A0A087Y5X3_POEFO Loading...

Histone H2B

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 , UniProt , Accession A0A087Y5X3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 122 aa.

						>A0A087Y5X3_POEFO|A0A087Y5X3
KRSLKKMTNDISKKKGKSSSEKKVKRKTKRRETYAMYIYKVLKQVHPDTGISSRAMSIMNSFVNDLFERIATEASRLAQYNKRSTITSREVQTAVRLLLPGELAKHAVSEGTKAVTKYTSSK
					

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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	K	35.8	Very low	33.9	Very low	263 Å²	263	164.9 Å²	164.9	100%	1.143	80%	0.803	S	S	*	*				0	142.1	0	-76.3	174.4	175.5	173.7	0	108.2
2	R	29.5	Very low	33.9	Very low	241 Å²	241	162 Å²	162	91%	0.909	81%	0.812	S	S	*	*			trans	3.6	124.3	155.5	-64.6	172.3	175.1	175.8	-3.4	115.1
3	S	30.9	Very low	34.2	Very low	102 Å²	102	164.2 Å²	164.2	71%	0.713	81%	0.813	S	S	*	*				168.1	171.4	66.3	-99	0	0	0	0	107.5
4	L	35	Very low	34.3	Very low	135 Å²	135	167.6 Å²	167.6	71%	0.707	82%	0.821	S	S	*	*			cis	-159	140	-8.5	-124.1	163.4	0	0	0	107.9	K6	L4-K6 HydrophobicContact CD2-CG 4.05Å
5	K	39.1	Very low	34.4	Very low	207 Å²	207	169.4 Å²	169.4	90%	0.9	82%	0.823	S	S	*	*			trans	-152.1	90.4	156.5	-159.4	169.2	-169.5	178.7	0	111.5
6	K	36.5	Very low	34.3	Very low	178 Å²	178	163.3 Å²	163.3	77%	0.774	82%	0.817	S	S	*	*			trans	-64.2	137.9	159	-63.4	175.9	175.6	-177.7	0	107.1	L4	L4-K6 HydrophobicContact CD2-CG 4.05Å
7	M	34	Very low	34.5	Very low	155 Å²	155	165.1 Å²	165.1	76%	0.764	82%	0.819	S	S	*	*			cis	82.8	94.4	29.3	-163.3	-179.9	-173.1	0	0	115
8	T	35.9	Very low	34.6	Very low	132 Å²	132	162.2 Å²	162.2	81%	0.81	82%	0.817	S	S	*	*			trans	-160.9	106.7	145.4	45.2	0	0	0	0	104.7
9	N	32.6	Very low	34.7	Very low	124 Å²	124	158.4 Å²	158.4	66%	0.663	81%	0.807	S	S	*	*				45.9	124.3	88.5	-68.5	8.3	0	0	0	111.9
10	D	31	Very low	35.2	Very low	139 Å²	139	156.4 Å²	156.4	74%	0.743	81%	0.808	S	S	*	*				-156.8	168.8	59.3	-122.4	-58.1	0	0	0	118.4
11	I	32.9	Very low	35.6	Very low	138 Å²	138	156.8 Å²	156.8	71%	0.708	81%	0.806	S	S	*	*			trans	-57	137.7	-169.6	-65.9	158.2	0	0	0	116.5
12	S	33.5	Very low	36.2	Very low	130 Å²	130	153.5 Å²	153.5	91%	0.909	79%	0.792	S	S	*	*			trans	-152.3	127.2	134.5	-92	0	0	0	0	113.4
13	K	37.4	Very low	37.3	Very low	191 Å²	191	151.8 Å²	151.8	83%	0.83	79%	0.791	S	S	*	*			trans	-109.7	104.8	-156.2	-180	-175	-171.7	175.8	0	110.3
14	K	35.9	Very low	38.6	Very low	211 Å²	211	152.9 Å²	152.9	92%	0.917	79%	0.793	S	S	*	*			trans	-121.8	106.2	169.1	-136.7	170.6	-172.3	175.1	0	111.6	G16	K14-G16 PolarHBondContact O-N 3.25Å; K14-G16 VanDerWaalsContact O-N 3.09Å
15	K	36	Very low	39.8	Very low	195 Å²	195	155.7 Å²	155.7	85%	0.848	80%	0.8	S	S	*	*			trans	-85	76.9	-165.8	-159.8	178.5	-171.6	-178.7	0	111.2	K17	K15-K17 PolarHBondContact O-N 3.25Å; K15-K17 VanDerWaalsContact O-N 3.1Å
16	G	33.5	Very low	41	Very low	71 Å²	71	156.8 Å²	156.8	73%	0.732	80%	0.798	S	S	*	*			trans	-72.8	92.1	173.1	0	0	0	0	0	111.7	K14 S18	K14-G16 PolarHBondContact O-N 3.25Å; K14-G16 VanDerWaalsContact O-N 3.09Å; G16-S18 PolarHBondContact O-N 3.34Å
17	K	36.3	Very low	42.3	Very low	195 Å²	195	158.2 Å²	158.2	85%	0.848	80%	0.804	S	S	*	*			trans	-75.7	86.9	178.3	-169.6	-178.1	-175.5	-175.5	0	109.4	K15 S19	K15-K17 PolarHBondContact O-N 3.25Å; K15-K17 VanDerWaalsContact O-N 3.1Å; K17-S19 VanDerWaalsContact C-N 3.32Å; K17-S19 PolarHBondContact O-N 3.3Å
18	S	36.2	Very low	43.7	Very low	113 Å²	113	157.1 Å²	157.1	79%	0.79	81%	0.806	S	S	*	*			trans	-67.2	89.9	174	47.5	0	0	0	0	110.3	G16 S20	G16-S18 PolarHBondContact O-N 3.34Å; S18-S20 PolarHBondContact O-N 2.66Å; S18-S20 VanDerWaalsContact O-N 3.09Å
19	S	37.9	Very low	45.1	Very low	89 Å²	89	160 Å²	160	62%	0.622	81%	0.808	S	S	*	*			trans	-59.2	112.3	169.7	44.1	0	0	0	0	109.3	K17 E21	K17-S19 VanDerWaalsContact C-N 3.32Å; K17-S19 PolarHBondContact O-N 3.3Å; S19-E21 PolarHBondContact O-N 3.34Å
20	S	44.6	Very low	46.8	Very low	118 Å²	118	165 Å²	165	83%	0.825	82%	0.817	S	S	*	*			trans	-68.7	75.7	168.2	35.1	0	0	0	0	109.5	S18 K22	S18-S20 PolarHBondContact O-N 2.66Å; S18-S20 VanDerWaalsContact O-N 3.09Å; S20-K22 PolarHBondContact O-N 3.27Å
21	E	43.8	Very low	48.8	Very low	166 Å²	166	168.8 Å²	168.8	78%	0.776	82%	0.821	S	S	*	*			trans	-59.4	105.9	172	-73.4	-166.9	149.3	0	0	108.9	S19 K23	S19-E21 PolarHBondContact O-N 3.34Å; E21-K23 PolarHBondContact O-N 3.31Å
22	K	47.9	Very low	51.1	Low	194 Å²	194	171 Å²	171	84%	0.843	83%	0.829	S	S	*	*			trans	-53.5	107	165.5	-70.8	176.6	178.3	176	0	106.7	S20 V24	S20-K22 PolarHBondContact O-N 3.27Å; K22-V24 PolarHBondContact O-N 2.74Å
23	K	51.7	Low	53.9	Low	205 Å²	205	168.3 Å²	168.3	89%	0.891	81%	0.806	S	S	*	*			trans	-57.9	89.1	169.6	-101.9	-178.5	175.8	173.6	0	108.2	E21 K25	E21-K23 PolarHBondContact O-N 3.31Å; K23-K25 VanDerWaalsContact C-N 3.35Å; K23-K25 PolarHBondContact O-N 3.15Å
24	V	58.4	Low	56.7	Low	124 Å²	124	162.9 Å²	162.9	75%	0.752	78%	0.781	S	S	*	*			trans	-59.8	104.3	167.5	177.2	0	0	0	0	105	K22 R26	K22-V24 PolarHBondContact O-N 2.74Å; V24-R26 PolarHBondContact O-N 3.09Å
25	K	61.6	Low	59.5	Low	195 Å²	195	154.3 Å²	154.3	85%	0.848	75%	0.75	S	S	*	*			trans	-59.8	94.7	171.2	-74.2	-177.7	177.6	178.3	0	106.3	K23 K27	K23-K25 VanDerWaalsContact C-N 3.35Å; K23-K25 PolarHBondContact O-N 3.15Å; K25-K27 PolarHBondContact O-N 3.38Å
26	R	62.7	Low	62.4	Low	230 Å²	230	150.5 Å²	150.5	87%	0.868	74%	0.736	S	S	*	*			trans	-48.1	117.3	172	-84.3	-179	167.4	168.8	-3.8	105.9	V24 T28	V24-R26 PolarHBondContact O-N 3.09Å; R26-T28 VanDerWaalsContact C-N 3.29Å; R26-T28 PolarHBondContact O-N 2.79Å
27	K	63.8	Low	65.4	Low	208 Å²	208	153.8 Å²	153.8	90%	0.904	73%	0.728	S	S	*	*			trans	-61.7	98	172.9	-76.4	-176.9	176.1	179.5	0	106.4	K25 K29	K25-K27 PolarHBondContact O-N 3.38Å; K27-K29 PolarHBondContact O-N 2.88Å; K27-K29 VanDerWaalsContact O-N 3.1Å
28	T	64.7	Low	68.3	Low	131 Å²	131	145.6 Å²	145.6	80%	0.804	69%	0.693	S	S	*	*			trans	-53.9	119.7	174.4	-49.6	0	0	0	0	107	R26 R30	R26-T28 VanDerWaalsContact C-N 3.29Å; R26-T28 PolarHBondContact O-N 2.79Å; T28-R30 PolarHBondContact O-N 3.18Å
29	K	65.1	Low	71.2	Confident	194 Å²	194	145.8 Å²	145.8	84%	0.843	68%	0.677	S	S	*	*			trans	-52	121.5	174.5	-82	-172.6	173.5	-175.6	0	107.2	K27 R31	K27-K29 PolarHBondContact O-N 2.88Å; K27-K29 VanDerWaalsContact O-N 3.1Å; K29-R31 PolarHBondContact O-N 3.24Å
30	R	68.1	Low	74.1	Confident	227 Å²	227	146.9 Å²	146.9	86%	0.857	67%	0.67	S	S	*	*			trans	-58.6	110.2	177.4	179.3	177.7	178.8	175	-2.4	106.9	T28 E32	T28-R30 PolarHBondContact O-N 3.18Å; R30-E32 PolarHBondContact O-N 3.01Å
31	R	73.6	Confident	76.6	Confident	220 Å²	220	145.2 Å²	145.2	83%	0.83	66%	0.655	S	S	*	*			trans	-68.1	118.9	167.2	-78.2	-172.6	169.1	-166.7	-4.3	107	K29 T33	K29-R31 PolarHBondContact O-N 3.24Å; R31-T33 HydrophobicContact CB-CG2 4.26Å; R31-T33 PolarHBondContact O-N 3.43Å
