A0A096N010_PAPAN Loading...

ALK and LTK ligand 1

AlphaFold DB , UniProt , Accession A0A096N010, Species PAPAN (Papio anubis, Olive baboon), Gene ALKAL1, Length 129 aa.

						>A0A096N010_PAPAN|A0A096N010|ALKAL1
MWPFKPGAPLPALLLLALALSPPGVHGRPRGRRGAHVTNEEPKPLLFLPAAGAGRTPSGSRSAEIFPRDSNLKDKFIKHFTGPVTFSPECSKHFHRLYYNTRECSTPAYYKRCARLLTRLAVSPLCSQT
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.6	Very low	50	Low	242 Å²	242	144.7 Å²	144.7	100%	1.192	79%	0.793	S	S	*	*				0	131	0	50.7	-170	79.4	0	0	107.9
2	W	42.1	Very low	50.8	Low	245 Å²	245	137.1 Å²	137.1	93%	0.928	76%	0.764	S	S	*	*			trans	-59	157.3	-150.2	-86.8	-33.9	0	0	0	118.7
3	P	51.4	Low	51.4	Low	113 Å²	113	136.8 Å²	136.8	73%	0.734	76%	0.759	S	S	*	*			trans	-78	138.6	164.7	34.8	-30.1	0	0	0	109.8
4	F	37.8	Very low	52.1	Low	194 Å²	194	136.2 Å²	136.2	85%	0.851	75%	0.753	S	S	*	*			trans	-113.4	91.9	171.3	-132.4	-90.7	0	0	0	110.1
5	K	50.7	Low	52.8	Low	198 Å²	198	135.3 Å²	135.3	86%	0.861	75%	0.745	S	S	*	*			trans	-103.2	137.4	138	-76.5	-171.8	170.2	179	0	104.6
6	P	48.6	Very low	53.3	Low	102 Å²	102	133.7 Å²	133.7	66%	0.662	74%	0.735	S	S	*	*				-154.8	175.4	81.1	34	-11.3	0	0	0	115.1
7	G	57.5	Low	53.8	Low	79 Å²	79	129.5 Å²	129.5	81%	0.814	72%	0.721	S	S	*	*			trans	-56.7	143.2	176.4	0	0	0	0	0	114.2
8	A	54.8	Low	54.2	Low	88 Å²	88	129.6 Å²	129.6	73%	0.727	72%	0.719	S	S	*	*			trans	-97.3	143.1	168.8	0	0	0	0	0	110	L10	A8-L10 PolarHBondContact O-N 3.3Å
9	P	55.5	Low	54.6	Low	94 Å²	94	127.2 Å²	127.2	61%	0.61	72%	0.718	S	S	*	*			trans	-82.8	103.6	-167	34.1	-32.9	0	0	0	110.2	P11 A12	P9-P11 WeakPolarHBondContact O-CD 3.42Å; P9-P11 VanDerWaalsContact O-N 3.1Å; P9-A12 PolarHBondContact O-N 3.47Å
10	L	55.4	Low	54.7	Low	152 Å²	152	127.9 Å²	127.9	80%	0.796	72%	0.719	S	S	*	*	H	α-helix	trans	-47.9	-24.6	163.8	-69.7	158.1	0	0	0	115.3	A8 A12	A8-L10 PolarHBondContact O-N 3.3Å; L10-A12 VanDerWaalsContact C-N 3.34Å; L10-A12 PolarHBondContact O-N 3.27Å
11	P	61	Low	54.7	Low	85 Å²	85	126 Å²	126	55%	0.552	71%	0.714	S	S	*	*	H	α-helix	trans	-62	-30.7	176.4	-27.2	34.1	0	0	0	115.8	P9 L14 L15	P9-P11 WeakPolarHBondContact O-CD 3.42Å; P9-P11 VanDerWaalsContact O-N 3.1Å; P11-L14 PolarHBondContact O-N 3.44Å; P11-L15 WeakPolarHBondContact O-CG 3.49Å; P11-L15 PolarHBondContact O-N 3.33Å
12	A	59	Low	55.7	Low	53 Å²	53	119.8 Å²	119.8	44%	0.438	69%	0.692	S	S	.	*	H	α-helix	trans	-72.2	-37.5	-171.8	0	0	0	0	0	112.6	P9 L10 L15 L16	P9-A12 PolarHBondContact O-N 3.47Å; L10-A12 VanDerWaalsContact C-N 3.34Å; L10-A12 PolarHBondContact O-N 3.27Å; A12-L15 PolarHBondContact O-N 3.36Å; A12-L16 PolarHBondContact O-N 3.22Å
13	L	58.3	Low	56	Low	133 Å²	133	114 Å²	114	70%	0.696	69%	0.686	S	S	*	*	H	α-helix	trans	-68	-34.8	176.6	-95.6	156	0	0	0	112.4	L16 A17	L13-L16 PolarHBondContact O-N 3.35Å; L13-A17 PolarHBondContact O-N 3.47Å
14	L	62	Low	56	Low	129 Å²	129	112.5 Å²	112.5	68%	0.675	69%	0.691	S	S	*	*	H	α-helix	trans	-68.8	-36.8	178.4	-145.3	94.4	0	0	0	111.9	P11 A17 L18	P11-L14 PolarHBondContact O-N 3.44Å; L14-A17 PolarHBondContact O-N 3.34Å; L14-L18 PolarHBondContact O-N 3.49Å
15	L	62.4	Low	56.6	Low	122 Å²	122	109.9 Å²	109.9	64%	0.639	69%	0.691	S	S	*	*	H	α-helix	trans	-68.5	-36.4	177.4	-69.3	170.8	0	0	0	112.3	P11 A12 A17 L18 A19	P11-L15 WeakPolarHBondContact O-CG 3.49Å; P11-L15 PolarHBondContact O-N 3.33Å; A12-L15 PolarHBondContact O-N 3.36Å; L15-A17 VanDerWaalsContact C-N 3.32Å; L15-A17 PolarHBondContact O-N 3.3Å; L15-L18 PolarHBondContact O-N 3.46Å; L15-A19 PolarHBondContact O-N 3.33Å
16	L	61.2	Low	56.9	Low	110 Å²	110	109.7 Å²	109.7	58%	0.576	69%	0.693	S	S	*	*	H	α-helix	trans	-62.4	-36.7	173.2	-91.1	147.2	0	0	0	112.5	A12 L13 A19 L20	A12-L16 PolarHBondContact O-N 3.22Å; L13-L16 PolarHBondContact O-N 3.35Å; L16-A19 PolarHBondContact O-N 3.46Å; L16-L20 WeakPolarHBondContact O-CD1 3.39Å; L16-L20 PolarHBondContact O-N 3.47Å
17	A	61.7	Low	56.6	Low	62 Å²	62	108.2 Å²	108.2	51%	0.512	70%	0.696	S	S	.	*	H	α-helix	trans	-69.2	-34	177.4	0	0	0	0	0	113.2	L13 L14 L15 S21	L13-A17 PolarHBondContact O-N 3.47Å; L14-A17 PolarHBondContact O-N 3.34Å; L15-A17 VanDerWaalsContact C-N 3.32Å; L15-A17 PolarHBondContact O-N 3.3Å; A17-S21 PolarHBondContact O-OG 3.48Å
18	L	60.8	Low	56.6	Low	131 Å²	131	114.1 Å²	114.1	69%	0.686	69%	0.694	S	S	*	*	H	α-helix	trans	-68.3	-35.8	174.8	-111.7	83.9	0	0	0	112.2	L14 L15 L20 S21	L14-L18 PolarHBondContact O-N 3.49Å; L15-L18 PolarHBondContact O-N 3.46Å; L18-L20 VanDerWaalsContact C-N 3.32Å; L18-L20 PolarHBondContact O-N 3.4Å; L18-S21 PolarHBondContact O-N 3.27Å
