A0A077ZJW4_TRITR Loading...

Histone domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZJW4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 165 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.5	Very low	46.8	Very low	248 Å²	248	177.8 Å²	177.8	100%	1.222	90%	0.9	S	S	*	*				0	101.2	0	-83.4	-178.4	165.4	0	0	109.7
2	A	46.4	Very low	45.7	Very low	102 Å²	102	172.7 Å²	172.7	84%	0.843	89%	0.893	S	S	*	*			trans	-168.6	109.9	157	0	0	0	0	0	107.8
3	L	49.4	Very low	45.2	Very low	180 Å²	180	167.3 Å²	167.3	94%	0.942	88%	0.88	S	S	*	*			trans	-76	126.3	-172.8	-79.7	146.2	0	0	0	111.7
4	T	58.2	Low	45.2	Very low	140 Å²	140	164.7 Å²	164.7	86%	0.859	88%	0.882	S	S	*	*			trans	-79.4	115.9	170.1	45.9	0	0	0	0	110.2	K6	T4-K6 PolarHBondContact O-N 3.41Å
5	K	55.7	Low	45.1	Very low	212 Å²	212	158.2 Å²	158.2	92%	0.922	87%	0.869	S	S	*	*			trans	-85.4	103.5	171.7	-95.7	-179.1	177.6	176.4	0	110.3	K7	K5-K7 PolarHBondContact O-N 3.45Å
6	K	52.2	Low	45.4	Very low	202 Å²	202	152.7 Å²	152.7	88%	0.878	85%	0.846	S	S	*	*			trans	-73.3	113.9	172.6	-159.6	174.1	-173.7	175.6	0	109.6	T4 Q8	T4-K6 PolarHBondContact O-N 3.41Å; K6-Q8 PolarHBondContact O-N 3.33Å
7	K	49.2	Very low	45.7	Very low	204 Å²	204	154.5 Å²	154.5	89%	0.887	84%	0.838	S	S	*	*			trans	-76.7	106	175.7	-162.1	173.7	-174.7	177.8	0	108.8	K5 R9	K5-K7 PolarHBondContact O-N 3.45Å; K7-R9 PolarHBondContact O-N 3.48Å
8	Q	44.2	Very low	46	Very low	181 Å²	181	147.7 Å²	147.7	85%	0.846	80%	0.804	S	S	*	*			trans	-68.2	126.8	173.6	-75.3	-171.2	-14.2	0	0	110.2	K6	K6-Q8 PolarHBondContact O-N 3.33Å
9	R	36.7	Very low	46.5	Very low	242 Å²	242	145.2 Å²	145.2	91%	0.913	79%	0.794	S	S	*	*			trans	-82	116.9	170.3	-62.6	172	92.5	175.3	6.2	107.4	K7 S11	K7-R9 PolarHBondContact O-N 3.48Å; R9-S11 PolarHBondContact O-N 3.34Å
10	T	41.8	Very low	47.2	Very low	143 Å²	143	140.1 Å²	140.1	88%	0.877	77%	0.769	S	S	*	*			trans	-79.9	105.5	167.9	51.7	0	0	0	0	108.7
11	S	37.2	Very low	47.9	Very low	102 Å²	102	136.8 Å²	136.8	71%	0.713	75%	0.748	S	S	*	*			trans	-79.5	154.5	166.1	46.7	0	0	0	0	111.4	R9	R9-S11 PolarHBondContact O-N 3.34Å
12	S	34.1	Very low	48.9	Very low	116 Å²	116	127.2 Å²	127.2	81%	0.811	70%	0.704	S	S	*	*			trans	83.4	104.7	156.2	72.5	0	0	0	0	119.5
13	S	38.8	Very low	49.7	Very low	103 Å²	103	123.6 Å²	123.6	72%	0.72	67%	0.673	S	S	*	*			trans	-150.5	72.6	145.1	74.5	0	0	0	0	111	G15	S13-G15 VanDerWaalsContact C-N 3.25Å; S13-G15 PolarHBondContact O-N 3.4Å
14	S	44.9	Very low	50.7	Low	131 Å²	131	120.2 Å²	120.2	92%	0.916	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	25.3	175	54.8	0	0	0	0	113.6
15	G	44.9	Very low	51.3	Low	67 Å²	67	114.2 Å²	114.2	69%	0.691	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112	3.4	-174.8	0	0	0	0	0	116	S13	S13-G15 VanDerWaalsContact C-N 3.25Å; S13-G15 PolarHBondContact O-N 3.4Å
16	S	49.9	Very low	51.9	Low	70 Å²	70	109.1 Å²	109.1	49%	0.49	59%	0.594	S	S	.	*			trans	-89.7	-15.4	-163.9	41.9	0	0	0	0	116.2	S18 T19 S20	S16-S18 PolarHBondContact O-N 2.76Å; S16-T19 PolarHBondContact O-N 3.04Å; S16-S20 WeakPolarHBondContact O-CB 3.48Å; S16-S20 PolarHBondContact O-N 3.48Å; S16-S20 PolarHBondContact O-OG 2.83Å; S16-S20 VanDerWaalsContact O-OG 3.04Å
17	Y	49.3	Very low	52.8	Low	183 Å²	183	102.7 Å²	102.7	72%	0.718	57%	0.567	S	S	*	*	H	α-helix	trans	-65.1	-37.3	-164.7	-130.5	-89.1	0	0	0	114.7	S20 Q21	Y17-S20 VanDerWaalsContact C-OG 3.28Å; Y17-S20 WeakPolarHBondContact CA-OG 3.39Å; Y17-S20 PolarHBondContact O-OG 2.92Å; Y17-Q21 WeakPolarHBondContact O-CG 3.38Å; Y17-Q21 PolarHBondContact O-N 3.32Å
18	S	52.4	Low	53.8	Low	33 Å²	33	99.9 Å²	99.9	23%	0.231	56%	0.555	C	S	.	*	H	α-helix	trans	-79.1	-39.5	-177.1	-179.8	0	0	0	0	112.4	S16 S20 Q21 T22 R92	S16-S18 PolarHBondContact O-N 2.76Å; S18-S20 VanDerWaalsContact C-N 3.28Å; S18-S20 PolarHBondContact O-N 2.75Å; S18-Q21 PolarHBondContact O-N 3.39Å; S18-T22 PolarHBondContact O-N 3.17Å; S18-T22 PolarHBondContact O-OG1 3.26Å; S18-R92 PolarHBondContact OG-NE 3.03Å
19	T	55.3	Low	54.9	Low	100 Å²	100	91.7 Å²	91.7	61%	0.613	52%	0.517	S	S	*	.	H	α-helix	trans	-67.9	-31.7	175.3	-51.6	0	0	0	0	111.2	S16 T22 S23	S16-T19 PolarHBondContact O-N 3.04Å; T19-T22 PolarHBondContact O-OG1 3.37Å; T19-S23 WeakPolarHBondContact O-CB 2.78Å; T19-S23 PolarHBondContact O-N 3.19Å
20	S	60.5	Low	56.4	Low	42 Å²	42	84.5 Å²	84.5	29%	0.294	49%	0.491	S	S	.	.	H	α-helix	trans	-66.9	-38.2	175.8	52.8	0	0	0	0	112.8	S16 Y17 S18 Q24	S16-S20 WeakPolarHBondContact O-CB 3.48Å; S16-S20 PolarHBondContact O-N 3.48Å; S16-S20 PolarHBondContact O-OG 2.83Å; S16-S20 VanDerWaalsContact O-OG 3.04Å; Y17-S20 VanDerWaalsContact C-OG 3.28Å; Y17-S20 WeakPolarHBondContact CA-OG 3.39Å; Y17-S20 PolarHBondContact O-OG 2.92Å; S18-S20 VanDerWaalsContact C-N 3.28Å; S18-S20 PolarHBondContact O-N 2.75Å; S20-Q24 WeakPolarHBondContact O-CB 3.49Å; S20-Q24 WeakPolarHBondContact O-CG 3.47Å; S20-Q24 PolarHBondContact O-N 2.91Å
21	Q	62.1	Low	57.6	Low	71 Å²	71	79.2 Å²	79.2	33%	0.332	46%	0.464	S	S	.	.	H	α-helix	trans	-68.4	-51.8	-178.7	-75.4	177.8	-9.2	0	0	111.6	Y17 S18 S23 Q24 L25	Y17-Q21 WeakPolarHBondContact O-CG 3.38Å; Y17-Q21 PolarHBondContact O-N 3.32Å; S18-Q21 PolarHBondContact O-N 3.39Å; Q21-S23 VanDerWaalsContact C-N 3.3Å; Q21-S23 PolarHBondContact O-N 2.86Å; Q21-Q24 WeakPolarHBondContact O-CB 3.22Å; Q21-Q24 PolarHBondContact O-N 3.38Å; Q21-L25 PolarHBondContact O-N 3.05Å
22	T	62.9	Low	58.6	Low	47 Å²	47	81.6 Å²	81.6	29%	0.288	46%	0.462	S	S	.	.	H	α-helix	trans	-61.4	-40.6	176.6	57.8	0	0	0	0	111.7	S18 T19 Q24 L25 E26	S18-T22 PolarHBondContact O-N 3.17Å; S18-T22 PolarHBondContact O-OG1 3.26Å; T19-T22 PolarHBondContact O-OG1 3.37Å; T22-Q24 VanDerWaalsContact C-N 3.3Å; T22-Q24 PolarHBondContact O-N 3.03Å; T22-L25 PolarHBondContact O-N 3.37Å; T22-E26 WeakPolarHBondContact O-CG 3.48Å; T22-E26 PolarHBondContact O-N 2.93Å
23	S	64.8	Low	59.5	Low	27 Å²	27	81 Å²	81	19%	0.189	45%	0.45	C	S	.	.	H	α-helix	trans	-63.8	-33.7	175.2	178.4	0	0	0	0	112.7	T19 Q21 E27 R35	T19-S23 WeakPolarHBondContact O-CB 2.78Å; T19-S23 PolarHBondContact O-N 3.19Å; Q21-S23 VanDerWaalsContact C-N 3.3Å; Q21-S23 PolarHBondContact O-N 2.86Å; S23-E27 VanDerWaalsContact O-CB 3.22Å; S23-E27 WeakPolarHBondContact O-CB 3.45Å; S23-E27 PolarHBondContact O-N 3.47Å; S23-R35 PolarHBondContact OG-NH2 2.91Å
24	Q	70.2	Confident	60.1	Low	109 Å²	109	82.2 Å²	82.2	51%	0.509	44%	0.443	S	S	.	.	H	α-helix	trans	-70.8	-38.7	177.7	-79.1	172.8	30.4	0	0	111.4	S20 Q21 T22 E27 K28	S20-Q24 WeakPolarHBondContact O-CB 3.49Å; S20-Q24 WeakPolarHBondContact O-CG 3.47Å; S20-Q24 PolarHBondContact O-N 2.91Å; Q21-Q24 WeakPolarHBondContact O-CB 3.22Å; Q21-Q24 PolarHBondContact O-N 3.38Å; T22-Q24 VanDerWaalsContact C-N 3.3Å; T22-Q24 PolarHBondContact O-N 3.03Å; Q24-E27 PolarHBondContact O-N 3.35Å; Q24-K28 WeakPolarHBondContact O-CG 3.19Å; Q24-K28 PolarHBondContact O-N 3.39Å
25	L	70.2	Confident	60.4	Low	13 Å²	13	84.2 Å²	84.2	7%	0.068	43%	0.431	C	S	.	.	H	α-helix	trans	-65.8	-46.9	173.1	-69.9	177.9	0	0	0	112.7	Q21 T22 E27 K28 L29 L81 F82 E87	Q21-L25 PolarHBondContact O-N 3.05Å; T22-L25 PolarHBondContact O-N 3.37Å; L25-E27 PolarHBondContact O-N 3.38Å; L25-K28 WeakPolarHBondContact O-CB 3.35Å; L25-K28 PolarHBondContact O-N 3.33Å; L25-L29 WeakPolarHBondContact O-CG 3.09Å; L25-L29 PolarHBondContact O-N 3.27Å; L25-L81 HydrophobicContact CB-CD2 4.27Å; L25-L81 HydrophobicContact CD2-CD1 3.99Å; L25-L81 HydrophobicContact CD2-CD2 3.78Å; L25-L81 HydrophobicContact CD2-CG 3.92Å; L25-F82 HydrophobicContact CD1-CD1 4.28Å; L25-F82 HydrophobicContact CD1-CE1 3.87Å; L25-E87 HydrophobicContact CD1-CG 3.65Å; L25-E87 WeakPolarHBondContact CD1-OE1 3.46Å; L25-E87 WeakPolarHBondContact CD1-OE2 3.15Å; L25-E87 WeakPolarHBondContact CD2-OE1 3.39Å; L25-E87 VanDerWaalsContact CG-CD 3.42Å; L25-E87 WeakPolarHBondContact CG-OE1 3.14Å; L25-E87 WeakPolarHBondContact CG-OE2 3.36Å
26	E	69.1	Low	60.5	Low	105 Å²	105	90.5 Å²	90.5	49%	0.491	43%	0.434	S	S	.	.	H	α-helix	trans	-58.4	-40.2	176.1	-75.2	-177.5	175	0	0	110.5	T22 K28 L29 Y30	T22-E26 WeakPolarHBondContact O-CG 3.48Å; T22-E26 PolarHBondContact O-N 2.93Å; E26-K28 PolarHBondContact O-N 3.18Å; E26-L29 PolarHBondContact O-N 3.02Å; E26-Y30 HydrophobicContact CB-CD2 4.46Å; E26-Y30 WeakPolarHBondContact O-CB 3.43Å; E26-Y30 PolarHBondContact O-N 3.34Å
27	E	70	Confident	60.5	Low	67 Å²	67	97.5 Å²	97.5	31%	0.313	45%	0.45	S	S	.	.	H	α-helix	trans	-64.8	-37.1	175.4	-171.1	170.8	-178.3	0	0	112.4	S23 Q24 L25 G31 K32	S23-E27 VanDerWaalsContact O-CB 3.22Å; S23-E27 WeakPolarHBondContact O-CB 3.45Å; S23-E27 PolarHBondContact O-N 3.47Å; Q24-E27 PolarHBondContact O-N 3.35Å; L25-E27 PolarHBondContact O-N 3.38Å; E27-G31 WeakPolarHBondContact O-CA 3.22Å; E27-G31 PolarHBondContact O-N 3.07Å; E27-K32 HydrophobicContact CG-CG 4.22Å; E27-K32 WeakPolarHBondContact OE1-CE 3.41Å; E27-K32 WeakPolarHBondContact OE1-CG 3.42Å; E27-K32 IonicContact OE1-NZ 3.81Å
28	K	71	Confident	60.2	Low	145 Å²	145	92.1 Å²	92.1	63%	0.63	45%	0.45	S	S	*	.	H	α-helix	trans	-66.3	-35.4	172.5	-74.7	174.3	-177.2	174.4	0	112.8	Q24 L25 E26 L81	Q24-K28 WeakPolarHBondContact O-CG 3.19Å; Q24-K28 PolarHBondContact O-N 3.39Å; L25-K28 WeakPolarHBondContact O-CB 3.35Å; L25-K28 PolarHBondContact O-N 3.33Å; E26-K28 PolarHBondContact O-N 3.18Å; K28-L81 HydrophobicContact CB-CD2 4.46Å; K28-L81 HydrophobicContact CD-CD1 4.29Å