32	E	80.5	Confident	79.2	Confident	185 Å²	185	138.8 Å²	138.8	86%	0.864	63%	0.626	S	S	*	*			trans	-67	128.1	168.5	-61.9	-171.7	157	0	0	107.7	R30	R30-E32 PolarHBondContact O-N 3.01Å
33	T	92.8	Very high	81.6	Confident	72 Å²	72	132.4 Å²	132.4	44%	0.442	60%	0.598	S	S	.	*			trans	-147.7	151.5	-174.5	55	0	0	0	0	108.8	R31 A35 N60	R31-T33 HydrophobicContact CB-CG2 4.26Å; R31-T33 PolarHBondContact O-N 3.43Å; T33-A35 PolarHBondContact O-N 2.96Å; T33-N60 WeakPolarHBondContact CA-OD1 3.22Å; T33-N60 WeakPolarHBondContact CB-OD1 3.3Å
34	Y	95.9	Very high	83.8	Confident	78 Å²	78	130 Å²	130	31%	0.306	59%	0.59	S	S	.	*	S	Bend	trans	-80	3.4	178.9	-64.1	-76.6	0	0	0	113.3	M36 Y37 I38 N60 V63	Y34-M36 VanDerWaalsContact C-N 3.3Å; Y34-M36 PolarHBondContact O-N 3.35Å; Y34-M36 VanDerWaalsContact O-N 3.15Å; Y34-Y37 HydrophobicContact CD1-CD2 4.24Å; Y34-Y37 PolarHBondContact O-N 3.45Å; Y34-I38 WeakPolarHBondContact O-CG1 3.39Å; Y34-I38 PolarHBondContact O-N 3.18Å; Y34-N60 PolarHBondContact N-OD1 2.93Å; Y34-V63 HydrophobicContact CD1-CG1 4.08Å; Y34-V63 HydrophobicContact CD2-CB 3.99Å; Y34-V63 HydrophobicContact CD2-CG1 3.51Å; Y34-V63 HydrophobicContact CE1-CG1 4.2Å; Y34-V63 HydrophobicContact CE2-CB 4.42Å; Y34-V63 HydrophobicContact CE2-CG1 3.65Å; Y34-V63 HydrophobicContact CG-CB 4.37Å; Y34-V63 HydrophobicContact CG-CG1 3.74Å
35	A	95.1	Very high	85.7	Confident	30 Å²	30	128.5 Å²	128.5	25%	0.248	58%	0.581	C	S	.	*	H	α-helix	trans	-55.5	-38.1	-169.3	0	0	0	0	0	114.4	T33 Y39 M56	T33-A35 PolarHBondContact O-N 2.96Å; A35-Y39 WeakPolarHBondContact O-CB 3.44Å; A35-Y39 PolarHBondContact O-N 2.97Å; A35-M56 VanDerWaalsContact CA-SD 3.58Å; A35-M56 HydrophobicContact CB-CE 4.4Å; A35-M56 HydrophobicContact CB-CG 3.95Å; A35-M56 HydrophobicContact CB-SD 3.73Å
36	M	95.3	Very high	87.4	Confident	115 Å²	115	124.2 Å²	124.2	57%	0.567	56%	0.564	S	S	*	*	H	α-helix	trans	-63.1	-41.5	175.3	-171.5	-166	-165.1	0	0	112.1	Y34 K40	Y34-M36 VanDerWaalsContact C-N 3.3Å; Y34-M36 PolarHBondContact O-N 3.35Å; Y34-M36 VanDerWaalsContact O-N 3.15Å; M36-K40 WeakPolarHBondContact O-CG 3.45Å; M36-K40 PolarHBondContact O-N 2.78Å
37	Y	97.3	Very high	89.1	Confident	141 Å²	141	117.1 Å²	117.1	55%	0.553	55%	0.548	S	S	*	.	H	α-helix	trans	-76.2	-41.9	-177.9	-54	-67.9	0	0	0	111.3	Y34 Y39 K40 V41	Y34-Y37 HydrophobicContact CD1-CD2 4.24Å; Y34-Y37 PolarHBondContact O-N 3.45Å; Y37-Y39 VanDerWaalsContact C-N 3.29Å; Y37-Y39 PolarHBondContact O-N 3.16Å; Y37-K40 PolarHBondContact O-N 2.86Å; Y37-V41 WeakPolarHBondContact O-CG2 3.37Å; Y37-V41 PolarHBondContact O-N 3.05Å
38	I	97.5	Very high	90.7	Very high	22 Å²	22	114.8 Å²	114.8	11%	0.113	55%	0.545	C	S	.	.	H	α-helix	trans	-56.3	-45.3	172.9	-65.4	161.7	0	0	0	110.1	Y34 L42 I51 M56 M59 N60	Y34-I38 WeakPolarHBondContact O-CG1 3.39Å; Y34-I38 PolarHBondContact O-N 3.18Å; I38-L42 WeakPolarHBondContact O-CB 3.44Å; I38-L42 PolarHBondContact O-N 3.01Å; I38-I51 HydrophobicContact CG2-CD1 4.43Å; I38-M56 HydrophobicContact CB-CE 4.31Å; I38-M56 HydrophobicContact CB-SD 3.88Å; I38-M56 HydrophobicContact CD1-SD 4.03Å; I38-M56 HydrophobicContact CG2-CE 4.04Å; I38-M56 HydrophobicContact CG2-SD 3.72Å; I38-M59 HydrophobicContact CD1-CB 3.9Å; I38-M59 HydrophobicContact CG2-CB 4.07Å; I38-M59 HydrophobicContact CG2-CG 4.44Å; I38-N60 HydrophobicContact CD1-CB 4.32Å
39	Y	97.4	Very high	92.2	Very high	117 Å²	117	111.9 Å²	111.9	46%	0.459	53%	0.527	S	S	.	.	H	α-helix	trans	-66.2	-40.8	177	-172.9	-101.4	0	0	0	113.1	A35 Y37 L42 K43 I51	A35-Y39 WeakPolarHBondContact O-CB 3.44Å; A35-Y39 PolarHBondContact O-N 2.97Å; Y37-Y39 VanDerWaalsContact C-N 3.29Å; Y37-Y39 PolarHBondContact O-N 3.16Å; Y39-L42 PolarHBondContact O-N 3.15Å; Y39-K43 HydrophobicContact CD1-CG 4.36Å; Y39-K43 HydrophobicContact CE1-CG 3.92Å; Y39-K43 HydrophobicContact CE2-CG 4.32Å; Y39-K43 WeakPolarHBondContact O-CG 3.5Å; Y39-K43 PolarHBondContact O-N 3.37Å; Y39-K43 WeakPolarHBondContact OH-CE 3.3Å; Y39-I51 HydrophobicContact CD2-CG2 4.31Å
40	K	98	Very high	93.8	Very high	112 Å²	112	105.5 Å²	105.5	49%	0.487	52%	0.516	S	S	.	.	H	α-helix	trans	-60.3	-48	174.9	-80.9	179.5	171.8	-175.1	0	112.1	M36 Y37 K43 Q44	M36-K40 WeakPolarHBondContact O-CG 3.45Å; M36-K40 PolarHBondContact O-N 2.78Å; Y37-K40 PolarHBondContact O-N 2.86Å; K40-K43 PolarHBondContact O-N 2.92Å; K40-Q44 WeakPolarHBondContact O-CG 3.45Å; K40-Q44 PolarHBondContact O-N 2.96Å; K40-Q44 VanDerWaalsContact O-N 3.1Å
41	V	97.9	Very high	95.2	Very high	84 Å²	84	97.2 Å²	97.2	51%	0.509	49%	0.489	S	S	.	.	H	α-helix	trans	-63.4	-44.4	177.9	173.9	0	0	0	0	110.5	Y37 K43 Q44 V45	Y37-V41 WeakPolarHBondContact O-CG2 3.37Å; Y37-V41 PolarHBondContact O-N 3.05Å; V41-K43 VanDerWaalsContact C-N 3.31Å; V41-K43 PolarHBondContact O-N 3.36Å; V41-Q44 WeakPolarHBondContact O-CB 3.48Å; V41-Q44 PolarHBondContact O-N 3.03Å; V41-V45 WeakPolarHBondContact O-CG2 3.18Å; V41-V45 PolarHBondContact O-N 3.3Å
42	L	98.1	Very high	96.3	Very high	31 Å²	31	90.1 Å²	90.1	16%	0.162	47%	0.473	C	S	.	.	H	α-helix	trans	-54.3	-46.3	175.3	176.2	62.4	0	0	0	111.9	I38 Y39 Q44 V45 H46 I51	I38-L42 WeakPolarHBondContact O-CB 3.44Å; I38-L42 PolarHBondContact O-N 3.01Å; Y39-L42 PolarHBondContact O-N 3.15Å; L42-Q44 VanDerWaalsContact C-N 3.3Å; L42-Q44 PolarHBondContact O-N 3.33Å; L42-V45 WeakPolarHBondContact O-CG2 3.42Å; L42-V45 PolarHBondContact O-N 3.35Å; L42-H46 HydrophobicContact CD1-CB 4.36Å; L42-H46 CarbonylContact O-C 3.55Å; L42-H46 PolarHBondContact O-N 3.07Å; L42-I51 HydrophobicContact CD2-CB 3.71Å; L42-I51 HydrophobicContact CD2-CG2 3.66Å
43	K	98	Very high	97.1	Very high	59 Å²	59	86.6 Å²	86.6	26%	0.257	47%	0.469	S	S	.	.	H	α-helix	trans	-72.6	-18.3	179.4	-68.1	-55.6	-167.5	-175.8	0	114.4	Y39 K40 V41 P47 T49	Y39-K43 HydrophobicContact CD1-CG 4.36Å; Y39-K43 HydrophobicContact CE1-CG 3.92Å; Y39-K43 HydrophobicContact CE2-CG 4.32Å; Y39-K43 WeakPolarHBondContact O-CG 3.5Å; Y39-K43 PolarHBondContact O-N 3.37Å; Y39-K43 WeakPolarHBondContact OH-CE 3.3Å; K40-K43 PolarHBondContact O-N 2.92Å; V41-K43 VanDerWaalsContact C-N 3.31Å; V41-K43 PolarHBondContact O-N 3.36Å; K43-P47 VanDerWaalsContact CD-O 3.23Å; K43-P47 WeakPolarHBondContact CD-O 3.39Å; K43-P47 WeakPolarHBondContact CE-O 3.3Å; K43-P47 PolarHBondContact NZ-O 3.34Å; K43-T49 PolarHBondContact NZ-O 2.97Å
44	Q	98	Very high	97.3	Very high	155 Å²	155	92.6 Å²	92.6	72%	0.724	48%	0.483	S	S	*	.	H	α-helix	trans	-75.6	-31.7	170.1	-73.3	175.7	-48.1	0	0	112.7	K40 V41 L42	K40-Q44 WeakPolarHBondContact O-CG 3.45Å; K40-Q44 PolarHBondContact O-N 2.96Å; K40-Q44 VanDerWaalsContact O-N 3.1Å; V41-Q44 WeakPolarHBondContact O-CB 3.48Å; V41-Q44 PolarHBondContact O-N 3.03Å; L42-Q44 VanDerWaalsContact C-N 3.3Å; L42-Q44 PolarHBondContact O-N 3.33Å
