A0A077ZEW1_TRITR Loading...

BrkDBD domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZEW1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 135 aa.

						>A0A077ZEW1_TRITR|A0A077ZEW1
MVADDVVNPQSRTLFIHPAVLFKADKGASFGLHFLLCMTTGFSFIPLAAHDSTTVNAFCMQAMTRKNYNAGFKLEVVKMAKESNNAQAVRKYRITRKMVINWRKQEEALKMMPKEQCARRPAIASCPELENSLAE
					

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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	39.2	Very low	51.2	Low	242 Å²	242	132.2 Å²	132.2	100%	1.192	76%	0.761	S	S	*	*				0	125.1	0	-85.2	169	160.8	0	0	107.2
2	V	51.7	Low	50.9	Low	122 Å²	122	138.7 Å²	138.7	74%	0.739	76%	0.764	S	S	*	*			trans	57.4	103.2	174.3	-159.7	0	0	0	0	116.9	D4	V2-D4 WeakPolarHBondContact CG1-OD2 3.48Å
3	A	51.1	Low	51.2	Low	98 Å²	98	136.9 Å²	136.9	81%	0.81	76%	0.76	S	S	*	*			trans	-85.2	130.7	155.8	0	0	0	0	0	107.5
4	D	57.6	Low	50.9	Low	134 Å²	134	137.6 Å²	137.6	72%	0.717	76%	0.76	S	S	*	*			trans	-116.9	109.3	163.9	-76.1	-67	0	0	0	108	V2	V2-D4 WeakPolarHBondContact CG1-OD2 3.48Å
5	D	60	Low	50.1	Low	136 Å²	136	140.5 Å²	140.5	73%	0.727	76%	0.763	S	S	*	*			trans	51	106.2	140	-64.3	-41.8	0	0	0	120.7
6	V	58.8	Low	50.5	Low	120 Å²	120	141.4 Å²	141.4	73%	0.727	76%	0.764	S	S	*	*				80.1	89.1	91.9	167.2	0	0	0	0	110.9
7	V	55.4	Low	50	Low	133 Å²	133	144.1 Å²	144.1	81%	0.806	77%	0.771	S	S	*	*				85.1	117.8	88.9	162.5	0	0	0	0	113.7
8	N	49.6	Very low	50.6	Low	110 Å²	110	141.8 Å²	141.8	59%	0.588	77%	0.765	S	S	*	*			trans	93.2	89.6	148.3	-161.7	24.4	0	0	0	119.3
9	P	45.6	Very low	50.6	Low	119 Å²	119	139.7 Å²	139.7	77%	0.773	77%	0.769	S	S	*	*			trans	-88.9	98.3	154	33.8	-24.7	0	0	0	109.6	S11	P9-S11 PolarHBondContact O-N 3.31Å
10	Q	44.5	Very low	50.8	Low	166 Å²	166	138.5 Å²	138.5	78%	0.776	77%	0.765	S	S	*	*			trans	-67.1	108.3	157.5	-72.2	-140.1	-25.8	0	0	106.4
11	S	49.5	Very low	50.6	Low	74 Å²	74	139.5 Å²	139.5	52%	0.517	77%	0.769	S	S	.	*				45.2	109	57.6	-141	0	0	0	0	107.6	P9	P9-S11 PolarHBondContact O-N 3.31Å
12	R	48.3	Very low	51.2	Low	210 Å²	210	136.6 Å²	136.6	79%	0.792	75%	0.75	S	S	*	*				173.3	136.1	69.9	-121.4	141.5	-159	-108.8	9.1	109.5
13	T	53.8	Low	51.1	Low	116 Å²	116	139.8 Å²	139.8	71%	0.712	75%	0.754	S	S	*	*				57.8	108.4	129.6	55.4	0	0	0	0	118.4
14	L	48.1	Very low	51.1	Low	147 Å²	147	139.4 Å²	139.4	77%	0.77	75%	0.75	S	S	*	*				49.7	119.6	77.1	-107.3	91.1	0	0	0	114.9
15	F	38.2	Very low	50.9	Low	181 Å²	181	139.4 Å²	139.4	79%	0.794	75%	0.75	S	S	*	*			trans	67	123.6	153.2	-73.3	-106.2	0	0	0	118.9
16	I	57.3	Low	50.9	Low	154 Å²	154	141.7 Å²	141.7	79%	0.79	75%	0.754	S	S	*	*				169.3	114.6	109.5	-79	156.4	0	0	0	106.5
17	H	41.1	Very low	50.6	Low	188 Å²	188	139.7 Å²	139.7	87%	0.87	76%	0.758	S	S	*	*			trans	-66.9	145.2	162.7	-86	-90.8	0	0	0	109.3
18	P	60.8	Low	50.6	Low	102 Å²	102	136.9 Å²	136.9	66%	0.662	75%	0.748	S	S	*	*			trans	-126.2	120.8	134.9	26.8	-13.3	0	0	0	110.6	V20	P18-V20 HydrophobicContact CB-CG2 4.44Å; P18-V20 PolarHBondContact O-N 3.47Å; P18-V20 VanDerWaalsContact O-N 3.14Å
19	A	50.1	Low	51	Low	103 Å²	103	137.4 Å²	137.4	85%	0.851	76%	0.761	S	S	*	*			trans	-57.4	111.1	157.5	0	0	0	0	0	108.2
20	V	55.9	Low	51.4	Low	114 Å²	114	140.3 Å²	140.3	69%	0.691	76%	0.761	S	S	*	*			trans	-110.5	94.1	165.9	-170.2	0	0	0	0	107	P18 F22	P18-V20 HydrophobicContact CB-CG2 4.44Å; P18-V20 PolarHBondContact O-N 3.47Å; P18-V20 VanDerWaalsContact O-N 3.14Å; V20-F22 PolarHBondContact O-N 3.3Å; V20-F22 VanDerWaalsContact O-N 3.15Å
21	L	45.5	Very low	51.9	Low	161 Å²	161	134.9 Å²	134.9	84%	0.843	75%	0.75	S	S	*	*			trans	-64.6	98.1	165.6	176.6	69.7	0	0	0	108.1
22	F	51.7	Low	52.2	Low	180 Å²	180	139 Å²	139	79%	0.789	77%	0.766	S	S	*	*			trans	-100.1	107.6	171.6	-151.8	-96.4	0	0	0	109.2	V20 A24	V20-F22 PolarHBondContact O-N 3.3Å; V20-F22 VanDerWaalsContact O-N 3.15Å; F22-A24 PolarHBondContact O-N 3.4Å
23	K	51.2	Low	52.4	Low	190 Å²	190	134.7 Å²	134.7	83%	0.826	75%	0.754	S	S	*	*			trans	-69.8	112.2	168.1	-91.1	174.4	164.8	148.7	0	108.3
24	A	50.9	Low	52.2	Low	89 Å²	89	137.3 Å²	137.3	74%	0.736	76%	0.756	S	S	*	*			trans	-108.9	107.8	164.7	0	0	0	0	0	108.7	F22	F22-A24 PolarHBondContact O-N 3.4Å
25	D	53.8	Low	52.3	Low	134 Å²	134	137.3 Å²	137.3	72%	0.717	76%	0.756	S	S	*	*			trans	-67.3	129.5	165.7	-163.7	-104.6	0	0	0	108
26	K	58.5	Low	53	Low	185 Å²	185	135 Å²	135	80%	0.804	75%	0.751	S	S	*	*	S	Bend	trans	51.6	103.6	164.3	-63.6	175.7	-170.1	166.9	0	117.4
27	G	52.3	Low	52.8	Low	78 Å²	78	129.8 Å²	129.8	80%	0.804	73%	0.728	S	S	*	*	S	Bend	trans	108.3	121.4	145.9	0	0	0	0	0	114.5
28	A	57.1	Low	53.3	Low	73 Å²	73	128.9 Å²	128.9	60%	0.603	73%	0.726	S	S	*	*			trans	77.9	98.6	170.3	0	0	0	0	0	116.9	F30	A28-F30 HydrophobicContact CB-CD2 4.06Å; A28-F30 HydrophobicContact CB-CE1 4.44Å; A28-F30 HydrophobicContact CB-CE2 3.35Å; A28-F30 HydrophobicContact CB-CZ 3.58Å
29	S	57.4	Low	53.2	Low	122 Å²	122	129.9 Å²	129.9	85%	0.853	73%	0.73	S	S	*	*			trans	-77	114.1	159.2	177.5	0	0	0	0	108.5
30	F	53.6	Low	53.4	Low	180 Å²	180	129.6 Å²	129.6	79%	0.789	72%	0.718	S	S	*	*			trans	-112.1	113.8	164.5	-57.2	-72.4	0	0	0	107.3	A28	A28-F30 HydrophobicContact CB-CD2 4.06Å; A28-F30 HydrophobicContact CB-CE1 4.44Å; A28-F30 HydrophobicContact CB-CE2 3.35Å; A28-F30 HydrophobicContact CB-CZ 3.58Å
31	G	55.7	Low	53	Low	52 Å²	52	128.3 Å²	128.3	54%	0.536	73%	0.728	S	S	.	*			trans	-63.2	152.5	-172.1	0	0	0	0	0	114	H33	G31-H33 PolarHBondContact O-N 3.02Å
32	L	55.6	Low	53	Low	161 Å²	161	129.4 Å²	129.4	84%	0.843	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-44.4	-10.6	179.7	-140.5	80.3	0	0	0	116.8	F34 L35	L32-F34 PolarHBondContact O-N 3.43Å; L32-L35 PolarHBondContact O-N 3.17Å
33	H	52.1	Low	52.4	Low	118 Å²	118	125.4 Å²	125.4	55%	0.546	72%	0.721	S	S	.	*	G	3₁₀ helix	trans	-63.8	-19.9	-178	-160.4	-150.1	0	0	0	113.8	G31 F44	G31-H33 PolarHBondContact O-N 3.02Å; H33-F44 AromaticContact CE1-CE1 3.59Å; H33-F44 AromaticContact CE1-CE2 3.09Å; H33-F44 WeakPolarHBondContact CE1-CE2 3.38Å; H33-F44 AromaticContact CE1-CZ 2.81Å; H33-F44 WeakPolarHBondContact CE1-CZ 3.12Å; H33-F44 AromaticContact ND1-CE1 3.51Å; H33-F44 AromaticContact ND1-CE2 3.87Å; H33-F44 AromaticContact ND1-CZ 3.11Å; H33-F44 WeakPolarHBondContact ND1-CZ 3.47Å; H33-F44 AromaticContact NE2-CE2 3.59Å; H33-F44 AromaticContact NE2-CZ 3.63Å
34	F	49	Very low	52	Low	171 Å²	171	120.3 Å²	120.3	75%	0.75	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-76	-27.3	-177.5	-166.7	-103.7	0	0	0	114.1	L32	L32-F34 PolarHBondContact O-N 3.43Å
35	L	51.3	Low	52.3	Low	148 Å²	148	122.4 Å²	122.4	78%	0.775	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-24.9	-172.3	-113.3	84.9	0	0	0	115.2	L32 C37	L32-L35 PolarHBondContact O-N 3.17Å; L35-C37 PolarHBondContact O-N 3.26Å