29	L	66.3	Low	59.8	Low	9 Å²	9	95.8 Å²	95.8	5%	0.047	48%	0.475	C	S	.	.	H	α-helix	trans	-79.4	-50.5	-176.8	-71.9	172.3	0	0	0	112.8	L25 E26 R77 E78 L81 F82	L25-L29 WeakPolarHBondContact O-CG 3.09Å; L25-L29 PolarHBondContact O-N 3.27Å; E26-L29 PolarHBondContact O-N 3.02Å; L29-R77 HydrophobicContact CD2-CG 4.09Å; L29-E78 HydrophobicContact CD1-CG 3.9Å; L29-E78 HydrophobicContact CD2-CB 4.41Å; L29-E78 HydrophobicContact CD2-CG 3.75Å; L29-E78 HydrophobicContact CG-CG 4.38Å; L29-L81 HydrophobicContact CD1-CD2 3.79Å; L29-L81 HydrophobicContact CD2-CB 4.1Å; L29-L81 HydrophobicContact CD2-CD2 3.41Å; L29-L81 VanDerWaalsContact CD2-CD2 3.41Å; L29-L81 HydrophobicContact CD2-CG 4.4Å; L29-L81 HydrophobicContact CG-CD2 3.35Å; L29-F82 HydrophobicContact CD1-CE2 4.34Å; L29-F82 HydrophobicContact CD1-CZ 3.89Å
30	Y	69	Low	59.1	Low	92 Å²	92	102.6 Å²	102.6	36%	0.361	49%	0.49	S	S	.	.	H	α-helix	trans	-104.1	-12.9	-166.9	-64.4	-63.4	0	0	0	112.5	E26 H34 E78	E26-Y30 HydrophobicContact CB-CD2 4.46Å; E26-Y30 WeakPolarHBondContact O-CB 3.43Å; E26-Y30 PolarHBondContact O-N 3.34Å; Y30-H34 VanDerWaalsContact CB-CD2 3.45Å; Y30-H34 WeakPolarHBondContact CB-CD2 3.33Å; Y30-H34 AromaticContact CD1-CE1 3.87Å; Y30-H34 AromaticContact CD1-NE2 3.9Å; Y30-H34 PolarHBondContact O-CD2 3.3Å; Y30-H34 PolarHBondContact O-NE2 2.75Å; Y30-E78 PolarHBondContact OH-OE1 3.29Å
31	G	65.7	Low	58.2	Low	31 Å²	31	106.3 Å²	106.3	32%	0.32	51%	0.512	S	S	.	.			trans	69.7	168.5	-174	0	0	0	0	0	112.4	E27 D33	E27-G31 WeakPolarHBondContact O-CA 3.22Å; E27-G31 PolarHBondContact O-N 3.07Å; G31-D33 PolarHBondContact O-N 3.46Å
32	K	59.8	Low	57.5	Low	152 Å²	152	108 Å²	108	66%	0.661	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-60.5	-18	-179.9	-72.4	178.6	178.7	175.9	0	113.8	E27 H34 R35	E27-K32 HydrophobicContact CG-CG 4.22Å; E27-K32 WeakPolarHBondContact OE1-CE 3.41Å; E27-K32 WeakPolarHBondContact OE1-CG 3.42Å; E27-K32 IonicContact OE1-NZ 3.81Å; K32-H34 VanDerWaalsContact C-N 3.28Å; K32-H34 PolarHBondContact O-N 3Å; K32-R35 PolarHBondContact O-N 3Å
33	D	53.1	Low	56.2	Low	105 Å²	105	115.6 Å²	115.6	56%	0.561	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-67.1	-22.7	-171	-71	-37.7	0	0	0	114.4	G31 R35 R36	G31-D33 PolarHBondContact O-N 3.46Å; D33-R35 VanDerWaalsContact C-N 3.26Å; D33-R35 PolarHBondContact O-N 3.45Å; D33-R36 PolarHBondContact O-N 3.07Å
34	H	51.1	Low	55.1	Low	127 Å²	127	122.3 Å²	122.3	59%	0.588	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-68.4	-25.6	178.3	-75.8	-109.6	0	0	0	112.8	Y30 K32 R36	Y30-H34 VanDerWaalsContact CB-CD2 3.45Å; Y30-H34 WeakPolarHBondContact CB-CD2 3.33Å; Y30-H34 AromaticContact CD1-CE1 3.87Å; Y30-H34 AromaticContact CD1-NE2 3.9Å; Y30-H34 PolarHBondContact O-CD2 3.3Å; Y30-H34 PolarHBondContact O-NE2 2.75Å; K32-H34 VanDerWaalsContact C-N 3.28Å; K32-H34 PolarHBondContact O-N 3Å; H34-R36 VanDerWaalsContact C-N 3.27Å; H34-R36 PolarHBondContact O-N 2.83Å
35	R	49.9	Very low	53.5	Low	173 Å²	173	122.5 Å²	122.5	65%	0.653	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-69.9	-21.3	177.2	-66.9	-171.1	-178.4	172.1	3.9	113.3	S23 K32 D33 R37	S23-R35 PolarHBondContact OG-NH2 2.91Å; K32-R35 PolarHBondContact O-N 3Å; D33-R35 VanDerWaalsContact C-N 3.26Å; D33-R35 PolarHBondContact O-N 3.45Å; R35-R37 VanDerWaalsContact C-N 3.25Å; R35-R37 PolarHBondContact O-N 3.37Å
36	R	48.5	Very low	52.3	Low	200 Å²	200	127.8 Å²	127.8	76%	0.755	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-74.8	-7.2	-176	-73	-173.9	173.9	-177.2	-1.1	114.6	D33 H34	D33-R36 PolarHBondContact O-N 3.07Å; H34-R36 VanDerWaalsContact C-N 3.27Å; H34-R36 PolarHBondContact O-N 2.83Å
37	R	48.5	Very low	50.9	Low	217 Å²	217	128.3 Å²	128.3	82%	0.819	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-84.6	-5.3	-175.5	-131	176.6	-174.2	-175	-1.6	114.9	R35	R35-R37 VanDerWaalsContact C-N 3.25Å; R35-R37 PolarHBondContact O-N 3.37Å
38	G	44.2	Very low	49.5	Very low	70 Å²	70	136.5 Å²	136.5	72%	0.722	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-107.2	3.7	-175.3	0	0	0	0	0	117.1
39	S	42.7	Very low	48.4	Very low	109 Å²	109	134.3 Å²	134.3	76%	0.762	69%	0.687	S	S	*	*			trans	-138.5	82.9	177.2	-78.3	0	0	0	0	110.7
40	R	41.3	Very low	47.4	Very low	244 Å²	244	140.2 Å²	140.2	92%	0.921	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-81.3	118.1	153.1	-90.6	-177.5	156.5	-178.9	-6	106.6	S42	R40-S42 PolarHBondContact O-N 3.34Å
41	P	41.8	Very low	46.1	Very low	119 Å²	119	145.8 Å²	145.8	77%	0.773	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-67.6	124.9	169.6	27.4	-29.2	0	0	0	107.9	K43	P41-K43 PolarHBondContact O-N 3.34Å
42	S	46.6	Very low	45.3	Very low	106 Å²	106	148.8 Å²	148.8	74%	0.741	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-61.9	117.8	166.4	52.6	0	0	0	0	107.8	R40 H44	R40-S42 PolarHBondContact O-N 3.34Å; S42-H44 PolarHBondContact O-N 3.34Å
43	K	36.6	Very low	44.5	Very low	207 Å²	207	147.4 Å²	147.4	90%	0.9	78%	0.778	S	S	*	*			trans	-71.2	99.1	168.1	-87	-178.9	173.8	179.7	0	107.6	P41	P41-K43 PolarHBondContact O-N 3.34Å
44	H	42.4	Very low	44.4	Very low	168 Å²	168	148 Å²	148	78%	0.778	79%	0.79	S	S	*	*			trans	-119.4	121.4	160.3	-89.7	-4	0	0	0	109.1	S42	S42-H44 PolarHBondContact O-N 3.34Å
45	S	36.4	Very low	43.8	Very low	113 Å²	113	146 Å²	146	79%	0.79	80%	0.803	S	S	*	*			trans	24.8	117.2	152.6	60.9	0	0	0	0	118.5
46	S	43.8	Very low	43.5	Very low	124 Å²	124	147.4 Å²	147.4	87%	0.867	81%	0.814	S	S	*	*				-165.9	127.5	122.2	38	0	0	0	0	109.8
47	S	40.8	Very low	43.3	Very low	117 Å²	117	141.6 Å²	141.6	82%	0.818	82%	0.816	S	S	*	*			trans	-65.5	129	170.9	40.2	0	0	0	0	111.1
48	R	40.9	Very low	43.3	Very low	238 Å²	238	140.3 Å²	140.3	90%	0.898	82%	0.82	S	S	*	*			trans	-179.5	145.3	134.1	-129.1	162.2	165.3	166.7	-4.9	113.6
49	S	47.5	Very low	43.6	Very low	99 Å²	99	146.2 Å²	146.2	69%	0.692	83%	0.826	S	S	*	*			trans	63.9	103.6	154.6	57.5	0	0	0	0	118.2
50	V	44.4	Very low	44	Very low	134 Å²	134	146.6 Å²	146.6	81%	0.812	82%	0.823	S	S	*	*				67.9	96.1	85.2	177.7	0	0	0	0	113
51	K	42.9	Very low	44.8	Very low	208 Å²	208	142.9 Å²	142.9	90%	0.904	82%	0.821	S	S	*	*				179.1	151.9	117.9	-111.7	168	179.9	177.8	0	112.1
52	A	48.2	Very low	45.5	Very low	94 Å²	94	142.5 Å²	142.5	78%	0.777	82%	0.816	S	S	*	*			trans	-70	170.6	-161.8	0	0	0	0	0	115.9
53	P	43.8	Very low	46.3	Very low	124 Å²	124	146.3 Å²	146.3	81%	0.805	82%	0.823	S	S	*	*			trans	-100.7	153.6	-155.4	38.7	-31.2	0	0	0	113.4
54	S	49.5	Very low	47.5	Very low	118 Å²	118	147.5 Å²	147.5	83%	0.825	82%	0.821	S	S	*	*			trans	-158.6	122.1	158.1	61.9	0	0	0	0	110
55	G	38.4	Very low	48.6	Very low	83 Å²	83	148.8 Å²	148.8	86%	0.856	83%	0.825	S	S	*	*			trans	-61.4	129.7	-169.7	0	0	0	0	0	114.6
56	K	44.8	Very low	50.5	Low	204 Å²	204	152.3 Å²	152.3	89%	0.887	82%	0.821	S	S	*	*			trans	-137.2	123.6	149.8	-74.9	-174.6	178.2	174.3	0	106.5	Q58	K56-Q58 PolarHBondContact O-N 3.28Å
57	G	43.1	Very low	52.2	Low	77 Å²	77	157.9 Å²	157.9	79%	0.794	82%	0.823	S	S	*	*			trans	-42.1	125.6	-165.2	0	0	0	0	0	113.8	K59	G57-K59 PolarHBondContact O-N 3.25Å
58	Q	50.1	Low	54.3	Low	190 Å²	190	163.8 Å²	163.8	89%	0.888	83%	0.827	S	S	*	*			trans	-60.3	96	160.3	-75.4	176.1	-9.2	0	0	106.5	K56 T60	K56-Q58 PolarHBondContact O-N 3.28Å; Q58-T60 PolarHBondContact O-N 3.35Å
59	K	49.2	Very low	56.5	Low	195 Å²	195	158.1 Å²	158.1	85%	0.848	81%	0.807	S	S	*	*			trans	-55.5	102.1	156.6	-80.3	-178.7	177.4	177.7	0	104.3	G57 L61	G57-K59 PolarHBondContact O-N 3.25Å; K59-L61 VanDerWaalsContact C-N 3.31Å; K59-L61 PolarHBondContact O-N 3.04Å
60	T	51.2	Low	58.5	Low	117 Å²	117	163.3 Å²	163.3	72%	0.718	81%	0.811	S	S	*	*			trans	-50	108.8	165.9	46.1	0	0	0	0	104.6	Q58 T62	Q58-T60 PolarHBondContact O-N 3.35Å; T60-T62 PolarHBondContact O-N 3.26Å
61	L	58.1	Low	60.7	Low	165 Å²	165	163.3 Å²	163.3	86%	0.864	81%	0.814	S	S	*	*			trans	-61.5	87.8	168.6	-81.8	152.5	0	0	0	103.6	K59 E63	K59-L61 VanDerWaalsContact C-N 3.31Å; K59-L61 PolarHBondContact O-N 3.04Å; L61-E63 VanDerWaalsContact C-N 3.26Å; L61-E63 PolarHBondContact O-N 3.25Å
62	T	57.5	Low	63.1	Low	111 Å²	111	155.4 Å²	155.4	68%	0.681	79%	0.792	S	S	*	*			trans	-54.5	105.9	165.5	44.8	0	0	0	0	103.5	T60 R64	T60-T62 PolarHBondContact O-N 3.26Å; T62-R64 PolarHBondContact O-N 3.49Å
63	E	62.4	Low	65.2	Low	187 Å²	187	153.8 Å²	153.8	87%	0.874	77%	0.772	S	S	*	*			trans	-56.7	99	175.5	-76.5	-170.5	158.1	0	0	104.9	L61 K65	L61-E63 VanDerWaalsContact C-N 3.26Å; L61-E63 PolarHBondContact O-N 3.25Å; E63-K65 PolarHBondContact O-N 2.98Å
64	R	61.4	Low	67.4	Low	231 Å²	231	150.3 Å²	150.3	87%	0.872	75%	0.746	S	S	*	*			trans	-56.1	107.3	-179.3	-76.2	-177.2	173.2	-175.7	-2.3	105.1	T62 R66	T62-R64 PolarHBondContact O-N 3.49Å; R64-R66 PolarHBondContact O-N 3.06Å
65	K	66.5	Low	69.5	Low	196 Å²	196	146.9 Å²	146.9	85%	0.852	73%	0.725	S	S	*	*			trans	-47.5	114.1	-179.8	-174	173.7	-176.7	175.2	0	106.6	E63 R67	E63-K65 PolarHBondContact O-N 2.98Å; K65-R67 PolarHBondContact O-N 2.98Å
66	R	76.3	Confident	72.2	Confident	186 Å²	186	147.3 Å²	147.3	70%	0.702	71%	0.707	S	S	*	*			trans	-56.5	112.2	-175.9	-70.5	-174.6	179.5	-159.7	-1.1	107.1	R64 R68	R64-R66 PolarHBondContact O-N 3.06Å; R66-R68 PolarHBondContact O-N 2.98Å