19	A	60.8	Low	56.4	Low	84 Å²	84	115.9 Å²	115.9	69%	0.694	70%	0.698	S	S	*	*	H	α-helix	trans	-70.2	-25.4	-178.3	0	0	0	0	0	113.7	L15 L16	L15-A19 PolarHBondContact O-N 3.33Å; L16-A19 PolarHBondContact O-N 3.46Å
20	L	57.7	Low	56.4	Low	141 Å²	141	122 Å²	122	74%	0.738	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-2	179.8	-93.3	82.8	0	0	0	114.4	L16 L18 P22	L16-L20 WeakPolarHBondContact O-CD1 3.39Å; L16-L20 PolarHBondContact O-N 3.47Å; L18-L20 VanDerWaalsContact C-N 3.32Å; L18-L20 PolarHBondContact O-N 3.4Å; L20-P22 WeakPolarHBondContact O-CD 3.19Å
21	S	54.6	Low	55.8	Low	88 Å²	88	118.7 Å²	118.7	62%	0.615	71%	0.711	S	S	*	*			trans	-85.3	111.8	178.6	-69.5	0	0	0	0	110.9	A17 L18	A17-S21 PolarHBondContact O-OG 3.48Å; L18-S21 PolarHBondContact O-N 3.27Å
22	P	55.5	Low	55.4	Low	112 Å²	112	125.1 Å²	125.1	73%	0.727	72%	0.724	S	S	*	*			trans	-66.9	147	172.8	26.7	-32.3	0	0	0	110.6	L20 G24	L20-P22 WeakPolarHBondContact O-CD 3.19Å; P22-G24 PolarHBondContact O-N 3.04Å
23	P	49.6	Very low	55	Low	124 Å²	124	133.6 Å²	133.6	81%	0.805	75%	0.745	S	S	*	*			trans	-66	110.6	176.7	26.5	-32	0	0	0	109.5	V25	P23-V25 PolarHBondContact O-N 2.99Å
24	G	50.6	Low	54.3	Low	81 Å²	81	131.2 Å²	131.2	84%	0.835	75%	0.753	S	S	*	*			trans	-60.4	104.1	172.2	0	0	0	0	0	110.3	P22	P22-G24 PolarHBondContact O-N 3.04Å
25	V	51.3	Low	53.4	Low	139 Å²	139	129.8 Å²	129.8	84%	0.842	76%	0.759	S	S	*	*			trans	-61.3	134.6	174.8	-73.1	0	0	0	0	111.1	P23 G27	P23-V25 PolarHBondContact O-N 2.99Å; V25-G27 PolarHBondContact O-N 3.11Å; V25-G27 VanDerWaalsContact O-N 3.11Å
26	H	57.4	Low	52.6	Low	195 Å²	195	132.4 Å²	132.4	90%	0.903	77%	0.768	S	S	*	*			trans	-60.7	102.3	-176.4	-151.4	-93	0	0	0	111.6
27	G	42.5	Very low	51.7	Low	71 Å²	71	133 Å²	133	73%	0.732	78%	0.776	S	S	*	*			trans	-110.1	100.2	177.3	0	0	0	0	0	112.4	V25	V25-G27 PolarHBondContact O-N 3.11Å; V25-G27 VanDerWaalsContact O-N 3.11Å
28	R	56.5	Low	50.4	Low	203 Å²	203	135.2 Å²	135.2	77%	0.766	78%	0.783	S	S	*	*			trans	-91.2	120.8	169.6	-170.5	-168.2	-164.9	-174.7	8	108.6	R30	R28-R30 PolarHBondContact O-N 3.44Å
29	P	50	Low	49.1	Very low	125 Å²	125	134.8 Å²	134.8	81%	0.812	78%	0.782	S	S	*	*			trans	-88.2	110.1	170.8	9.9	7	0	0	0	109.8
30	R	55.4	Low	47.8	Very low	221 Å²	221	138.2 Å²	138.2	83%	0.834	78%	0.783	S	S	*	*			trans	-82.2	102.8	156.3	-97.3	-177.7	164.3	171.5	-4.2	107.3	R28	R28-R30 PolarHBondContact O-N 3.44Å
31	G	43.2	Very low	46.7	Very low	83 Å²	83	139.1 Å²	139.1	86%	0.856	78%	0.784	S	S	*	*			trans	-89.6	119.9	172	0	0	0	0	0	111.5
32	R	52.3	Low	46.1	Very low	220 Å²	220	140.2 Å²	140.2	83%	0.83	79%	0.789	S	S	*	*			trans	-103	132.2	-176.4	175.6	-176.7	-178.4	-175	1.1	109.5
33	R	51.8	Low	45.3	Very low	232 Å²	232	144.5 Å²	144.5	88%	0.875	80%	0.796	S	S	*	*			trans	30.6	126.4	154.7	-61.6	176.6	-146.6	-138.2	-0	119.6
34	G	42.8	Very low	45.4	Very low	83 Å²	83	143.8 Å²	143.8	86%	0.856	79%	0.791	S	S	*	*			trans	-133.1	113.7	149.7	0	0	0	0	0	109.1
35	A	43.6	Very low	45	Very low	98 Å²	98	147.3 Å²	147.3	81%	0.81	79%	0.79	S	S	*	*			trans	-83	135.1	167	0	0	0	0	0	107.9
36	H	45.7	Very low	44.2	Very low	177 Å²	177	146.9 Å²	146.9	82%	0.819	78%	0.783	S	S	*	*			trans	-113.4	107.3	162.6	-165.2	-92.4	0	0	0	107.6
37	V	41.4	Very low	43.3	Very low	124 Å²	124	146.2 Å²	146.2	75%	0.752	78%	0.777	S	S	*	*			trans	-104.6	140.3	162.9	162.6	0	0	0	0	106.4
38	T	35.4	Very low	43.2	Very low	107 Å²	107	150.2 Å²	150.2	66%	0.656	78%	0.781	S	S	*	*			trans	150.7	115.5	152.5	-64.7	0	0	0	0	104.4
39	N	33	Very low	43.2	Very low	123 Å²	123	146.2 Å²	146.2	66%	0.658	78%	0.781	S	S	*	*				-171.8	141.7	72	-156.1	-144.2	0	0	0	110.4
40	E	33.7	Very low	42.6	Very low	156 Å²	156	145.3 Å²	145.3	73%	0.729	78%	0.784	S	S	*	*			trans	74.6	137	155.9	-39.5	-50.9	75.6	0	0	120.2
41	E	33.8	Very low	42.1	Very low	160 Å²	160	139.7 Å²	139.7	75%	0.748	79%	0.786	S	S	*	*			cis	-166.3	145.4	-3.3	174.1	-101.8	100.9	0	0	106.9	K43	E41-K43 PolarHBondContact OE1-N 3.34Å
42	P	43.3	Very low	42.3	Very low	111 Å²	111	139.5 Å²	139.5	72%	0.721	78%	0.783	S	S	*	*			trans	-115.3	116.1	-174.8	34.8	-20.5	0	0	0	115.5
43	K	39.1	Very low	42	Very low	201 Å²	201	134 Å²	134	87%	0.874	79%	0.785	S	S	*	*			trans	-162.6	148.3	135.3	-125.7	148.1	-178.7	153.5	0	115.6	E41	E41-K43 PolarHBondContact OE1-N 3.34Å
44	P	50.1	Low	41.5	Very low	109 Å²	109	126.3 Å²	126.3	71%	0.708	78%	0.778	S	S	*	*			trans	-108.1	135.7	-162.1	35.9	-22.8	0	0	0	112.7