36	L	51.6	Low	52.1	Low	131 Å²	131	120.3 Å²	120.3	69%	0.686	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-74.4	-10.4	-179.9	-80.2	164.9	0	0	0	113.7	M38	L36-M38 PolarHBondContact O-N 3.26Å
37	C	53.7	Low	51.6	Low	45 Å²	45	118.7 Å²	118.7	30%	0.304	69%	0.689	S	S	.	*	G	3₁₀ helix	trans	-76.4	-14.9	-173	-175.3	0	0	0	0	114.9	L35 F44	L35-C37 PolarHBondContact O-N 3.26Å; C37-F44 HydrophobicContact CB-CB 4.38Å; C37-F44 HydrophobicContact CB-CD1 4.35Å; C37-F44 VanDerWaalsContact SG-CB 3.57Å
38	M	51.2	Low	51.7	Low	170 Å²	170	118.9 Å²	118.9	84%	0.837	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-91.7	-10	-168.7	-71.4	-75.9	-82.8	0	0	115.3	L36	L36-M38 PolarHBondContact O-N 3.26Å
39	T	60.1	Low	51.2	Low	122 Å²	122	118.8 Å²	118.8	75%	0.748	68%	0.683	S	S	*	*	S	Bend	trans	-119.2	-2.7	-169.4	56.4	0	0	0	0	115.3
40	T	53.2	Low	50.5	Low	97 Å²	97	120.6 Å²	120.6	60%	0.595	68%	0.677	S	S	*	*	S	Bend	trans	-127.9	118	175.1	49	0	0	0	0	109.2	F42	T40-F42 VanDerWaalsContact C-N 3.3Å; T40-F42 PolarHBondContact O-N 3.25Å
41	G	47	Very low	49.7	Very low	87 Å²	87	117 Å²	117	90%	0.897	67%	0.666	S	S	*	*	S	Bend	trans	-63	89	171.2	0	0	0	0	0	111.1
42	F	47.1	Very low	49.2	Very low	185 Å²	185	117.1 Å²	117.1	81%	0.811	66%	0.659	S	S	*	*	S	Bend	trans	-164.4	128.7	153	-138.4	-104.5	0	0	0	106.8	T40 F44	T40-F42 VanDerWaalsContact C-N 3.3Å; T40-F42 PolarHBondContact O-N 3.25Å; F42-F44 PolarHBondContact O-N 3.27Å
43	S	38.9	Very low	48.8	Very low	96 Å²	96	112.6 Å²	112.6	67%	0.671	64%	0.638	S	S	*	*			trans	-37.6	117	-177.7	41.6	0	0	0	0	115.6
44	F	42.3	Very low	48.6	Very low	82 Å²	82	112.8 Å²	112.8	36%	0.36	65%	0.648	S	S	.	*			trans	-124.7	93.6	159.9	-173.8	-96.1	0	0	0	109.4	H33 C37 F42 L47	H33-F44 AromaticContact CE1-CE1 3.59Å; H33-F44 AromaticContact CE1-CE2 3.09Å; H33-F44 WeakPolarHBondContact CE1-CE2 3.38Å; H33-F44 AromaticContact CE1-CZ 2.81Å; H33-F44 WeakPolarHBondContact CE1-CZ 3.12Å; H33-F44 AromaticContact ND1-CE1 3.51Å; H33-F44 AromaticContact ND1-CE2 3.87Å; H33-F44 AromaticContact ND1-CZ 3.11Å; H33-F44 WeakPolarHBondContact ND1-CZ 3.47Å; H33-F44 AromaticContact NE2-CE2 3.59Å; H33-F44 AromaticContact NE2-CZ 3.63Å; C37-F44 HydrophobicContact CB-CB 4.38Å; C37-F44 HydrophobicContact CB-CD1 4.35Å; C37-F44 VanDerWaalsContact SG-CB 3.57Å; F42-F44 PolarHBondContact O-N 3.27Å; F44-L47 HydrophobicContact CZ-CB 4.19Å
45	I	56.2	Low	48.4	Very low	133 Å²	133	111 Å²	111	68%	0.682	65%	0.651	S	S	*	*			trans	-71.8	142.5	174.6	-62.7	165.4	0	0	0	107.2	L47	I45-L47 PolarHBondContact O-N 3.06Å
46	P	50.1	Low	48.4	Very low	91 Å²	91	108.2 Å²	108.2	59%	0.591	64%	0.636	S	S	*	*			trans	-57.1	109.6	-178	-18.9	29.8	0	0	0	110.9	A48	P46-A48 PolarHBondContact O-N 3.34Å; P46-A48 VanDerWaalsContact O-N 3.14Å
47	L	48.1	Very low	48	Very low	150 Å²	150	104.8 Å²	104.8	79%	0.785	63%	0.627	S	S	*	*	S	Bend	trans	-86.6	60.1	166.3	-166.3	63.6	0	0	0	108.6	F44 I45	F44-L47 HydrophobicContact CZ-CB 4.19Å; I45-L47 PolarHBondContact O-N 3.06Å
48	A	53.8	Low	47.7	Very low	83 Å²	83	108.8 Å²	108.8	69%	0.686	64%	0.639	S	S	*	*	S	Bend	trans	-156.5	103.6	169	0	0	0	0	0	105.6	P46	P46-A48 PolarHBondContact O-N 3.34Å; P46-A48 VanDerWaalsContact O-N 3.14Å
49	A	48	Very low	47.4	Very low	71 Å²	71	104.8 Å²	104.8	59%	0.587	63%	0.627	S	S	*	*			trans	58.8	99.6	-154.3	0	0	0	0	0	112.4	D51	A49-D51 PolarHBondContact O-N 2.92Å
50	H	41	Very low	46.8	Very low	160 Å²	160	105.7 Å²	105.7	74%	0.741	63%	0.625	S	S	*	*			trans	-64.3	85.2	135.2	-158.3	-67.4	0	0	0	103.5	S52	H50-S52 VanDerWaalsContact ND1-CA 3.32Å; H50-S52 WeakPolarHBondContact ND1-CA 3.47Å; H50-S52 WeakPolarHBondContact ND1-CB 3.34Å; H50-S52 PolarHBondContact ND1-N 3.1Å; H50-S52 PolarHBondContact O-N 3.31Å
51	D	38.3	Very low	46.9	Very low	103 Å²	103	106.6 Å²	106.6	55%	0.551	62%	0.622	S	S	*	*			trans	-58	88.9	143	-93.8	-2.9	0	0	0	104.1	A49 T53	A49-D51 PolarHBondContact O-N 2.92Å; D51-T53 WeakPolarHBondContact CA-OG1 3.46Å; D51-T53 VanDerWaalsContact CB-CB 3.42Å; D51-T53 WeakPolarHBondContact CB-O 3.46Å; D51-T53 WeakPolarHBondContact CB-OG1 3.45Å; D51-T53 PolarHBondContact O-N 3.36Å; D51-T53 WeakPolarHBondContact OD1-CB 3.5Å; D51-T53 PolarHBondContact OD1-OG1 2.96Å
52	S	44.2	Very low	47.3	Very low	55 Å²	55	106.1 Å²	106.1	39%	0.385	61%	0.609	S	S	.	*			trans	-65.6	41.1	141.2	-160.9	0	0	0	0	107.9	H50 N56	H50-S52 VanDerWaalsContact ND1-CA 3.32Å; H50-S52 WeakPolarHBondContact ND1-CA 3.47Å; H50-S52 WeakPolarHBondContact ND1-CB 3.34Å; H50-S52 PolarHBondContact ND1-N 3.1Å; H50-S52 PolarHBondContact O-N 3.31Å; S52-N56 PolarHBondContact OG-ND2 3Å; S52-N56 VanDerWaalsContact OG-ND2 3.15Å
53	T	47.7	Very low	47.9	Very low	67 Å²	67	105.6 Å²	105.6	41%	0.411	61%	0.612	S	S	.	*			trans	-139.3	58.3	-168.5	-29	0	0	0	0	102.7	D51 A57	D51-T53 WeakPolarHBondContact CA-OG1 3.46Å; D51-T53 VanDerWaalsContact CB-CB 3.42Å; D51-T53 WeakPolarHBondContact CB-O 3.46Å; D51-T53 WeakPolarHBondContact CB-OG1 3.45Å; D51-T53 PolarHBondContact O-N 3.36Å; D51-T53 WeakPolarHBondContact OD1-CB 3.5Å; D51-T53 PolarHBondContact OD1-OG1 2.96Å; T53-A57 HydrophobicContact CG2-CB 4.25Å
54	T	47	Very low	49.4	Very low	122 Å²	122	106 Å²	106	75%	0.748	61%	0.61	S	S	*	*	S	Bend		-157.4	-21.8	128.5	-75.4	0	0	0	0	112.1
55	V	46	Very low	50.9	Low	134 Å²	134	113 Å²	113	81%	0.812	63%	0.634	S	S	*	*	S	Bend	trans	-97.8	-14.2	174.2	-62.8	0	0	0	0	114.3
56	N	50.6	Low	52.2	Low	88 Å²	88	111.5 Å²	111.5	47%	0.471	62%	0.623	S	S	.	*	S	Bend	trans	-109.6	-6.4	169.1	-75.9	-39.7	0	0	0	113.6	S52 F58 C59	S52-N56 PolarHBondContact OG-ND2 3Å; S52-N56 VanDerWaalsContact OG-ND2 3.15Å; N56-F58 PolarHBondContact O-N 2.85Å; N56-C59 WeakPolarHBondContact O-CB 3.4Å; N56-C59 PolarHBondContact O-N 3.11Å
57	A	43.5	Very low	53.9	Low	59 Å²	59	113.6 Å²	113.6	49%	0.488	63%	0.629	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.9	-14.4	176.9	0	0	0	0	0	113.9	T53 C59	T53-A57 HydrophobicContact CG2-CB 4.25Å; A57-C59 VanDerWaalsContact C-N 3.3Å
58	F	47.5	Very low	55.9	Low	130 Å²	130	108.5 Å²	108.5	57%	0.57	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-10.3	170.7	-149.8	-94.6	0	0	0	112.8	N56 R93	N56-F58 PolarHBondContact O-N 2.85Å; F58-R93 HydrophobicContact CZ-CB 3.94Å; F58-R93 HydrophobicContact CZ-CG 4.01Å
59	C	45.4	Very low	57.7	Low	85 Å²	85	108.1 Å²	108.1	57%	0.574	59%	0.586	S	S	*	*	S	Bend	trans	-87.5	-15	-170.6	-162.6	0	0	0	0	114	N56 A57	N56-C59 WeakPolarHBondContact O-CB 3.4Å; N56-C59 PolarHBondContact O-N 3.11Å; A57-C59 VanDerWaalsContact C-N 3.3Å
60	M	46.9	Very low	59.8	Low	142 Å²	142	104.7 Å²	104.7	70%	0.7	56%	0.558	S	S	*	*			trans	-131	42.9	-171.9	-65	-66.9	147.8	0	0	112.5	A62	M60-A62 PolarHBondContact O-N 2.64Å
61	Q	56.2	Low	62.3	Low	116 Å²	116	98.1 Å²	98.1	54%	0.542	53%	0.533	S	S	.	.	S	Bend	trans	-60.8	109.6	161.1	-160.3	165.4	87.5	0	0	105.8	M63	Q61-M63 PolarHBondContact O-N 3.23Å