45	V	98.1	Very high	97.4	Very high	93 Å²	93	90.5 Å²	90.5	56%	0.564	48%	0.482	S	S	*	.	H	α-helix	trans	-96.2	-30.9	179.7	-65	0	0	0	0	113.9	V41 L42	V41-V45 WeakPolarHBondContact O-CG2 3.18Å; V41-V45 PolarHBondContact O-N 3.3Å; L42-V45 WeakPolarHBondContact O-CG2 3.42Å; L42-V45 PolarHBondContact O-N 3.35Å
46	H	97.9	Very high	97.5	Very high	104 Å²	104	90.5 Å²	90.5	48%	0.481	48%	0.477	S	S	.	.			trans	-144.1	85.3	-176.9	-63.6	97.5	0	0	0	110.4	L42 D48 T49	L42-H46 HydrophobicContact CD1-CB 4.36Å; L42-H46 CarbonylContact O-C 3.55Å; L42-H46 PolarHBondContact O-N 3.07Å; H46-D48 VanDerWaalsContact C-N 3.3Å; H46-D48 PolarHBondContact O-N 3.31Å; H46-T49 PolarHBondContact O-N 3.31Å
47	P	97.6	Very high	97.6	Very high	81 Å²	81	88.5 Å²	88.5	53%	0.526	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-35.8	-174.5	-28.1	36.7	0	0	0	114.6	K43	K43-P47 VanDerWaalsContact CD-O 3.23Å; K43-P47 WeakPolarHBondContact CD-O 3.39Å; K43-P47 WeakPolarHBondContact CE-O 3.3Å; K43-P47 PolarHBondContact NZ-O 3.34Å
48	D	97.6	Very high	97.6	Very high	159 Å²	159	87 Å²	87	85%	0.85	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-12.1	-173.8	-53.5	-58.2	0	0	0	113.6	H46	H46-D48 VanDerWaalsContact C-N 3.3Å; H46-D48 PolarHBondContact O-N 3.31Å
49	T	97.4	Very high	97.7	Very high	70 Å²	70	89.7 Å²	89.7	43%	0.429	49%	0.488	S	S	.	.			trans	-82.1	137.4	-176.7	-53.8	0	0	0	0	112.3	K43 H46	K43-T49 PolarHBondContact NZ-O 2.97Å; H46-T49 PolarHBondContact O-N 3.31Å
50	G	96.9	Very high	97.6	Very high	60 Å²	60	85.4 Å²	85.4	62%	0.619	47%	0.473	S	S	*	.			trans	-99.2	163.1	171.7	0	0	0	0	0	112.9
51	I	97.9	Very high	97.6	Very high	53 Å²	53	83.4 Å²	83.4	27%	0.272	47%	0.474	S	S	.	.			trans	-127.4	132.8	174.2	-175.5	171.4	0	0	0	110.1	I38 Y39 L42 A55 M56 M59	I38-I51 HydrophobicContact CG2-CD1 4.43Å; Y39-I51 HydrophobicContact CD2-CG2 4.31Å; L42-I51 HydrophobicContact CD2-CB 3.71Å; L42-I51 HydrophobicContact CD2-CG2 3.66Å; I51-A55 HydrophobicContact CD1-CB 4.13Å; I51-A55 HydrophobicContact CG1-CB 3.67Å; I51-M56 HydrophobicContact CD1-CB 4.43Å; I51-M56 HydrophobicContact CD1-CE 4.38Å; I51-M56 HydrophobicContact CG2-CE 3.68Å; I51-M59 HydrophobicContact CD1-CG 4.13Å
52	S	98.2	Very high	97.6	Very high	71 Å²	71	85 Å²	85	50%	0.497	47%	0.473	S	S	.	.			trans	-73.6	157.4	179.2	72.2	0	0	0	0	111.9	R54 A55 M56	S52-R54 VanDerWaalsContact C-N 3.25Å; S52-R54 PolarHBondContact O-N 3.46Å; S52-A55 PolarHBondContact O-N 2.99Å; S52-A55 WeakPolarHBondContact OG-CB 3.23Å; S52-A55 PolarHBondContact OG-N 3.33Å; S52-M56 WeakPolarHBondContact O-CB 3.18Å; S52-M56 PolarHBondContact O-N 3.14Å
53	S	96.3	Very high	97.5	Very high	112 Å²	112	85.6 Å²	85.6	78%	0.783	48%	0.479	S	S	*	.	H	α-helix	trans	-58.5	-36.2	176.7	54.5	0	0	0	0	112.9	S57	S53-S57 PolarHBondContact O-N 2.54Å
54	R	97.5	Very high	97.5	Very high	198 Å²	198	86 Å²	86	75%	0.747	48%	0.484	S	S	*	.	H	α-helix	trans	-65.5	-48.9	174.9	-169.8	-173.9	-63.5	159.6	0.3	111.3	S52 M56 S57 I58	S52-R54 VanDerWaalsContact C-N 3.25Å; S52-R54 PolarHBondContact O-N 3.46Å; R54-M56 VanDerWaalsContact C-N 3.33Å; R54-M56 PolarHBondContact O-N 3.16Å; R54-S57 WeakPolarHBondContact O-CB 3.44Å; R54-S57 PolarHBondContact O-N 2.81Å; R54-I58 WeakPolarHBondContact O-CG1 3.21Å; R54-I58 PolarHBondContact O-N 2.89Å; R54-I58 VanDerWaalsContact O-N 3.11Å
55	A	98.1	Very high	97.5	Very high	34 Å²	34	81.8 Å²	81.8	28%	0.281	47%	0.466	S	S	.	.	H	α-helix	trans	-62.8	-40	177.2	0	0	0	0	0	111.8	I51 S52 S57 I58 M59	I51-A55 HydrophobicContact CD1-CB 4.13Å; I51-A55 HydrophobicContact CG1-CB 3.67Å; S52-A55 PolarHBondContact O-N 2.99Å; S52-A55 WeakPolarHBondContact OG-CB 3.23Å; S52-A55 PolarHBondContact OG-N 3.33Å; A55-S57 VanDerWaalsContact C-N 3.31Å; A55-S57 PolarHBondContact O-N 3.29Å; A55-I58 PolarHBondContact O-N 3.25Å; A55-M59 WeakPolarHBondContact O-CG 3.34Å; A55-M59 PolarHBondContact O-N 2.88Å
56	M	97.4	Very high	97.4	Very high	30 Å²	30	79.9 Å²	79.9	15%	0.148	45%	0.452	C	S	.	.	H	α-helix	trans	-59.7	-40.1	174	-176.6	60	79.5	0	0	112.1	A35 I38 I51 S52 R54 M59 N60	A35-M56 VanDerWaalsContact CA-SD 3.58Å; A35-M56 HydrophobicContact CB-CE 4.4Å; A35-M56 HydrophobicContact CB-CG 3.95Å; A35-M56 HydrophobicContact CB-SD 3.73Å; I38-M56 HydrophobicContact CB-CE 4.31Å; I38-M56 HydrophobicContact CB-SD 3.88Å; I38-M56 HydrophobicContact CD1-SD 4.03Å; I38-M56 HydrophobicContact CG2-CE 4.04Å; I38-M56 HydrophobicContact CG2-SD 3.72Å; I51-M56 HydrophobicContact CD1-CB 4.43Å; I51-M56 HydrophobicContact CD1-CE 4.38Å; I51-M56 HydrophobicContact CG2-CE 3.68Å; S52-M56 WeakPolarHBondContact O-CB 3.18Å; S52-M56 PolarHBondContact O-N 3.14Å; R54-M56 VanDerWaalsContact C-N 3.33Å; R54-M56 PolarHBondContact O-N 3.16Å; M56-M59 PolarHBondContact O-N 3.47Å; M56-N60 WeakPolarHBondContact O-CB 3.42Å; M56-N60 PolarHBondContact O-N 2.8Å
57	S	96.6	Very high	97.4	Very high	73 Å²	73	80.9 Å²	80.9	51%	0.51	46%	0.456	S	S	.	.	H	α-helix	trans	-64.7	-40.6	175.4	-165.7	0	0	0	0	112.3	S53 R54 A55 N60 S61	S53-S57 PolarHBondContact O-N 2.54Å; R54-S57 WeakPolarHBondContact O-CB 3.44Å; R54-S57 PolarHBondContact O-N 2.81Å; A55-S57 VanDerWaalsContact C-N 3.31Å; A55-S57 PolarHBondContact O-N 3.29Å; S57-N60 PolarHBondContact O-N 3.02Å; S57-S61 PolarHBondContact O-N 3.3Å; S57-S61 PolarHBondContact O-OG 3.02Å
58	I	97.9	Very high	97.4	Very high	109 Å²	109	83.1 Å²	83.1	56%	0.559	46%	0.459	S	S	*	.	H	α-helix	trans	-63.5	-48.4	176.2	-65	165.8	0	0	0	110.1	R54 A55 N60 S61 F62	R54-I58 WeakPolarHBondContact O-CG1 3.21Å; R54-I58 PolarHBondContact O-N 2.89Å; R54-I58 VanDerWaalsContact O-N 3.11Å; A55-I58 PolarHBondContact O-N 3.25Å; I58-N60 VanDerWaalsContact C-N 3.33Å; I58-N60 PolarHBondContact O-N 3.07Å; I58-S61 PolarHBondContact O-N 2.98Å; I58-S61 VanDerWaalsContact O-N 3.16Å; I58-F62 PolarHBondContact O-N 3.41Å
59	M	98.3	Very high	97.4	Very high	78 Å²	78	82 Å²	82	38%	0.384	44%	0.443	S	S	.	.	H	α-helix	trans	-60.7	-40	177.7	-68.4	-58.6	-65.1	0	0	112.4	I38 I51 A55 M56 F62 V63	I38-M59 HydrophobicContact CD1-CB 3.9Å; I38-M59 HydrophobicContact CG2-CB 4.07Å; I38-M59 HydrophobicContact CG2-CG 4.44Å; I51-M59 HydrophobicContact CD1-CG 4.13Å; A55-M59 WeakPolarHBondContact O-CG 3.34Å; A55-M59 PolarHBondContact O-N 2.88Å; M56-M59 PolarHBondContact O-N 3.47Å; M59-F62 PolarHBondContact O-N 3.34Å; M59-V63 WeakPolarHBondContact O-CG2 3.43Å; M59-V63 PolarHBondContact O-N 2.89Å; M59-V63 VanDerWaalsContact O-N 3.08Å