45	L	42.6	Very low	41.7	Very low	156 Å²	156	134.2 Å²	134.2	82%	0.817	78%	0.782	S	S	*	*			trans	-153.5	115.4	162.4	-84.7	-172.1	0	0	0	112.9
46	L	35	Very low	42	Very low	130 Å²	130	135.2 Å²	135.2	68%	0.681	78%	0.778	S	S	*	*			trans	78.7	112.8	142.4	-47.9	170.8	0	0	0	118.8
47	F	37.7	Very low	42.1	Very low	181 Å²	181	132.7 Å²	132.7	79%	0.794	78%	0.777	S	S	*	*				60.3	121.4	101.4	-71.3	-78.9	0	0	0	112.9
48	L	41	Very low	42.7	Very low	155 Å²	155	132.5 Å²	132.5	81%	0.812	78%	0.782	S	S	*	*			cis	-169.7	172.2	40.1	-96.2	136.1	0	0	0	110
49	P	55.9	Low	43.4	Very low	118 Å²	118	129.6 Å²	129.6	77%	0.766	77%	0.772	S	S	*	*			trans	-92.2	155.8	-173.1	36.9	-31.2	0	0	0	113.2
50	A	38.3	Very low	44.2	Very low	106 Å²	106	129.1 Å²	129.1	88%	0.876	78%	0.779	S	S	*	*			trans	-146.9	141.1	164	0	0	0	0	0	111.2
51	A	44.4	Very low	45.2	Very low	104 Å²	104	132.9 Å²	132.9	86%	0.86	79%	0.786	S	S	*	*			trans	-73.7	151.7	-161	0	0	0	0	0	115.2
52	G	48.5	Very low	46	Very low	78 Å²	78	130.7 Å²	130.7	80%	0.804	79%	0.789	S	S	*	*			trans	86.7	100	137.1	0	0	0	0	0	117.5
53	A	45	Very low	46.5	Very low	106 Å²	106	129.5 Å²	129.5	88%	0.876	79%	0.789	S	S	*	*			trans	-176.4	125.5	132.2	0	0	0	0	0	110.3
54	G	42.2	Very low	46.9	Very low	70 Å²	70	128.3 Å²	128.3	72%	0.722	79%	0.786	S	S	*	*			trans	75.8	100.2	155.9	0	0	0	0	0	116.3	T56	G54-T56 PolarHBondContact O-N 3.01Å
55	R	45.4	Very low	47.1	Very low	249 Å²	249	130.2 Å²	130.2	94%	0.94	79%	0.789	S	S	*	*			trans	-53.2	111.7	149.7	-77.5	176.7	-179.9	-179.2	-0.2	107.3	P57	R55-P57 WeakPolarHBondContact O-CD 3.47Å
56	T	51.4	Low	47.4	Very low	119 Å²	119	129.4 Å²	129.4	73%	0.73	78%	0.779	S	S	*	*			trans	-60.1	117.6	160.7	50.6	0	0	0	0	107.6	G54 S58	G54-T56 PolarHBondContact O-N 3.01Å; T56-S58 PolarHBondContact O-N 3.49Å
57	P	48	Very low	48.4	Very low	124 Å²	124	127.8 Å²	127.8	81%	0.805	78%	0.776	S	S	*	*			trans	-74.4	83	152.6	7.7	12.6	0	0	0	104.7	R55 G59	R55-P57 WeakPolarHBondContact O-CD 3.47Å; P57-G59 PolarHBondContact O-N 3.16Å
58	S	52.4	Low	49.3	Very low	120 Å²	120	130.4 Å²	130.4	84%	0.839	78%	0.781	S	S	*	*			trans	-71	68.4	155.3	-169.1	0	0	0	0	106.5	T56	T56-S58 PolarHBondContact O-N 3.49Å
59	G	49.9	Very low	50.2	Low	45 Å²	45	123.9 Å²	123.9	46%	0.464	75%	0.747	S	S	.	*			trans	-121.3	94.6	170	0	0	0	0	0	103.3	P57 R61	P57-G59 PolarHBondContact O-N 3.16Å; G59-R61 PolarHBondContact O-N 3.07Å
60	S	51	Low	50.6	Low	114 Å²	114	122 Å²	122	80%	0.797	74%	0.737	S	S	*	*			trans	-50.4	88.7	158.9	52.9	0	0	0	0	107.4	S62	S60-S62 PolarHBondContact O-N 2.95Å
61	R	53.5	Low	52.3	Low	234 Å²	234	121.6 Å²	121.6	88%	0.883	72%	0.719	S	S	*	*			trans	-74.6	58.7	165.8	-70	-174.2	176.2	-172.6	-0.3	107.3	G59 A63	G59-R61 PolarHBondContact O-N 3.07Å; R61-A63 PolarHBondContact O-N 3.08Å
62	S	51.5	Low	54	Low	115 Å²	115	121.3 Å²	121.3	80%	0.804	70%	0.703	S	S	*	*			trans	-73.9	55.4	148.2	-72.8	0	0	0	0	107.9	S60	S60-S62 PolarHBondContact O-N 2.95Å
63	A	53.4	Low	55.7	Low	86 Å²	86	118.3 Å²	118.3	71%	0.711	67%	0.668	S	S	*	*			trans	-104.9	49.9	154.9	0	0	0	0	0	105.5	R61 I65	R61-A63 PolarHBondContact O-N 3.08Å; A63-I65 VanDerWaalsContact C-N 3.27Å; A63-I65 PolarHBondContact O-N 3.34Å
64	E	47.7	Very low	57.6	Low	175 Å²	175	115 Å²	115	82%	0.818	64%	0.635	S	S	*	*			trans	-70.6	98.2	165.7	-153.5	178.9	143.9	0	0	104.9	F66	E64-F66 PolarHBondContact O-N 2.85Å
65	I	54.6	Low	59.7	Low	150 Å²	150	118 Å²	118	77%	0.769	63%	0.628	S	S	*	*			trans	-5.8	90.9	165.6	-59.1	149.1	0	0	0	111.5	A63 P67	A63-I65 VanDerWaalsContact C-N 3.27Å; A63-I65 PolarHBondContact O-N 3.34Å; I65-P67 WeakPolarHBondContact O-CD 3.47Å; I65-P67 VanDerWaalsContact O-N 3.16Å
66	F	47.6	Very low	61.7	Low	138 Å²	138	109.3 Å²	109.3	61%	0.605	60%	0.598	S	S	*	*			trans	-69.9	108	171.9	-148.1	-122.4	0	0	0	105.8	E64 R68 D69 P107	E64-F66 PolarHBondContact O-N 2.85Å; F66-R68 VanDerWaalsContact C-N 3.31Å; F66-R68 PolarHBondContact O-N 3.1Å; F66-D69 HydrophobicContact CD1-CB 4.42Å; F66-D69 WeakPolarHBondContact CD1-OD2 2.97Å; F66-D69 HydrophobicContact CE1-CB 3.9Å; F66-D69 VanDerWaalsContact CE1-OD1 3.28Å; F66-D69 WeakPolarHBondContact CE1-OD1 3.35Å; F66-D69 WeakPolarHBondContact CE1-OD2 3.2Å; F66-D69 VanDerWaalsContact CG-OD2 3.32Å; F66-D69 WeakPolarHBondContact CG-OD2 3.2Å; F66-D69 HydrophobicContact CZ-CB 4.47Å; F66-D69 VanDerWaalsContact CZ-OD1 3.28Å; F66-D69 WeakPolarHBondContact CZ-OD1 3.42Å; F66-P107 HydrophobicContact CE1-CG 3.64Å; F66-P107 HydrophobicContact CZ-CG 3.89Å