62	A	55.1	Low	65	Low	76 Å²	76	96 Å²	96	63%	0.628	52%	0.52	S	S	*	.			trans	-29.5	127.8	-169	0	0	0	0	0	112	M60 T64	M60-A62 PolarHBondContact O-N 2.64Å; A62-T64 PolarHBondContact O-N 3.37Å; A62-T64 PolarHBondContact O-OG1 3.09Å
63	M	59.8	Low	67.4	Low	175 Å²	175	94.9 Å²	94.9	86%	0.862	51%	0.507	S	S	*	.			trans	-61.5	39.9	-167.6	-165.5	167.8	-78.9	0	0	114.9	Q61 R65	Q61-M63 PolarHBondContact O-N 3.23Å; M63-R65 PolarHBondContact O-N 3.29Å
64	T	69.4	Low	69.7	Low	105 Å²	105	93.8 Å²	93.8	64%	0.644	50%	0.499	S	S	*	.			trans	-64.9	117.5	161.7	60.9	0	0	0	0	107.8	A62 K66	A62-T64 PolarHBondContact O-N 3.37Å; A62-T64 PolarHBondContact O-OG1 3.09Å; T64-K66 PolarHBondContact O-N 2.96Å; T64-K66 VanDerWaalsContact O-N 3.09Å
65	R	74.7	Confident	72	Confident	228 Å²	228	92.8 Å²	92.8	86%	0.86	49%	0.486	S	S	*	.			trans	-65.5	112.3	173.6	-60.9	-175	-52.7	-167.5	-0.2	107.8	M63	M63-R65 PolarHBondContact O-N 3.29Å
66	K	83.4	Confident	74.4	Confident	101 Å²	101	86.4 Å²	86.4	44%	0.439	45%	0.447	S	S	.	.			trans	-78.1	131.7	173.8	-65.5	-179	-176.9	175.3	0	109.7	T64 Y68	T64-K66 PolarHBondContact O-N 2.96Å; T64-K66 VanDerWaalsContact O-N 3.09Å; K66-Y68 HydrophobicContact CB-CD2 4.42Å; K66-Y68 HydrophobicContact CB-CE1 4.23Å; K66-Y68 HydrophobicContact CB-CE2 3.61Å; K66-Y68 WeakPolarHBondContact CD-OH 3.43Å; K66-Y68 WeakPolarHBondContact O-CD2 3.13Å; K66-Y68 WeakPolarHBondContact O-CE2 3.47Å
67	N	85.4	Confident	76.5	Confident	135 Å²	135	82.3 Å²	82.3	72%	0.722	43%	0.425	S	S	*	.			trans	-87.4	137.3	168.1	-70.4	-22.5	0	0	0	109
68	Y	90.6	Very high	79	Confident	44 Å²	44	85.7 Å²	85.7	17%	0.173	43%	0.429	C	S	.	.			trans	-127.2	122.8	-179.6	-59.2	-82.4	0	0	0	109.4	K66 F72 K73 I94 M98 W102	K66-Y68 HydrophobicContact CB-CD2 4.42Å; K66-Y68 HydrophobicContact CB-CE1 4.23Å; K66-Y68 HydrophobicContact CB-CE2 3.61Å; K66-Y68 WeakPolarHBondContact CD-OH 3.43Å; K66-Y68 WeakPolarHBondContact O-CD2 3.13Å; K66-Y68 WeakPolarHBondContact O-CE2 3.47Å; Y68-F72 AromaticContact CD1-CD1 3.5Å; Y68-F72 HydrophobicContact CD1-CD1 3.5Å; Y68-F72 VanDerWaalsContact CD1-CD1 3.5Å; Y68-F72 AromaticContact CD1-CE1 3.31Å; Y68-F72 HydrophobicContact CD1-CE1 3.31Å; Y68-F72 HydrophobicContact CD1-CZ 4.23Å; Y68-F72 HydrophobicContact CE1-CD1 4.36Å; Y68-F72 AromaticContact CE1-CE1 3.72Å; Y68-F72 HydrophobicContact CE1-CE1 3.72Å; Y68-F72 HydrophobicContact CE1-CZ 4.36Å; Y68-F72 HydrophobicContact CG-CD1 4.17Å; Y68-F72 HydrophobicContact CG-CE1 4.28Å; Y68-K73 WeakPolarHBondContact O-CE 3.45Å; Y68-K73 PolarHBondContact O-NZ 3.27Å; Y68-I94 HydrophobicContact CE1-CG2 4.16Å; Y68-M98 HydrophobicContact CD2-CE 3.8Å; Y68-M98 HydrophobicContact CE2-CE 3.15Å; Y68-W102 HydrophobicContact CD1-CH2 4.05Å; Y68-W102 AromaticContact CD2-CH2 3.97Å; Y68-W102 HydrophobicContact CD2-CH2 3.97Å; Y68-W102 AromaticContact CD2-CZ2 3.81Å; Y68-W102 HydrophobicContact CD2-CZ2 3.81Å; Y68-W102 HydrophobicContact CE1-CH2 4.33Å; Y68-W102 HydrophobicContact CE2-CH2 4.3Å; Y68-W102 HydrophobicContact CE2-CZ2 4.35Å; Y68-W102 AromaticContact CG-CH2 3.82Å; Y68-W102 HydrophobicContact CG-CH2 3.82Å; Y68-W102 AromaticContact CG-CZ2 3.96Å; Y68-W102 HydrophobicContact CG-CZ2 3.96Å
69	N	92	Very high	81.3	Confident	74 Å²	74	81.3 Å²	81.3	40%	0.396	41%	0.411	S	S	.	.			trans	-62.9	150	175.1	-66.6	1.2	0	0	0	110.7	G71 F72 K73 K114 C117	N69-G71 PolarHBondContact O-N 3.46Å; N69-F72 WeakPolarHBondContact O-CB 3.35Å; N69-F72 PolarHBondContact O-N 3.49Å; N69-F72 VanDerWaalsContact O-N 3.16Å; N69-K73 WeakPolarHBondContact O-CG 3.36Å; N69-K73 PolarHBondContact O-N 3.47Å; N69-K73 VanDerWaalsContact O-N 3.08Å; N69-K114 WeakPolarHBondContact CB-O 3.09Å; N69-C117 PolarHBondContact OD1-SG 3.15Å
70	A	92.2	Very high	83.7	Confident	0 Å²	0	77.4 Å²	77.4	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-57.3	-39.2	177.3	0	0	0	0	0	112.2	F72 K73 L74 L109 M112 P113 K114 Q116	A70-F72 PolarHBondContact O-N 3.31Å; A70-K73 PolarHBondContact O-N 2.97Å; A70-L74 WeakPolarHBondContact O-CG 3.36Å; A70-L74 PolarHBondContact O-N 2.96Å; A70-L109 HydrophobicContact CB-CD2 4.48Å; A70-M112 HydrophobicContact CB-CB 3.95Å; A70-P113 WeakPolarHBondContact CB-O 3.4Å; A70-K114 PolarHBondContact N-O 3.13Å; A70-Q116 WeakPolarHBondContact CB-O 3.2Å; A70-Q116 PolarHBondContact N-O 3.44Å
71	G	93.2	Very high	85.9	Confident	22 Å²	22	75.7 Å²	75.7	23%	0.227	37%	0.373	C	S	.	.	H	α-helix	trans	-59.2	-44.5	175.6	0	0	0	0	0	113	N69 K73 L74 E75 K114	N69-G71 PolarHBondContact O-N 3.46Å; G71-K73 PolarHBondContact O-N 3.16Å; G71-L74 PolarHBondContact O-N 3.01Å; G71-E75 PolarHBondContact O-N 3.26Å; G71-K114 PolarHBondContact N-O 3.21Å
72	F	94.8	Very high	87.8	Confident	59 Å²	59	76.2 Å²	76.2	26%	0.259	38%	0.375	S	S	.	.	H	α-helix	trans	-62.4	-44.2	175.9	177	-93.9	0	0	0	111.6	Y68 N69 A70 L74 E75 V76 Y92 W102	Y68-F72 AromaticContact CD1-CD1 3.5Å; Y68-F72 HydrophobicContact CD1-CD1 3.5Å; Y68-F72 VanDerWaalsContact CD1-CD1 3.5Å; Y68-F72 AromaticContact CD1-CE1 3.31Å; Y68-F72 HydrophobicContact CD1-CE1 3.31Å; Y68-F72 HydrophobicContact CD1-CZ 4.23Å; Y68-F72 HydrophobicContact CE1-CD1 4.36Å; Y68-F72 AromaticContact CE1-CE1 3.72Å; Y68-F72 HydrophobicContact CE1-CE1 3.72Å; Y68-F72 HydrophobicContact CE1-CZ 4.36Å; Y68-F72 HydrophobicContact CG-CD1 4.17Å; Y68-F72 HydrophobicContact CG-CE1 4.28Å; N69-F72 WeakPolarHBondContact O-CB 3.35Å; N69-F72 PolarHBondContact O-N 3.49Å; N69-F72 VanDerWaalsContact O-N 3.16Å; A70-F72 PolarHBondContact O-N 3.31Å; F72-L74 VanDerWaalsContact C-N 3.28Å; F72-L74 PolarHBondContact O-N 3.24Å; F72-E75 PolarHBondContact O-N 2.99Å; F72-V76 HydrophobicContact CD1-CG2 4.1Å; F72-V76 HydrophobicContact CE1-CG2 3.67Å; F72-V76 HydrophobicContact CE2-CG2 4.37Å; F72-V76 HydrophobicContact CZ-CG2 3.83Å; F72-V76 WeakPolarHBondContact O-CG2 3.12Å; F72-V76 PolarHBondContact O-N 3.21Å; F72-Y92 AromaticContact CE2-CD1 3.9Å; F72-Y92 HydrophobicContact CE2-CD1 3.9Å; F72-Y92 HydrophobicContact CE2-CE1 4.36Å; F72-Y92 AromaticContact CZ-CD1 3.97Å; F72-Y92 HydrophobicContact CZ-CD1 3.97Å; F72-Y92 HydrophobicContact CZ-CG 4.31Å; F72-W102 HydrophobicContact CD1-CH2 4.43Å; F72-W102 HydrophobicContact CE1-CH2 4.16Å; F72-W102 HydrophobicContact CE1-CZ3 4.19Å