67	R	79.5	Confident	74.4	Confident	242 Å²	242	142.4 Å²	142.4	91%	0.913	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-67.1	120.9	-178.5	-70.7	-176.1	175.7	-178.1	-2	107.7	K65	K65-R67 PolarHBondContact O-N 2.98Å
68	R	85.2	Confident	76.8	Confident	241 Å²	241	141 Å²	141	91%	0.909	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-82.1	130.3	172.6	-168.9	178.5	179.8	177.6	0.2	108.2	R66	R66-R68 PolarHBondContact O-N 2.98Å
69	Y	85.6	Confident	78.8	Confident	119 Å²	119	136 Å²	136	47%	0.467	63%	0.634	S	S	.	*	P	Polyproline II helix	trans	-64.8	147.5	170.4	-67.6	-75.6	0	0	0	110.3	T73 L74	Y69-T73 HydrophobicContact CD1-CG2 4.09Å; Y69-L74 HydrophobicContact CD2-CD1 3.9Å; Y69-L74 HydrophobicContact CD2-CD2 3.57Å; Y69-L74 HydrophobicContact CD2-CG 3.81Å; Y69-L74 HydrophobicContact CE2-CD2 3.85Å; Y69-L74 HydrophobicContact CG-CD1 4.44Å; Y69-L74 HydrophobicContact CG-CD2 3.94Å; Y69-L74 HydrophobicContact CG-CG 3.98Å
70	R	90.4	Very high	81	Confident	208 Å²	208	134.3 Å²	134.3	79%	0.785	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-62.7	145.6	171.8	-68.9	-175	173.1	-166.1	-2	109.4	G72 T73	R70-G72 PolarHBondContact O-N 3.33Å; R70-T73 VanDerWaalsContact O-CB 3.27Å; R70-T73 WeakPolarHBondContact O-CB 3.44Å; R70-T73 PolarHBondContact O-N 3.45Å; R70-T73 PolarHBondContact O-OG1 2.94Å
71	P	91	Very high	83	Confident	133 Å²	133	130.4 Å²	130.4	86%	0.864	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.4	141.7	174.3	24.5	-33.7	0	0	0	109.9	T73	P71-T73 VanDerWaalsContact C-N 3.26Å; P71-T73 PolarHBondContact O-N 2.89Å
72	G	92.4	Very high	84.6	Confident	43 Å²	43	126.3 Å²	126.3	44%	0.443	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	82.4	-23.1	-174.2	0	0	0	0	0	115.6	R70 A75 L76	R70-G72 PolarHBondContact O-N 3.33Å; G72-A75 PolarHBondContact O-N 3.48Å; G72-L76 WeakPolarHBondContact O-CG 3.22Å; G72-L76 PolarHBondContact O-N 3.17Å
73	T	92.7	Very high	86.4	Confident	60 Å²	60	128.1 Å²	128.1	37%	0.368	57%	0.573	S	S	.	*	H	α-helix	trans	-65.5	-44.4	-178.8	-59.1	0	0	0	0	112.4	Y69 R70 P71 R77	Y69-T73 HydrophobicContact CD1-CG2 4.09Å; R70-T73 VanDerWaalsContact O-CB 3.27Å; R70-T73 WeakPolarHBondContact O-CB 3.44Å; R70-T73 PolarHBondContact O-N 3.45Å; R70-T73 PolarHBondContact O-OG1 2.94Å; P71-T73 VanDerWaalsContact C-N 3.26Å; P71-T73 PolarHBondContact O-N 2.89Å; T73-R77 PolarHBondContact O-N 3.24Å
74	L	90.9	Very high	87.9	Confident	50 Å²	50	128 Å²	128	26%	0.262	57%	0.57	S	S	.	*	H	α-helix	trans	-69.4	-41.8	175.8	-71.1	179.2	0	0	0	111.4	Y69 L76 R77 E78	Y69-L74 HydrophobicContact CD2-CD1 3.9Å; Y69-L74 HydrophobicContact CD2-CD2 3.57Å; Y69-L74 HydrophobicContact CD2-CG 3.81Å; Y69-L74 HydrophobicContact CE2-CD2 3.85Å; Y69-L74 HydrophobicContact CG-CD1 4.44Å; Y69-L74 HydrophobicContact CG-CD2 3.94Å; Y69-L74 HydrophobicContact CG-CG 3.98Å; L74-L76 PolarHBondContact O-N 3.31Å; L74-R77 WeakPolarHBondContact O-CA 3.48Å; L74-R77 WeakPolarHBondContact O-CB 3.38Å; L74-R77 PolarHBondContact O-N 3.44Å; L74-E78 WeakPolarHBondContact O-CG 3.44Å; L74-E78 PolarHBondContact O-N 3.4Å
75	A	93	Very high	89.2	Confident	47 Å²	47	118.4 Å²	118.4	39%	0.388	54%	0.543	S	S	.	.	H	α-helix	trans	-57.8	-45.5	177.9	0	0	0	0	0	112.2	G72 R77 E78 I79	G72-A75 PolarHBondContact O-N 3.48Å; A75-R77 VanDerWaalsContact C-N 3.3Å; A75-R77 PolarHBondContact O-N 2.94Å; A75-E78 PolarHBondContact O-N 2.83Å; A75-I79 WeakPolarHBondContact O-CD1 3.49Å; A75-I79 VanDerWaalsContact O-CG1 3.24Å; A75-I79 WeakPolarHBondContact O-CG1 3.43Å; A75-I79 PolarHBondContact O-N 3.41Å
76	L	94.1	Very high	90.5	Very high	91 Å²	91	116.1 Å²	116.1	48%	0.476	55%	0.545	S	S	.	.	H	α-helix	trans	-65.2	-32.8	176.1	-71.1	174.5	0	0	0	112.9	G72 L74 R80	G72-L76 WeakPolarHBondContact O-CG 3.22Å; G72-L76 PolarHBondContact O-N 3.17Å; L74-L76 PolarHBondContact O-N 3.31Å; L76-R80 WeakPolarHBondContact O-CB 3.42Å; L76-R80 WeakPolarHBondContact O-CD 2.95Å; L76-R80 VanDerWaalsContact O-CG 3.23Å; L76-R80 WeakPolarHBondContact O-CG 3.42Å; L76-R80 PolarHBondContact O-N 3.29Å
77	R	92.4	Very high	91.2	Very high	102 Å²	102	109.6 Å²	109.6	39%	0.385	52%	0.523	S	S	.	.	H	α-helix	trans	-68.4	-44.3	174.5	-177.1	-174.8	-68	-173.2	-4.4	111	L29 T73 L74 A75 R80 L81	L29-R77 HydrophobicContact CD2-CG 4.09Å; T73-R77 PolarHBondContact O-N 3.24Å; L74-R77 WeakPolarHBondContact O-CA 3.48Å; L74-R77 WeakPolarHBondContact O-CB 3.38Å; L74-R77 PolarHBondContact O-N 3.44Å; A75-R77 VanDerWaalsContact C-N 3.3Å; A75-R77 PolarHBondContact O-N 2.94Å; R77-R80 PolarHBondContact O-N 3.22Å; R77-L81 WeakPolarHBondContact O-CB 3.17Å; R77-L81 PolarHBondContact O-N 3.17Å
78	E	92.2	Very high	91.9	Very high	48 Å²	48	100 Å²	100	22%	0.224	49%	0.489	C	S	.	.	H	α-helix	trans	-59.8	-50.3	176.4	-73	168	-166.9	0	0	110.9	L29 Y30 L74 A75 R80 L81 F82	L29-E78 HydrophobicContact CD1-CG 3.9Å; L29-E78 HydrophobicContact CD2-CB 4.41Å; L29-E78 HydrophobicContact CD2-CG 3.75Å; L29-E78 HydrophobicContact CG-CG 4.38Å; Y30-E78 PolarHBondContact OH-OE1 3.29Å; L74-E78 WeakPolarHBondContact O-CG 3.44Å; L74-E78 PolarHBondContact O-N 3.4Å; A75-E78 PolarHBondContact O-N 2.83Å; E78-R80 PolarHBondContact O-N 2.97Å; E78-L81 PolarHBondContact O-N 2.93Å; E78-L81 VanDerWaalsContact O-N 3.08Å; E78-F82 HydrophobicContact CB-CD2 4.22Å; E78-F82 HydrophobicContact CB-CE2 3.92Å; E78-F82 HydrophobicContact CG-CE2 4.39Å; E78-F82 WeakPolarHBondContact O-CD2 3.32Å; E78-F82 WeakPolarHBondContact O-CG 3.38Å; E78-F82 PolarHBondContact O-N 2.95Å
79	I	93.9	Very high	92.2	Very high	83 Å²	83	92.7 Å²	92.7	43%	0.426	47%	0.468	S	S	.	.	H	α-helix	trans	-54.7	-50.7	176.9	-68.2	163.4	0	0	0	110.9	A75 L81 F82 Q83	A75-I79 WeakPolarHBondContact O-CD1 3.49Å; A75-I79 VanDerWaalsContact O-CG1 3.24Å; A75-I79 WeakPolarHBondContact O-CG1 3.43Å; A75-I79 PolarHBondContact O-N 3.41Å; I79-L81 VanDerWaalsContact C-N 3.27Å; I79-L81 PolarHBondContact O-N 3.41Å; I79-F82 PolarHBondContact O-N 3.31Å; I79-Q83 HydrophobicContact CG2-CG 4.34Å; I79-Q83 WeakPolarHBondContact O-CB 3.09Å; I79-Q83 VanDerWaalsContact O-CG 3.26Å; I79-Q83 WeakPolarHBondContact O-CG 3.28Å; I79-Q83 PolarHBondContact O-N 3.33Å
80	R	94.2	Very high	92.6	Very high	161 Å²	161	90.5 Å²	90.5	61%	0.608	46%	0.464	S	S	*	.	H	α-helix	trans	-64.6	-30.5	179.6	-70.8	170.4	-172.9	168.7	2.6	113.2	L76 R77 E78 K84	L76-R80 WeakPolarHBondContact O-CB 3.42Å; L76-R80 WeakPolarHBondContact O-CD 2.95Å; L76-R80 VanDerWaalsContact O-CG 3.23Å; L76-R80 WeakPolarHBondContact O-CG 3.42Å; L76-R80 PolarHBondContact O-N 3.29Å; R77-R80 PolarHBondContact O-N 3.22Å; E78-R80 PolarHBondContact O-N 2.97Å; R80-K84 WeakPolarHBondContact O-CD 3.49Å; R80-K84 VanDerWaalsContact O-CG 3.26Å; R80-K84 WeakPolarHBondContact O-CG 3.46Å
81	L	92.4	Very high	92.8	Very high	34 Å²	34	89.8 Å²	89.8	18%	0.178	46%	0.461	C	S	.	.	H	α-helix	trans	-72.6	-51.9	177.2	179.7	66.8	0	0	0	110.2	L25 K28 L29 R77 E78 I79 Q83 K84 G85	L25-L81 HydrophobicContact CB-CD2 4.27Å; L25-L81 HydrophobicContact CD2-CD1 3.99Å; L25-L81 HydrophobicContact CD2-CD2 3.78Å; L25-L81 HydrophobicContact CD2-CG 3.92Å; K28-L81 HydrophobicContact CB-CD2 4.46Å; K28-L81 HydrophobicContact CD-CD1 4.29Å; L29-L81 HydrophobicContact CD1-CD2 3.79Å; L29-L81 HydrophobicContact CD2-CB 4.1Å; L29-L81 HydrophobicContact CD2-CD2 3.41Å; L29-L81 VanDerWaalsContact CD2-CD2 3.41Å; L29-L81 HydrophobicContact CD2-CG 4.4Å; L29-L81 HydrophobicContact CG-CD2 3.35Å; R77-L81 WeakPolarHBondContact O-CB 3.17Å; R77-L81 PolarHBondContact O-N 3.17Å; E78-L81 PolarHBondContact O-N 2.93Å; E78-L81 VanDerWaalsContact O-N 3.08Å; I79-L81 VanDerWaalsContact C-N 3.27Å; I79-L81 PolarHBondContact O-N 3.41Å; L81-Q83 VanDerWaalsContact C-N 3.34Å; L81-Q83 PolarHBondContact O-N 3.17Å; L81-K84 PolarHBondContact O-N 3.13Å; L81-G85 PolarHBondContact O-N 3Å
82	F	93.3	Very high	92.8	Very high	80 Å²	80	86.9 Å²	86.9	35%	0.351	43%	0.433	S	S	.	.	H	α-helix	trans	-68.4	-31.6	-176.1	-63.7	-53.4	0	0	0	112.8	L25 L29 E78 I79 K84 G85 L89	L25-F82 HydrophobicContact CD1-CD1 4.28Å; L25-F82 HydrophobicContact CD1-CE1 3.87Å; L29-F82 HydrophobicContact CD1-CE2 4.34Å; L29-F82 HydrophobicContact CD1-CZ 3.89Å; E78-F82 HydrophobicContact CB-CD2 4.22Å; E78-F82 HydrophobicContact CB-CE2 3.92Å; E78-F82 HydrophobicContact CG-CE2 4.39Å; E78-F82 WeakPolarHBondContact O-CD2 3.32Å; E78-F82 WeakPolarHBondContact O-CG 3.38Å; E78-F82 PolarHBondContact O-N 2.95Å; I79-F82 PolarHBondContact O-N 3.31Å; F82-K84 VanDerWaalsContact C-N 3.31Å; F82-K84 PolarHBondContact O-N 3.14Å; F82-G85 PolarHBondContact O-N 3.18Å; F82-L89 HydrophobicContact CD1-CD1 4.44Å; F82-L89 HydrophobicContact CD1-CD2 3.64Å; F82-L89 HydrophobicContact CE1-CD2 3.77Å
83	Q	94.2	Very high	92.9	Very high	149 Å²	149	87.3 Å²	87.3	70%	0.696	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-24.2	173.6	-74.5	179.1	-23.6	0	0	113.9	I79 L81	I79-Q83 HydrophobicContact CG2-CG 4.34Å; I79-Q83 WeakPolarHBondContact O-CB 3.09Å; I79-Q83 VanDerWaalsContact O-CG 3.26Å; I79-Q83 WeakPolarHBondContact O-CG 3.28Å; I79-Q83 PolarHBondContact O-N 3.33Å; L81-Q83 VanDerWaalsContact C-N 3.34Å; L81-Q83 PolarHBondContact O-N 3.17Å
84	K	93.7	Very high	93.1	Very high	185 Å²	185	87.7 Å²	87.7	80%	0.804	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-23.4	176.4	-75.1	179.2	-179.6	-168.4	0	112.8	R80 L81 F82	R80-K84 WeakPolarHBondContact O-CD 3.49Å; R80-K84 VanDerWaalsContact O-CG 3.26Å; R80-K84 WeakPolarHBondContact O-CG 3.46Å; L81-K84 PolarHBondContact O-N 3.13Å; F82-K84 VanDerWaalsContact C-N 3.31Å; F82-K84 PolarHBondContact O-N 3.14Å