67	P	58	Low	63.3	Low	96 Å²	96	103.9 Å²	103.9	62%	0.623	56%	0.564	S	S	*	*			trans	-71.5	92.5	-174.8	-6.5	23.5	0	0	0	107.1	I65 D69	I65-P67 WeakPolarHBondContact O-CD 3.47Å; I65-P67 VanDerWaalsContact O-N 3.16Å; P67-D69 WeakPolarHBondContact O-CA 3Å; P67-D69 VanDerWaalsContact O-CG 3.3Å; P67-D69 PolarHBondContact O-N 3.22Å
68	R	55.7	Low	65.1	Low	237 Å²	237	104.5 Å²	104.5	89%	0.894	55%	0.554	S	S	*	*			trans	-13.7	93.5	-175.2	-77.8	-156.1	170.9	-163.8	0.6	112.5	F66 S70	F66-R68 VanDerWaalsContact C-N 3.31Å; F66-R68 PolarHBondContact O-N 3.1Å; R68-S70 PolarHBondContact O-N 3.3Å; R68-S70 PolarHBondContact O-OG 3.1Å
69	D	60	Low	66.7	Low	18 Å²	18	106.1 Å²	106.1	10%	0.096	55%	0.548	C	S	.	.			trans	-78.2	38.1	-149.4	-60.3	-111.3	0	0	0	114.3	F66 P67 N71 L72 K73	F66-D69 HydrophobicContact CD1-CB 4.42Å; F66-D69 WeakPolarHBondContact CD1-OD2 2.97Å; F66-D69 HydrophobicContact CE1-CB 3.9Å; F66-D69 VanDerWaalsContact CE1-OD1 3.28Å; F66-D69 WeakPolarHBondContact CE1-OD1 3.35Å; F66-D69 WeakPolarHBondContact CE1-OD2 3.2Å; F66-D69 VanDerWaalsContact CG-OD2 3.32Å; F66-D69 WeakPolarHBondContact CG-OD2 3.2Å; F66-D69 HydrophobicContact CZ-CB 4.47Å; F66-D69 VanDerWaalsContact CZ-OD1 3.28Å; F66-D69 WeakPolarHBondContact CZ-OD1 3.42Å; P67-D69 WeakPolarHBondContact O-CA 3Å; P67-D69 VanDerWaalsContact O-CG 3.3Å; P67-D69 PolarHBondContact O-N 3.22Å; D69-N71 PolarHBondContact O-N 3.31Å; D69-L72 HydrophobicContact CB-CB 4.28Å; D69-L72 PolarHBondContact O-N 3.3Å; D69-L72 WeakPolarHBondContact OD1-CD1 3.31Å; D69-K73 VanDerWaalsContact O-CB 3.31Å; D69-K73 WeakPolarHBondContact O-CB 3.37Å; D69-K73 PolarHBondContact O-N 3.05Å
70	S	63.4	Low	68.4	Low	79 Å²	79	108.9 Å²	108.9	55%	0.552	55%	0.548	S	S	*	.	H	α-helix	trans	-58.9	-38.7	173.5	53.8	0	0	0	0	110.9	R68 D74	R68-S70 PolarHBondContact O-N 3.3Å; R68-S70 PolarHBondContact O-OG 3.1Å; S70-D74 WeakPolarHBondContact O-CB 3.21Å; S70-D74 PolarHBondContact O-N 3.22Å
71	N	74.2	Confident	70.1	Confident	96 Å²	96	104.4 Å²	104.4	51%	0.513	52%	0.516	S	S	.	.	H	α-helix	trans	-70.1	-38.7	179.3	-161.5	-91.4	0	0	0	113	D69 K75	D69-N71 PolarHBondContact O-N 3.31Å; N71-K75 WeakPolarHBondContact O-CG 3.4Å; N71-K75 PolarHBondContact O-N 3.1Å; N71-K75 WeakPolarHBondContact OD1-CE 3.44Å; N71-K75 PolarHBondContact OD1-NZ 2.02Å
72	L	81.6	Confident	71.4	Confident	99 Å²	99	94.8 Å²	94.8	52%	0.518	49%	0.489	S	S	.	.	H	α-helix	trans	-72.7	-38.8	176.5	-63.9	-175.6	0	0	0	111.6	D69 D74 K75 F76	D69-L72 HydrophobicContact CB-CB 4.28Å; D69-L72 PolarHBondContact O-N 3.3Å; D69-L72 WeakPolarHBondContact OD1-CD1 3.31Å; L72-D74 VanDerWaalsContact C-N 3.34Å; L72-D74 PolarHBondContact O-N 3.48Å; L72-K75 PolarHBondContact O-N 2.99Å; L72-F76 VanDerWaalsContact O-CB 3.24Å; L72-F76 WeakPolarHBondContact O-CB 3.2Å; L72-F76 PolarHBondContact O-N 3.04Å
73	K	83.3	Confident	72.3	Confident	15 Å²	15	95.9 Å²	95.9	7%	0.065	49%	0.494	C	S	.	.	H	α-helix	trans	-54.3	-52	171.4	-176	-175.3	63	155.9	0	110.6	D69 K75 F76 I77 Y98 C104 Y110	D69-K73 VanDerWaalsContact O-CB 3.31Å; D69-K73 WeakPolarHBondContact O-CB 3.37Å; D69-K73 PolarHBondContact O-N 3.05Å; K73-K75 PolarHBondContact O-N 2.8Å; K73-F76 PolarHBondContact O-N 3.03Å; K73-I77 HydrophobicContact CG-CG1 4.04Å; K73-I77 WeakPolarHBondContact O-CB 3.12Å; K73-I77 VanDerWaalsContact O-CG1 3.23Å; K73-I77 WeakPolarHBondContact O-CG1 3.38Å; K73-I77 PolarHBondContact O-N 2.93Å; K73-Y98 HydrophobicContact CD-CE2 4.05Å; K73-Y98 VanDerWaalsContact CE-OH 3.26Å; K73-Y98 WeakPolarHBondContact CE-OH 3.17Å; K73-Y98 HydrophobicContact CG-CE2 4.09Å; K73-Y98 PolarHBondContact NZ-O 3.24Å; K73-C104 WeakPolarHBondContact CD-O 3.33Å; K73-Y110 HydrophobicContact CB-CE1 4.33Å; K73-Y110 HydrophobicContact CB-CE2 3.71Å; K73-Y110 HydrophobicContact CD-CE1 4.13Å; K73-Y110 HydrophobicContact CG-CD1 4.39Å; K73-Y110 HydrophobicContact CG-CD2 4.5Å; K73-Y110 HydrophobicContact CG-CE1 3.88Å; K73-Y110 HydrophobicContact CG-CE2 4.01Å
74	D	84.9	Confident	73	Confident	35 Å²	35	93.6 Å²	93.6	19%	0.187	47%	0.47	C	S	.	.	H	α-helix	trans	-59.2	-48.1	-177.3	-121.6	-92	0	0	0	112.1	S70 L72 K78 Y98	S70-D74 WeakPolarHBondContact O-CB 3.21Å; S70-D74 PolarHBondContact O-N 3.22Å; L72-D74 VanDerWaalsContact C-N 3.34Å; L72-D74 PolarHBondContact O-N 3.48Å; D74-K78 WeakPolarHBondContact O-CB 3.44Å; D74-K78 WeakPolarHBondContact O-CD 3.02Å; D74-K78 WeakPolarHBondContact O-CG 3.01Å; D74-K78 PolarHBondContact O-N 3.04Å; D74-K78 WeakPolarHBondContact OD1-CE 3.42Å; D74-K78 IonicContact OD1-NZ 2.66Å; D74-K78 PolarHBondContact OD1-NZ 3.47Å; D74-Y98 WeakPolarHBondContact CA-OH 2.91Å; D74-Y98 PolarHBondContact N-OH 3.3Å; D74-Y98 WeakPolarHBondContact OD2-CE1 3.28Å; D74-Y98 PolarHBondContact OD2-OH 2.99Å