73	K	94.7	Very high	89.6	Confident	30 Å²	30	75 Å²	75	13%	0.13	36%	0.363	C	S	.	.	H	α-helix	trans	-60.1	-40.1	177.3	-63.7	174.5	-176.6	156.2	0	111.4	Y68 N69 A70 G71 V76 V77 W102 L109 C117	Y68-K73 WeakPolarHBondContact O-CE 3.45Å; Y68-K73 PolarHBondContact O-NZ 3.27Å; N69-K73 WeakPolarHBondContact O-CG 3.36Å; N69-K73 PolarHBondContact O-N 3.47Å; N69-K73 VanDerWaalsContact O-N 3.08Å; A70-K73 PolarHBondContact O-N 2.97Å; G71-K73 PolarHBondContact O-N 3.16Å; K73-V76 PolarHBondContact O-N 2.77Å; K73-V77 VanDerWaalsContact O-CG2 3.26Å; K73-V77 WeakPolarHBondContact O-CG2 2.86Å; K73-V77 PolarHBondContact O-N 3.14Å; K73-W102 HydrophobicContact CB-CD2 4.05Å; K73-W102 HydrophobicContact CB-CE3 4.23Å; K73-W102 HydrophobicContact CB-CG 4.27Å; K73-W102 HydrophobicContact CD-CD2 4.33Å; K73-W102 HydrophobicContact CD-CG 4.45Å; K73-W102 HydrophobicContact CD-CZ2 4.24Å; K73-W102 HydrophobicContact CG-CD2 3.82Å; K73-W102 HydrophobicContact CG-CE3 4.16Å; K73-W102 HydrophobicContact CG-CG 4.3Å; K73-W102 HydrophobicContact CG-CH2 4.13Å; K73-W102 HydrophobicContact CG-CZ2 3.79Å; K73-W102 HydrophobicContact CG-CZ3 4.31Å; K73-L109 HydrophobicContact CB-CD1 3.74Å; K73-L109 HydrophobicContact CB-CD2 4.11Å; K73-L109 HydrophobicContact CD-CD1 4.39Å; K73-L109 HydrophobicContact CD-CD2 3.61Å; K73-C117 PolarHBondContact NZ-O 3.48Å
74	L	95.4	Very high	91.2	Very high	44 Å²	44	70.2 Å²	70.2	23%	0.23	34%	0.341	C	S	.	.	H	α-helix	trans	-66.3	-39.5	176.2	-73.8	171.8	0	0	0	112.6	A70 G71 F72 V77 K78 E106 L109 K110	A70-L74 WeakPolarHBondContact O-CG 3.36Å; A70-L74 PolarHBondContact O-N 2.96Å; G71-L74 PolarHBondContact O-N 3.01Å; F72-L74 VanDerWaalsContact C-N 3.28Å; F72-L74 PolarHBondContact O-N 3.24Å; L74-V77 PolarHBondContact O-N 2.75Å; L74-K78 WeakPolarHBondContact O-CB 3.33Å; L74-K78 PolarHBondContact O-N 3.08Å; L74-E106 HydrophobicContact CD2-CG 4.48Å; L74-L109 HydrophobicContact CD2-CB 3.77Å; L74-L109 HydrophobicContact CG-CB 4.06Å; L74-K110 HydrophobicContact CD2-CG 4.07Å
75	E	95.4	Very high	92.3	Very high	102 Å²	102	67 Å²	67	48%	0.477	32%	0.319	S	S	.	.	H	α-helix	trans	-62.5	-43.3	175.6	-170.9	-173.4	168.2	0	0	111.8	G71 F72 V77 K78 M79 Y92	G71-E75 PolarHBondContact O-N 3.26Å; F72-E75 PolarHBondContact O-N 2.99Å; E75-V77 VanDerWaalsContact C-N 3.32Å; E75-V77 PolarHBondContact O-N 2.87Å; E75-K78 PolarHBondContact O-N 2.99Å; E75-M79 PolarHBondContact O-N 3.2Å; E75-Y92 PolarHBondContact OE1-OH 2.96Å
76	V	95.8	Very high	93.1	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-60.5	-44.1	174.1	171.8	0	0	0	0	110.8	F72 K73 M79 A80 A88 Y92 I94 V99 W102	F72-V76 HydrophobicContact CD1-CG2 4.1Å; F72-V76 HydrophobicContact CE1-CG2 3.67Å; F72-V76 HydrophobicContact CE2-CG2 4.37Å; F72-V76 HydrophobicContact CZ-CG2 3.83Å; F72-V76 WeakPolarHBondContact O-CG2 3.12Å; F72-V76 PolarHBondContact O-N 3.21Å; K73-V76 PolarHBondContact O-N 2.77Å; V76-M79 PolarHBondContact O-N 2.79Å; V76-A80 VanDerWaalsContact O-CB 3.3Å; V76-A80 WeakPolarHBondContact O-CB 3.3Å; V76-A80 PolarHBondContact O-N 2.82Å; V76-A88 HydrophobicContact CG1-CB 4.48Å; V76-Y92 HydrophobicContact CB-CD2 4.32Å; V76-Y92 HydrophobicContact CB-CE2 4.3Å; V76-Y92 HydrophobicContact CG1-CD2 4.28Å; V76-Y92 HydrophobicContact CG2-CD1 4.2Å; V76-Y92 HydrophobicContact CG2-CD2 3.66Å; V76-Y92 HydrophobicContact CG2-CE1 4.4Å; V76-Y92 HydrophobicContact CG2-CE2 3.87Å; V76-Y92 HydrophobicContact CG2-CG 3.84Å; V76-I94 HydrophobicContact CB-CD1 4.34Å; V76-I94 HydrophobicContact CG1-CD1 3.35Å; V76-I94 HydrophobicContact CG2-CD1 4.04Å; V76-V99 HydrophobicContact CG1-CG1 4.48Å; V76-V99 HydrophobicContact CG1-CG2 4.02Å; V76-W102 HydrophobicContact CB-CE3 4.11Å; V76-W102 HydrophobicContact CB-CZ3 4.12Å; V76-W102 HydrophobicContact CG1-CE3 3.85Å; V76-W102 HydrophobicContact CG1-CZ3 3.95Å; V76-W102 HydrophobicContact CG2-CZ3 4.04Å
77	V	95.5	Very high	93.6	Very high	2 Å²	2	57.2 Å²	57.2	1%	0.012	29%	0.29	C	S	.	.	H	α-helix	trans	-64.3	-43.5	178.1	166.7	0	0	0	0	111.3	K73 L74 E75 A80 K81 W102 R103 E106	K73-V77 VanDerWaalsContact O-CG2 3.26Å; K73-V77 WeakPolarHBondContact O-CG2 2.86Å; K73-V77 PolarHBondContact O-N 3.14Å; L74-V77 PolarHBondContact O-N 2.75Å; E75-V77 VanDerWaalsContact C-N 3.32Å; E75-V77 PolarHBondContact O-N 2.87Å; V77-A80 PolarHBondContact O-N 3.23Å; V77-K81 WeakPolarHBondContact O-CG 3.49Å; V77-K81 PolarHBondContact O-N 3.45Å; V77-W102 HydrophobicContact CG2-CB 3.69Å; V77-R103 HydrophobicContact CG1-CG 4.17Å; V77-R103 HydrophobicContact CG2-CG 4.08Å; V77-E106 HydrophobicContact CG1-CB 4.39Å; V77-E106 HydrophobicContact CG1-CG 4.04Å
78	K	96.1	Very high	94	Very high	129 Å²	129	50.8 Å²	50.8	56%	0.561	26%	0.256	S	S	*	.	H	α-helix	trans	-57.3	-50.6	175.4	-179.6	178.5	173.5	-177.8	0	110.8	L74 E75 A80 K81 E82	L74-K78 WeakPolarHBondContact O-CB 3.33Å; L74-K78 PolarHBondContact O-N 3.08Å; E75-K78 PolarHBondContact O-N 2.99Å; K78-A80 VanDerWaalsContact C-N 3.32Å; K78-A80 PolarHBondContact O-N 3.42Å; K78-K81 WeakPolarHBondContact O-CB 3.28Å; K78-K81 PolarHBondContact O-N 3.47Å; K78-K81 VanDerWaalsContact O-N 3.13Å; K78-E82 WeakPolarHBondContact CE-OE1 3.5Å; K78-E82 WeakPolarHBondContact CG-OE1 3.25Å; K78-E82 IonicContact NZ-OE1 3.99Å; K78-E82 WeakPolarHBondContact O-CG 3.38Å; K78-E82 PolarHBondContact O-N 3.01Å
79	M	95.2	Very high	94.2	Very high	39 Å²	39	50.1 Å²	50.1	19%	0.192	26%	0.256	C	S	.	.	H	α-helix	trans	-62.2	-39.4	177.9	180	75.7	-72	0	0	112.5	E75 V76 K81 E82 S83 K91 Y92	E75-M79 PolarHBondContact O-N 3.2Å; V76-M79 PolarHBondContact O-N 2.79Å; M79-K81 VanDerWaalsContact C-N 3.26Å; M79-K81 PolarHBondContact O-N 3.24Å; M79-E82 HydrophobicContact CE-CB 3.81Å; M79-E82 PolarHBondContact O-N 3.47Å; M79-S83 WeakPolarHBondContact CE-OG 3.26Å; M79-S83 PolarHBondContact O-N 3.02Å; M79-S83 PolarHBondContact O-OG 3.35Å; M79-K91 HydrophobicContact CG-CD 4.43Å; M79-K91 HydrophobicContact SD-CD 4.3Å; M79-Y92 HydrophobicContact CB-CE2 4.06Å; M79-Y92 HydrophobicContact CG-CE2 4.16Å
80	A	95	Very high	94.2	Very high	2 Å²	2	55.6 Å²	55.6	2%	0.017	27%	0.271	C	S	.	.	H	α-helix	trans	-68	-24.9	178.8	0	0	0	0	0	113.3	V76 V77 K78 A88 V99 R103	V76-A80 VanDerWaalsContact O-CB 3.3Å; V76-A80 WeakPolarHBondContact O-CB 3.3Å; V76-A80 PolarHBondContact O-N 2.82Å; V77-A80 PolarHBondContact O-N 3.23Å; K78-A80 VanDerWaalsContact C-N 3.32Å; K78-A80 PolarHBondContact O-N 3.42Å; A80-A88 HydrophobicContact CB-CB 4.03Å; A80-V99 HydrophobicContact CB-CG1 3.6Å; A80-R103 PolarHBondContact O-NH1 2.94Å
81	K	94.7	Very high	94.3	Very high	106 Å²	106	61.5 Å²	61.5	46%	0.461	30%	0.297	S	S	.	.	H	α-helix	trans	-78.8	-41.5	171.9	-75.5	-177.9	170.4	-172.5	0	112.6	V77 K78 M79 E106	V77-K81 WeakPolarHBondContact O-CG 3.49Å; V77-K81 PolarHBondContact O-N 3.45Å; K78-K81 WeakPolarHBondContact O-CB 3.28Å; K78-K81 PolarHBondContact O-N 3.47Å; K78-K81 VanDerWaalsContact O-N 3.13Å; M79-K81 VanDerWaalsContact C-N 3.26Å; M79-K81 PolarHBondContact O-N 3.24Å; K81-E106 WeakPolarHBondContact CE-OE2 3.46Å; K81-E106 IonicContact NZ-OE1 3.41Å; K81-E106 PolarHBondContact NZ-OE1 3.24Å; K81-E106 IonicContact NZ-OE2 3.33Å; K81-E106 PolarHBondContact NZ-OE2 2.67Å
82	E	95.3	Very high	94.3	Very high	127 Å²	127	62.3 Å²	62.3	59%	0.593	29%	0.293	S	S	*	.	H	α-helix	trans	-72.6	-36.2	-177.9	-71.9	169.3	178.2	0	0	113	K78 M79	K78-E82 WeakPolarHBondContact CE-OE1 3.5Å; K78-E82 WeakPolarHBondContact CG-OE1 3.25Å; K78-E82 IonicContact NZ-OE1 3.99Å; K78-E82 WeakPolarHBondContact O-CG 3.38Å; K78-E82 PolarHBondContact O-N 3.01Å; M79-E82 HydrophobicContact CE-CB 3.81Å; M79-E82 PolarHBondContact O-N 3.47Å