60	N	96.4	Very high	97.5	Very high	27 Å²	27	80.3 Å²	80.3	14%	0.144	43%	0.431	C	S	.	.	H	α-helix	trans	-63.3	-42.9	174.8	-178.7	89.3	0	0	0	111.8	T33 Y34 I38 M56 S57 I58 V63 N64	T33-N60 WeakPolarHBondContact CA-OD1 3.22Å; T33-N60 WeakPolarHBondContact CB-OD1 3.3Å; Y34-N60 PolarHBondContact N-OD1 2.93Å; I38-N60 HydrophobicContact CD1-CB 4.32Å; M56-N60 WeakPolarHBondContact O-CB 3.42Å; M56-N60 PolarHBondContact O-N 2.8Å; S57-N60 PolarHBondContact O-N 3.02Å; I58-N60 VanDerWaalsContact C-N 3.33Å; I58-N60 PolarHBondContact O-N 3.07Å; N60-V63 PolarHBondContact O-N 3.47Å; N60-N64 PolarHBondContact ND2-ND2 3.33Å; N60-N64 PolarHBondContact O-N 3.18Å; N60-N64 PolarHBondContact O-ND2 3.47Å
61	S	97.4	Very high	97.6	Very high	71 Å²	71	79.2 Å²	79.2	50%	0.497	42%	0.416	S	S	.	.	H	α-helix	trans	-65.1	-40.9	175.8	-64.3	0	0	0	0	112.2	S57 I58 V63 N64 D65	S57-S61 PolarHBondContact O-N 3.3Å; S57-S61 PolarHBondContact O-OG 3.02Å; I58-S61 PolarHBondContact O-N 2.98Å; I58-S61 VanDerWaalsContact O-N 3.16Å; S61-V63 PolarHBondContact O-N 2.8Å; S61-N64 PolarHBondContact O-N 2.66Å; S61-N64 VanDerWaalsContact O-N 3.13Å; S61-D65 PolarHBondContact O-N 2.99Å
62	F	97.8	Very high	97.6	Very high	116 Å²	116	79.4 Å²	79.4	51%	0.509	42%	0.42	S	S	.	.	H	α-helix	trans	-58.7	-43.5	176.2	174.1	-105.3	0	0	0	112.7	I58 M59 N64 D65 L66	I58-F62 PolarHBondContact O-N 3.41Å; M59-F62 PolarHBondContact O-N 3.34Å; F62-N64 VanDerWaalsContact C-N 3.31Å; F62-N64 PolarHBondContact O-N 2.94Å; F62-D65 PolarHBondContact O-N 3.15Å; F62-L66 HydrophobicContact CZ-CD2 4.44Å; F62-L66 WeakPolarHBondContact O-CB 3.39Å; F62-L66 PolarHBondContact O-N 3.48Å
63	V	97.4	Very high	97.6	Very high	45 Å²	45	77.8 Å²	77.8	27%	0.273	40%	0.404	S	S	.	.	H	α-helix	trans	-62.8	-37.6	175.8	174.2	0	0	0	0	111.7	Y34 M59 N60 S61 F67	Y34-V63 HydrophobicContact CD1-CG1 4.08Å; Y34-V63 HydrophobicContact CD2-CB 3.99Å; Y34-V63 HydrophobicContact CD2-CG1 3.51Å; Y34-V63 HydrophobicContact CE1-CG1 4.2Å; Y34-V63 HydrophobicContact CE2-CB 4.42Å; Y34-V63 HydrophobicContact CE2-CG1 3.65Å; Y34-V63 HydrophobicContact CG-CB 4.37Å; Y34-V63 HydrophobicContact CG-CG1 3.74Å; M59-V63 WeakPolarHBondContact O-CG2 3.43Å; M59-V63 PolarHBondContact O-N 2.89Å; M59-V63 VanDerWaalsContact O-N 3.08Å; N60-V63 PolarHBondContact O-N 3.47Å; S61-V63 PolarHBondContact O-N 2.8Å; V63-F67 VanDerWaalsContact O-CB 3.22Å; V63-F67 WeakPolarHBondContact O-CB 3.42Å; V63-F67 PolarHBondContact O-N 3.43Å
64	N	96.7	Very high	97.7	Very high	67 Å²	67	72.5 Å²	72.5	36%	0.358	37%	0.367	S	S	.	.	H	α-helix	trans	-70.4	-45.2	177.7	-75.3	-75.5	0	0	0	112.3	N60 S61 F62 L66 F67 E68	N60-N64 PolarHBondContact ND2-ND2 3.33Å; N60-N64 PolarHBondContact O-N 3.18Å; N60-N64 PolarHBondContact O-ND2 3.47Å; S61-N64 PolarHBondContact O-N 2.66Å; S61-N64 VanDerWaalsContact O-N 3.13Å; F62-N64 VanDerWaalsContact C-N 3.31Å; F62-N64 PolarHBondContact O-N 2.94Å; N64-L66 PolarHBondContact O-N 3.22Å; N64-F67 PolarHBondContact O-N 3.34Å; N64-E68 WeakPolarHBondContact O-CB 3.33Å; N64-E68 PolarHBondContact O-N 2.96Å
65	D	97.6	Very high	97.7	Very high	66 Å²	66	65 Å²	65	35%	0.353	35%	0.346	S	S	.	.	H	α-helix	trans	-59.2	-46	176.2	176.3	41.8	0	0	0	111.5	S61 F62 E68 R69	S61-D65 PolarHBondContact O-N 2.99Å; F62-D65 PolarHBondContact O-N 3.15Å; D65-E68 PolarHBondContact O-N 2.94Å; D65-R69 VanDerWaalsContact CG-NE 3.33Å; D65-R69 VanDerWaalsContact CG-NH2 3.3Å; D65-R69 VanDerWaalsContact O-CG 3.25Å; D65-R69 WeakPolarHBondContact O-CG 3.44Å; D65-R69 PolarHBondContact O-N 2.94Å; D65-R69 IonicContact OD1-CZ 2.66Å; D65-R69 IonicContact OD1-NE 2.78Å; D65-R69 PolarHBondContact OD1-NE 3.07Å; D65-R69 IonicContact OD1-NH2 3.99Å; D65-R69 PolarHBondContact OD1-NH2 2.87Å; D65-R69 IonicContact OD2-CZ 3.82Å; D65-R69 IonicContact OD2-NE 3.01Å; D65-R69 PolarHBondContact OD2-NE 3.44Å; D65-R69 IonicContact OD2-NH2 2.8Å; D65-R69 PolarHBondContact OD2-NH2 3.36Å
66	L	97.3	Very high	97.7	Very high	53 Å²	53	69.1 Å²	69.1	28%	0.277	35%	0.354	S	S	.	.	H	α-helix	trans	-65.6	-40.5	176.5	-176.5	59.7	0	0	0	112.5	F62 N64 I70 L99	F62-L66 HydrophobicContact CZ-CD2 4.44Å; F62-L66 WeakPolarHBondContact O-CB 3.39Å; F62-L66 PolarHBondContact O-N 3.48Å; N64-L66 PolarHBondContact O-N 3.22Å; L66-I70 HydrophobicContact CD1-CD1 3.86Å; L66-I70 HydrophobicContact CD1-CG1 4.24Å; L66-I70 HydrophobicContact CG-CD1 3.86Å; L66-I70 VanDerWaalsContact O-CG1 3.31Å; L66-I70 WeakPolarHBondContact O-CG1 3.44Å; L66-I70 PolarHBondContact O-N 3.1Å; L66-L99 HydrophobicContact CD1-CD2 4.26Å
67	F	97.5	Very high	97.7	Very high	126 Å²	126	69 Å²	69	55%	0.553	35%	0.354	S	S	*	.	H	α-helix	trans	-61.2	-48	175.6	173.7	-93.4	0	0	0	111.8	V63 N64 R69 I70 A71	V63-F67 VanDerWaalsContact O-CB 3.22Å; V63-F67 WeakPolarHBondContact O-CB 3.42Å; V63-F67 PolarHBondContact O-N 3.43Å; N64-F67 PolarHBondContact O-N 3.34Å; F67-R69 PolarHBondContact O-N 2.99Å; F67-I70 PolarHBondContact O-N 3.46Å; F67-A71 HydrophobicContact CE1-CB 4.48Å; F67-A71 VanDerWaalsContact O-CB 3.26Å; F67-A71 WeakPolarHBondContact O-CB 3.21Å; F67-A71 PolarHBondContact O-N 3.05Å
68	E	97.8	Very high	97.8	Very high	128 Å²	128	65.7 Å²	65.7	60%	0.598	33%	0.331	S	S	*	.	H	α-helix	trans	-62.9	-43.2	-179.2	-174.9	170.8	-176.9	0	0	111.6	N64 D65 A71 T72	N64-E68 WeakPolarHBondContact O-CB 3.33Å; N64-E68 PolarHBondContact O-N 2.96Å; D65-E68 PolarHBondContact O-N 2.94Å; E68-A71 PolarHBondContact O-N 2.78Å; E68-T72 VanDerWaalsContact O-CB 3.25Å; E68-T72 WeakPolarHBondContact O-CB 3.34Å; E68-T72 PolarHBondContact O-N 3.22Å; E68-T72 PolarHBondContact O-OG1 2.94Å
69	R	98.3	Very high	97.8	Very high	136 Å²	136	66.8 Å²	66.8	51%	0.513	33%	0.334	S	S	.	.	H	α-helix	trans	-59.3	-50.2	174.8	-70.1	173.3	-165.9	-145.9	10.5	112	D65 F67 T72 E73 L98	D65-R69 VanDerWaalsContact CG-NE 3.33Å; D65-R69 VanDerWaalsContact CG-NH2 3.3Å; D65-R69 VanDerWaalsContact O-CG 3.25Å; D65-R69 WeakPolarHBondContact O-CG 3.44Å; D65-R69 PolarHBondContact O-N 2.94Å; D65-R69 IonicContact OD1-CZ 2.66Å; D65-R69 IonicContact OD1-NE 2.78Å; D65-R69 PolarHBondContact OD1-NE 3.07Å; D65-R69 IonicContact OD1-NH2 3.99Å; D65-R69 PolarHBondContact OD1-NH2 2.87Å; D65-R69 IonicContact OD2-CZ 3.82Å; D65-R69 IonicContact OD2-NE 3.01Å; D65-R69 PolarHBondContact OD2-NE 3.44Å; D65-R69 IonicContact OD2-NH2 2.8Å; D65-R69 PolarHBondContact OD2-NH2 3.36Å; F67-R69 PolarHBondContact O-N 2.99Å; R69-T72 PolarHBondContact O-N 3.46Å; R69-E73 WeakPolarHBondContact O-CB 3.45Å; R69-E73 PolarHBondContact O-N 2.88Å; R69-L98 HydrophobicContact CB-CD1 4.01Å; R69-L98 HydrophobicContact CB-CD2 4.32Å