85	G	90.4	Very high	93.4	Very high	29 Å²	29	86.9 Å²	86.9	30%	0.299	43%	0.43	S	S	.	.			trans	-94.7	170.2	178.6	0	0	0	0	0	112.1	L81 F82	L81-G85 PolarHBondContact O-N 3Å; F82-G85 PolarHBondContact O-N 3.18Å
86	T	91.9	Very high	93.4	Very high	147 Å²	147	87.5 Å²	87.5	90%	0.902	43%	0.425	S	S	*	.			trans	-132.9	18.3	174.1	55.7	0	0	0	0	111.7
87	E	92.1	Very high	93.5	Very high	50 Å²	50	92.2 Å²	92.2	23%	0.234	44%	0.437	C	S	.	.			trans	-77.8	147.9	-178.9	69.7	-149.3	111.8	0	0	112.1	L25 L89	L25-E87 HydrophobicContact CD1-CG 3.65Å; L25-E87 WeakPolarHBondContact CD1-OE1 3.46Å; L25-E87 WeakPolarHBondContact CD1-OE2 3.15Å; L25-E87 WeakPolarHBondContact CD2-OE1 3.39Å; L25-E87 VanDerWaalsContact CG-CD 3.42Å; L25-E87 WeakPolarHBondContact CG-OE1 3.14Å; L25-E87 WeakPolarHBondContact CG-OE2 3.36Å; E87-L89 HydrophobicContact CG-CD2 4.42Å; E87-L89 PolarHBondContact O-N 3.26Å
88	L	93.2	Very high	93.7	Very high	39 Å²	39	91.1 Å²	91.1	20%	0.204	44%	0.441	C	S	.	.			trans	-68.4	127	177.3	-61.2	175	0	0	0	110.2	Q122 E126	L88-Q122 HydrophobicContact CD1-CB 4.47Å; L88-Q122 HydrophobicContact CD1-CG 4.13Å; L88-Q122 HydrophobicContact CD2-CG 4.45Å; L88-E126 VanDerWaalsContact CA-OE2 3.28Å; L88-E126 WeakPolarHBondContact CA-OE2 3.09Å
89	L	93.3	Very high	93.8	Very high	89 Å²	89	89.8 Å²	89.8	47%	0.466	44%	0.436	S	S	.	.			trans	-90	-27.3	-174.4	-57.7	-177.9	0	0	0	112.2	F82 E87 E126	F82-L89 HydrophobicContact CD1-CD1 4.44Å; F82-L89 HydrophobicContact CD1-CD2 3.64Å; F82-L89 HydrophobicContact CE1-CD2 3.77Å; E87-L89 HydrophobicContact CG-CD2 4.42Å; E87-L89 PolarHBondContact O-N 3.26Å; L89-E126 PolarHBondContact N-OE1 3.3Å; L89-E126 PolarHBondContact N-OE2 3.17Å
90	L	93.5	Very high	93.8	Very high	72 Å²	72	91.2 Å²	91.2	38%	0.377	44%	0.436	S	S	.	.	S	Bend	trans	-77.5	138.8	177.9	-59.9	176.2	0	0	0	110.8	R92 F95 Q122 E126	L90-R92 PolarHBondContact O-N 3.24Å; L90-F95 HydrophobicContact CD1-CD2 4.01Å; L90-F95 HydrophobicContact CD1-CE2 4.43Å; L90-Q122 PolarHBondContact O-NE2 3.33Å; L90-E126 VanDerWaalsContact CB-OE1 3.24Å; L90-E126 WeakPolarHBondContact CB-OE1 3.4Å; L90-E126 HydrophobicContact CD1-CG 3.73Å; L90-E126 HydrophobicContact CG-CG 3.9Å; L90-E126 WeakPolarHBondContact CG-OE1 3.5Å; L90-E126 PolarHBondContact N-OE1 2.92Å
91	R	94.1	Very high	93.8	Very high	193 Å²	193	86.5 Å²	86.5	73%	0.728	42%	0.423	S	S	*	.			trans	-65.2	123.9	174	-66.6	-177.5	179.8	-172.9	0.1	109.3	A93 P94 F95	R91-A93 PolarHBondContact O-N 3.45Å; R91-P94 HydrophobicContact CB-CG 3.93Å; R91-P94 WeakPolarHBondContact O-CD 3.26Å; R91-F95 PolarHBondContact O-N 3.49Å
92	R	91.9	Very high	93.9	Very high	72 Å²	72	89 Å²	89	27%	0.272	44%	0.436	S	S	.	.	H	α-helix	trans	-53.6	-46.2	-177.5	-62.9	-179	177.4	-143.3	-5.6	113.1	S18 L90 F95 Q96 E119	S18-R92 PolarHBondContact OG-NE 3.03Å; L90-R92 PolarHBondContact O-N 3.24Å; R92-F95 PolarHBondContact O-N 2.81Å; R92-Q96 WeakPolarHBondContact O-CB 3.26Å; R92-Q96 WeakPolarHBondContact O-CG 3.24Å; R92-Q96 PolarHBondContact O-N 3.1Å; R92-E119 IonicContact CZ-OE1 3.31Å; R92-E119 IonicContact NH1-OE1 2.75Å; R92-E119 PolarHBondContact NH1-OE1 3.37Å; R92-E119 IonicContact NH2-OE1 3.77Å
93	A	93.9	Very high	93.9	Very high	52 Å²	52	85.7 Å²	85.7	43%	0.43	42%	0.424	S	S	.	.	H	α-helix	trans	-66	-50.5	-174.9	0	0	0	0	0	113.8	R91 F95 Q96 R97	R91-A93 PolarHBondContact O-N 3.45Å; A93-F95 PolarHBondContact O-N 3.28Å; A93-Q96 PolarHBondContact O-N 3.17Å; A93-R97 WeakPolarHBondContact O-CG 3.49Å; A93-R97 PolarHBondContact O-N 2.77Å; A93-R97 VanDerWaalsContact O-N 3.17Å
94	P	96.6	Very high	93.8	Very high	69 Å²	69	84 Å²	84	45%	0.448	42%	0.415	S	S	.	.	H	α-helix	trans	-57	-44.2	171.1	-27.9	35	0	0	0	113.7	R91 Q96 R97 V98	R91-P94 HydrophobicContact CB-CG 3.93Å; R91-P94 WeakPolarHBondContact O-CD 3.26Å; P94-Q96 VanDerWaalsContact C-N 3.34Å; P94-Q96 PolarHBondContact O-N 3.4Å; P94-R97 WeakPolarHBondContact O-CB 3.34Å; P94-R97 PolarHBondContact O-N 3.41Å; P94-R97 VanDerWaalsContact O-N 3.13Å; P94-V98 PolarHBondContact O-N 3.4Å
95	F	96.6	Very high	93.8	Very high	32 Å²	32	84.3 Å²	84.3	14%	0.14	41%	0.412	C	S	.	.	H	α-helix	trans	-59.5	-45.5	178.9	-177.5	-96.2	0	0	0	111.6	L90 R91 R92 A93 R97 V98 V99 L121 Q122 A125	L90-F95 HydrophobicContact CD1-CD2 4.01Å; L90-F95 HydrophobicContact CD1-CE2 4.43Å; R91-F95 PolarHBondContact O-N 3.49Å; R92-F95 PolarHBondContact O-N 2.81Å; A93-F95 PolarHBondContact O-N 3.28Å; F95-R97 VanDerWaalsContact C-N 3.3Å; F95-R97 PolarHBondContact O-N 3.46Å; F95-V98 PolarHBondContact O-N 3Å; F95-V99 HydrophobicContact CD1-CG2 3.99Å; F95-V99 HydrophobicContact CE1-CG2 3.53Å; F95-V99 HydrophobicContact CZ-CG2 3.84Å; F95-V99 WeakPolarHBondContact O-CG2 3.31Å; F95-V99 PolarHBondContact O-N 3.32Å; F95-L121 HydrophobicContact CE1-CB 4.26Å; F95-L121 HydrophobicContact CZ-CB 4.43Å; F95-Q122 HydrophobicContact CD1-CB 3.75Å; F95-Q122 HydrophobicContact CD1-CG 3.94Å; F95-Q122 HydrophobicContact CD2-CG 4.46Å; F95-Q122 HydrophobicContact CE1-CB 3.47Å; F95-Q122 VanDerWaalsContact CE1-CB 3.47Å; F95-Q122 HydrophobicContact CE1-CG 4.04Å; F95-Q122 HydrophobicContact CG-CB 4.46Å; F95-Q122 HydrophobicContact CG-CG 4.18Å; F95-Q122 VanDerWaalsContact CZ-CA 3.42Å; F95-Q122 HydrophobicContact CZ-CB 3.98Å; F95-Q122 HydrophobicContact CZ-CG 4.35Å; F95-A125 HydrophobicContact CE2-CB 3.87Å; F95-A125 HydrophobicContact CZ-CB 3.96Å
96	Q	94.6	Very high	94	Very high	61 Å²	61	88.9 Å²	88.9	29%	0.285	43%	0.429	S	S	.	.	H	α-helix	trans	-61.2	-35	176.5	-73	175.3	-6.9	0	0	113.3	R92 A93 P94 R100 L118	R92-Q96 WeakPolarHBondContact O-CB 3.26Å; R92-Q96 WeakPolarHBondContact O-CG 3.24Å; R92-Q96 PolarHBondContact O-N 3.1Å; A93-Q96 PolarHBondContact O-N 3.17Å; P94-Q96 VanDerWaalsContact C-N 3.34Å; P94-Q96 PolarHBondContact O-N 3.4Å; Q96-R100 WeakPolarHBondContact O-CG 3.45Å; Q96-R100 PolarHBondContact O-N 3.41Å; Q96-R100 VanDerWaalsContact O-N 3.14Å; Q96-L118 HydrophobicContact CG-CB 4.41Å; Q96-L118 HydrophobicContact CG-CD1 4.01Å; Q96-L118 HydrophobicContact CG-CD2 4.41Å
97	R	95.1	Very high	93.6	Very high	189 Å²	189	84.8 Å²	84.8	71%	0.713	42%	0.416	S	S	*	.	H	α-helix	trans	-64.6	-43.8	175.3	-67.5	178.1	-157.7	-86.1	2.4	111.1	A93 P94 F95 R100 D101	A93-R97 WeakPolarHBondContact O-CG 3.49Å; A93-R97 PolarHBondContact O-N 2.77Å; A93-R97 VanDerWaalsContact O-N 3.17Å; P94-R97 WeakPolarHBondContact O-CB 3.34Å; P94-R97 PolarHBondContact O-N 3.41Å; P94-R97 VanDerWaalsContact O-N 3.13Å; F95-R97 VanDerWaalsContact C-N 3.3Å; F95-R97 PolarHBondContact O-N 3.46Å; R97-R100 PolarHBondContact O-N 3Å; R97-D101 PolarHBondContact O-N 3.3Å
98	V	96	Very high	93.2	Very high	80 Å²	80	88.6 Å²	88.6	49%	0.485	43%	0.431	S	S	.	.	H	α-helix	trans	-63.3	-44.6	177.6	175.7	0	0	0	0	111.3	P94 F95 R100 D101 I102	P94-V98 PolarHBondContact O-N 3.4Å; F95-V98 PolarHBondContact O-N 3Å; V98-R100 VanDerWaalsContact C-N 3.28Å; V98-R100 PolarHBondContact O-N 3.46Å; V98-D101 PolarHBondContact O-N 2.96Å; V98-I102 HydrophobicContact CG1-CD1 3.79Å; V98-I102 HydrophobicContact CG1-CG1 4.38Å; V98-I102 WeakPolarHBondContact O-CG1 3.34Å; V98-I102 PolarHBondContact O-N 2.92Å
99	V	94.8	Very high	92.4	Very high	19 Å²	19	93.7 Å²	93.7	12%	0.115	45%	0.454	C	S	.	.	H	α-helix	trans	-59	-40.8	177.3	172.6	0	0	0	0	111.6	F95 A103 F113 L118 L121	F95-V99 HydrophobicContact CD1-CG2 3.99Å; F95-V99 HydrophobicContact CE1-CG2 3.53Å; F95-V99 HydrophobicContact CZ-CG2 3.84Å; F95-V99 WeakPolarHBondContact O-CG2 3.31Å; F95-V99 PolarHBondContact O-N 3.32Å; V99-A103 WeakPolarHBondContact O-CB 3.46Å; V99-A103 PolarHBondContact O-N 2.93Å; V99-F113 HydrophobicContact CG1-CE1 3.98Å; V99-F113 HydrophobicContact CG1-CZ 3.97Å; V99-L118 HydrophobicContact CB-CD2 4.37Å; V99-L118 HydrophobicContact CG1-CD2 3.88Å; V99-L121 HydrophobicContact CG1-CD1 3.77Å
100	R	93.6	Very high	91.9	Very high	113 Å²	113	96.9 Å²	96.9	43%	0.426	47%	0.471	S	S	.	.	H	α-helix	trans	-70.2	-40.5	177.9	-70.1	176.6	-172.2	-76.5	0.4	112.6	Q96 R97 V98 A103 Q104 F113	Q96-R100 WeakPolarHBondContact O-CG 3.45Å; Q96-R100 PolarHBondContact O-N 3.41Å; Q96-R100 VanDerWaalsContact O-N 3.14Å; R97-R100 PolarHBondContact O-N 3Å; V98-R100 VanDerWaalsContact C-N 3.28Å; V98-R100 PolarHBondContact O-N 3.46Å; R100-A103 PolarHBondContact O-N 2.94Å; R100-Q104 WeakPolarHBondContact O-CB 3.45Å; R100-Q104 PolarHBondContact O-N 3.42Å; R100-F113 HydrophobicContact CG-CD2 4.4Å; R100-F113 HydrophobicContact CG-CE2 4.34Å
101	D	94.2	Very high	91.7	Very high	62 Å²	62	97.4 Å²	97.4	33%	0.332	47%	0.474	S	S	.	.	H	α-helix	trans	-59.8	-46.6	174.1	178.1	38.9	0	0	0	111.1	R97 V98 A103 Q104 R105	R97-D101 PolarHBondContact O-N 3.3Å; V98-D101 PolarHBondContact O-N 2.96Å; D101-A103 PolarHBondContact O-N 3.22Å; D101-Q104 WeakPolarHBondContact O-CB 3.31Å; D101-Q104 PolarHBondContact O-N 3.2Å; D101-R105 WeakPolarHBondContact O-CG 3.07Å; D101-R105 PolarHBondContact O-N 2.84Å; D101-R105 IonicContact OD1-CZ 3.89Å; D101-R105 IonicContact OD1-NE 3.48Å; D101-R105 PolarHBondContact OD1-NE 2.83Å; D101-R105 VanDerWaalsContact OD1-NE 3.07Å; D101-R105 IonicContact OD1-NH2 3.43Å; D101-R105 IonicContact OD2-CZ 3.07Å; D101-R105 VanDerWaalsContact OD2-CZ 3.27Å; D101-R105 IonicContact OD2-NE 2.8Å; D101-R105 PolarHBondContact OD2-NE 2.7Å; D101-R105 IonicContact OD2-NH2 3.53Å; D101-R105 PolarHBondContact OD2-NH2 3.49Å