75	K	86.2	Confident	73.9	Confident	133 Å²	133	91.6 Å²	91.6	58%	0.578	47%	0.47	S	S	*	.	H	α-helix	trans	-63.3	-45.5	178.3	-71.7	170	173.2	168.1	0	112.1	N71 L72 K73 H79	N71-K75 WeakPolarHBondContact O-CG 3.4Å; N71-K75 PolarHBondContact O-N 3.1Å; N71-K75 WeakPolarHBondContact OD1-CE 3.44Å; N71-K75 PolarHBondContact OD1-NZ 2.02Å; L72-K75 PolarHBondContact O-N 2.99Å; K73-K75 PolarHBondContact O-N 2.8Å; K75-H79 VanDerWaalsContact O-CB 3.28Å; K75-H79 WeakPolarHBondContact O-CB 3.49Å; K75-H79 PolarHBondContact O-N 3.3Å
76	F	86.9	Confident	74.6	Confident	67 Å²	67	87.8 Å²	87.8	29%	0.294	45%	0.449	S	S	.	.	H	α-helix	trans	-64.6	-53.4	-179.6	-170.4	-84.4	0	0	0	110.8	L72 K73 K78 H79 F80 Y110 K111	L72-F76 VanDerWaalsContact O-CB 3.24Å; L72-F76 WeakPolarHBondContact O-CB 3.2Å; L72-F76 PolarHBondContact O-N 3.04Å; K73-F76 PolarHBondContact O-N 3.03Å; F76-K78 PolarHBondContact O-N 2.89Å; F76-H79 PolarHBondContact O-N 3.28Å; F76-F80 AromaticContact CD1-CD2 3.57Å; F76-F80 HydrophobicContact CD1-CD2 3.57Å; F76-F80 AromaticContact CD1-CE2 3.92Å; F76-F80 HydrophobicContact CD1-CE2 3.92Å; F76-F80 HydrophobicContact CD2-CD2 4.23Å; F76-F80 AromaticContact CD2-CE2 3.85Å; F76-F80 HydrophobicContact CD2-CE2 3.85Å; F76-F80 AromaticContact CE1-CD2 3.32Å; F76-F80 HydrophobicContact CE1-CD2 3.32Å; F76-F80 AromaticContact CE1-CE2 3.41Å; F76-F80 HydrophobicContact CE1-CE2 3.41Å; F76-F80 VanDerWaalsContact CE1-CE2 3.41Å; F76-F80 HydrophobicContact CE1-CG 4.2Å; F76-F80 HydrophobicContact CE1-CZ 4.3Å; F76-F80 HydrophobicContact CE2-CD2 4.04Å; F76-F80 AromaticContact CE2-CE2 3.34Å; F76-F80 HydrophobicContact CE2-CE2 3.34Å; F76-F80 HydrophobicContact CE2-CZ 4.17Å; F76-F80 HydrophobicContact CG-CD2 4.03Å; F76-F80 HydrophobicContact CG-CE2 4.13Å; F76-F80 AromaticContact CZ-CD2 3.59Å; F76-F80 HydrophobicContact CZ-CD2 3.59Å; F76-F80 AromaticContact CZ-CE2 3.1Å; F76-F80 HydrophobicContact CZ-CE2 3.1Å; F76-F80 AromaticContact CZ-CZ 3.78Å; F76-F80 HydrophobicContact CZ-CZ 3.78Å; F76-F80 VanDerWaalsContact O-CD2 3.29Å; F76-F80 WeakPolarHBondContact O-CD2 3.24Å; F76-F80 PolarHBondContact O-N 3.44Å; F76-Y110 HydrophobicContact CB-CD2 4.48Å; F76-Y110 HydrophobicContact CD1-CD2 4.39Å; F76-Y110 HydrophobicContact CG-CD2 4.48Å; F76-K111 HydrophobicContact CE1-CG 3.85Å; F76-K111 HydrophobicContact CZ-CG 3.67Å
77	I	85.8	Confident	75.8	Confident	6 Å²	6	81.9 Å²	81.9	3%	0.031	42%	0.424	C	S	.	.	H	α-helix	trans	-61.9	-46	-177.5	-62.8	-64.4	0	0	0	110.2	K73 H79 F80 T81 Y98 Y110 C113 A114 L117	K73-I77 HydrophobicContact CG-CG1 4.04Å; K73-I77 WeakPolarHBondContact O-CB 3.12Å; K73-I77 VanDerWaalsContact O-CG1 3.23Å; K73-I77 WeakPolarHBondContact O-CG1 3.38Å; K73-I77 PolarHBondContact O-N 2.93Å; I77-H79 VanDerWaalsContact C-N 3.32Å; I77-H79 PolarHBondContact O-N 3.22Å; I77-F80 PolarHBondContact O-N 2.85Å; I77-T81 HydrophobicContact CG2-CG2 3.99Å; I77-T81 WeakPolarHBondContact O-CB 3.44Å; I77-T81 WeakPolarHBondContact O-CG2 3.5Å; I77-T81 PolarHBondContact O-N 3.33Å; I77-T81 PolarHBondContact O-OG1 3.33Å; I77-Y98 HydrophobicContact CB-CE2 3.95Å; I77-Y98 HydrophobicContact CG1-CE2 3.98Å; I77-Y98 HydrophobicContact CG2-CD2 4.22Å; I77-Y98 HydrophobicContact CG2-CE2 3.86Å; I77-Y110 HydrophobicContact CD1-CG 4.41Å; I77-Y110 WeakPolarHBondContact CD1-O 3.16Å; I77-C113 HydrophobicContact CD1-CB 3.99Å; I77-A114 HydrophobicContact CD1-CB 3.92Å; I77-L117 HydrophobicContact CG2-CD1 3.44Å; I77-L117 VanDerWaalsContact CG2-CD1 3.44Å
78	K	85	Confident	76.7	Confident	136 Å²	136	82.6 Å²	82.6	59%	0.591	43%	0.429	S	S	*	.	H	α-helix	trans	-58.5	-40.3	175.8	-75.5	170.9	169.5	164.2	0	113	D74 F76 T81 G82	D74-K78 WeakPolarHBondContact O-CB 3.44Å; D74-K78 WeakPolarHBondContact O-CD 3.02Å; D74-K78 WeakPolarHBondContact O-CG 3.01Å; D74-K78 PolarHBondContact O-N 3.04Å; D74-K78 WeakPolarHBondContact OD1-CE 3.42Å; D74-K78 IonicContact OD1-NZ 2.66Å; D74-K78 PolarHBondContact OD1-NZ 3.47Å; F76-K78 PolarHBondContact O-N 2.89Å; K78-T81 PolarHBondContact O-OG1 2.87Å; K78-G82 PolarHBondContact O-N 2.86Å