70	I	98.3	Very high	97.7	Very high	33 Å²	33	71.6 Å²	71.6	17%	0.169	35%	0.348	C	S	.	.	H	α-helix	trans	-63.9	-43.8	180	-66.9	167.1	0	0	0	110.9	L66 F67 E73 A74 V91 A94 V95 L98	L66-I70 HydrophobicContact CD1-CD1 3.86Å; L66-I70 HydrophobicContact CD1-CG1 4.24Å; L66-I70 HydrophobicContact CG-CD1 3.86Å; L66-I70 VanDerWaalsContact O-CG1 3.31Å; L66-I70 WeakPolarHBondContact O-CG1 3.44Å; L66-I70 PolarHBondContact O-N 3.1Å; F67-I70 PolarHBondContact O-N 3.46Å; I70-E73 PolarHBondContact O-N 3.49Å; I70-A74 WeakPolarHBondContact O-CB 3.4Å; I70-A74 PolarHBondContact O-N 3.01Å; I70-V91 HydrophobicContact CG2-CG1 4.07Å; I70-A94 HydrophobicContact CG2-CB 4.33Å; I70-V95 HydrophobicContact CD1-CG2 4Å; I70-V95 HydrophobicContact CG1-CG2 4.33Å; I70-V95 HydrophobicContact CG2-CG2 4.26Å; I70-L98 HydrophobicContact CB-CD1 4.26Å; I70-L98 HydrophobicContact CG1-CD1 3.71Å
71	A	98.2	Very high	97.6	Very high	37 Å²	37	75 Å²	75	31%	0.306	37%	0.367	S	S	.	.	H	α-helix	trans	-65	-42.5	179.8	0	0	0	0	0	112.1	F67 E68 S75	F67-A71 HydrophobicContact CE1-CB 4.48Å; F67-A71 VanDerWaalsContact O-CB 3.26Å; F67-A71 WeakPolarHBondContact O-CB 3.21Å; F67-A71 PolarHBondContact O-N 3.05Å; E68-A71 PolarHBondContact O-N 2.78Å; A71-S75 VanDerWaalsContact O-CB 3.27Å; A71-S75 WeakPolarHBondContact O-CB 3.45Å; A71-S75 PolarHBondContact O-N 3.34Å
72	T	98.4	Very high	97.6	Very high	58 Å²	58	81.2 Å²	81.2	36%	0.356	39%	0.385	S	S	.	.	H	α-helix	trans	-61.6	-47.2	176.5	-61.9	0	0	0	0	111.2	E68 R69 S75 R76	E68-T72 VanDerWaalsContact O-CB 3.25Å; E68-T72 WeakPolarHBondContact O-CB 3.34Å; E68-T72 PolarHBondContact O-N 3.22Å; E68-T72 PolarHBondContact O-OG1 2.94Å; R69-T72 PolarHBondContact O-N 3.46Å; T72-S75 WeakPolarHBondContact O-CB 3.31Å; T72-S75 PolarHBondContact O-N 2.94Å; T72-R76 WeakPolarHBondContact O-CG 3.27Å; T72-R76 PolarHBondContact O-N 3.18Å
73	E	98.4	Very high	97.5	Very high	36 Å²	36	81.8 Å²	81.8	17%	0.168	38%	0.384	C	S	.	.	H	α-helix	trans	-72.2	-38.3	-177.6	-164.3	57.6	-150.3	0	0	112	R69 I70 S75 R76 L77 A94 L97 L98	R69-E73 WeakPolarHBondContact O-CB 3.45Å; R69-E73 PolarHBondContact O-N 2.88Å; I70-E73 PolarHBondContact O-N 3.49Å; E73-S75 VanDerWaalsContact C-N 3.3Å; E73-S75 PolarHBondContact O-N 3.45Å; E73-R76 PolarHBondContact O-N 3.16Å; E73-R76 WeakPolarHBondContact OE2-CD 3.33Å; E73-R76 IonicContact OE2-CZ 3.33Å; E73-R76 IonicContact OE2-NE 3.34Å; E73-R76 IonicContact OE2-NH1 2.76Å; E73-R76 PolarHBondContact OE2-NH1 2.78Å; E73-L77 VanDerWaalsContact O-CG 3.3Å; E73-L77 WeakPolarHBondContact O-CG 3.4Å; E73-L77 PolarHBondContact O-N 3.39Å; E73-A94 HydrophobicContact CB-CB 3.94Å; E73-A94 HydrophobicContact CG-CB 4.16Å; E73-L97 HydrophobicContact CG-CD1 4.18Å; E73-L98 HydrophobicContact CB-CD1 4.14Å
74	A	98.4	Very high	97.4	Very high	1 Å²	1	85.8 Å²	85.8	1%	0.008	41%	0.413	C	S	.	.	H	α-helix	trans	-63.7	-35.1	172.4	0	0	0	0	0	112.4	I70 L77 A78 I86 E90 V91 A94	I70-A74 WeakPolarHBondContact O-CB 3.4Å; I70-A74 PolarHBondContact O-N 3.01Å; A74-L77 PolarHBondContact O-N 2.76Å; A74-A78 PolarHBondContact O-N 3.21Å; A74-I86 HydrophobicContact CB-CG2 3.87Å; A74-E90 HydrophobicContact CB-CB 4.27Å; A74-V91 HydrophobicContact CB-CG2 4.21Å; A74-A94 HydrophobicContact CB-CB 4.06Å
75	S	98.3	Very high	97.4	Very high	42 Å²	42	86.9 Å²	86.9	29%	0.294	42%	0.423	S	S	.	.	H	α-helix	trans	-65.1	-45.9	173.6	-174.1	0	0	0	0	111.9	A71 T72 E73 L77 A78 Q79	A71-S75 VanDerWaalsContact O-CB 3.27Å; A71-S75 WeakPolarHBondContact O-CB 3.45Å; A71-S75 PolarHBondContact O-N 3.34Å; T72-S75 WeakPolarHBondContact O-CB 3.31Å; T72-S75 PolarHBondContact O-N 2.94Å; E73-S75 VanDerWaalsContact C-N 3.3Å; E73-S75 PolarHBondContact O-N 3.45Å; S75-L77 PolarHBondContact O-N 3.19Å; S75-A78 PolarHBondContact O-N 3.37Å; S75-Q79 WeakPolarHBondContact O-CG 3.42Å; S75-Q79 PolarHBondContact O-N 3Å; S75-Q79 PolarHBondContact OG-NE2 3.16Å
76	R	98.1	Very high	97.5	Very high	120 Å²	120	87.4 Å²	87.4	45%	0.453	43%	0.425	S	S	.	.	H	α-helix	trans	-58.1	-45.7	173.4	-71.3	168.9	178	165.8	-3.2	111.9	T72 E73 A78 Q79 Y80	T72-R76 WeakPolarHBondContact O-CG 3.27Å; T72-R76 PolarHBondContact O-N 3.18Å; E73-R76 PolarHBondContact O-N 3.16Å; E73-R76 WeakPolarHBondContact OE2-CD 3.33Å; E73-R76 IonicContact OE2-CZ 3.33Å; E73-R76 IonicContact OE2-NE 3.34Å; E73-R76 IonicContact OE2-NH1 2.76Å; E73-R76 PolarHBondContact OE2-NH1 2.78Å; R76-A78 VanDerWaalsContact C-N 3.34Å; R76-A78 PolarHBondContact O-N 3.01Å; R76-Q79 PolarHBondContact O-N 3.44Å; R76-Y80 HydrophobicContact CB-CD2 4.47Å; R76-Y80 HydrophobicContact CB-CE2 4.06Å; R76-Y80 WeakPolarHBondContact O-CD2 3.31Å; R76-Y80 PolarHBondContact O-N 2.95Å
77	L	97.9	Very high	97.4	Very high	27 Å²	27	87.3 Å²	87.3	14%	0.141	43%	0.426	C	S	.	.	H	α-helix	trans	-61.4	-39.1	177.3	-70.7	168.5	0	0	0	112.6	E73 A74 S75 N81 E90 T93 A94 L97	E73-L77 VanDerWaalsContact O-CG 3.3Å; E73-L77 WeakPolarHBondContact O-CG 3.4Å; E73-L77 PolarHBondContact O-N 3.39Å; A74-L77 PolarHBondContact O-N 2.76Å; S75-L77 PolarHBondContact O-N 3.19Å; L77-N81 PolarHBondContact O-N 3.27Å; L77-N81 PolarHBondContact O-ND2 3.45Å; L77-E90 HydrophobicContact CB-CB 4.24Å; L77-E90 HydrophobicContact CB-CG 4.08Å; L77-T93 HydrophobicContact CD1-CG2 3.77Å; L77-T93 HydrophobicContact CD2-CG2 4.32Å; L77-A94 HydrophobicContact CD1-CB 4.17Å; L77-L97 HydrophobicContact CD1-CD1 4.26Å; L77-L97 HydrophobicContact CD2-CD1 4.4Å
78	A	98	Very high	97.4	Very high	4 Å²	4	85 Å²	85	3%	0.033	43%	0.426	C	S	.	.	H	α-helix	trans	-64.4	-44.3	173.2	0	0	0	0	0	111.6	A74 S75 R76 N81 K82 R83 I86 E90	A74-A78 PolarHBondContact O-N 3.21Å; S75-A78 PolarHBondContact O-N 3.37Å; R76-A78 VanDerWaalsContact C-N 3.34Å; R76-A78 PolarHBondContact O-N 3.01Å; A78-N81 CarbonylContact O-C 3.47Å; A78-N81 PolarHBondContact O-N 3Å; A78-K82 PolarHBondContact O-N 3.38Å; A78-R83 PolarHBondContact O-N 2.97Å; A78-I86 HydrophobicContact CB-CG1 3.97Å; A78-E90 HydrophobicContact CB-CG 4.27Å
79	Q	97.3	Very high	97.3	Very high	132 Å²	132	86.8 Å²	86.8	62%	0.617	43%	0.427	S	S	*	.	H	α-helix	trans	-63.2	-44.4	178.5	-70	173.6	16	0	0	112.8	S75 R76 N81 K82	S75-Q79 WeakPolarHBondContact O-CG 3.42Å; S75-Q79 PolarHBondContact O-N 3Å; S75-Q79 PolarHBondContact OG-NE2 3.16Å; R76-Q79 PolarHBondContact O-N 3.44Å; Q79-N81 VanDerWaalsContact C-N 3.25Å; Q79-N81 PolarHBondContact O-N 3.48Å; Q79-K82 WeakPolarHBondContact O-CA 3.25Å; Q79-K82 PolarHBondContact O-N 2.93Å
80	Y	96.4	Very high	97.3	Very high	178 Å²	178	80.6 Å²	80.6	70%	0.698	40%	0.404	S	S	*	.	H	α-helix	trans	-59.5	-37.3	175.2	-68.2	-44.6	0	0	0	112.2	R76 K82	R76-Y80 HydrophobicContact CB-CD2 4.47Å; R76-Y80 HydrophobicContact CB-CE2 4.06Å; R76-Y80 WeakPolarHBondContact O-CD2 3.31Å; R76-Y80 PolarHBondContact O-N 2.95Å; Y80-K82 PolarHBondContact O-N 3.42Å
81	N	95.3	Very high	97.3	Very high	100 Å²	100	82 Å²	82	54%	0.535	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	7	174.9	-69.7	-61.5	0	0	0	113.8	L77 A78 Q79 R83	L77-N81 PolarHBondContact O-N 3.27Å; L77-N81 PolarHBondContact O-ND2 3.45Å; A78-N81 CarbonylContact O-C 3.47Å; A78-N81 PolarHBondContact O-N 3Å; Q79-N81 VanDerWaalsContact C-N 3.25Å; Q79-N81 PolarHBondContact O-N 3.48Å; N81-R83 VanDerWaalsContact C-N 3.25Å; N81-R83 HydrophobicContact CB-CG 4.35Å; N81-R83 PolarHBondContact O-N 3.44Å