102	I	94.8	Very high	91.5	Very high	87 Å²	87	99.5 Å²	99.5	45%	0.446	48%	0.482	S	S	.	.	H	α-helix	trans	-61.3	-44.9	175.7	-65.6	168.2	0	0	0	111.1	V98 Q104 R105 L106	V98-I102 HydrophobicContact CG1-CD1 3.79Å; V98-I102 HydrophobicContact CG1-CG1 4.38Å; V98-I102 WeakPolarHBondContact O-CG1 3.34Å; V98-I102 PolarHBondContact O-N 2.92Å; I102-Q104 VanDerWaalsContact C-N 3.29Å; I102-Q104 PolarHBondContact O-N 3.07Å; I102-R105 PolarHBondContact O-N 3.22Å; I102-L106 HydrophobicContact CG2-CD1 3.99Å; I102-L106 HydrophobicContact CG2-CG 4.41Å; I102-L106 VanDerWaalsContact O-CG 3.31Å; I102-L106 WeakPolarHBondContact O-CG 3.5Å; I102-L106 PolarHBondContact O-N 3.06Å
103	A	93.6	Very high	91.6	Very high	11 Å²	11	98.2 Å²	98.2	9%	0.091	48%	0.479	C	S	.	.	H	α-helix	trans	-61.6	-37.5	178.1	0	0	0	0	0	112.7	V99 R100 D101 L106 K108 F113	V99-A103 WeakPolarHBondContact O-CB 3.46Å; V99-A103 PolarHBondContact O-N 2.93Å; R100-A103 PolarHBondContact O-N 2.94Å; D101-A103 PolarHBondContact O-N 3.22Å; A103-L106 PolarHBondContact O-N 2.75Å; A103-K108 PolarHBondContact O-N 3.36Å; A103-K108 VanDerWaalsContact O-N 3.1Å; A103-F113 HydrophobicContact CB-CE2 4.02Å; A103-F113 HydrophobicContact CB-CZ 3.78Å
104	Q	93	Very high	91.6	Very high	113 Å²	113	103.9 Å²	103.9	53%	0.528	49%	0.494	S	S	.	.	H	α-helix	trans	-65.8	-44	174.9	-173.7	176.6	-1.2	0	0	111.6	R100 D101 I102 L106 G107 Q109	R100-Q104 WeakPolarHBondContact O-CB 3.45Å; R100-Q104 PolarHBondContact O-N 3.42Å; D101-Q104 WeakPolarHBondContact O-CB 3.31Å; D101-Q104 PolarHBondContact O-N 3.2Å; I102-Q104 VanDerWaalsContact C-N 3.29Å; I102-Q104 PolarHBondContact O-N 3.07Å; Q104-L106 VanDerWaalsContact C-N 3.26Å; Q104-L106 PolarHBondContact O-N 3.44Å; Q104-G107 PolarHBondContact O-N 2.96Å; Q104-Q109 HydrophobicContact CG-CG 4.34Å
105	R	93.4	Very high	91.4	Very high	192 Å²	192	108.7 Å²	108.7	73%	0.725	50%	0.503	S	S	*	.	H	α-helix	trans	-63.6	-29.7	175.9	-67.8	174.4	-167.6	-151.8	6.7	113.2	D101 I102 G107	D101-R105 WeakPolarHBondContact O-CG 3.07Å; D101-R105 PolarHBondContact O-N 2.84Å; D101-R105 IonicContact OD1-CZ 3.89Å; D101-R105 IonicContact OD1-NE 3.48Å; D101-R105 PolarHBondContact OD1-NE 2.83Å; D101-R105 VanDerWaalsContact OD1-NE 3.07Å; D101-R105 IonicContact OD1-NH2 3.43Å; D101-R105 IonicContact OD2-CZ 3.07Å; D101-R105 VanDerWaalsContact OD2-CZ 3.27Å; D101-R105 IonicContact OD2-NE 2.8Å; D101-R105 PolarHBondContact OD2-NE 2.7Å; D101-R105 IonicContact OD2-NH2 3.53Å; D101-R105 PolarHBondContact OD2-NH2 3.49Å; I102-R105 PolarHBondContact O-N 3.22Å; R105-G107 PolarHBondContact O-N 3.05Å
106	L	92.8	Very high	91.4	Very high	125 Å²	125	113.6 Å²	113.6	65%	0.654	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	8.2	173.9	-66.6	173.6	0	0	0	113.6	I102 A103 Q104	I102-L106 HydrophobicContact CG2-CD1 3.99Å; I102-L106 HydrophobicContact CG2-CG 4.41Å; I102-L106 VanDerWaalsContact O-CG 3.31Å; I102-L106 WeakPolarHBondContact O-CG 3.5Å; I102-L106 PolarHBondContact O-N 3.06Å; A103-L106 PolarHBondContact O-N 2.75Å; Q104-L106 VanDerWaalsContact C-N 3.26Å; Q104-L106 PolarHBondContact O-N 3.44Å
107	G	85.4	Confident	91.4	Very high	61 Å²	61	112.7 Å²	112.7	63%	0.629	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.1	10	176.7	0	0	0	0	0	115	Q104 R105 Q109	Q104-G107 PolarHBondContact O-N 2.96Å; R105-G107 PolarHBondContact O-N 3.05Å; G107-Q109 PolarHBondContact O-N 3.45Å
108	K	82.4	Confident	91.4	Very high	129 Å²	129	104 Å²	104	56%	0.561	50%	0.5	S	S	*	.			trans	-103.6	60.9	-177.2	-61	-178.2	-179	177.7	0	111.5	A103 D110 L111	A103-K108 PolarHBondContact O-N 3.36Å; A103-K108 VanDerWaalsContact O-N 3.1Å; K108-D110 VanDerWaalsContact C-N 3.27Å; K108-D110 PolarHBondContact O-N 2.99Å; K108-L111 HydrophobicContact CB-CB 4.22Å; K108-L111 HydrophobicContact CD-CD2 4.39Å; K108-L111 WeakPolarHBondContact O-CB 3.26Å; K108-L111 PolarHBondContact O-N 3.4Å
109	Q	76.1	Confident	91.4	Very high	147 Å²	147	102.3 Å²	102.3	69%	0.687	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-32.4	-171.3	-59.2	-169.7	-1.5	0	0	113.4	Q104 G107	Q104-Q109 HydrophobicContact CG-CG 4.34Å; G107-Q109 PolarHBondContact O-N 3.45Å
110	D	82.9	Confident	91.5	Very high	155 Å²	155	104.3 Å²	104.3	83%	0.829	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	13.1	-176.1	-61.9	-43.6	0	0	0	114.6	K108 R112	K108-D110 VanDerWaalsContact C-N 3.27Å; K108-D110 PolarHBondContact O-N 2.99Å; D110-R112 PolarHBondContact O-N 2.92Å
111	L	89.2	Confident	91.6	Very high	83 Å²	83	102.9 Å²	102.9	44%	0.435	51%	0.506	S	S	.	.			trans	-72.1	115.5	-174.8	-167	64.9	0	0	0	112	K108 F113	K108-L111 HydrophobicContact CB-CB 4.22Å; K108-L111 HydrophobicContact CD-CD2 4.39Å; K108-L111 WeakPolarHBondContact O-CB 3.26Å; K108-L111 PolarHBondContact O-N 3.4Å; L111-F113 HydrophobicContact CB-CE2 4.37Å; L111-F113 HydrophobicContact CD2-CE1 3.97Å; L111-F113 HydrophobicContact CD2-CE2 4.02Å; L111-F113 HydrophobicContact CD2-CZ 3.56Å; L111-F113 HydrophobicContact CG-CE2 4.2Å; L111-F113 HydrophobicContact CG-CZ 4.21Å
112	R	91.8	Very high	91.7	Very high	237 Å²	237	100 Å²	100	89%	0.894	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-89.5	121.5	171.7	-65.5	-176.3	176.9	-170.7	-0.3	110.5	D110	D110-R112 PolarHBondContact O-N 2.92Å
113	F	92	Very high	91.8	Very high	46 Å²	46	99.5 Å²	99.5	20%	0.202	49%	0.491	C	S	.	.	P	Polyproline II helix	trans	-92.3	128.7	177.3	-68.6	-90	0	0	0	111.8	V99 R100 A103 L111 L118 L121	V99-F113 HydrophobicContact CG1-CE1 3.98Å; V99-F113 HydrophobicContact CG1-CZ 3.97Å; R100-F113 HydrophobicContact CG-CD2 4.4Å; R100-F113 HydrophobicContact CG-CE2 4.34Å; A103-F113 HydrophobicContact CB-CE2 4.02Å; A103-F113 HydrophobicContact CB-CZ 3.78Å; L111-F113 HydrophobicContact CB-CE2 4.37Å; L111-F113 HydrophobicContact CD2-CE1 3.97Å; L111-F113 HydrophobicContact CD2-CE2 4.02Å; L111-F113 HydrophobicContact CD2-CZ 3.56Å; L111-F113 HydrophobicContact CG-CE2 4.2Å; L111-F113 HydrophobicContact CG-CZ 4.21Å; F113-L118 HydrophobicContact CB-CD1 3.88Å; F113-L118 HydrophobicContact CB-CD2 3.87Å; F113-L118 HydrophobicContact CB-CG 3.76Å; F113-L118 HydrophobicContact CD1-CD2 3.91Å; F113-L118 HydrophobicContact CD1-CG 4.48Å; F113-L118 HydrophobicContact CG-CD2 3.86Å; F113-L118 HydrophobicContact CG-CG 4.31Å; F113-L121 HydrophobicContact CE1-CD1 4.33Å
114	K	95.2	Very high	92	Very high	171 Å²	171	101.1 Å²	101.1	74%	0.743	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-65.9	150.6	163.9	-67.5	-175.7	179.7	178.7	0	109.6	I116 A117 L118	K114-I116 VanDerWaalsContact C-N 3.33Å; K114-I116 PolarHBondContact O-N 2.96Å; K114-A117 HydrophobicContact CB-CB 4.3Å; K114-A117 WeakPolarHBondContact O-CB 3.33Å; K114-A117 PolarHBondContact O-N 3.08Å; K114-L118 PolarHBondContact O-N 3.33Å
115	R	92.7	Very high	92.2	Very high	170 Å²	170	97.4 Å²	97.4	64%	0.642	50%	0.497	S	S	*	.	H	α-helix	trans	-56.6	-46.4	176	177.9	-177.5	159.5	-148.5	-11.4	112.1	A117 L118 E119	R115-A117 VanDerWaalsContact C-N 3.28Å; R115-A117 PolarHBondContact O-N 3.36Å; R115-L118 PolarHBondContact O-N 2.99Å; R115-E119 IonicContact CZ-OE1 2.75Å; R115-E119 VanDerWaalsContact CZ-OE1 3.31Å; R115-E119 IonicContact NE-OE1 3.55Å; R115-E119 PolarHBondContact NE-OE1 3.05Å; R115-E119 IonicContact NH2-OE1 3.2Å; R115-E119 PolarHBondContact NH2-OE1 2.83Å; R115-E119 IonicContact NH2-OE2 3.27Å; R115-E119 PolarHBondContact O-N 3.31Å
116	I	95.5	Very high	92.3	Very high	134 Å²	134	89.2 Å²	89.2	69%	0.687	47%	0.467	S	S	*	.	H	α-helix	trans	-61.4	-37.8	-179.6	-62	171.9	0	0	0	110.9	K114 L118 E119 A120	K114-I116 VanDerWaalsContact C-N 3.33Å; K114-I116 PolarHBondContact O-N 2.96Å; I116-L118 VanDerWaalsContact C-N 3.35Å; I116-L118 PolarHBondContact O-N 3.22Å; I116-E119 PolarHBondContact O-N 3.04Å; I116-A120 WeakPolarHBondContact O-CB 3.33Å; I116-A120 PolarHBondContact O-N 2.9Å
117	A	95.7	Very high	92.5	Very high	42 Å²	42	86.3 Å²	86.3	35%	0.347	46%	0.462	S	S	.	.	H	α-helix	trans	-63.6	-40.3	177.5	0	0	0	0	0	112	K114 R115 A120 L121	K114-A117 HydrophobicContact CB-CB 4.3Å; K114-A117 WeakPolarHBondContact O-CB 3.33Å; K114-A117 PolarHBondContact O-N 3.08Å; R115-A117 VanDerWaalsContact C-N 3.28Å; R115-A117 PolarHBondContact O-N 3.36Å; A117-A120 PolarHBondContact O-N 2.7Å; A117-L121 WeakPolarHBondContact O-CG 3.31Å; A117-L121 PolarHBondContact O-N 2.78Å
118	L	95.2	Very high	93	Very high	7 Å²	7	87.9 Å²	87.9	4%	0.037	45%	0.449	C	S	.	.	H	α-helix	trans	-68.3	-38.6	176	-65.9	167.3	0	0	0	112	Q96 V99 F113 K114 R115 I116 Q122	Q96-L118 HydrophobicContact CG-CB 4.41Å; Q96-L118 HydrophobicContact CG-CD1 4.01Å; Q96-L118 HydrophobicContact CG-CD2 4.41Å; V99-L118 HydrophobicContact CB-CD2 4.37Å; V99-L118 HydrophobicContact CG1-CD2 3.88Å; F113-L118 HydrophobicContact CB-CD1 3.88Å; F113-L118 HydrophobicContact CB-CD2 3.87Å; F113-L118 HydrophobicContact CB-CG 3.76Å; F113-L118 HydrophobicContact CD1-CD2 3.91Å; F113-L118 HydrophobicContact CD1-CG 4.48Å; F113-L118 HydrophobicContact CG-CD2 3.86Å; F113-L118 HydrophobicContact CG-CG 4.31Å; K114-L118 PolarHBondContact O-N 3.33Å; R115-L118 PolarHBondContact O-N 2.99Å; I116-L118 VanDerWaalsContact C-N 3.35Å; I116-L118 PolarHBondContact O-N 3.22Å; L118-Q122 WeakPolarHBondContact O-CB 3.38Å; L118-Q122 PolarHBondContact O-N 3.4Å