79	H	85.8	Confident	77.7	Confident	154 Å²	154	78.3 Å²	78.3	71%	0.713	42%	0.419	S	S	*	.	H	α-helix	trans	-64.7	-41.7	177.6	-176.5	72.3	0	0	0	112.3	K75 F76 I77	K75-H79 VanDerWaalsContact O-CB 3.28Å; K75-H79 WeakPolarHBondContact O-CB 3.49Å; K75-H79 PolarHBondContact O-N 3.3Å; F76-H79 PolarHBondContact O-N 3.28Å; I77-H79 VanDerWaalsContact C-N 3.32Å; I77-H79 PolarHBondContact O-N 3.22Å
80	F	85.7	Confident	78.7	Confident	104 Å²	104	78.3 Å²	78.3	46%	0.456	42%	0.42	S	S	.	.	H	α-helix	trans	-80.3	-30.8	-179.2	-82.3	-82.7	0	0	0	114	F76 I77 A114	F76-F80 AromaticContact CD1-CD2 3.57Å; F76-F80 HydrophobicContact CD1-CD2 3.57Å; F76-F80 AromaticContact CD1-CE2 3.92Å; F76-F80 HydrophobicContact CD1-CE2 3.92Å; F76-F80 HydrophobicContact CD2-CD2 4.23Å; F76-F80 AromaticContact CD2-CE2 3.85Å; F76-F80 HydrophobicContact CD2-CE2 3.85Å; F76-F80 AromaticContact CE1-CD2 3.32Å; F76-F80 HydrophobicContact CE1-CD2 3.32Å; F76-F80 AromaticContact CE1-CE2 3.41Å; F76-F80 HydrophobicContact CE1-CE2 3.41Å; F76-F80 VanDerWaalsContact CE1-CE2 3.41Å; F76-F80 HydrophobicContact CE1-CG 4.2Å; F76-F80 HydrophobicContact CE1-CZ 4.3Å; F76-F80 HydrophobicContact CE2-CD2 4.04Å; F76-F80 AromaticContact CE2-CE2 3.34Å; F76-F80 HydrophobicContact CE2-CE2 3.34Å; F76-F80 HydrophobicContact CE2-CZ 4.17Å; F76-F80 HydrophobicContact CG-CD2 4.03Å; F76-F80 HydrophobicContact CG-CE2 4.13Å; F76-F80 AromaticContact CZ-CD2 3.59Å; F76-F80 HydrophobicContact CZ-CD2 3.59Å; F76-F80 AromaticContact CZ-CE2 3.1Å; F76-F80 HydrophobicContact CZ-CE2 3.1Å; F76-F80 AromaticContact CZ-CZ 3.78Å; F76-F80 HydrophobicContact CZ-CZ 3.78Å; F76-F80 VanDerWaalsContact O-CD2 3.29Å; F76-F80 WeakPolarHBondContact O-CD2 3.24Å; F76-F80 PolarHBondContact O-N 3.44Å; I77-F80 PolarHBondContact O-N 2.85Å; F80-A114 HydrophobicContact CB-CB 3.63Å
81	T	86.3	Confident	79.6	Confident	20 Å²	20	77.3 Å²	77.3	12%	0.123	41%	0.413	C	S	.	.	H	α-helix	trans	-79.8	-23.7	176.7	56.6	0	0	0	0	112.3	I77 K78 A114 L117	I77-T81 HydrophobicContact CG2-CG2 3.99Å; I77-T81 WeakPolarHBondContact O-CB 3.44Å; I77-T81 WeakPolarHBondContact O-CG2 3.5Å; I77-T81 PolarHBondContact O-N 3.33Å; I77-T81 PolarHBondContact O-OG1 3.33Å; K78-T81 PolarHBondContact O-OG1 2.87Å; T81-A114 HydrophobicContact CG2-CB 4.21Å; T81-L117 HydrophobicContact CG2-CB 3.92Å; T81-L117 HydrophobicContact CG2-CD1 4.48Å
82	G	81.8	Confident	80.2	Confident	32 Å²	32	81.2 Å²	81.2	33%	0.33	43%	0.425	S	S	.	.			trans	67.9	-166.2	-176	0	0	0	0	0	112.8	K78 V84	K78-G82 PolarHBondContact O-N 2.86Å; G82-V84 WeakPolarHBondContact O-CG2 3.45Å; G82-V84 PolarHBondContact O-N 3.08Å
83	P	70.6	Confident	80.3	Confident	138 Å²	138	81.2 Å²	81.2	90%	0.896	42%	0.423	S	S	*	.	S	Bend	trans	-72.1	81.2	171.9	30.5	-32.6	0	0	0	109.6
84	V	68.9	Low	80.5	Confident	37 Å²	37	81 Å²	81	22%	0.224	42%	0.422	C	S	.	.			trans	-91.4	111.8	171.4	-94	0	0	0	0	108.9	G82 F86 A121	G82-V84 WeakPolarHBondContact O-CG2 3.45Å; G82-V84 PolarHBondContact O-N 3.08Å; V84-F86 HydrophobicContact CB-CE1 3.78Å; V84-F86 HydrophobicContact CB-CE2 4.23Å; V84-F86 HydrophobicContact CB-CZ 3.63Å; V84-F86 HydrophobicContact CG1-CE1 4.44Å; V84-F86 HydrophobicContact CG2-CE1 4.02Å; V84-F86 HydrophobicContact CG2-CE2 3.89Å; V84-F86 HydrophobicContact CG2-CZ 3.35Å; V84-A121 HydrophobicContact CB-CB 4.1Å; V84-A121 HydrophobicContact CG1-CB 3.51Å
85	T	65.7	Low	80.6	Confident	133 Å²	133	85 Å²	85	82%	0.816	44%	0.439	S	S	*	.			trans	-81.4	115.1	169.1	51.5	0	0	0	0	108.2
86	F	69.1	Low	80.7	Confident	71 Å²	71	87.3 Å²	87.3	31%	0.311	44%	0.444	S	S	.	.			trans	-93.6	134.6	175.7	-56.2	-64.2	0	0	0	110.1	V84 F94 A121	V84-F86 HydrophobicContact CB-CE1 3.78Å; V84-F86 HydrophobicContact CB-CE2 4.23Å; V84-F86 HydrophobicContact CB-CZ 3.63Å; V84-F86 HydrophobicContact CG1-CE1 4.44Å; V84-F86 HydrophobicContact CG2-CE1 4.02Å; V84-F86 HydrophobicContact CG2-CE2 3.89Å; V84-F86 HydrophobicContact CG2-CZ 3.35Å; F86-F94 HydrophobicContact CD1-CD1 4.07Å; F86-F94 AromaticContact CD1-CD2 3.82Å; F86-F94 HydrophobicContact CD1-CD2 3.82Å; F86-F94 AromaticContact CD1-CE1 3.77Å; F86-F94 HydrophobicContact CD1-CE1 3.77Å; F86-F94 AromaticContact CD1-CE2 3.44Å; F86-F94 HydrophobicContact CD1-CE2 3.44Å; F86-F94 VanDerWaalsContact CD1-CE2 3.44Å; F86-F94 HydrophobicContact CD1-CG 4.1Å; F86-F94 AromaticContact CD1-CZ 3.42Å; F86-F94 HydrophobicContact CD1-CZ 3.42Å; F86-F94 VanDerWaalsContact CD1-CZ 3.42Å; F86-F94 HydrophobicContact CD2-CD1 4.42Å; F86-F94 AromaticContact CE1-CD1 3.57Å; F86-F94 HydrophobicContact CE1-CD1 3.57Å; F86-F94 HydrophobicContact CE1-CD2 4.07Å; F86-F94 AromaticContact CE1-CE1 2.99Å; F86-F94 