83	S	92.7	Very high	94.1	Very high	52 Å²	52	67.1 Å²	67.1	36%	0.364	31%	0.31	S	S	.	.	S	Bend	trans	-111.9	-96.1	-178.3	63.3	0	0	0	0	111	M79 Q87	M79-S83 WeakPolarHBondContact CE-OG 3.26Å; M79-S83 PolarHBondContact O-N 3.02Å; M79-S83 PolarHBondContact O-OG 3.35Å; S83-Q87 WeakPolarHBondContact OG-CB 3.22Å
84	N	92.8	Very high	93.9	Very high	74 Å²	74	66 Å²	66	40%	0.396	31%	0.305	S	S	.	.			trans	-162.4	169.3	170.2	61	58.9	0	0	0	109.8	A86 Q87 A88	N84-A86 VanDerWaalsContact C-N 3.26Å; N84-A86 PolarHBondContact O-N 2.99Å; N84-A86 WeakPolarHBondContact OD1-CA 3.46Å; N84-A86 WeakPolarHBondContact OD1-CB 3.45Å; N84-A86 PolarHBondContact OD1-N 3.36Å; N84-Q87 PolarHBondContact O-N 3.21Å; N84-Q87 WeakPolarHBondContact OD1-CG 3.44Å; N84-Q87 PolarHBondContact OD1-N 2.99Å; N84-A88 PolarHBondContact O-N 2.83Å
85	N	92.7	Very high	93.7	Very high	36 Å²	36	67.8 Å²	67.8	19%	0.193	32%	0.318	C	S	.	.	H	α-helix	trans	-63.2	-31	179.9	-61.7	-30.7	0	0	0	112.9	A88 V89 V99 R103	N85-A88 PolarHBondContact O-N 3.35Å; N85-V89 VanDerWaalsContact O-CG2 3.28Å; N85-V89 WeakPolarHBondContact O-CG2 3.32Å; N85-V89 PolarHBondContact O-N 2.96Å; N85-V99 HydrophobicContact CB-CG1 4.2Å; N85-R103 WeakPolarHBondContact OD1-CD 3.49Å; N85-R103 PolarHBondContact OD1-NH1 2.94Å
86	A	92.4	Very high	93.5	Very high	30 Å²	30	69.8 Å²	69.8	25%	0.248	32%	0.321	C	S	.	.	H	α-helix	trans	-71.8	-37.1	-177.8	0	0	0	0	0	112.1	N84 V89 R90	N84-A86 VanDerWaalsContact C-N 3.26Å; N84-A86 PolarHBondContact O-N 2.99Å; N84-A86 WeakPolarHBondContact OD1-CA 3.46Å; N84-A86 WeakPolarHBondContact OD1-CB 3.45Å; N84-A86 PolarHBondContact OD1-N 3.36Å; A86-V89 PolarHBondContact O-N 3.42Å; A86-R90 WeakPolarHBondContact O-CG 3.11Å; A86-R90 PolarHBondContact O-N 3.48Å
87	Q	93.6	Very high	93.4	Very high	95 Å²	95	78 Å²	78	44%	0.444	36%	0.357	S	S	.	.	H	α-helix	trans	-64.1	-44.5	173.2	-72.9	-66.6	-8.3	0	0	110.8	S83 N84 V89 R90 K91	S83-Q87 WeakPolarHBondContact OG-CB 3.22Å; N84-Q87 PolarHBondContact O-N 3.21Å; N84-Q87 WeakPolarHBondContact OD1-CG 3.44Å; N84-Q87 PolarHBondContact OD1-N 2.99Å; Q87-V89 VanDerWaalsContact C-N 3.35Å; Q87-V89 PolarHBondContact O-N 3.38Å; Q87-R90 PolarHBondContact O-N 3.44Å; Q87-K91 WeakPolarHBondContact O-CB 3.44Å; Q87-K91 PolarHBondContact O-N 3.46Å
88	A	94.2	Very high	93.3	Very high	0 Å²	0	80.2 Å²	80.2	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-60	-43	175	0	0	0	0	0	112.4	V76 A80 N84 N85 R90 K91 Y92 V99	V76-A88 HydrophobicContact CG1-CB 4.48Å; A80-A88 HydrophobicContact CB-CB 4.03Å; N84-A88 PolarHBondContact O-N 2.83Å; N85-A88 PolarHBondContact O-N 3.35Å; A88-R90 PolarHBondContact O-N 3.02Å; A88-K91 PolarHBondContact O-N 3.4Å; A88-Y92 HydrophobicContact CB-CD2 4.34Å; A88-Y92 VanDerWaalsContact O-CD2 3.25Å; A88-Y92 WeakPolarHBondContact O-CD2 3.39Å; A88-Y92 PolarHBondContact O-N 3.06Å; A88-V99 HydrophobicContact CB-CG1 4.35Å; A88-V99 HydrophobicContact CB-CG2 4.34Å
89	V	93.6	Very high	93.3	Very high	30 Å²	30	74 Å²	74	18%	0.182	34%	0.341	C	S	.	.	H	α-helix	trans	-59.1	-46.2	175.2	162.6	0	0	0	0	111.7	N85 A86 Q87 R93 I94 R96 V99	N85-V89 VanDerWaalsContact O-CG2 3.28Å; N85-V89 WeakPolarHBondContact O-CG2 3.32Å; N85-V89 PolarHBondContact O-N 2.96Å; A86-V89 PolarHBondContact O-N 3.42Å; Q87-V89 VanDerWaalsContact C-N 3.35Å; Q87-V89 PolarHBondContact O-N 3.38Å; V89-R93 VanDerWaalsContact O-CA 3.28Å; V89-R93 WeakPolarHBondContact O-CA 3.32Å; V89-R93 PolarHBondContact O-N 3.38Å; V89-I94 VanDerWaalsContact CG1-O 3.32Å; V89-I94 WeakPolarHBondContact CG1-O 3.46Å; V89-I94 WeakPolarHBondContact CG2-O 3.39Å; V89-R96 VanDerWaalsContact CG2-CA 3.49Å; V89-R96 HydrophobicContact CG2-CB 3.97Å; V89-V99 HydrophobicContact CG2-CG2 4.02Å
90	R	93.5	Very high	93.3	Very high	189 Å²	189	75.5 Å²	75.5	71%	0.713	35%	0.349	S	S	*	.	H	α-helix	trans	-64.9	-45.3	178.8	-71.6	175.6	-177.7	-155.9	0.8	111.8	A86 Q87 A88	A86-R90 WeakPolarHBondContact O-CG 3.11Å; A86-R90 PolarHBondContact O-N 3.48Å; Q87-R90 PolarHBondContact O-N 3.44Å; A88-R90 PolarHBondContact O-N 3.02Å
91	K	93.6	Very high	93.3	Very high	124 Å²	124	78.8 Å²	78.8	54%	0.539	37%	0.366	S	S	.	.	H	α-helix	trans	-66	-50.5	-177.5	-172.2	179.6	-178.4	-168.2	0	112.3	M79 Q87 A88	M79-K91 HydrophobicContact CG-CD 4.43Å; M79-K91 HydrophobicContact SD-CD 4.3Å; Q87-K91 WeakPolarHBondContact O-CB 3.44Å; Q87-K91 PolarHBondContact O-N 3.46Å; A88-K91 PolarHBondContact O-N 3.4Å
92	Y	92.6	Very high	93.3	Very high	39 Å²	39	74.4 Å²	74.4	15%	0.153	35%	0.347	C	S	.	.	H	α-helix	trans	-95.4	-3.6	-172.4	-60.1	-70.9	0	0	0	114.1	F72 E75 V76 M79 A88 I94	F72-Y92 AromaticContact CE2-CD1 3.9Å; F72-Y92 HydrophobicContact CE2-CD1 3.9Å; F72-Y92 HydrophobicContact CE2-CE1 4.36Å; F72-Y92 AromaticContact CZ-CD1 3.97Å; F72-Y92 HydrophobicContact CZ-CD1 3.97Å; F72-Y92 HydrophobicContact CZ-CG 4.31Å; E75-Y92 PolarHBondContact OE1-OH 2.96Å; V76-Y92 HydrophobicContact CB-CD2 4.32Å; V76-Y92 HydrophobicContact CB-CE2 4.3Å; V76-Y92 HydrophobicContact CG1-CD2 4.28Å; V76-Y92 HydrophobicContact CG2-CD1 4.2Å; V76-Y92 HydrophobicContact CG2-CD2 3.66Å; V76-Y92 HydrophobicContact CG2-CE1 4.4Å; V76-Y92 HydrophobicContact CG2-CE2 3.87Å; V76-Y92 HydrophobicContact CG2-CG 3.84Å; M79-Y92 HydrophobicContact CB-CE2 4.06Å; M79-Y92 HydrophobicContact CG-CE2 4.16Å; A88-Y92 HydrophobicContact CB-CD2 4.34Å; A88-Y92 VanDerWaalsContact O-CD2 3.25Å; A88-Y92 WeakPolarHBondContact O-CD2 3.39Å; A88-Y92 PolarHBondContact O-N 3.06Å; Y92-I94 PolarHBondContact O-N 3.21Å
93	R	91.1	Very high	93.3	Very high	160 Å²	160	72.8 Å²	72.8	60%	0.604	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	40.2	-176.7	-53.5	-171.8	174.9	-168.6	-2	113.1	F58 V89	F58-R93 HydrophobicContact CZ-CB 3.94Å; F58-R93 HydrophobicContact CZ-CG 4.01Å; V89-R93 VanDerWaalsContact O-CA 3.28Å; V89-R93 WeakPolarHBondContact O-CA 3.32Å; V89-R93 PolarHBondContact O-N 3.38Å
94	I	90.7	Very high	93.4	Very high	5 Å²	5	78.6 Å²	78.6	3%	0.026	35%	0.354	C	S	.	.			trans	-108.2	159.6	177.3	58.4	-177.7	0	0	0	110.3	Y68 V76 V89 Y92 M98 V99 W102	Y68-I94 HydrophobicContact CE1-CG2 4.16Å; V76-I94 HydrophobicContact CB-CD1 4.34Å; V76-I94 HydrophobicContact CG1-CD1 3.35Å; V76-I94 HydrophobicContact CG2-CD1 4.04Å; V89-I94 VanDerWaalsContact CG1-O 3.32Å; V89-I94 WeakPolarHBondContact CG1-O 3.46Å; V89-I94 WeakPolarHBondContact CG2-O 3.39Å; Y92-I94 PolarHBondContact O-N 3.21Å; I94-M98 HydrophobicContact CB-SD 4.46Å; I94-V99 HydrophobicContact CD1-CG2 3.39Å; I94-V99 HydrophobicContact CG1-CG2 3.82Å; I94-W102 HydrophobicContact CD1-CE3 4.46Å; I94-W102 HydrophobicContact CD1-CZ3 3.77Å