119	E	95.2	Very high	93.7	Very high	44 Å²	44	85.9 Å²	85.9	21%	0.206	44%	0.444	C	S	.	.	H	α-helix	trans	-66.3	-38.9	175.1	-71.6	179.2	169.6	0	0	111.6	R92 R115 I116 Q122 T123	R92-E119 IonicContact CZ-OE1 3.31Å; R92-E119 IonicContact NH1-OE1 2.75Å; R92-E119 PolarHBondContact NH1-OE1 3.37Å; R92-E119 IonicContact NH2-OE1 3.77Å; R115-E119 IonicContact CZ-OE1 2.75Å; R115-E119 VanDerWaalsContact CZ-OE1 3.31Å; R115-E119 IonicContact NE-OE1 3.55Å; R115-E119 PolarHBondContact NE-OE1 3.05Å; R115-E119 IonicContact NH2-OE1 3.2Å; R115-E119 PolarHBondContact NH2-OE1 2.83Å; R115-E119 IonicContact NH2-OE2 3.27Å; R115-E119 PolarHBondContact O-N 3.31Å; I116-E119 PolarHBondContact O-N 3.04Å; E119-Q122 PolarHBondContact O-N 3.46Å; E119-T123 WeakPolarHBondContact O-CB 3.35Å; E119-T123 PolarHBondContact O-N 3.01Å; E119-T123 PolarHBondContact O-OG1 3.38Å
120	A	96.6	Very high	94.6	Very high	61 Å²	61	82.5 Å²	82.5	50%	0.504	43%	0.434	S	S	.	.	H	α-helix	trans	-65.1	-45.3	175.1	0	0	0	0	0	112.1	I116 A117 Q122 T123 G124	I116-A120 WeakPolarHBondContact O-CB 3.33Å; I116-A120 PolarHBondContact O-N 2.9Å; A117-A120 PolarHBondContact O-N 2.7Å; A120-Q122 VanDerWaalsContact C-N 3.3Å; A120-Q122 PolarHBondContact O-N 2.92Å; A120-T123 PolarHBondContact O-N 2.86Å; A120-G124 PolarHBondContact O-N 3.38Å
121	L	96.4	Very high	95.2	Very high	84 Å²	84	76 Å²	76	44%	0.44	40%	0.402	S	S	.	.	H	α-helix	trans	-60.1	-41	174.5	-74.2	173	0	0	0	111.7	F95 V99 F113 A117 A125	F95-L121 HydrophobicContact CE1-CB 4.26Å; F95-L121 HydrophobicContact CZ-CB 4.43Å; V99-L121 HydrophobicContact CG1-CD1 3.77Å; F113-L121 HydrophobicContact CE1-CD1 4.33Å; A117-L121 WeakPolarHBondContact O-CG 3.31Å; A117-L121 PolarHBondContact O-N 2.78Å; L121-A125 VanDerWaalsContact O-CB 3.26Å; L121-A125 WeakPolarHBondContact O-CB 3.37Å; L121-A125 PolarHBondContact O-N 2.91Å
122	Q	96.7	Very high	95.5	Very high	2 Å²	2	72.4 Å²	72.4	1%	0.009	38%	0.384	C	S	.	.	H	α-helix	trans	-65.1	-46.1	177.2	-171	172.7	-15.4	0	0	111.7	L88 L90 F95 L118 E119 A120 G124 A125 E126	L88-Q122 HydrophobicContact CD1-CB 4.47Å; L88-Q122 HydrophobicContact CD1-CG 4.13Å; L88-Q122 HydrophobicContact CD2-CG 4.45Å; L90-Q122 PolarHBondContact O-NE2 3.33Å; F95-Q122 HydrophobicContact CD1-CB 3.75Å; F95-Q122 HydrophobicContact CD1-CG 3.94Å; F95-Q122 HydrophobicContact CD2-CG 4.46Å; F95-Q122 HydrophobicContact CE1-CB 3.47Å; F95-Q122 VanDerWaalsContact CE1-CB 3.47Å; F95-Q122 HydrophobicContact CE1-CG 4.04Å; F95-Q122 HydrophobicContact CG-CB 4.46Å; F95-Q122 HydrophobicContact CG-CG 4.18Å; F95-Q122 VanDerWaalsContact CZ-CA 3.42Å; F95-Q122 HydrophobicContact CZ-CB 3.98Å; F95-Q122 HydrophobicContact CZ-CG 4.35Å; L118-Q122 WeakPolarHBondContact O-CB 3.38Å; L118-Q122 PolarHBondContact O-N 3.4Å; E119-Q122 PolarHBondContact O-N 3.46Å; A120-Q122 VanDerWaalsContact C-N 3.3Å; A120-Q122 PolarHBondContact O-N 2.92Å; Q122-G124 PolarHBondContact O-N 2.65Å; Q122-A125 PolarHBondContact O-N 3.3Å; Q122-E126 HydrophobicContact CG-CG 4.45Å; Q122-E126 WeakPolarHBondContact CG-OE1 3.24Å; Q122-E126 PolarHBondContact NE2-OE1 2.95Å; Q122-E126 WeakPolarHBondContact O-CG 3.49Å; Q122-E126 PolarHBondContact O-N 3.38Å
123	T	96.3	Very high	95.8	Very high	75 Å²	75	65 Å²	65	46%	0.46	36%	0.361	S	S	.	.	H	α-helix	trans	-60.1	-46.4	178.9	-53.5	0	0	0	0	111.1	E119 A120 A127	E119-T123 WeakPolarHBondContact O-CB 3.35Å; E119-T123 PolarHBondContact O-N 3.01Å; E119-T123 PolarHBondContact O-OG1 3.38Å; A120-T123 PolarHBondContact O-N 2.86Å; T123-A127 VanDerWaalsContact O-CB 3.31Å; T123-A127 WeakPolarHBondContact O-CB 3.49Å; T123-A127 PolarHBondContact O-N 3.05Å
124	G	96.8	Very high	96	Very high	46 Å²	46	68.4 Å²	68.4	47%	0.474	38%	0.377	S	S	.	.	H	α-helix	trans	-64.4	-42	177.3	0	0	0	0	0	113.1	A120 Q122 Y128	A120-G124 PolarHBondContact O-N 3.38Å; Q122-G124 PolarHBondContact O-N 2.65Å; G124-Y128 WeakPolarHBondContact O-CB 3.44Å; G124-Y128 PolarHBondContact O-N 3.18Å
125	A	97.2	Very high	96	Very high	34 Å²	34	63 Å²	63	28%	0.281	36%	0.356	S	S	.	.	H	α-helix	trans	-65	-44.4	178.3	0	0	0	0	0	112.3	F95 L121 Q122 Y128 L129	F95-A125 HydrophobicContact CE2-CB 3.87Å; F95-A125 HydrophobicContact CZ-CB 3.96Å; L121-A125 VanDerWaalsContact O-CB 3.26Å; L121-A125 WeakPolarHBondContact O-CB 3.37Å; L121-A125 PolarHBondContact O-N 2.91Å; Q122-A125 PolarHBondContact O-N 3.3Å; A125-Y128 PolarHBondContact O-N 2.97Å; A125-L129 VanDerWaalsContact O-CG 3.31Å; A125-L129 WeakPolarHBondContact O-CG 3.23Å; A125-L129 PolarHBondContact O-N 2.9Å
126	E	96.6	Very high	96.3	Very high	20 Å²	20	54.9 Å²	54.9	9%	0.093	33%	0.326	C	S	.	.	H	α-helix	trans	-66.6	-43	177.6	-71.2	-171.5	-151.5	0	0	111.8	L88 L89 L90 Q122 Y128 L129 V130	L88-E126 VanDerWaalsContact CA-OE2 3.28Å; L88-E126 WeakPolarHBondContact CA-OE2 3.09Å; L89-E126 PolarHBondContact N-OE1 3.3Å; L89-E126 PolarHBondContact N-OE2 3.17Å; L90-E126 VanDerWaalsContact CB-OE1 3.24Å; L90-E126 WeakPolarHBondContact CB-OE1 3.4Å; L90-E126 HydrophobicContact CD1-CG 3.73Å; L90-E126 HydrophobicContact CG-CG 3.9Å; L90-E126 WeakPolarHBondContact CG-OE1 3.5Å; L90-E126 PolarHBondContact N-OE1 2.92Å; Q122-E126 HydrophobicContact CG-CG 4.45Å; Q122-E126 WeakPolarHBondContact CG-OE1 3.24Å; Q122-E126 PolarHBondContact NE2-OE1 2.95Å; Q122-E126 WeakPolarHBondContact O-CG 3.49Å; Q122-E126 PolarHBondContact O-N 3.38Å; E126-Y128 VanDerWaalsContact C-N 3.32Å; E126-Y128 PolarHBondContact O-N 3.27Å; E126-L129 PolarHBondContact O-N 3.43Å; E126-V130 WeakPolarHBondContact O-CG2 3.38Å; E126-V130 PolarHBondContact O-N 3.4Å
127	A	96.4	Very high	96.4	Very high	65 Å²	65	52 Å²	52	54%	0.537	31%	0.312	S	S	.	.	H	α-helix	trans	-59.2	-43.1	175.8	0	0	0	0	0	112.1	T123 V130 G131	T123-A127 VanDerWaalsContact O-CB 3.31Å; T123-A127 WeakPolarHBondContact O-CB 3.49Å; T123-A127 PolarHBondContact O-N 3.05Å; A127-V130 PolarHBondContact O-N 2.8Å; A127-G131 PolarHBondContact O-N 3.33Å
128	Y	96	Very high	96.4	Very high	94 Å²	94	55.3 Å²	55.3	37%	0.369	32%	0.323	S	S	.	.	H	α-helix	trans	-61.3	-46	175.5	173.9	-93.6	0	0	0	112.3	G124 A125 E126 G131 L132 E162	G124-Y128 WeakPolarHBondContact O-CB 3.44Å; G124-Y128 PolarHBondContact O-N 3.18Å; A125-Y128 PolarHBondContact O-N 2.97Å; E126-Y128 VanDerWaalsContact C-N 3.32Å; E126-Y128 PolarHBondContact O-N 3.27Å; Y128-G131 PolarHBondContact O-N 2.78Å; Y128-L132 HydrophobicContact CE1-CD2 4.34Å; Y128-L132 WeakPolarHBondContact O-CB 3.45Å; Y128-L132 PolarHBondContact O-N 3.16Å; Y128-E162 WeakPolarHBondContact CE2-OE1 3.35Å; Y128-E162 PolarHBondContact OH-OE2 3.39Å
129	L	96.1	Very high	96.5	Very high	86 Å²	86	55.6 Å²	55.6	45%	0.45	33%	0.326	S	S	.	.	H	α-helix	trans	-64.2	-41.2	178.9	-71.9	173.3	0	0	0	111.8	A125 E126 L132 M133	A125-L129 VanDerWaalsContact O-CG 3.31Å; A125-L129 WeakPolarHBondContact O-CG 3.23Å; A125-L129 PolarHBondContact O-N 2.9Å; E126-L129 PolarHBondContact O-N 3.43Å; L129-L132 PolarHBondContact O-N 2.96Å; L129-M133 WeakPolarHBondContact O-CB 3.46Å; L129-M133 WeakPolarHBondContact O-CG 2.94Å; L129-M133 PolarHBondContact O-N 3.4Å
130	V	96.1	Very high	96.6	Very high	77 Å²	77	53.5 Å²	53.5	47%	0.467	32%	0.317	S	S	.	.	H	α-helix	trans	-61	-49.2	176.1	172.6	0	0	0	0	110.4	E126 A127 L132 M133 E134	E126-V130 WeakPolarHBondContact O-CG2 3.38Å; E126-V130 PolarHBondContact O-N 3.4Å; A127-V130 PolarHBondContact O-N 2.8Å; V130-L132 PolarHBondContact O-N 3.43Å; V130-M133 PolarHBondContact O-N 3.05Å; V130-M133 VanDerWaalsContact O-N 3.11Å; V130-E134 WeakPolarHBondContact O-CG 3.39Å; V130-E134 PolarHBondContact O-N 2.94Å
131	G	95.7	Very high	96.7	Very high	17 Å²	17	55.3 Å²	55.3	18%	0.175	32%	0.317	C	S	.	.	H	α-helix	trans	-60.9	-41.2	177.6	0	0	0	0	0	113.1	A127 Y128 M133 E134 D135	A127-G131 PolarHBondContact O-N 3.33Å; Y128-G131 PolarHBondContact O-N 2.78Å; G131-M133 VanDerWaalsContact C-N 3.3Å; G131-M133 PolarHBondContact O-N 3.26Å; G131-E134 PolarHBondContact O-N 3.48Å; G131-D135 PolarHBondContact O-N 3.24Å; G131-D135 VanDerWaalsContact O-N 3.17Å
132	L	95.9	Very high	96.7	Very high	9 Å²	9	59 Å²	59	5%	0.047	33%	0.331	C	S	.	.	H	α-helix	trans	-62.9	-37.6	174.8	178.1	61	0	0	0	112.2	Y128 L129 V130 T136 M153 A156 L157	Y128-L132 HydrophobicContact CE1-CD2 4.34Å; Y128-L132 WeakPolarHBondContact O-CB 3.45Å; Y128-L132 PolarHBondContact O-N 3.16Å; L129-L132 PolarHBondContact O-N 2.96Å; V130-L132 PolarHBondContact O-N 3.43Å; L132-T136 VanDerWaalsContact O-CB 3.32Å; L132-T136 WeakPolarHBondContact O-CB 3.32Å; L132-T136 PolarHBondContact O-N 3.42Å; L132-T136 PolarHBondContact O-OG1 2.7Å; L132-M153 HydrophobicContact CD1-CG 4.4Å; L132-M153 HydrophobicContact CD2-CG 4.16Å; L132-M153 HydrophobicContact CD2-SD 4.31Å; L132-M153 HydrophobicContact CG-CG 4.38Å; L132-A156 HydrophobicContact CD1-CB 4.09Å; L132-L157 HydrophobicContact CD1-CD2 3.62Å; L132-L157 HydrophobicContact CD1-CG 3.87Å; L132-L157 HydrophobicContact CD2-CD2 4.03Å; L132-L157 HydrophobicContact CG-CD2 4.49Å