82	K	96.7	Very high	97.3	Very high	201 Å²	201	83.4 Å²	83.4	87%	0.874	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	34.9	-177.6	-55.4	-179.5	-177.5	178.7	0	113.7	A78 Q79 Y80	A78-K82 PolarHBondContact O-N 3.38Å; Q79-K82 WeakPolarHBondContact O-CA 3.25Å; Q79-K82 PolarHBondContact O-N 2.93Å; Y80-K82 PolarHBondContact O-N 3.42Å
83	R	96.1	Very high	97.3	Very high	128 Å²	128	83.3 Å²	83.3	48%	0.483	41%	0.413	S	S	.	.			trans	-105.1	138.3	179	-68.2	-179.7	172.7	-159.8	-10.1	111.2	A78 N81 E90	A78-R83 PolarHBondContact O-N 2.97Å; N81-R83 VanDerWaalsContact C-N 3.25Å; N81-R83 HydrophobicContact CB-CG 4.35Å; N81-R83 PolarHBondContact O-N 3.44Å; R83-E90 IonicContact NH1-OE1 3.33Å
84	S	95.1	Very high	97.3	Very high	128 Å²	128	81.6 Å²	81.6	90%	0.895	41%	0.405	S	S	*	.	S	Bend	trans	-84.8	-11.3	172.8	52.6	0	0	0	0	113.7
85	T	97.3	Very high	97.2	Very high	91 Å²	91	82.4 Å²	82.4	56%	0.558	41%	0.41	S	S	*	.	S	Bend	trans	-116.3	125.2	-178	-49	0	0	0	0	110.5
86	I	97.8	Very high	97.2	Very high	77 Å²	77	87.8 Å²	87.8	40%	0.395	42%	0.424	S	S	.	.			trans	-79.3	122.6	168.3	-58.4	174.6	0	0	0	107.7	A74 A78 E90 V91	A74-I86 HydrophobicContact CB-CG2 3.87Å; A78-I86 HydrophobicContact CB-CG1 3.97Å; I86-E90 HydrophobicContact CG2-CB 4.08Å; I86-V91 HydrophobicContact CG2-CG2 3.96Å
87	T	97.1	Very high	97.2	Very high	50 Å²	50	87.4 Å²	87.4	31%	0.307	43%	0.43	S	S	.	.			trans	-104.4	175	176.3	81.8	0	0	0	0	110.9	R89 E90 V91	T87-R89 PolarHBondContact O-N 2.88Å; T87-R89 VanDerWaalsContact O-N 3.14Å; T87-R89 WeakPolarHBondContact OG1-CB 3.25Å; T87-R89 PolarHBondContact OG1-N 2.81Å; T87-R89 VanDerWaalsContact OG1-N 3.16Å; T87-E90 VanDerWaalsContact CA-OE2 3.3Å; T87-E90 WeakPolarHBondContact CA-OE2 3.26Å; T87-E90 VanDerWaalsContact CB-OE2 3.22Å; T87-E90 WeakPolarHBondContact CB-OE2 3.35Å; T87-E90 PolarHBondContact N-OE2 2.89Å; T87-E90 PolarHBondContact O-N 3.4Å; T87-E90 PolarHBondContact OG1-OE2 3.08Å; T87-V91 PolarHBondContact O-N 3.46Å
88	S	96.2	Very high	97.2	Very high	77 Å²	77	89.2 Å²	89.2	54%	0.538	44%	0.44	S	S	.	.	H	α-helix	trans	-56.4	-25.7	171.9	51.1	0	0	0	0	113	Q92	S88-Q92 WeakPolarHBondContact O-CB 3.44Å; S88-Q92 PolarHBondContact O-N 3.16Å
89	R	96.4	Very high	97.1	Very high	166 Å²	166	91 Å²	91	63%	0.626	45%	0.449	S	S	*	.	H	α-helix	trans	-68.8	-44.9	177.7	-171.9	-177.6	-179.7	-167.8	-0.1	112.5	T87 Q92 T93	T87-R89 PolarHBondContact O-N 2.88Å; T87-R89 VanDerWaalsContact O-N 3.14Å; T87-R89 WeakPolarHBondContact OG1-CB 3.25Å; T87-R89 PolarHBondContact OG1-N 2.81Å; T87-R89 VanDerWaalsContact OG1-N 3.16Å; R89-Q92 PolarHBondContact O-N 2.77Å; R89-T93 WeakPolarHBondContact O-CB 3.44Å; R89-T93 PolarHBondContact O-N 3.4Å; R89-T93 PolarHBondContact O-OG1 3.5Å
90	E	97.8	Very high	97.1	Very high	6 Å²	6	88.9 Å²	88.9	3%	0.028	45%	0.447	C	S	.	.	H	α-helix	trans	-65.8	-41.4	177.1	-69.8	74.7	-157.9	0	0	110.5	A74 L77 A78 R83 I86 T87 T93 A94	A74-E90 HydrophobicContact CB-CB 4.27Å; L77-E90 HydrophobicContact CB-CB 4.24Å; L77-E90 HydrophobicContact CB-CG 4.08Å; A78-E90 HydrophobicContact CB-CG 4.27Å; R83-E90 IonicContact NH1-OE1 3.33Å; I86-E90 HydrophobicContact CG2-CB 4.08Å; T87-E90 VanDerWaalsContact CA-OE2 3.3Å; T87-E90 WeakPolarHBondContact CA-OE2 3.26Å; T87-E90 VanDerWaalsContact CB-OE2 3.22Å; T87-E90 WeakPolarHBondContact CB-OE2 3.35Å; T87-E90 PolarHBondContact N-OE2 2.89Å; T87-E90 PolarHBondContact O-N 3.4Å; T87-E90 PolarHBondContact OG1-OE2 3.08Å; E90-T93 PolarHBondContact O-N 3.13Å; E90-A94 WeakPolarHBondContact O-CB 3.22Å; E90-A94 PolarHBondContact O-N 3.06Å
91	V	98.3	Very high	97.1	Very high	62 Å²	62	83 Å²	83	38%	0.376	44%	0.44	S	S	.	.	H	α-helix	trans	-61.8	-47.5	174.4	179.1	0	0	0	0	111.7	I70 A74 I86 T87 T93 A94 V95	I70-V91 HydrophobicContact CG2-CG1 4.07Å; A74-V91 HydrophobicContact CB-CG2 4.21Å; I86-V91 HydrophobicContact CG2-CG2 3.96Å; T87-V91 PolarHBondContact O-N 3.46Å; V91-T93 VanDerWaalsContact C-N 3.26Å; V91-T93 PolarHBondContact O-N 3.27Å; V91-A94 PolarHBondContact O-N 2.91Å; V91-V95 WeakPolarHBondContact O-CG2 3.41Å; V91-V95 PolarHBondContact O-N 3.39Å
92	Q	97.9	Very high	97.1	Very high	68 Å²	68	83.2 Å²	83.2	32%	0.318	44%	0.438	S	S	.	.	H	α-helix	trans	-61.2	-36.1	177.8	-174.4	-175.6	4.9	0	0	112.1	S88 R89 R96 V108	S88-Q92 WeakPolarHBondContact O-CB 3.44Å; S88-Q92 PolarHBondContact O-N 3.16Å; R89-Q92 PolarHBondContact O-N 2.77Å; Q92-R96 WeakPolarHBondContact O-CG 3.48Å; Q92-R96 PolarHBondContact O-N 3.27Å; Q92-V108 HydrophobicContact CG-CG1 3.92Å; Q92-V108 HydrophobicContact CG-CG2 4.07Å; Q92-V108 VanDerWaalsContact NE2-CG1 3.29Å
93	T	97.9	Very high	97.1	Very high	55 Å²	55	78.8 Å²	78.8	34%	0.337	42%	0.423	S	S	.	.	H	α-helix	trans	-73.4	-44	178.3	-54.6	0	0	0	0	110.9	L77 R89 E90 V91 V95 R96 L97	L77-T93 HydrophobicContact CD1-CG2 3.77Å; L77-T93 HydrophobicContact CD2-CG2 4.32Å; R89-T93 WeakPolarHBondContact O-CB 3.44Å; R89-T93 PolarHBondContact O-N 3.4Å; R89-T93 PolarHBondContact O-OG1 3.5Å; E90-T93 PolarHBondContact O-N 3.13Å; V91-T93 VanDerWaalsContact C-N 3.26Å; V91-T93 PolarHBondContact O-N 3.27Å; T93-V95 VanDerWaalsContact C-N 3.32Å; T93-V95 PolarHBondContact O-N 3.44Å; T93-R96 WeakPolarHBondContact O-CB 3.36Å; T93-R96 PolarHBondContact O-N 2.8Å; T93-L97 WeakPolarHBondContact O-CG 3.43Å; T93-L97 PolarHBondContact O-N 3.2Å; T93-L97 VanDerWaalsContact O-N 3.09Å
94	A	98.1	Very high	97.2	Very high	0 Å²	0	73.2 Å²	73.2	0%	0	40%	0.404	C	S	.	.	H	α-helix	trans	-56.3	-43.7	173.1	0	0	0	0	0	112.2	I70 E73 A74 L77 E90 V91 R96 L97 L98	I70-A94 HydrophobicContact CG2-CB 4.33Å; E73-A94 HydrophobicContact CB-CB 3.94Å; E73-A94 HydrophobicContact CG-CB 4.16Å; A74-A94 HydrophobicContact CB-CB 4.06Å; L77-A94 HydrophobicContact CD1-CB 4.17Å; E90-A94 WeakPolarHBondContact O-CB 3.22Å; E90-A94 PolarHBondContact O-N 3.06Å; V91-A94 PolarHBondContact O-N 2.91Å; A94-R96 VanDerWaalsContact C-N 3.29Å; A94-R96 PolarHBondContact O-N 3.26Å; A94-L97 PolarHBondContact O-N 3.41Å; A94-L97 VanDerWaalsContact O-N 3.15Å; A94-L98 WeakPolarHBondContact O-CB 3.37Å; A94-L98 WeakPolarHBondContact O-CG 3.43Å; A94-L98 PolarHBondContact O-N 3.06Å
95	V	98.3	Very high	97.3	Very high	18 Å²	18	73.3 Å²	73.3	11%	0.109	39%	0.389	C	S	.	.	H	α-helix	trans	-58.9	-38.7	175.1	168.5	0	0	0	0	112.1	I70 V91 T93 L99 A107 V108	I70-V95 HydrophobicContact CD1-CG2 4Å; I70-V95 HydrophobicContact CG1-CG2 4.33Å; I70-V95 HydrophobicContact CG2-CG2 4.26Å; V91-V95 WeakPolarHBondContact O-CG2 3.41Å; V91-V95 PolarHBondContact O-N 3.39Å; T93-V95 VanDerWaalsContact C-N 3.32Å; T93-V95 PolarHBondContact O-N 3.44Å; V95-L99 HydrophobicContact CG1-CD1 3.95Å; V95-L99 HydrophobicContact CG1-CG 4.48Å; V95-L99 WeakPolarHBondContact O-CB 3.39Å; V95-L99 PolarHBondContact O-N 3.1Å; V95-L99 VanDerWaalsContact O-N 3.07Å; V95-A107 HydrophobicContact CG1-CB 3.66Å; V95-V108 HydrophobicContact CG1-CG2 4.12Å