95	T	91.3	Very high	93.4	Very high	82 Å²	82	79.2 Å²	79.2	50%	0.503	35%	0.354	S	S	.	.			trans	-74.3	147.4	178.6	67.8	0	0	0	0	111.5	K97 M98 V99	T95-K97 PolarHBondContact O-N 3.01Å; T95-M98 WeakPolarHBondContact O-CB 3.36Å; T95-M98 PolarHBondContact O-N 2.92Å; T95-M98 VanDerWaalsContact OG1-CG 3.22Å; T95-M98 WeakPolarHBondContact OG1-CG 3.38Å; T95-M98 PolarHBondContact OG1-SD 3.39Å; T95-M98 VanDerWaalsContact OG1-SD 3.39Å; T95-V99 PolarHBondContact O-N 2.86Å
96	R	91.8	Very high	93.4	Very high	144 Å²	144	78.9 Å²	78.9	54%	0.543	35%	0.352	S	S	.	.	H	α-helix	trans	-54.7	-38.1	176.2	-174.1	-173.5	-67.1	-110.5	1	112.1	V89 M98 V99 I100	V89-R96 VanDerWaalsContact CG2-CA 3.49Å; V89-R96 HydrophobicContact CG2-CB 3.97Å; R96-M98 VanDerWaalsContact C-N 3.29Å; R96-M98 PolarHBondContact O-N 3.39Å; R96-V99 PolarHBondContact O-N 3.05Å; R96-I100 HydrophobicContact CG-CD1 3.93Å; R96-I100 HydrophobicContact CG-CG1 4.49Å; R96-I100 WeakPolarHBondContact O-CG1 3.49Å; R96-I100 PolarHBondContact O-N 3.48Å
97	K	94.1	Very high	93.4	Very high	174 Å²	174	82.9 Å²	82.9	76%	0.757	37%	0.365	S	S	*	.	H	α-helix	trans	-57.8	-41.2	178	-175.1	174.9	-179.7	177	0	111.9	T95 I100 N101	T95-K97 PolarHBondContact O-N 3.01Å; K97-I100 PolarHBondContact O-N 2.93Å; K97-N101 WeakPolarHBondContact O-CB 3.47Å; K97-N101 PolarHBondContact O-N 3.15Å
98	M	93.1	Very high	93.3	Very high	47 Å²	47	79.9 Å²	79.9	23%	0.232	36%	0.356	C	S	.	.	H	α-helix	trans	-65.5	-45.7	178.4	-68.7	167.2	74.3	0	0	111.9	Y68 I94 T95 R96 I100 N101 W102	Y68-M98 HydrophobicContact CD2-CE 3.8Å; Y68-M98 HydrophobicContact CE2-CE 3.15Å; I94-M98 HydrophobicContact CB-SD 4.46Å; T95-M98 WeakPolarHBondContact O-CB 3.36Å; T95-M98 PolarHBondContact O-N 2.92Å; T95-M98 VanDerWaalsContact OG1-CG 3.22Å; T95-M98 WeakPolarHBondContact OG1-CG 3.38Å; T95-M98 PolarHBondContact OG1-SD 3.39Å; T95-M98 VanDerWaalsContact OG1-SD 3.39Å; R96-M98 VanDerWaalsContact C-N 3.29Å; R96-M98 PolarHBondContact O-N 3.39Å; M98-I100 VanDerWaalsContact C-N 3.32Å; M98-I100 PolarHBondContact O-N 2.74Å; M98-N101 PolarHBondContact O-N 3.2Å; M98-W102 HydrophobicContact CB-CH2 4.48Å; M98-W102 HydrophobicContact CB-CZ2 4.36Å; M98-W102 HydrophobicContact CE-CH2 3.53Å; M98-W102 HydrophobicContact CE-CZ2 3.41Å; M98-W102 VanDerWaalsContact CE-CZ2 3.41Å; M98-W102 WeakPolarHBondContact O-CB 2.92Å; M98-W102 VanDerWaalsContact O-CG 3.27Å; M98-W102 PolarHBondContact O-N 3.14Å
99	V	94.8	Very high	93.2	Very high	0 Å²	0	80.2 Å²	80.2	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-58	-47	177.4	-178.8	0	0	0	0	110.7	V76 A80 N85 A88 V89 I94 T95 R96 N101 W102 R103	V76-V99 HydrophobicContact CG1-CG1 4.48Å; V76-V99 HydrophobicContact CG1-CG2 4.02Å; A80-V99 HydrophobicContact CB-CG1 3.6Å; N85-V99 HydrophobicContact CB-CG1 4.2Å; A88-V99 HydrophobicContact CB-CG1 4.35Å; A88-V99 HydrophobicContact CB-CG2 4.34Å; V89-V99 HydrophobicContact CG2-CG2 4.02Å; I94-V99 HydrophobicContact CD1-CG2 3.39Å; I94-V99 HydrophobicContact CG1-CG2 3.82Å; T95-V99 PolarHBondContact O-N 2.86Å; R96-V99 PolarHBondContact O-N 3.05Å; V99-N101 PolarHBondContact O-N 3.2Å; V99-W102 PolarHBondContact O-N 3.03Å; V99-R103 VanDerWaalsContact O-CG 3.32Å; V99-R103 WeakPolarHBondContact O-CG 3.37Å; V99-R103 PolarHBondContact O-N 2.98Å
100	I	95.4	Very high	93	Very high	69 Å²	69	83.4 Å²	83.4	35%	0.354	37%	0.37	S	S	.	.	H	α-helix	trans	-61.3	-46.1	178.2	-66	167.2	0	0	0	110.7	R96 K97 M98 R103 K104	R96-I100 HydrophobicContact CG-CD1 3.93Å; R96-I100 HydrophobicContact CG-CG1 4.49Å; R96-I100 WeakPolarHBondContact O-CG1 3.49Å; R96-I100 PolarHBondContact O-N 3.48Å; K97-I100 PolarHBondContact O-N 2.93Å; M98-I100 VanDerWaalsContact C-N 3.32Å; M98-I100 PolarHBondContact O-N 2.74Å; I100-R103 PolarHBondContact O-N 3.37Å; I100-K104 PolarHBondContact O-N 3.3Å; I100-K104 VanDerWaalsContact O-N 3.13Å
101	N	95	Very high	92.9	Very high	71 Å²	71	81.7 Å²	81.7	38%	0.38	37%	0.372	S	S	.	.	H	α-helix	trans	-63.3	-45	-179.9	-174.9	57.8	0	0	0	112.1	K97 M98 V99 R103 K104 Q105	K97-N101 WeakPolarHBondContact O-CB 3.47Å; K97-N101 PolarHBondContact O-N 3.15Å; M98-N101 PolarHBondContact O-N 3.2Å; V99-N101 PolarHBondContact O-N 3.2Å; N101-R103 VanDerWaalsContact C-N 3.31Å; N101-R103 PolarHBondContact O-N 3.02Å; N101-K104 WeakPolarHBondContact O-CB 3.47Å; N101-K104 PolarHBondContact O-N 3.38Å; N101-K104 VanDerWaalsContact O-N 3.15Å; N101-Q105 PolarHBondContact ND2-OE1 3.13Å; N101-Q105 WeakPolarHBondContact O-CG 3.32Å; N101-Q105 PolarHBondContact O-N 3.29Å
102	W	95.3	Very high	92.6	Very high	15 Å²	15	77 Å²	77	6%	0.057	35%	0.352	C	S	.	.	H	α-helix	trans	-65.3	-34.2	178.1	-64.1	-21.8	0	0	0	112.8	Y68 F72 K73 V76 V77 I94 M98 V99 K104 Q105 E106 L109	Y68-W102 HydrophobicContact CD1-CH2 4.05Å; Y68-W102 AromaticContact CD2-CH2 3.97Å; Y68-W102 HydrophobicContact CD2-CH2 3.97Å; Y68-W102 AromaticContact CD2-CZ2 3.81Å; Y68-W102 HydrophobicContact CD2-CZ2 3.81Å; Y68-W102 HydrophobicContact CE1-CH2 4.33Å; Y68-W102 HydrophobicContact CE2-CH2 4.3Å; Y68-W102 HydrophobicContact CE2-CZ2 4.35Å; Y68-W102 AromaticContact CG-CH2 3.82Å; Y68-W102 HydrophobicContact CG-CH2 3.82Å; Y68-W102 AromaticContact CG-CZ2 3.96Å; Y68-W102 HydrophobicContact CG-CZ2 3.96Å; F72-W102 HydrophobicContact CD1-CH2 4.43Å; F72-W102 HydrophobicContact CE1-CH2 4.16Å; F72-W102 HydrophobicContact CE1-CZ3 4.19Å; K73-W102 HydrophobicContact CB-CD2 4.05Å; K73-W102 HydrophobicContact CB-CE3 4.23Å; K73-W102 HydrophobicContact CB-CG 4.27Å; K73-W102 HydrophobicContact CD-CD2 4.33Å; K73-W102 HydrophobicContact CD-CG 4.45Å; K73-W102 HydrophobicContact CD-CZ2 4.24Å; K73-W102 HydrophobicContact CG-CD2 3.82Å; K73-W102 HydrophobicContact CG-CE3 4.16Å; K73-W102 HydrophobicContact CG-CG 4.3Å; K73-W102 HydrophobicContact CG-CH2 4.13Å; K73-W102 HydrophobicContact CG-CZ2 3.79Å; K73-W102 HydrophobicContact CG-CZ3 4.31Å; V76-W102 HydrophobicContact CB-CE3 4.11Å; V76-W102 HydrophobicContact CB-CZ3 4.12Å; V76-W102 HydrophobicContact CG1-CE3 3.85Å; V76-W102 HydrophobicContact CG1-CZ3 3.95Å; V76-W102 HydrophobicContact CG2-CZ3 4.04Å; V77-W102 HydrophobicContact CG2-CB 3.69Å; I94-W102 HydrophobicContact CD1-CE3 4.46Å; I94-W102 HydrophobicContact CD1-CZ3 3.77Å; M98-W102 HydrophobicContact CB-CH2 4.48Å; M98-W102 HydrophobicContact CB-CZ2 4.36Å; M98-W102 HydrophobicContact CE-CH2 3.53Å; M98-W102 HydrophobicContact CE-CZ2 3.41Å; M98-W102 VanDerWaalsContact CE-CZ2 3.41Å; M98-W102 WeakPolarHBondContact O-CB 2.92Å; M98-W102 VanDerWaalsContact O-CG 3.27Å; M98-W102 PolarHBondContact O-N 3.14Å; V99-W102 PolarHBondContact O-N 3.03Å; W102-K104 VanDerWaalsContact C-N 3.34Å; W102-Q105 CarbonylContact O-C 3.38Å; W102-Q105 PolarHBondContact O-N 2.92Å; W102-E106 PolarHBondContact O-N 3Å; W102-E106 VanDerWaalsContact O-N 3.08Å; W102-L109 HydrophobicContact CB-CD1 4.13Å