133	M	96.6	Very high	96.7	Very high	82 Å²	82	61.1 Å²	61.1	40%	0.404	35%	0.349	S	S	.	.	H	α-helix	trans	-72	-31.4	179.1	-69.7	-71.3	-70.9	0	0	112.3	L129 V130 G131 N137 I148 M153	L129-M133 WeakPolarHBondContact O-CB 3.46Å; L129-M133 WeakPolarHBondContact O-CG 2.94Å; L129-M133 PolarHBondContact O-N 3.4Å; V130-M133 PolarHBondContact O-N 3.05Å; V130-M133 VanDerWaalsContact O-N 3.11Å; G131-M133 VanDerWaalsContact C-N 3.3Å; G131-M133 PolarHBondContact O-N 3.26Å; M133-N137 VanDerWaalsContact O-CB 3.28Å; M133-N137 WeakPolarHBondContact O-CB 3.32Å; M133-N137 PolarHBondContact O-N 3.46Å; M133-I148 HydrophobicContact CE-CD1 3.37Å; M133-I148 HydrophobicContact SD-CD1 4.23Å; M133-M153 HydrophobicContact SD-CE 4.12Å
134	E	96.4	Very high	96.8	Very high	116 Å²	116	67.1 Å²	67.1	54%	0.542	37%	0.369	S	S	.	.	H	α-helix	trans	-63.4	-50.2	171.1	-71.6	173.6	-179.1	0	0	111.1	V130 G131 T136 N137 L138	V130-E134 WeakPolarHBondContact O-CG 3.39Å; V130-E134 PolarHBondContact O-N 2.94Å; G131-E134 PolarHBondContact O-N 3.48Å; E134-T136 VanDerWaalsContact C-N 3.32Å; E134-T136 PolarHBondContact O-N 3.11Å; E134-N137 WeakPolarHBondContact O-CB 3.28Å; E134-N137 PolarHBondContact O-N 3.14Å; E134-N137 VanDerWaalsContact O-N 3.14Å; E134-L138 WeakPolarHBondContact O-CG 3.27Å; E134-L138 PolarHBondContact O-N 2.89Å
135	D	96.7	Very high	96.8	Very high	57 Å²	57	67.3 Å²	67.3	31%	0.305	36%	0.355	S	S	.	.	H	α-helix	trans	-59.4	-43.6	176	-66.3	-27.7	0	0	0	111.3	G131 N137 L138 A139 A156 R160	G131-D135 PolarHBondContact O-N 3.24Å; G131-D135 VanDerWaalsContact O-N 3.17Å; D135-N137 VanDerWaalsContact C-N 3.32Å; D135-N137 PolarHBondContact O-N 3.42Å; D135-L138 PolarHBondContact O-N 2.94Å; D135-A139 PolarHBondContact O-N 3.29Å; D135-A156 HydrophobicContact CB-CB 3.81Å; D135-R160 IonicContact OD2-CZ 2.83Å; D135-R160 IonicContact OD2-NE 3.64Å; D135-R160 PolarHBondContact OD2-NE 3.46Å; D135-R160 IonicContact OD2-NH2 3.85Å; D135-R160 PolarHBondContact OD2-NH2 3.26Å
136	T	97.6	Very high	96.7	Very high	1 Å²	1	74.8 Å²	74.8	1%	0.006	38%	0.384	C	S	.	.	H	α-helix	trans	-62.3	-39	176.8	-59.2	0	0	0	0	111.7	L132 E134 A139 T140 I148 D152 M153	L132-T136 VanDerWaalsContact O-CB 3.32Å; L132-T136 WeakPolarHBondContact O-CB 3.32Å; L132-T136 PolarHBondContact O-N 3.42Å; L132-T136 PolarHBondContact O-OG1 2.7Å; E134-T136 VanDerWaalsContact C-N 3.32Å; E134-T136 PolarHBondContact O-N 3.11Å; T136-A139 PolarHBondContact O-N 3.27Å; T136-T140 WeakPolarHBondContact O-CB 3.28Å; T136-T140 PolarHBondContact O-N 3.25Å; T136-T140 PolarHBondContact O-OG1 3.47Å; T136-I148 HydrophobicContact CG2-CB 4.1Å; T136-I148 HydrophobicContact CG2-CG2 4.12Å; T136-D152 HydrophobicContact CG2-CB 3.77Å; T136-M153 HydrophobicContact CG2-CB 4.16Å
137	N	97.3	Very high	96.7	Very high	73 Å²	73	78.7 Å²	78.7	39%	0.39	41%	0.409	S	S	.	.	H	α-helix	trans	-66.8	-40.7	176.7	-176.2	50.7	0	0	0	111.3	M133 E134 D135 T140 I141	M133-N137 VanDerWaalsContact O-CB 3.28Å; M133-N137 WeakPolarHBondContact O-CB 3.32Å; M133-N137 PolarHBondContact O-N 3.46Å; E134-N137 WeakPolarHBondContact O-CB 3.28Å; E134-N137 PolarHBondContact O-N 3.14Å; E134-N137 VanDerWaalsContact O-N 3.14Å; D135-N137 VanDerWaalsContact C-N 3.32Å; D135-N137 PolarHBondContact O-N 3.42Å; N137-T140 WeakPolarHBondContact O-CB 3.38Å; N137-T140 PolarHBondContact O-N 3.4Å; N137-I141 WeakPolarHBondContact O-CG1 3.31Å; N137-I141 PolarHBondContact O-N 3.22Å
138	L	97	Very high	96.7	Very high	112 Å²	112	79 Å²	79	59%	0.586	40%	0.401	S	S	*	.	H	α-helix	trans	-61.3	-44.8	174.2	-67.2	176	0	0	0	112	E134 D135 T140 I141 H142	E134-L138 WeakPolarHBondContact O-CG 3.27Å; E134-L138 PolarHBondContact O-N 2.89Å; D135-L138 PolarHBondContact O-N 2.94Å; L138-T140 VanDerWaalsContact C-N 3.27Å; L138-T140 PolarHBondContact O-N 2.99Å; L138-I141 PolarHBondContact O-N 2.81Å; L138-H142 WeakPolarHBondContact O-CB 3.44Å; L138-H142 PolarHBondContact O-N 3.48Å
139	A	96.9	Very high	96.8	Very high	13 Å²	13	77.7 Å²	77.7	11%	0.107	40%	0.4	C	S	.	.	H	α-helix	trans	-60.4	-37.4	174.2	0	0	0	0	0	112.6	D135 T136 H142 A143 D152 L155	D135-A139 PolarHBondContact O-N 3.29Å; T136-A139 PolarHBondContact O-N 3.27Å; A139-H142 WeakPolarHBondContact O-CB 3.48Å; A139-H142 PolarHBondContact O-N 3.16Å; A139-A143 PolarHBondContact O-N 2.75Å; A139-A143 VanDerWaalsContact O-N 3.15Å; A139-D152 HydrophobicContact CB-CB 4.16Å; A139-L155 HydrophobicContact CB-CD2 4.13Å
140	T	97.7	Very high	96.8	Very high	0 Å²	0	78.6 Å²	78.6	0%	0	41%	0.41	C	S	.	.	H	α-helix	trans	-66.1	-44.6	177.3	-59.8	0	0	0	0	111.7	T136 N137 L138 A143 K144 R145 T147 I148 D152	T136-T140 WeakPolarHBondContact O-CB 3.28Å; T136-T140 PolarHBondContact O-N 3.25Å; T136-T140 PolarHBondContact O-OG1 3.47Å; N137-T140 WeakPolarHBondContact O-CB 3.38Å; N137-T140 PolarHBondContact O-N 3.4Å; L138-T140 VanDerWaalsContact C-N 3.27Å; L138-T140 PolarHBondContact O-N 2.99Å; T140-A143 CarbonylContact O-C 3.57Å; T140-A143 PolarHBondContact O-N 2.92Å; T140-K144 PolarHBondContact O-N 3.4Å; T140-R145 CarbonylContact C-O 3.6Å; T140-R145 HydrophobicContact CG2-CB 3.88Å; T140-R145 PolarHBondContact O-N 3.12Å; T140-T147 VanDerWaalsContact CG2-O 3.28Å; T140-T147 WeakPolarHBondContact CG2-O 3.46Å; T140-I148 HydrophobicContact CG2-CG2 4.42Å; T140-D152 PolarHBondContact OG1-OD2 2.96Å
141	I	97.5	Very high	96.7	Very high	99 Å²	99	81.4 Å²	81.4	51%	0.508	41%	0.413	S	S	.	.	H	α-helix	trans	-64.1	-41.8	176.3	-68.2	166	0	0	0	110.4	N137 L138 A143 K144	N137-I141 WeakPolarHBondContact O-CG1 3.31Å; N137-I141 PolarHBondContact O-N 3.22Å; L138-I141 PolarHBondContact O-N 2.81Å; I141-A143 PolarHBondContact O-N 3.26Å; I141-K144 PolarHBondContact O-N 3.38Å
142	H	96.8	Very high	96.8	Very high	161 Å²	161	80.9 Å²	80.9	75%	0.745	41%	0.406	S	S	*	.	H	α-helix	trans	-56.8	-38.8	175.7	-178.1	73.4	0	0	0	111.9	L138 A139 K144	L138-H142 WeakPolarHBondContact O-CB 3.44Å; L138-H142 PolarHBondContact O-N 3.48Å; A139-H142 WeakPolarHBondContact O-CB 3.48Å; A139-H142 PolarHBondContact O-N 3.16Å; H142-K144 PolarHBondContact O-N 2.91Å
143	A	97.2	Very high	96.8	Very high	46 Å²	46	83.7 Å²	83.7	38%	0.38	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	15.9	175.6	0	0	0	0	0	114.7	A139 T140 I141 R145	A139-A143 PolarHBondContact O-N 2.75Å; A139-A143 VanDerWaalsContact O-N 3.15Å; T140-A143 CarbonylContact O-C 3.57Å; T140-A143 PolarHBondContact O-N 2.92Å; I141-A143 PolarHBondContact O-N 3.26Å; A143-R145 VanDerWaalsContact C-N 3.25Å; A143-R145 PolarHBondContact O-N 3.29Å
144	K	97.4	Very high	96.7	Very high	202 Å²	202	85.6 Å²	85.6	88%	0.878	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	32.2	-179.8	-56.8	-180	-179.1	177.3	0	114.2	T140 I141 H142	T140-K144 PolarHBondContact O-N 3.4Å; I141-K144 PolarHBondContact O-N 3.38Å; H142-K144 PolarHBondContact O-N 2.91Å
145	R	97.5	Very high	96.6	Very high	50 Å²	50	83.8 Å²	83.8	19%	0.189	42%	0.421	C	S	.	.			trans	-116.2	163.7	176.3	-72.4	177.1	-72.9	106.4	-4.1	110.7	T140 A143 T147 R151 D152	T140-R145 CarbonylContact C-O 3.6Å; T140-R145 HydrophobicContact CG2-CB 3.88Å; T140-R145 PolarHBondContact O-N 3.12Å; A143-R145 VanDerWaalsContact C-N 3.25Å; A143-R145 PolarHBondContact O-N 3.29Å; R145-T147 PolarHBondContact NH1-O 2.94Å; R145-R151 VanDerWaalsContact CZ-NH2 3.34Å; R145-D152 IonicContact CZ-OD1 3.53Å; R145-D152 IonicContact CZ-OD2 3.58Å; R145-D152 IonicContact NH1-OD1 3.46Å; R145-D152 PolarHBondContact NH1-OD1 3.01Å; R145-D152 IonicContact NH1-OD2 2.74Å; R145-D152 PolarHBondContact NH1-OD2 3.49Å; R145-D152 IonicContact NH2-OD1 2.69Å; R145-D152 PolarHBondContact NH2-OD1 2.91Å; R145-D152 IonicContact NH2-OD2 3.49Å; R145-D152 PolarHBondContact NH2-OD2 3.48Å
146	Q	94.5	Very high	96.5	Very high	191 Å²	191	81.3 Å²	81.3	89%	0.893	41%	0.409	S	S	*	.	S	Bend	trans	-115.2	-13	171.9	-65.1	179.8	-5.5	0	0	112.5
147	T	97.3	Very high	96.4	Very high	101 Å²	101	82.6 Å²	82.6	62%	0.62	42%	0.415	S	S	*	.	S	Bend	trans	-98.8	119.2	177.1	-49.4	0	0	0	0	108.9	T140 R145	T140-T147 VanDerWaalsContact CG2-O 3.28Å; T140-T147 WeakPolarHBondContact CG2-O 3.46Å; R145-T147 PolarHBondContact NH1-O 2.94Å
148	I	96.9	Very high	96.2	Very high	72 Å²	72	85.5 Å²	85.5	37%	0.369	42%	0.421	S	S	.	.			trans	-64	143.1	173	62.2	175.5	0	0	0	110.7	M133 T136 T140	M133-I148 HydrophobicContact CE-CD1 3.37Å; M133-I148 HydrophobicContact SD-CD1 4.23Å; T136-I148 HydrophobicContact CG2-CB 4.1Å; T136-I148 HydrophobicContact CG2-CG2 4.12Å; T140-I148 HydrophobicContact CG2-CG2 4.42Å
149	M	97.7	Very high	96	Very high	67 Å²	67	86.9 Å²	86.9	33%	0.33	43%	0.428	S	S	.	.			trans	-131.1	158.3	178.5	-61.3	-177.9	178.1	0	0	110.6	R151 D152 M153	M149-R151 HydrophobicContact CB-CG 4.01Å; M149-R151 PolarHBondContact O-N 3.37Å; M149-R151 VanDerWaalsContact O-N 3.12Å; M149-R151 PolarHBondContact SD-NH2 3.2Å; M149-D152 WeakPolarHBondContact CA-OD2 3.38Å; M149-D152 WeakPolarHBondContact CB-OD2 3.43Å; M149-D152 PolarHBondContact N-OD2 2.9Å; M149-D152 WeakPolarHBondContact O-CB 3.33Å; M149-D152 PolarHBondContact O-N 3.25Å; M149-M153 PolarHBondContact O-N 3.27Å
150	P	96.3	Very high	95.8	Very high	104 Å²	104	90.7 Å²	90.7	68%	0.675	44%	0.44	S	S	*	.	H	α-helix	trans	-54.5	-33.8	178.6	-28.3	35.9	0	0	0	114.2	D152 M153 Q154	P150-D152 VanDerWaalsContact C-N 3.28Å; P150-D152 PolarHBondContact O-N 2.99Å; P150-M153 PolarHBondContact O-N 2.95Å; P150-Q154 WeakPolarHBondContact O-CG 3.34Å; P150-Q154 PolarHBondContact O-N 3.46Å
151	R	95.1	Very high	95.4	Very high	136 Å²	136	93.2 Å²	93.2	51%	0.513	47%	0.466	S	S	.	.	H	α-helix	trans	-62.4	-32.4	175	66.4	-175.2	178.2	-153.2	3	113.7	R145 M149 L155	R145-R151 VanDerWaalsContact CZ-NH2 3.34Å; M149-R151 HydrophobicContact CB-CG 4.01Å; M149-R151 PolarHBondContact O-N 3.37Å; M149-R151 VanDerWaalsContact O-N 3.12Å; M149-R151 PolarHBondContact SD-NH2 3.2Å; R151-L155 WeakPolarHBondContact O-CB 3.35Å; R151-L155 PolarHBondContact O-N 3.46Å