96	R	97.4	Very high	97.3	Very high	156 Å²	156	74.4 Å²	74.4	59%	0.589	39%	0.387	S	S	*	.	H	α-helix	trans	-71.7	-26.8	176.8	-71.3	177.8	175.2	-160	-1.8	113.9	Q92 T93 A94 V108	Q92-R96 WeakPolarHBondContact O-CG 3.48Å; Q92-R96 PolarHBondContact O-N 3.27Å; T93-R96 WeakPolarHBondContact O-CB 3.36Å; T93-R96 PolarHBondContact O-N 2.8Å; A94-R96 VanDerWaalsContact C-N 3.29Å; A94-R96 PolarHBondContact O-N 3.26Å; R96-V108 HydrophobicContact CG-CG2 3.76Å
97	L	97.6	Very high	97.3	Very high	111 Å²	111	72.6 Å²	72.6	58%	0.581	38%	0.384	S	S	*	.	H	α-helix	trans	-80.5	-34	175.8	-66.9	172.5	0	0	0	112.1	E73 L77 T93 A94	E73-L97 HydrophobicContact CG-CD1 4.18Å; L77-L97 HydrophobicContact CD1-CD1 4.26Å; L77-L97 HydrophobicContact CD2-CD1 4.4Å; T93-L97 WeakPolarHBondContact O-CG 3.43Å; T93-L97 PolarHBondContact O-N 3.2Å; T93-L97 VanDerWaalsContact O-N 3.09Å; A94-L97 PolarHBondContact O-N 3.41Å; A94-L97 VanDerWaalsContact O-N 3.15Å
98	L	97.5	Very high	97.4	Very high	66 Å²	66	71 Å²	71	35%	0.346	37%	0.374	S	S	.	.	H	α-helix	trans	-91.1	-28.1	-173.2	-68.3	167.5	0	0	0	114.4	R69 I70 E73 A94	R69-L98 HydrophobicContact CB-CD1 4.01Å; R69-L98 HydrophobicContact CB-CD2 4.32Å; I70-L98 HydrophobicContact CB-CD1 4.26Å; I70-L98 HydrophobicContact CG1-CD1 3.71Å; E73-L98 HydrophobicContact CB-CD1 4.14Å; A94-L98 WeakPolarHBondContact O-CB 3.37Å; A94-L98 WeakPolarHBondContact O-CG 3.43Å; A94-L98 PolarHBondContact O-N 3.06Å
99	L	96.8	Very high	97.5	Very high	40 Å²	40	69.7 Å²	69.7	21%	0.209	37%	0.365	C	S	.	.	S	Bend	trans	-104.7	137.6	-178	-59.5	-174.5	0	0	0	111.8	L66 V95 L103 A104 A107	L66-L99 HydrophobicContact CD1-CD2 4.26Å; V95-L99 HydrophobicContact CG1-CD1 3.95Å; V95-L99 HydrophobicContact CG1-CG 4.48Å; V95-L99 WeakPolarHBondContact O-CB 3.39Å; V95-L99 PolarHBondContact O-N 3.1Å; V95-L99 VanDerWaalsContact O-N 3.07Å; L99-L103 HydrophobicContact CB-CB 4.25Å; L99-A104 HydrophobicContact CB-CB 4.04Å; L99-A104 WeakPolarHBondContact O-CB 3.37Å; L99-A107 HydrophobicContact CD1-CB 3.64Å
100	P	96.7	Very high	97.5	Very high	89 Å²	89	66.7 Å²	66.7	58%	0.578	36%	0.358	S	S	*	.			trans	-81.1	142.7	178.8	31.9	-34.8	0	0	0	112.6	E102 L103	P100-E102 PolarHBondContact O-N 2.94Å; P100-L103 HydrophobicContact CG-CD1 4.2Å; P100-L103 WeakPolarHBondContact O-CB 3.45Å; P100-L103 PolarHBondContact O-N 2.91Å
101	G	95.8	Very high	97.5	Very high	54 Å²	54	68.1 Å²	68.1	56%	0.557	38%	0.375	S	S	*	.	H	α-helix	trans	47.2	-121.2	161.3	0	0	0	0	0	115.5	L103 A104 K105	G101-L103 VanDerWaalsContact C-N 3.26Å; G101-L103 PolarHBondContact O-N 3.33Å; G101-A104 PolarHBondContact O-N 3.03Å; G101-K105 PolarHBondContact O-N 3.31Å
102	E	96.5	Very high	97.5	Very high	105 Å²	105	68.4 Å²	68.4	49%	0.491	38%	0.377	S	S	.	.	H	α-helix	trans	-62.5	-27.8	-178.2	-63.7	-51.6	124.9	0	0	113.7	P100 K105 H106	P100-E102 PolarHBondContact O-N 2.94Å; E102-K105 PolarHBondContact O-N 3.41Å; E102-K105 WeakPolarHBondContact OE1-CE 3.41Å; E102-K105 IonicContact OE1-NZ 2.66Å; E102-K105 PolarHBondContact OE1-NZ 3.03Å; E102-K105 WeakPolarHBondContact OE2-CD 3.39Å; E102-K105 IonicContact OE2-NZ 3.78Å; E102-H106 PolarHBondContact O-N 2.9Å; E102-H106 PolarHBondContact O-ND1 2.91Å
103	L	97.1	Very high	97.5	Very high	108 Å²	108	70.6 Å²	70.6	57%	0.565	39%	0.385	S	S	*	.	H	α-helix	trans	-66.8	-40.7	177.6	-64	178.5	0	0	0	111.1	L99 P100 G101 A107	L99-L103 HydrophobicContact CB-CB 4.25Å; P100-L103 HydrophobicContact CG-CD1 4.2Å; P100-L103 WeakPolarHBondContact O-CB 3.45Å; P100-L103 PolarHBondContact O-N 2.91Å; G101-L103 VanDerWaalsContact C-N 3.26Å; G101-L103 PolarHBondContact O-N 3.33Å; L103-A107 VanDerWaalsContact O-CB 3.23Å; L103-A107 WeakPolarHBondContact O-CB 3.44Å; L103-A107 PolarHBondContact O-N 3.29Å
104	A	97.3	Very high	97.4	Very high	11 Å²	11	70.8 Å²	70.8	9%	0.091	39%	0.392	C	S	.	.	H	α-helix	trans	-63.5	-41.3	174.1	0	0	0	0	0	112	L99 G101 V108	L99-A104 HydrophobicContact CB-CB 4.04Å; L99-A104 WeakPolarHBondContact O-CB 3.37Å; G101-A104 PolarHBondContact O-N 3.03Å; A104-V108 VanDerWaalsContact O-CB 3.3Å; A104-V108 WeakPolarHBondContact O-CB 3.35Å; A104-V108 WeakPolarHBondContact O-CG2 3.41Å; A104-V108 PolarHBondContact O-N 3.15Å
105	K	97.5	Very high	97.3	Very high	129 Å²	129	74.2 Å²	74.2	56%	0.561	41%	0.413	S	S	*	.	H	α-helix	trans	-60.9	-49.7	178.3	-66.3	179.5	-173.2	170.9	0	111.7	G101 E102 S109	G101-K105 PolarHBondContact O-N 3.31Å; E102-K105 PolarHBondContact O-N 3.41Å; E102-K105 WeakPolarHBondContact OE1-CE 3.41Å; E102-K105 IonicContact OE1-NZ 2.66Å; E102-K105 PolarHBondContact OE1-NZ 3.03Å; E102-K105 WeakPolarHBondContact OE2-CD 3.39Å; E102-K105 IonicContact OE2-NZ 3.78Å; K105-S109 WeakPolarHBondContact O-CB 3.36Å; K105-S109 PolarHBondContact O-N 3.39Å
106	H	98.1	Very high	97.2	Very high	114 Å²	114	77 Å²	77	53%	0.528	43%	0.43	S	S	.	.	H	α-helix	trans	-64.7	-47.2	178	-68.6	103.6	0	0	0	112.1	E102 V108 S109 E110	E102-H106 PolarHBondContact O-N 2.9Å; E102-H106 PolarHBondContact O-ND1 2.91Å; H106-V108 VanDerWaalsContact C-N 3.32Å; H106-V108 PolarHBondContact O-N 2.85Å; H106-S109 WeakPolarHBondContact O-CB 3.46Å; H106-S109 PolarHBondContact O-N 3.18Å; H106-S109 VanDerWaalsContact O-N 3.15Å; H106-E110 PolarHBondContact O-N 3.19Å
107	A	97.9	Very high	97.2	Very high	39 Å²	39	77.3 Å²	77.3	32%	0.322	44%	0.436	S	S	.	.	H	α-helix	trans	-61.1	-39.7	180	0	0	0	0	0	112.7	V95 L99 L103 G111	V95-A107 HydrophobicContact CG1-CB 3.66Å; L99-A107 HydrophobicContact CD1-CB 3.64Å; L103-A107 VanDerWaalsContact O-CB 3.23Å; L103-A107 WeakPolarHBondContact O-CB 3.44Å; L103-A107 PolarHBondContact O-N 3.29Å; A107-G111 PolarHBondContact O-N 2.93Å
108	V	97.8	Very high	97.1	Very high	16 Å²	16	80.4 Å²	80.4	10%	0.097	44%	0.441	C	S	.	.	H	α-helix	trans	-66.4	-43.6	174.3	169.6	0	0	0	0	111.3	Q92 V95 R96 A104 H106 G111 T112	Q92-V108 HydrophobicContact CG-CG1 3.92Å; Q92-V108 HydrophobicContact CG-CG2 4.07Å; Q92-V108 VanDerWaalsContact NE2-CG1 3.29Å; V95-V108 HydrophobicContact CG1-CG2 4.12Å; R96-V108 HydrophobicContact CG-CG2 3.76Å; A104-V108 VanDerWaalsContact O-CB 3.3Å; A104-V108 WeakPolarHBondContact O-CB 3.35Å; A104-V108 WeakPolarHBondContact O-CG2 3.41Å; A104-V108 PolarHBondContact O-N 3.15Å; H106-V108 VanDerWaalsContact C-N 3.32Å; H106-V108 PolarHBondContact O-N 2.85Å; V108-G111 PolarHBondContact O-N 2.85Å; V108-T112 PolarHBondContact O-N 3.47Å; V108-T112 PolarHBondContact O-OG1 3.05Å