HydrophobicContact CE1-CE1 2.99Å; F86-F94 AromaticContact CE1-CE2 3.53Å; F86-F94 HydrophobicContact CE1-CE2 3.53Å; F86-F94 HydrophobicContact CE1-CG 4.07Å; F86-F94 AromaticContact CE1-CZ 2.95Å; F86-F94 HydrophobicContact CE1-CZ 2.95Å; F86-F94 AromaticContact CE2-CD1 3.93Å; F86-F94 HydrophobicContact CE2-CD1 3.93Å; F86-F94 HydrophobicContact CE2-CE1 4.1Å; F86-F94 HydrophobicContact CE2-CG 4.45Å; F86-F94 HydrophobicContact CG-CD1 4.47Å; F86-F94 HydrophobicContact CG-CD2 4.26Å; F86-F94 HydrophobicContact CG-CE2 4.32Å; F86-F94 HydrophobicContact CG-CG 4.32Å; F86-F94 HydrophobicContact CG-CZ 4.47Å; F86-F94 AromaticContact CZ-CD1 3.45Å; F86-F94 HydrophobicContact CZ-CD1 3.45Å; F86-F94 VanDerWaalsContact CZ-CD1 3.45Å; F86-F94 AromaticContact CZ-CE1 3.16Å; F86-F94 HydrophobicContact CZ-CE1 3.16Å; F86-F94 HydrophobicContact CZ-CE2 4.41Å; F86-F94 HydrophobicContact CZ-CG 4.22Å; F86-F94 AromaticContact CZ-CZ 3.69Å; F86-F94 HydrophobicContact CZ-CZ 3.69Å; F86-A121 HydrophobicContact CD1-CB 3.97Å; F86-A121 HydrophobicContact CE1-CB 3.44Å; F86-A121 VanDerWaalsContact CE1-CB 3.44Å; F86-A121 HydrophobicContact CZ-CB 4.49Å
87	S	73.1	Confident	80.8	Confident	14 Å²	14	85.3 Å²	85.3	10%	0.098	44%	0.436	C	S	.	.			trans	-59.5	144.4	164.3	176.3	0	0	0	0	110.2	E89 C90 S91 C126 T129	S87-E89 PolarHBondContact O-N 2.84Å; S87-C90 PolarHBondContact O-N 3.19Å; S87-C90 VanDerWaalsContact O-N 3.08Å; S87-S91 PolarHBondContact O-N 2.9Å; S87-C126 WeakPolarHBondContact CB-O 3.35Å; S87-T129 WeakPolarHBondContact OG-CG2 3.21Å; S87-T129 PolarHBondContact OG-OG1 2.99Å
88	P	75.8	Confident	80.9	Confident	110 Å²	110	86.1 Å²	86.1	71%	0.714	44%	0.439	S	S	*	.	H	α-helix	trans	-56.8	-30.6	-178.4	21.3	-34.4	0	0	0	113.6	C90 S91	P88-C90 PolarHBondContact O-N 3.04Å; P88-S91 PolarHBondContact O-N 3.19Å
89	E	77.4	Confident	81	Confident	148 Å²	148	85 Å²	85	69%	0.692	43%	0.432	S	S	*	.	H	α-helix	trans	-63.6	-40.9	176.9	-64.6	-159.3	157.4	0	0	112.1	S87	S87-E89 PolarHBondContact O-N 2.84Å
90	C	80.1	Confident	81.1	Confident	17 Å²	17	83.2 Å²	83.2	12%	0.115	43%	0.428	C	S	.	.	H	α-helix	trans	-85.9	-23	179.5	-78.2	0	0	0	0	113.6	S87 P88 K92 H93 F94 C126	S87-C90 PolarHBondContact O-N 3.19Å; S87-C90 VanDerWaalsContact O-N 3.08Å; P88-C90 PolarHBondContact O-N 3.04Å; C90-K92 PolarHBondContact O-N 3.35Å; C90-H93 PolarHBondContact O-N 3.43Å; C90-F94 HydrophobicContact CB-CD2 4.19Å; C90-F94 HydrophobicContact CB-CE2 4.36Å; C90-F94 WeakPolarHBondContact O-CD2 3.29Å; C90-F94 PolarHBondContact O-N 2.98Å; C90-C126 HydrophobicContact CB-CB 3.66Å; C90-C126 WeakPolarHBondContact CB-SG 3.16Å; C90-C126 WeakPolarHBondContact SG-CA 3.28Å; C90-C126 WeakPolarHBondContact SG-CB 3.28Å; C90-C126 CovalentContact SG-SG 2.02Å; C90-C126 PolarHBondContact SG-SG 2.69Å
91	S	82.9	Confident	81.1	Confident	59 Å²	59	80.4 Å²	80.4	41%	0.413	42%	0.419	S	S	.	.	H	α-helix	trans	-52.7	-40.6	-179.9	-176.4	0	0	0	0	112.9	S87 P88 F94 H95	S87-S91 PolarHBondContact O-N 2.9Å; P88-S91 PolarHBondContact O-N 3.19Å; S91-F94 WeakPolarHBondContact O-CB 3.37Å; S91-F94 PolarHBondContact O-N 3.46Å; S91-H95 WeakPolarHBondContact O-CB 3.39Å; S91-H95 PolarHBondContact O-N 3.18Å
92	K	86.3	Confident	81	Confident	177 Å²	177	89.8 Å²	89.8	77%	0.77	45%	0.452	S	S	*	.	H	α-helix	trans	-64.7	-42.2	176.4	-172.9	177.6	-178.6	178.4	0	112.6	C90 H95 R96	C90-K92 PolarHBondContact O-N 3.35Å; K92-H95 PolarHBondContact O-N 3.08Å; K92-R96 PolarHBondContact O-N 3.48Å
93	H	84.7	Confident	81	Confident	99 Å²	99	90.9 Å²	90.9	46%	0.458	45%	0.449	S	S	.	.	H	α-helix	trans	-66.7	-42.3	177.5	-172.2	79.3	0	0	0	111.1	C90 H95 R96 L97	C90-H93 PolarHBondContact O-N 3.43Å; H93-H95 PolarHBondContact O-N 3.5Å; H93-R96 PolarHBondContact O-N 3.18Å; H93-L97 WeakPolarHBondContact O-CB 3.46Å; H93-L97 PolarHBondContact O-N 2.95Å