152	D	97	Very high	94.6	Very high	6 Å²	6	92.4 Å²	92.4	3%	0.032	46%	0.459	C	S	.	.	H	α-helix	trans	-71.7	-38.9	179	-54.1	-45.4	0	0	0	109.6	T136 A139 T140 R145 M149 P150 L155 A156	T136-D152 HydrophobicContact CG2-CB 3.77Å; A139-D152 HydrophobicContact CB-CB 4.16Å; T140-D152 PolarHBondContact OG1-OD2 2.96Å; R145-D152 IonicContact CZ-OD1 3.53Å; R145-D152 IonicContact CZ-OD2 3.58Å; R145-D152 IonicContact NH1-OD1 3.46Å; R145-D152 PolarHBondContact NH1-OD1 3.01Å; R145-D152 IonicContact NH1-OD2 2.74Å; R145-D152 PolarHBondContact NH1-OD2 3.49Å; R145-D152 IonicContact NH2-OD1 2.69Å; R145-D152 PolarHBondContact NH2-OD1 2.91Å; R145-D152 IonicContact NH2-OD2 3.49Å; R145-D152 PolarHBondContact NH2-OD2 3.48Å; M149-D152 WeakPolarHBondContact CA-OD2 3.38Å; M149-D152 WeakPolarHBondContact CB-OD2 3.43Å; M149-D152 PolarHBondContact N-OD2 2.9Å; M149-D152 WeakPolarHBondContact O-CB 3.33Å; M149-D152 PolarHBondContact O-N 3.25Å; P150-D152 VanDerWaalsContact C-N 3.28Å; P150-D152 PolarHBondContact O-N 2.99Å; D152-L155 PolarHBondContact O-N 3.43Å; D152-A156 WeakPolarHBondContact O-CB 3.25Å; D152-A156 PolarHBondContact O-N 3.2Å
153	M	95.2	Very high	93.4	Very high	68 Å²	68	88.4 Å²	88.4	34%	0.335	44%	0.442	S	S	.	.	H	α-helix	trans	-68.7	-42	175.1	-174.4	-179.7	-68.7	0	0	111.6	L132 M133 T136 M149 P150 L155 A156 L157	L132-M153 HydrophobicContact CD1-CG 4.4Å; L132-M153 HydrophobicContact CD2-CG 4.16Å; L132-M153 HydrophobicContact CD2-SD 4.31Å; L132-M153 HydrophobicContact CG-CG 4.38Å; M133-M153 HydrophobicContact SD-CE 4.12Å; T136-M153 HydrophobicContact CG2-CB 4.16Å; M149-M153 PolarHBondContact O-N 3.27Å; P150-M153 PolarHBondContact O-N 2.95Å; M153-L155 VanDerWaalsContact C-N 3.32Å; M153-L155 PolarHBondContact O-N 2.91Å; M153-A156 PolarHBondContact O-N 3.28Å; M153-L157 HydrophobicContact CG-CD1 4.24Å; M153-L157 WeakPolarHBondContact O-CB 3.45Å; M153-L157 VanDerWaalsContact O-CG 3.31Å; M153-L157 WeakPolarHBondContact O-CG 3.35Å; M153-L157 PolarHBondContact O-N 3.26Å
154	Q	94.5	Very high	91.5	Very high	122 Å²	122	97.3 Å²	97.3	57%	0.57	47%	0.466	S	S	*	.	H	α-helix	trans	-59.8	-43.2	173.8	-73.6	171.4	-14.3	0	0	111.6	P150 L157 R158	P150-Q154 WeakPolarHBondContact O-CG 3.34Å; P150-Q154 PolarHBondContact O-N 3.46Å; Q154-L157 PolarHBondContact O-N 3.15Å; Q154-R158 VanDerWaalsContact O-CB 3.25Å; Q154-R158 WeakPolarHBondContact O-CB 3.49Å; Q154-R158 PolarHBondContact O-N 3.06Å
155	L	94.1	Very high	89.5	Confident	79 Å²	79	98 Å²	98	41%	0.414	47%	0.469	S	S	.	.	H	α-helix	trans	-61.8	-46.2	174.8	179.4	62.2	0	0	0	111.4	A139 R151 D152 M153 L157 R158 L159	A139-L155 HydrophobicContact CB-CD2 4.13Å; R151-L155 WeakPolarHBondContact O-CB 3.35Å; R151-L155 PolarHBondContact O-N 3.46Å; D152-L155 PolarHBondContact O-N 3.43Å; M153-L155 VanDerWaalsContact C-N 3.32Å; M153-L155 PolarHBondContact O-N 2.91Å; L155-L157 PolarHBondContact O-N 3.26Å; L155-R158 WeakPolarHBondContact O-CB 3.49Å; L155-R158 PolarHBondContact O-N 3.49Å; L155-L159 HydrophobicContact CD1-CD1 4.2Å; L155-L159 HydrophobicContact CD1-CG 4.2Å; L155-L159 HydrophobicContact CG-CD1 4.12Å; L155-L159 HydrophobicContact CG-CG 4.5Å; L155-L159 WeakPolarHBondContact O-CG 3.44Å; L155-L159 PolarHBondContact O-N 3.37Å
156	A	94.8	Very high	89.1	Confident	5 Å²	5	100.4 Å²	100.4	4%	0.041	48%	0.483	C	S	.	.	H	α-helix	trans	-58.7	-48.4	177.1	0	0	0	0	0	112	L132 D135 D152 M153 R158 L159 R160	L132-A156 HydrophobicContact CD1-CB 4.09Å; D135-A156 HydrophobicContact CB-CB 3.81Å; D152-A156 WeakPolarHBondContact O-CB 3.25Å; D152-A156 PolarHBondContact O-N 3.2Å; M153-A156 PolarHBondContact O-N 3.28Å; A156-R158 VanDerWaalsContact C-N 3.28Å; A156-R158 PolarHBondContact O-N 2.74Å; A156-L159 PolarHBondContact O-N 2.91Å; A156-R160 WeakPolarHBondContact O-CB 3.28Å; A156-R160 PolarHBondContact O-N 2.69Å
157	L	95.1	Very high	88.8	Confident	27 Å²	27	95.6 Å²	95.6	14%	0.141	46%	0.462	C	S	.	.	H	α-helix	trans	-63.3	-34.1	176.8	-69	171.1	0	0	0	112.7	L132 M153 Q154 L155 G161 E162 M163	L132-L157 HydrophobicContact CD1-CD2 3.62Å; L132-L157 HydrophobicContact CD1-CG 3.87Å; L132-L157 HydrophobicContact CD2-CD2 4.03Å; L132-L157 HydrophobicContact CG-CD2 4.49Å; M153-L157 HydrophobicContact CG-CD1 4.24Å; M153-L157 WeakPolarHBondContact O-CB 3.45Å; M153-L157 VanDerWaalsContact O-CG 3.31Å; M153-L157 WeakPolarHBondContact O-CG 3.35Å; M153-L157 PolarHBondContact O-N 3.26Å; Q154-L157 PolarHBondContact O-N 3.15Å; L155-L157 PolarHBondContact O-N 3.26Å; L157-G161 PolarHBondContact O-N 2.94Å; L157-E162 HydrophobicContact CD2-CB 4.46Å; L157-E162 VanDerWaalsContact CD2-OE2 3.28Å; L157-E162 WeakPolarHBondContact CD2-OE2 3.4Å; L157-E162 PolarHBondContact O-N 3.25Å; L157-M163 HydrophobicContact CB-CB 4.44Å; L157-M163 HydrophobicContact CB-CG 3.56Å; L157-M163 HydrophobicContact CD1-CG 4.16Å; L157-M163 HydrophobicContact CG-CG 4.44Å; L157-M163 PolarHBondContact O-N 3.44Å
158	R	93.7	Very high	88.3	Confident	135 Å²	135	95.3 Å²	95.3	51%	0.509	45%	0.453	S	S	.	.	H	α-helix	trans	-67.7	-44.9	176.1	-176.9	62.8	174	166.5	-0.1	111.4	Q154 L155 A156 R160 G161 F165	Q154-R158 VanDerWaalsContact O-CB 3.25Å; Q154-R158 WeakPolarHBondContact O-CB 3.49Å; Q154-R158 PolarHBondContact O-N 3.06Å; L155-R158 WeakPolarHBondContact O-CB 3.49Å; L155-R158 PolarHBondContact O-N 3.49Å; A156-R158 VanDerWaalsContact C-N 3.28Å; A156-R158 PolarHBondContact O-N 2.74Å; R158-R160 VanDerWaalsContact C-N 3.32Å; R158-G161 PolarHBondContact O-N 3.48Å; R158-F165 VanDerWaalsContact CZ-CD2 3.44Å; R158-F165 VanDerWaalsContact CZ-CE2 3.43Å; R158-F165 VanDerWaalsContact NH1-CE2 3.33Å
159	L	92.7	Very high	87.8	Confident	141 Å²	141	96.6 Å²	96.6	74%	0.738	46%	0.458	S	S	*	.	H	α-helix	trans	-67.8	-32.6	178	-69.2	174.7	0	0	0	112.2	L155 A156 G161	L155-L159 HydrophobicContact CD1-CD1 4.2Å; L155-L159 HydrophobicContact CD1-CG 4.2Å; L155-L159 HydrophobicContact CG-CD1 4.12Å; L155-L159 HydrophobicContact CG-CG 4.5Å; L155-L159 WeakPolarHBondContact O-CG 3.44Å; L155-L159 PolarHBondContact O-N 3.37Å; A156-L159 PolarHBondContact O-N 2.91Å; L159-G161 VanDerWaalsContact C-N 3.28Å; L159-G161 PolarHBondContact O-N 3.29Å
160	R	92.6	Very high	87.2	Confident	93 Å²	93	98.5 Å²	98.5	35%	0.351	47%	0.466	S	S	.	.	H	α-helix	trans	-73.7	-18.3	175.6	-161.6	-179.5	-86.1	-171.1	-3.9	113.5	D135 A156 R158 E162	D135-R160 IonicContact OD2-CZ 2.83Å; D135-R160 IonicContact OD2-NE 3.64Å; D135-R160 PolarHBondContact OD2-NE 3.46Å; D135-R160 IonicContact OD2-NH2 3.85Å; D135-R160 PolarHBondContact OD2-NH2 3.26Å; A156-R160 WeakPolarHBondContact O-CB 3.28Å; A156-R160 PolarHBondContact O-N 2.69Å; R158-R160 VanDerWaalsContact C-N 3.32Å; R160-E162 HydrophobicContact CB-CG 4.36Å; R160-E162 WeakPolarHBondContact CD-OE1 3.49Å; R160-E162 WeakPolarHBondContact CD-OE2 3.5Å; R160-E162 HydrophobicContact CG-CG 4.09Å; R160-E162 IonicContact NH1-OE1 3.96Å; R160-E162 PolarHBondContact NH1-OE1 2.97Å; R160-E162 IonicContact NH1-OE2 2.92Å
161	G	89.7	Confident	86.6	Confident	53 Å²	53	98.1 Å²	98.1	55%	0.546	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	81	12.4	-178.2	0	0	0	0	0	114.7	L157 R158 L159	L157-G161 PolarHBondContact O-N 2.94Å; R158-G161 PolarHBondContact O-N 3.48Å; L159-G161 VanDerWaalsContact C-N 3.28Å; L159-G161 PolarHBondContact O-N 3.29Å
162	E	80.8	Confident	86	Confident	81 Å²	81	95.4 Å²	95.4	38%	0.379	45%	0.447	S	S	.	.			trans	-82.2	-27	179.8	-69.4	173.4	168.1	0	0	112.5	Y128 L157 R160 R164	Y128-E162 WeakPolarHBondContact CE2-OE1 3.35Å; Y128-E162 PolarHBondContact OH-OE2 3.39Å; L157-E162 HydrophobicContact CD2-CB 4.46Å; L157-E162 VanDerWaalsContact CD2-OE2 3.28Å; L157-E162 WeakPolarHBondContact CD2-OE2 3.4Å; L157-E162 PolarHBondContact O-N 3.25Å; R160-E162 HydrophobicContact CB-CG 4.36Å; R160-E162 WeakPolarHBondContact CD-OE1 3.49Å; R160-E162 WeakPolarHBondContact CD-OE2 3.5Å; R160-E162 HydrophobicContact CG-CG 4.09Å; R160-E162 IonicContact NH1-OE1 3.96Å; R160-E162 PolarHBondContact NH1-OE1 2.97Å; R160-E162 IonicContact NH1-OE2 2.92Å; E162-R164 PolarHBondContact O-N 3.15Å
163	M	70.9	Confident	85.1	Confident	78 Å²	78	102.3 Å²	102.3	38%	0.384	48%	0.479	S	S	.	.			trans	-85.3	97.5	171.9	-75.9	-75	-71.7	0	0	109.9	L157 F165	L157-M163 HydrophobicContact CB-CB 4.44Å; L157-M163 HydrophobicContact CB-CG 3.56Å; L157-M163 HydrophobicContact CD1-CG 4.16Å; L157-M163 HydrophobicContact CG-CG 4.44Å; L157-M163 PolarHBondContact O-N 3.44Å; M163-F165 HydrophobicContact CE-CE1 4.4Å
164	R	58.6	Low	84.3	Confident	233 Å²	233	105.2 Å²	105.2	88%	0.879	49%	0.491	S	S	*	.			trans	-77.9	123.8	163.7	-63.4	-178.4	-178.4	177.1	-1	108.3	E162	E162-R164 PolarHBondContact O-N 3.15Å
165	F	54.1	Low	83.4	Confident	215 Å²	215	103.6 Å²	103.6	94%	0.943	48%	0.484	S	S	*	.			trans	-91.8	0	161.8	-64.5	-61	0	0	0	108.6	R158 M163	R158-F165 VanDerWaalsContact CZ-CD2 3.44Å; R158-F165 VanDerWaalsContact CZ-CE2 3.43Å; R158-F165 VanDerWaalsContact NH1-CE2 3.33Å; M163-F165 HydrophobicContact CE-CE1 4.4Å

Retrieved 165 of 165 residues in 125.4 ms (Link to these results)

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