103	R	94.8	Very high	92.3	Very high	92 Å²	92	79 Å²	79	35%	0.347	37%	0.369	S	S	.	.	H	α-helix	trans	-62.5	-40.7	171.7	-74.9	-176.4	67.3	167.6	3.1	112.2	V77 A80 N85 V99 I100 N101 Q105 E106	V77-R103 HydrophobicContact CG1-CG 4.17Å; V77-R103 HydrophobicContact CG2-CG 4.08Å; A80-R103 PolarHBondContact O-NH1 2.94Å; N85-R103 WeakPolarHBondContact OD1-CD 3.49Å; N85-R103 PolarHBondContact OD1-NH1 2.94Å; V99-R103 VanDerWaalsContact O-CG 3.32Å; V99-R103 WeakPolarHBondContact O-CG 3.37Å; V99-R103 PolarHBondContact O-N 2.98Å; I100-R103 PolarHBondContact O-N 3.37Å; N101-R103 VanDerWaalsContact C-N 3.31Å; N101-R103 PolarHBondContact O-N 3.02Å; R103-Q105 VanDerWaalsContact C-N 3.29Å; R103-Q105 PolarHBondContact O-N 2.75Å; R103-E106 WeakPolarHBondContact O-CB 3.42Å; R103-E106 PolarHBondContact O-N 3.36Å
104	K	95.1	Very high	92.1	Very high	174 Å²	174	79 Å²	79	76%	0.757	37%	0.374	S	S	*	.	H	α-helix	trans	-66.3	-33	174.7	-68.2	-178.4	178	-170.8	0	112.3	I100 N101 W102	I100-K104 PolarHBondContact O-N 3.3Å; I100-K104 VanDerWaalsContact O-N 3.13Å; N101-K104 WeakPolarHBondContact O-CB 3.47Å; N101-K104 PolarHBondContact O-N 3.38Å; N101-K104 VanDerWaalsContact O-N 3.15Å; W102-K104 VanDerWaalsContact C-N 3.34Å
105	Q	92.5	Very high	91.8	Very high	88 Å²	88	86.8 Å²	86.8	41%	0.411	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	15.9	-178.9	-64.8	-179.8	-36.1	0	0	113.2	N101 W102 R103 E107 A108 L109	N101-Q105 PolarHBondContact ND2-OE1 3.13Å; N101-Q105 WeakPolarHBondContact O-CG 3.32Å; N101-Q105 PolarHBondContact O-N 3.29Å; W102-Q105 CarbonylContact O-C 3.38Å; W102-Q105 PolarHBondContact O-N 2.92Å; R103-Q105 VanDerWaalsContact C-N 3.29Å; R103-Q105 PolarHBondContact O-N 2.75Å; Q105-E107 PolarHBondContact O-N 2.79Å; Q105-A108 HydrophobicContact CB-CB 4.41Å; Q105-A108 CarbonylContact O-C 3.56Å; Q105-A108 WeakPolarHBondContact O-CA 3.48Å; Q105-A108 VanDerWaalsContact O-CB 3.28Å; Q105-A108 WeakPolarHBondContact O-CB 3.28Å; Q105-A108 PolarHBondContact O-N 3.39Å; Q105-A108 VanDerWaalsContact O-N 3.13Å; Q105-L109 WeakPolarHBondContact O-CG 3.38Å; Q105-L109 PolarHBondContact O-N 2.78Å
106	E	93.1	Very high	91.3	Very high	29 Å²	29	86 Å²	86	14%	0.136	40%	0.401	C	S	.	.	H	α-helix	trans	-58.9	-47.2	-172	-179.5	-177.4	171.7	0	0	113	L74 V77 K81 W102 R103 A108 L109 K110	L74-E106 HydrophobicContact CD2-CG 4.48Å; V77-E106 HydrophobicContact CG1-CB 4.39Å; V77-E106 HydrophobicContact CG1-CG 4.04Å; K81-E106 WeakPolarHBondContact CE-OE2 3.46Å; K81-E106 IonicContact NZ-OE1 3.41Å; K81-E106 PolarHBondContact NZ-OE1 3.24Å; K81-E106 IonicContact NZ-OE2 3.33Å; K81-E106 PolarHBondContact NZ-OE2 2.67Å; W102-E106 PolarHBondContact O-N 3Å; W102-E106 VanDerWaalsContact O-N 3.08Å; R103-E106 WeakPolarHBondContact O-CB 3.42Å; R103-E106 PolarHBondContact O-N 3.36Å; E106-A108 VanDerWaalsContact C-N 3.26Å; E106-A108 PolarHBondContact O-N 3.33Å; E106-L109 WeakPolarHBondContact O-CB 3.37Å; E106-L109 PolarHBondContact O-N 3.49Å; E106-K110 WeakPolarHBondContact O-CG 3.43Å; E106-K110 PolarHBondContact O-N 3.36Å; E106-K110 WeakPolarHBondContact OE1-CE 3.28Å; E106-K110 IonicContact OE1-NZ 2.78Å; E106-K110 PolarHBondContact OE1-NZ 2.6Å
107	E	93.1	Very high	90.8	Very high	113 Å²	113	81.1 Å²	81.1	53%	0.528	39%	0.389	S	S	.	.	H	α-helix	trans	-61.3	-39.4	178	-59.3	-49.2	133.4	0	0	111.5	Q105 L109 K110 M111	Q105-E107 PolarHBondContact O-N 2.79Å; E107-L109 VanDerWaalsContact C-N 3.28Å; E107-L109 PolarHBondContact O-N 3Å; E107-K110 PolarHBondContact O-N 3.41Å; E107-K110 IonicContact OE1-NZ 2.67Å; E107-K110 PolarHBondContact OE1-NZ 3.48Å; E107-K110 IonicContact OE2-NZ 2.6Å; E107-K110 PolarHBondContact OE2-NZ 3.08Å; E107-M111 WeakPolarHBondContact O-CG 3.48Å; E107-M111 PolarHBondContact O-N 3.45Å
108	A	90.9	Very high	89.9	Confident	32 Å²	32	74.9 Å²	74.9	26%	0.264	37%	0.369	S	S	.	.	H	α-helix	trans	-64.2	-30.5	174	0	0	0	0	0	113.3	Q105 E106 M112 R119	Q105-A108 HydrophobicContact CB-CB 4.41Å; Q105-A108 CarbonylContact O-C 3.56Å; Q105-A108 WeakPolarHBondContact O-CA 3.48Å; Q105-A108 VanDerWaalsContact O-CB 3.28Å; Q105-A108 WeakPolarHBondContact O-CB 3.28Å; Q105-A108 PolarHBondContact O-N 3.39Å; Q105-A108 VanDerWaalsContact O-N 3.13Å; E106-A108 VanDerWaalsContact C-N 3.26Å; E106-A108 PolarHBondContact O-N 3.33Å; A108-M112 WeakPolarHBondContact O-CG 2.81Å; A108-R119 VanDerWaalsContact CA-NH2 3.33Å; A108-R119 PolarHBondContact O-NH2 3.41Å
109	L	91	Very high	89	Confident	7 Å²	7	80.4 Å²	80.4	4%	0.037	39%	0.388	C	S	.	.	H	α-helix	trans	-80.9	-32.5	177.4	-71.3	169.9	0	0	0	112.3	A70 K73 L74 W102 Q105 E106 E107 M111 M112	A70-L109 HydrophobicContact CB-CD2 4.48Å; K73-L109 HydrophobicContact CB-CD1 3.74Å; K73-L109 HydrophobicContact CB-CD2 4.11Å; K73-L109 HydrophobicContact CD-CD1 4.39Å; K73-L109 HydrophobicContact CD-CD2 3.61Å; L74-L109 HydrophobicContact CD2-CB 3.77Å; L74-L109 HydrophobicContact CG-CB 4.06Å; W102-L109 HydrophobicContact CB-CD1 4.13Å; Q105-L109 WeakPolarHBondContact O-CG 3.38Å; Q105-L109 PolarHBondContact O-N 2.78Å; E106-L109 WeakPolarHBondContact O-CB 3.37Å; E106-L109 PolarHBondContact O-N 3.49Å; E107-L109 VanDerWaalsContact C-N 3.28Å; E107-L109 PolarHBondContact O-N 3Å; L109-M111 VanDerWaalsContact C-N 3.28Å; L109-M111 PolarHBondContact O-N 3.13Å; L109-M112 HydrophobicContact CD2-SD 4.45Å; L109-M112 PolarHBondContact O-N 3.39Å
110	K	90.9	Very high	88.1	Confident	98 Å²	98	89.6 Å²	89.6	43%	0.426	42%	0.422	S	S	.	.	H	α-helix	trans	-64	-33.2	175.5	-71.7	172.5	-175.7	160.9	0	112.6	L74 E106 E107 M112	L74-K110 HydrophobicContact CD2-CG 4.07Å; E106-K110 WeakPolarHBondContact O-CG 3.43Å; E106-K110 PolarHBondContact O-N 3.36Å; E106-K110 WeakPolarHBondContact OE1-CE 3.28Å; E106-K110 IonicContact OE1-NZ 2.78Å; E106-K110 PolarHBondContact OE1-NZ 2.6Å; E107-K110 PolarHBondContact O-N 3.41Å; E107-K110 IonicContact OE1-NZ 2.67Å; E107-K110 PolarHBondContact OE1-NZ 3.48Å; E107-K110 IonicContact OE2-NZ 2.6Å; E107-K110 PolarHBondContact OE2-NZ 3.08Å; K110-M112 VanDerWaalsContact C-N 3.27Å; K110-M112 PolarHBondContact O-N 3.43Å
111	M	90.4	Very high	86.9	Confident	153 Å²	153	91.1 Å²	91.1	75%	0.754	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-11.4	177.6	-61.7	-63.1	134.1	0	0	113.5	E107 L109	E107-M111 WeakPolarHBondContact O-CG 3.48Å; E107-M111 PolarHBondContact O-N 3.45Å; L109-M111 VanDerWaalsContact C-N 3.28Å; L109-M111 PolarHBondContact O-N 3.13Å
112	M	87.2	Confident	85.6	Confident	24 Å²	24	93.1 Å²	93.1	12%	0.118	46%	0.463	C	S	.	.	S	Bend	trans	-90.6	144.3	-178.9	-71.6	-179.2	64.8	0	0	111.5	A70 A108 L109 K110 K114 Q116 R119	A70-M112 HydrophobicContact CB-CB 3.95Å; A108-M112 WeakPolarHBondContact O-CG 2.81Å; L109-M112 HydrophobicContact CD2-SD 4.45Å; L109-M112 PolarHBondContact O-N 3.39Å; K110-M112 VanDerWaalsContact C-N 3.27Å; K110-M112 PolarHBondContact O-N 3.43Å; M112-K114 PolarHBondContact O-N 3.15Å; M112-Q116 HydrophobicContact CE-CB 4.15Å; M112-Q116 HydrophobicContact CE-CG 4.03Å; M112-R119 HydrophobicContact CE-CG 3.81Å; M112-R119 HydrophobicContact CG-CG 4.5Å; M112-R119 HydrophobicContact SD-CG 3.74Å
