03Å; K92-G95 PolarHBondContact O-N 2.76Å; R93-G95 VanDerWaalsContact C-N 3.28Å; R93-G95 PolarHBondContact O-N 2.82Å
96	R	93.5	Very high	90.9	Very high	164 Å²	164	87 Å²	87	62%	0.619	50%	0.502	S	S	*	.			trans	-111.2	113.2	178.1	-61.4	-58.7	-174.6	174.6	-1.3	109.9	L91 K92 Q94	L91-R96 CarbonylContact C-O 3.51Å; L91-R96 HydrophobicContact CB-CB 4.22Å; L91-R96 WeakPolarHBondContact CB-O 3.47Å; L91-R96 HydrophobicContact CD2-CB 4.27Å; L91-R96 CarbonylContact O-C 3.59Å; L91-R96 WeakPolarHBondContact O-CA 3.46Å; L91-R96 PolarHBondContact O-N 3.16Å; K92-R96 PolarHBondContact N-O 3.08Å; Q94-R96 VanDerWaalsContact C-N 3.26Å; Q94-R96 PolarHBondContact O-N 3.26Å
97	T	91.7	Very high	90.5	Very high	97 Å²	97	91.9 Å²	91.9	60%	0.595	53%	0.53	S	S	*	.			trans	-93.2	125.5	177.4	-56.8	0	0	0	0	109.8	Y99	T97-Y99 HydrophobicContact CG2-CE1 4.3Å
98	L	91.9	Very high	90.2	Very high	72 Å²	72	94.4 Å²	94.4	38%	0.377	54%	0.544	S	S	.	.			trans	-96	113.6	171.9	-170.3	65.4	0	0	0	109.2	V88 L91 F101	V88-L98 HydrophobicContact CG2-CD2 4.45Å; L91-L98 HydrophobicContact CD1-CB 4Å; L91-L98 HydrophobicContact CD1-CD2 4.07Å; L91-L98 HydrophobicContact CD1-CG 4.5Å; L98-F101 HydrophobicContact CB-CD2 4.35Å; L98-F101 HydrophobicContact CD1-CE2 4.34Å; L98-F101 HydrophobicContact CD2-CD2 3.46Å; L98-F101 VanDerWaalsContact CD2-CD2 3.46Å; L98-F101 HydrophobicContact CD2-CE1 4.46Å; L98-F101 HydrophobicContact CD2-CE2 3.37Å; L98-F101 HydrophobicContact CD2-CG 4.08Å; L98-F101 HydrophobicContact CD2-CZ 3.9Å; L98-F101 HydrophobicContact CG-CD2 3.49Å; L98-F101 VanDerWaalsContact CG-CD2 3.49Å; L98-F101 HydrophobicContact CG-CE2 3.61Å; L98-F101 HydrophobicContact CG-CG 4.41Å
99	Y	91.3	Very high	89.8	Confident	198 Å²	198	99.4 Å²	99.4	78%	0.776	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	151.2	-178.9	-58.9	-79.5	0	0	0	112	T97 F101	T97-Y99 HydrophobicContact CG2-CE1 4.3Å; Y99-F101 VanDerWaalsContact C-N 3.33Å; Y99-F101 WeakPolarHBondContact O-CD2 3.39Å
100	G	91.8	Very high	89.4	Confident	84 Å²	84	98.5 Å²	98.5	87%	0.866	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	82.5	7.5	-179.9	0	0	0	0	0	114.8
101	F	86.9	Confident	88.8	Confident	94 Å²	94	106.1 Å²	106.1	41%	0.412	63%	0.626	S	S	.	*			trans	-119.4	34	175.9	-64.1	-99.9	0	0	0	111.8	A84 V88 L98 Y99 G103	A84-F101 HydrophobicContact CB-CD1 4.42Å; A84-F101 HydrophobicContact CB-CE1 4.5Å; V88-F101 HydrophobicContact CG2-CB 3.51Å; V88-F101 HydrophobicContact CG2-CD1 4.16Å; V88-F101 HydrophobicContact CG2-CG 3.93Å; L98-F101 HydrophobicContact CB-CD2 4.35Å; L98-F101 HydrophobicContact CD1-CE2 4.34Å; L98-F101 HydrophobicContact CD2-CD2 3.46Å; L98-F101 VanDerWaalsContact CD2-CD2 3.46Å; L98-F101 HydrophobicContact CD2-CE1 4.46Å; L98-F101 HydrophobicContact CD2-CE2 3.37Å; L98-F101 HydrophobicContact CD2-CG 4.08Å; L98-F101 HydrophobicContact CD2-CZ 3.9Å; L98-F101 HydrophobicContact CG-CD2 3.49Å; L98-F101 VanDerWaalsContact CG-CD2 3.49Å; L98-F101 HydrophobicContact CG-CE2 3.61Å; L98-F101 HydrophobicContact CG-CG 4.41Å; Y99-F101 VanDerWaalsContact C-N 3.33Å; Y99-F101 WeakPolarHBondContact O-CD2 3.39Å; F101-G103 PolarHBondContact O-N 3.12Å
102	G	75.4	Confident	88.2	Confident	79 Å²	79	113.2 Å²	113.2	81%	0.814	67%	0.669	S	S	*	*			trans	-61	124.9	164.9	0	0	0	0	0	108.3
103	G	58.5	Low	87.6	Confident	132 Å²	132	109.9 Å²	109.9	100%	1.361	67%	0.671	S	S	*	*			trans	-74.4	0	174.3	0	0	0	0	0	112	F101	F101-G103 PolarHBondContact O-N 3.12Å

Retrieved 103 of 103 residues in 143 ms (Link to these results)

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