109	S	97.9	Very high	97	Very high	50 Å²	50	81.4 Å²	81.4	35%	0.35	45%	0.45	S	S	.	.	H	α-helix	trans	-57.9	-51.6	177	179.4	0	0	0	0	112	K105 H106 G111 T112 K113	K105-S109 WeakPolarHBondContact O-CB 3.36Å; K105-S109 PolarHBondContact O-N 3.39Å; H106-S109 WeakPolarHBondContact O-CB 3.46Å; H106-S109 PolarHBondContact O-N 3.18Å; H106-S109 VanDerWaalsContact O-N 3.15Å; S109-G111 PolarHBondContact O-N 3.39Å; S109-T112 PolarHBondContact O-N 3.19Å; S109-K113 VanDerWaalsContact O-CG 3.31Å; S109-K113 WeakPolarHBondContact O-CG 3.5Å; S109-K113 PolarHBondContact O-N 3.22Å; S109-K113 WeakPolarHBondContact OG-CE 3.46Å
110	E	98.1	Very high	96.9	Very high	103 Å²	103	84 Å²	84	48%	0.481	47%	0.472	S	S	.	.	H	α-helix	trans	-65.2	-38.4	178.3	-63.2	-46.9	124.4	0	0	112.4	H106 K113 A114	H106-E110 PolarHBondContact O-N 3.19Å; E110-K113 PolarHBondContact O-N 3.19Å; E110-K113 IonicContact OE1-NZ 3.86Å; E110-K113 PolarHBondContact OE1-NZ 3.44Å; E110-K113 IonicContact OE2-NZ 3.78Å; E110-A114 WeakPolarHBondContact O-CB 3.41Å; E110-A114 PolarHBondContact O-N 3.11Å
111	G	97.6	Very high	96.5	Very high	37 Å²	37	84.2 Å²	84.2	38%	0.381	48%	0.475	S	S	.	.	H	α-helix	trans	-59.9	-46.9	173.7	0	0	0	0	0	112.8	A107 V108 S109 A114 V115	A107-G111 PolarHBondContact O-N 2.93Å; V108-G111 PolarHBondContact O-N 2.85Å; S109-G111 PolarHBondContact O-N 3.39Å; G111-A114 PolarHBondContact O-N 3.26Å; G111-V115 WeakPolarHBondContact O-CG2 3.23Å; G111-V115 PolarHBondContact O-N 3.35Å; G111-V115 VanDerWaalsContact O-N 3.1Å
112	T	97.4	Very high	94.9	Very high	68 Å²	68	93.2 Å²	93.2	42%	0.417	50%	0.499	S	S	.	.	H	α-helix	trans	-63.5	-46.4	176.8	-61.7	0	0	0	0	111.5	V108 S109 A114 V115 T116	V108-T112 PolarHBondContact O-N 3.47Å; V108-T112 PolarHBondContact O-OG1 3.05Å; S109-T112 PolarHBondContact O-N 3.19Å; T112-A114 VanDerWaalsContact C-N 3.3Å; T112-A114 PolarHBondContact O-N 3.45Å; T112-V115 PolarHBondContact O-N 2.76Å; T112-T116 PolarHBondContact O-N 3.29Å; T112-T116 PolarHBondContact O-OG1 2.82Å
113	K	97.4	Very high	94.8	Very high	113 Å²	113	92.7 Å²	92.7	49%	0.491	50%	0.499	S	S	.	.	H	α-helix	trans	-55.5	-44.2	175.8	-70.6	169.9	-172	174.3	0	112.1	S109 E110 T116 K117	S109-K113 VanDerWaalsContact O-CG 3.31Å; S109-K113 WeakPolarHBondContact O-CG 3.5Å; S109-K113 PolarHBondContact O-N 3.22Å; S109-K113 WeakPolarHBondContact OG-CE 3.46Å; E110-K113 PolarHBondContact O-N 3.19Å; E110-K113 IonicContact OE1-NZ 3.86Å; E110-K113 PolarHBondContact OE1-NZ 3.44Å; E110-K113 IonicContact OE2-NZ 3.78Å; K113-T116 PolarHBondContact O-N 2.98Å; K113-K117 WeakPolarHBondContact O-CB 3.13Å; K113-K117 PolarHBondContact O-N 3Å
114	A	96.9	Very high	94.7	Very high	60 Å²	60	91.8 Å²	91.8	50%	0.496	50%	0.496	S	S	.	.	H	α-helix	trans	-63.9	-43.6	179.4	0	0	0	0	0	112.3	E110 G111 T112 Y118	E110-A114 WeakPolarHBondContact O-CB 3.41Å; E110-A114 PolarHBondContact O-N 3.11Å; G111-A114 PolarHBondContact O-N 3.26Å; T112-A114 VanDerWaalsContact C-N 3.3Å; T112-A114 PolarHBondContact O-N 3.45Å; A114-Y118 WeakPolarHBondContact O-CB 3.39Å; A114-Y118 PolarHBondContact O-N 2.69Å
115	V	96.2	Very high	94.6	Very high	71 Å²	71	96.3 Å²	96.3	43%	0.43	52%	0.518	S	S	.	.	H	α-helix	trans	-63	-48.6	175.9	172.7	0	0	0	0	111	G111 T112 K117 Y118 T119	G111-V115 WeakPolarHBondContact O-CG2 3.23Å; G111-V115 PolarHBondContact O-N 3.35Å; G111-V115 VanDerWaalsContact O-N 3.1Å; T112-V115 PolarHBondContact O-N 2.76Å; V115-K117 PolarHBondContact O-N 2.76Å; V115-Y118 PolarHBondContact O-N 3.07Å; V115-T119 PolarHBondContact O-N 3.29Å; V115-T119 PolarHBondContact O-OG1 2.71Å
116	T	96.4	Very high	94.4	Very high	76 Å²	76	94.4 Å²	94.4	47%	0.466	52%	0.516	S	S	.	.	H	α-helix	trans	-58.4	-48.1	178.1	-58.8	0	0	0	0	111.3	T112 K113 Y118 T119 S120	T112-T116 PolarHBondContact O-N 3.29Å; T112-T116 PolarHBondContact O-OG1 2.82Å; K113-T116 PolarHBondContact O-N 2.98Å; T116-Y118 VanDerWaalsContact C-N 3.31Å; T116-Y118 PolarHBondContact O-N 3.05Å; T116-T119 WeakPolarHBondContact CA-OG1 3.43Å; T116-T119 PolarHBondContact O-N 3.1Å; T116-T119 PolarHBondContact O-OG1 2.89Å; T116-S120 PolarHBondContact O-N 2.95Å; T116-S120 PolarHBondContact O-OG 2.88Å
117	K	97.2	Very high	94.2	Very high	164 Å²	164	93.2 Å²	93.2	71%	0.713	52%	0.515	S	S	*	.	H	α-helix	trans	-58.6	-43	177.6	-177.4	175.3	180	175.6	0	112	K113 V115 S120 S121	K113-K117 WeakPolarHBondContact O-CB 3.13Å; K113-K117 PolarHBondContact O-N 3Å; V115-K117 PolarHBondContact O-N 2.76Å; K117-S120 PolarHBondContact O-N 2.8Å; K117-S121 WeakPolarHBondContact O-CB 3.36Å; K117-S121 PolarHBondContact O-N 3.02Å; K117-S121 VanDerWaalsContact O-N 3.16Å; K117-S121 PolarHBondContact O-OG 2.9Å
118	Y	95.7	Very high	93.9	Very high	176 Å²	176	96.8 Å²	96.8	69%	0.69	53%	0.528	S	S	*	.	H	α-helix	trans	-61.7	-47.5	176.6	178.8	-103.6	0	0	0	111.5	A114 V115 T116 S120 S121	A114-Y118 WeakPolarHBondContact O-CB 3.39Å; A114-Y118 PolarHBondContact O-N 2.69Å; V115-Y118 PolarHBondContact O-N 3.07Å; T116-Y118 VanDerWaalsContact C-N 3.31Å; T116-Y118 PolarHBondContact O-N 3.05Å; Y118-S120 VanDerWaalsContact C-N 3.33Å; Y118-S120 PolarHBondContact O-N 3.09Å; Y118-S121 PolarHBondContact O-N 3.1Å; Y118-S121 PolarHBondContact O-OG 3.09Å
119	T	94.8	Very high	93.6	Very high	87 Å²	87	102.6 Å²	102.6	53%	0.534	56%	0.558	S	S	.	*	H	α-helix	trans	-64.7	-32.6	178.9	50	0	0	0	0	113.8	V115 T116 S121	V115-T119 PolarHBondContact O-N 3.29Å; V115-T119 PolarHBondContact O-OG1 2.71Å; T116-T119 WeakPolarHBondContact CA-OG1 3.43Å; T116-T119 PolarHBondContact O-N 3.1Å; T116-T119 PolarHBondContact O-OG1 2.89Å; T119-S121 VanDerWaalsContact C-N 3.34Å
120	S	93.7	Very high	93.3	Very high	95 Å²	95	106.6 Å²	106.6	66%	0.664	58%	0.575	S	S	*	*	H	α-helix	trans	-81.1	-10.6	176.7	-58.1	0	0	0	0	114.1	T116 K117 Y118	T116-S120 PolarHBondContact O-N 2.95Å; T116-S120 PolarHBondContact O-OG 2.88Å; K117-S120 PolarHBondContact O-N 2.8Å; Y118-S120 VanDerWaalsContact C-N 3.33Å; Y118-S120 PolarHBondContact O-N 3.09Å
121	S	89.2	Confident	92.9	Very high	92 Å²	92	106.9 Å²	106.9	64%	0.643	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	11	178.9	64.1	0	0	0	0	114.1	K117 Y118 T119	K117-S121 WeakPolarHBondContact O-CB 3.36Å; K117-S121 PolarHBondContact O-N 3.02Å; K117-S121 VanDerWaalsContact O-N 3.16Å; K117-S121 PolarHBondContact O-OG 2.9Å; Y118-S121 PolarHBondContact O-N 3.1Å; Y118-S121 PolarHBondContact O-OG 3.09Å; T119-S121 VanDerWaalsContact C-N 3.34Å
122	K	62.6	Low	92.5	Very high	244 Å²	244	113.3 Å²	113.3	100%	1.061	60%	0.601	S	S	*	*			trans	-109.3	0	-179.4	-172.9	-174.5	179	-171.7	0	110.5

Retrieved 122 of 122 residues in 33 ms (Link to these results)

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