113	P	87.9	Confident	84.4	Confident	81 Å²	81	98.4 Å²	98.4	53%	0.526	49%	0.491	S	S	.	.			trans	-55.9	137.8	166.5	-21.6	32.1	0	0	0	110.7	A70 E115 Q116	A70-P113 WeakPolarHBondContact CB-O 3.4Å; P113-E115 PolarHBondContact O-N 3.36Å; P113-E115 VanDerWaalsContact O-N 3.1Å; P113-Q116 HydrophobicContact CB-CB 4.3Å; P113-Q116 WeakPolarHBondContact O-CB 3.35Å; P113-Q116 PolarHBondContact O-N 3.41Å
114	K	86	Confident	83.2	Confident	161 Å²	161	96.2 Å²	96.2	70%	0.7	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-31.6	-173	-68.5	179.7	-178.8	174.9	0	113.5	N69 A70 G71 M112	N69-K114 WeakPolarHBondContact CB-O 3.09Å; A70-K114 PolarHBondContact N-O 3.13Å; G71-K114 PolarHBondContact N-O 3.21Å; M112-K114 PolarHBondContact O-N 3.15Å
115	E	84.1	Confident	82.1	Confident	168 Å²	168	93.8 Å²	93.8	79%	0.785	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-19.1	-178	-61.8	176.8	179.9	0	0	112.9	P113 C117	P113-E115 PolarHBondContact O-N 3.36Å; P113-E115 VanDerWaalsContact O-N 3.1Å; E115-C117 PolarHBondContact O-N 3.07Å
116	Q	81.9	Confident	81	Confident	65 Å²	65	93.2 Å²	93.2	30%	0.304	50%	0.503	S	S	.	.			trans	-75	123.7	-174.4	-164.3	176.5	28.4	0	0	111	A70 M112 P113 A118	A70-Q116 WeakPolarHBondContact CB-O 3.2Å; A70-Q116 PolarHBondContact N-O 3.44Å; M112-Q116 HydrophobicContact CE-CB 4.15Å; M112-Q116 HydrophobicContact CE-CG 4.03Å; P113-Q116 HydrophobicContact CB-CB 4.3Å; P113-Q116 WeakPolarHBondContact O-CB 3.35Å; P113-Q116 PolarHBondContact O-N 3.41Å; Q116-A118 VanDerWaalsContact CD-O 3.26Å; Q116-A118 WeakPolarHBondContact CG-O 3.37Å; Q116-A118 PolarHBondContact NE2-O 3.28Å; Q116-A118 VanDerWaalsContact NE2-O 3.11Å
117	C	81	Confident	80	Confident	43 Å²	43	95.1 Å²	95.1	29%	0.291	52%	0.518	S	S	.	.	S	Bend	trans	-77.6	-36.4	177.6	-75.2	0	0	0	0	113.3	N69 K73 E115	N69-C117 PolarHBondContact OD1-SG 3.15Å; K73-C117 PolarHBondContact NZ-O 3.48Å; E115-C117 PolarHBondContact O-N 3.07Å
118	A	74.9	Confident	78.9	Confident	42 Å²	42	97.5 Å²	97.5	35%	0.347	53%	0.528	S	S	.	.	S	Bend	trans	-150.1	153.8	-171	0	0	0	0	0	110.1	Q116 R120	Q116-A118 VanDerWaalsContact CD-O 3.26Å; Q116-A118 WeakPolarHBondContact CG-O 3.37Å; Q116-A118 PolarHBondContact NE2-O 3.28Å; Q116-A118 VanDerWaalsContact NE2-O 3.11Å; A118-R120 HydrophobicContact CB-CG 4.08Å; A118-R120 PolarHBondContact O-N 3.38Å
119	R	74.6	Confident	78	Confident	164 Å²	164	101.4 Å²	101.4	62%	0.619	55%	0.545	S	S	*	.			trans	-78.3	53.5	175.1	-60	175.8	177.8	-165.6	-10	110.8	A108 M112	A108-R119 VanDerWaalsContact CA-NH2 3.33Å; A108-R119 PolarHBondContact O-NH2 3.41Å; M112-R119 HydrophobicContact CE-CG 3.81Å; M112-R119 HydrophobicContact CG-CG 4.5Å; M112-R119 HydrophobicContact SD-CG 3.74Å
120	R	76.2	Confident	77.2	Confident	192 Å²	192	107 Å²	107	73%	0.725	57%	0.57	S	S	*	*			trans	-92	131.6	174.8	-69.8	-173.2	178.2	-174.8	-2.5	108.2	A118	A118-R120 HydrophobicContact CB-CG 4.08Å; A118-R120 PolarHBondContact O-N 3.38Å
121	P	69.6	Low	76.5	Confident	101 Å²	101	107.9 Å²	107.9	66%	0.656	58%	0.58	S	S	*	*			trans	-60.7	146.5	164.1	28	-31.7	0	0	0	108.3	I123	P121-I123 PolarHBondContact O-N 2.86Å
122	A	67.8	Low	75.6	Confident	113 Å²	113	104.3 Å²	104.3	93%	0.934	57%	0.57	S	S	*	*	S	Bend	trans	-66.7	-16.4	174.9	0	0	0	0	0	112.2
123	I	69.5	Low	74.6	Confident	126 Å²	126	109.9 Å²	109.9	65%	0.646	60%	0.599	S	S	*	*	S	Bend	trans	-74.1	129.2	-177.7	-51.9	173.3	0	0	0	108.9	P121	P121-I123 PolarHBondContact O-N 2.86Å
124	A	69.9	Low	73.9	Confident	47 Å²	47	110.1 Å²	110.1	39%	0.388	61%	0.608	S	S	.	*			trans	-57.9	150	171.5	0	0	0	0	0	110.3	C126	A124-C126 PolarHBondContact O-N 3.21Å
125	S	71.6	Confident	72.7	Confident	123 Å²	123	113.6 Å²	113.6	86%	0.86	63%	0.627	S	S	*	*	S	Bend	trans	-64.3	-15.1	-177.3	-168.5	0	0	0	0	113.8
126	C	70.1	Confident	72.2	Confident	76 Å²	76	110.9 Å²	110.9	51%	0.514	62%	0.619	S	S	.	*			trans	-138.9	70.8	-174.2	-62.4	0	0	0	0	110.2	A124 E128 L129	A124-C126 PolarHBondContact O-N 3.21Å; C126-E128 PolarHBondContact O-N 2.96Å; C126-L129 HydrophobicContact CB-CB 4.37Å; C126-L129 PolarHBondContact O-N 3.3Å
127	P	70.7	Confident	71.6	Confident	69 Å²	69	113.3 Å²	113.3	45%	0.448	64%	0.636	S	S	.	*	H	α-helix	trans	-61.7	-28.8	179.8	26	-33.7	0	0	0	112.3	L129 E130 N131	P127-L129 PolarHBondContact O-N 3Å; P127-E130 PolarHBondContact O-N 3.41Å; P127-E130 VanDerWaalsContact O-N 3.17Å; P127-N131 PolarHBondContact O-N 2.89Å
128	E	70.6	Confident	71.1	Confident	162 Å²	162	117.2 Å²	117.2	76%	0.757	66%	0.655	S	S	*	*	H	α-helix	trans	-63.9	-26.1	-179.5	-168	159.8	-168.4	0	0	113.7	C126 S132	C126-E128 PolarHBondContact O-N 2.96Å; E128-S132 PolarHBondContact O-N 3.48Å; E128-S132 PolarHBondContact O-OG 2.83Å
129	L	72.6	Confident	70.9	Confident	115 Å²	115	121.6 Å²	121.6	60%	0.602	67%	0.673	S	S	*	*	H	α-helix	trans	-76.2	-26.4	177.9	-137.9	120	0	0	0	112.5	C126 P127 S132	C126-L129 HydrophobicContact CB-CB 4.37Å; C126-L129 PolarHBondContact O-N 3.3Å; P127-L129 PolarHBondContact O-N 3Å; L129-S132 PolarHBondContact O-OG 3.44Å
130	E	73.8	Confident	70.7	Confident	124 Å²	124	118.9 Å²	118.9	58%	0.579	68%	0.676	S	S	*	*	H	α-helix	trans	-76.3	-34.8	177	-66.5	179.1	175.6	0	0	111.2	P127	P127-E130 PolarHBondContact O-N 3.41Å; P127-E130 VanDerWaalsContact O-N 3.17Å
131	N	75.8	Confident	70.3	Confident	116 Å²	116	114.1 Å²	114.1	62%	0.62	67%	0.673	S	S	*	*	H	α-helix	trans	-68.5	-37.3	177.9	-66.4	-17.7	0	0	0	112.5	P127 L133 A134	P127-N131 PolarHBondContact O-N 2.89Å; N131-L133 VanDerWaalsContact C-N 3.29Å; N131-L133 PolarHBondContact O-N 3.36Å; N131-A134 PolarHBondContact O-N 3.25Å
132	S	71.7	Confident	70.4	Confident	78 Å²	78	115 Å²	115	55%	0.545	67%	0.674	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.9	-9.8	-178.7	42.6	0	0	0	0	114.7	E128 L129	E128-S132 PolarHBondContact O-N 3.48Å; E128-S132 PolarHBondContact O-OG 2.83Å; L129-S132 PolarHBondContact O-OG 3.44Å
133	L	67.1	Low	70.6	Confident	141 Å²	141	115.2 Å²	115.2	74%	0.738	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	-8.6	172.1	-70.1	173.2	0	0	0	113	N131	N131-L133 VanDerWaalsContact C-N 3.29Å; N131-L133 PolarHBondContact O-N 3.36Å
134	A	73.4	Confident	70.6	Confident	87 Å²	87	114.3 Å²	114.3	72%	0.719	66%	0.655	S	S	*	*			trans	-98.4	-6.9	-178.1	0	0	0	0	0	113.6	N131	N131-A134 PolarHBondContact O-N 3.25Å
135	E	60.5	Low	70.7	Confident	233 Å²	233	120.4 Å²	120.4	100%	1.089	68%	0.679	S	S	*	*			trans	-86.6	0	166.4	-67.7	-174.3	175.3	0	0	111.1

Retrieved 135 of 135 residues in 64.4 ms (Link to these results)

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