94	F	87.1	Confident	81.5	Confident	12 Å²	12	84.3 Å²	84.3	5%	0.053	41%	0.406	C	S	.	.	H	α-helix	trans	-55.4	-50.8	172.7	-97.3	-93.5	0	0	0	112.7	F86 C90 S91 R96 L97 Y98 L117 L120 A121	F86-F94 HydrophobicContact CD1-CD1 4.07Å; F86-F94 AromaticContact CD1-CD2 3.82Å; F86-F94 HydrophobicContact CD1-CD2 3.82Å; F86-F94 AromaticContact CD1-CE1 3.77Å; F86-F94 HydrophobicContact CD1-CE1 3.77Å; F86-F94 AromaticContact CD1-CE2 3.44Å; F86-F94 HydrophobicContact CD1-CE2 3.44Å; F86-F94 VanDerWaalsContact CD1-CE2 3.44Å; F86-F94 HydrophobicContact CD1-CG 4.1Å; F86-F94 AromaticContact CD1-CZ 3.42Å; F86-F94 HydrophobicContact CD1-CZ 3.42Å; F86-F94 VanDerWaalsContact CD1-CZ 3.42Å; F86-F94 HydrophobicContact CD2-CD1 4.42Å; F86-F94 AromaticContact CE1-CD1 3.57Å; F86-F94 HydrophobicContact CE1-CD1 3.57Å; F86-F94 HydrophobicContact CE1-CD2 4.07Å; F86-F94 AromaticContact CE1-CE1 2.99Å; F86-F94 HydrophobicContact CE1-CE1 2.99Å; F86-F94 AromaticContact CE1-CE2 3.53Å; F86-F94 HydrophobicContact CE1-CE2 3.53Å; F86-F94 HydrophobicContact CE1-CG 4.07Å; F86-F94 AromaticContact CE1-CZ 2.95Å; F86-F94 HydrophobicContact CE1-CZ 2.95Å; F86-F94 AromaticContact CE2-CD1 3.93Å; F86-F94 HydrophobicContact CE2-CD1 3.93Å; F86-F94 HydrophobicContact CE2-CE1 4.1Å; F86-F94 HydrophobicContact CE2-CG 4.45Å; F86-F94 HydrophobicContact CG-CD1 4.47Å; F86-F94 HydrophobicContact CG-CD2 4.26Å; F86-F94 HydrophobicContact CG-CE2 4.32Å; F86-F94 HydrophobicContact CG-CG 4.32Å; F86-F94 HydrophobicContact CG-CZ 4.47Å; F86-F94 AromaticContact CZ-CD1 3.45Å; F86-F94 HydrophobicContact CZ-CD1 3.45Å; F86-F94 VanDerWaalsContact CZ-CD1 3.45Å; F86-F94 AromaticContact CZ-CE1 3.16Å; F86-F94 HydrophobicContact CZ-CE1 3.16Å; F86-F94 HydrophobicContact CZ-CE2 4.41Å; F86-F94 HydrophobicContact CZ-CG 4.22Å; F86-F94 AromaticContact CZ-CZ 3.69Å; F86-F94 HydrophobicContact CZ-CZ 3.69Å; C90-F94 HydrophobicContact CB-CD2 4.19Å; C90-F94 HydrophobicContact CB-CE2 4.36Å; C90-F94 WeakPolarHBondContact O-CD2 3.29Å; C90-F94 PolarHBondContact O-N 2.98Å; S91-F94 WeakPolarHBondContact O-CB 3.37Å; S91-F94 PolarHBondContact O-N 3.46Å; F94-R96 VanDerWaalsContact C-N 3.29Å; F94-R96 PolarHBondContact O-N 3.01Å; F94-L97 PolarHBondContact O-N 2.83Å; F94-Y98 VanDerWaalsContact O-CB 3.26Å; F94-Y98 WeakPolarHBondContact O-CB 3.39Å; F94-Y98 PolarHBondContact O-N 3.18Å; F94-L117 HydrophobicContact CD1-CB 4.33Å; F94-L117 HydrophobicContact CD1-CD2 3.34Å; F94-L117 HydrophobicContact CD1-CG 4.37Å; F94-L117 HydrophobicContact CE1-CB 3.66Å; F94-L117 HydrophobicContact CE1-CD2 3.5Å; F94-L117 VanDerWaalsContact CE1-CD2 3.5Å; F94-L117 HydrophobicContact CE1-CG 4.15Å; F94-L117 WeakPolarHBondContact CE1-O 3.26Å; F94-L117 HydrophobicContact CG-CD2 4.34Å; F94-L117 WeakPolarHBondContact CZ-O 3.06Å; F94-L120 HydrophobicContact CD2-CB 4.38Å; F94-L120 HydrophobicContact CE1-CB 4.26Å; F94-L120 HydrophobicContact CE2-CB 3.34Å; F94-L120 HydrophobicContact CE2-CD1 4.38Å; F94-L120 HydrophobicContact CE2-CG 4.49Å; F94-L120 HydrophobicContact CZ-CB 3.26Å; F94-L120 HydrophobicContact CZ-CD1 4.36Å; F94-L120 HydrophobicContact CZ-CG 4.45Å; F94-A121 HydrophobicContact CZ-CB 4.2Å
95	H	87	Confident	82.2	Confident	118 Å²	118	85.6 Å²	85.6	55%	0.546	42%	0.417	S	S	.	.	H	α-helix	trans	-61.5	-41.9	-179.4	-156.7	-96.5	0	0	0	111	S91 K92 H93 L97 Y99	S91-H95 WeakPolarHBondContact O-CB 3.39Å; S91-H95 PolarHBondContact O-N 3.18Å; K92-H95 PolarHBondContact O-N 3.08Å; H93-H95 PolarHBondContact O-N 3.5Å; H95-L97 PolarHBondContact O-N 3.09Å; H95-Y99 AromaticContact CD2-CE2 3.84Å; H95-Y99 AromaticContact CE1-CD2 3.66Å; H95-Y99 AromaticContact CE1-CE2 3.51Å; H95-Y99 AromaticContact ND1-CD2 3.82Å; H95-Y99 AromaticContact NE2-CD2 3.91Å; H95-Y99 AromaticContact NE2-CE2 3.34Å; H95-Y99 VanDerWaalsContact NE2-CE2 3.34Å; H95-Y99 WeakPolarHBondContact NE2-CE2 3.28Å; H95-Y99 WeakPolarHBondContact O-CD2 3.09Å; H95-Y99 PolarHBondContact O-N 2.04Å
96	R	88.8	Confident	83.2	Confident	182 Å²	182	82.2 Å²	82.2	69%	0.687	40%	0.396	S	S	*	.	H	α-helix	trans	-62.4	-44.6	175.6	-169.6	-179.8	-179.3	176.5	-0.5	111.4	K92 H93 F94 N100	K92-R96 PolarHBondContact O-N 3.48Å; H93-R96 PolarHBondContact O-N 3.18Å; F94-R96 VanDerWaalsContact C-N 3.29Å; F94-R96 PolarHBondContact O-N 3.01Å; R96-N100 WeakPolarHBondContact CG-ND2 3.46Å; R96-N100 WeakPolarHBondContact O-CB 3.33Å; R96-N100 PolarHBondContact O-N 2.84Å; R96-N100 PolarHBondContact O-ND2 3.5Å
97	L	88.8	Confident	83.8	Confident	24 Å²	24	81.7 Å²	81.7	13%	0.126	40%	0.4	C	S	.	.	H	α-helix	trans	-66.2	-45.3	-179	-162	82.9	0	0	0	111.3	H93 F94 H95 Y99 T101 L116 L117 L120	H93-L97 WeakPolarHBondContact O-CB 3.46Å; H93-L97 PolarHBondContact O-N 2.95Å; F94-L97 PolarHBondContact O-N 2.83Å; H95-L97 PolarHBondContact O-N 3.09Å; L97-Y99 VanDerWaalsContact C-N 3.31Å; L97-Y99 PolarHBondContact O-N 2.92Å; L97-T101 WeakPolarHBondContact CA-OG1 3.14Å; L97-T101 HydrophobicContact CD1-CG2 4.26Å; L97-T101 WeakPolarHBondContact CD1-OG1 3.34Å; L97-T101 WeakPolarHBondContact CG-OG1 3.05Å; L97-T101 VanDerWaalsContact O-CB 3.28Å; L97-T101 WeakPolarHBondContact O-CB 3.09Å; L97-T101 PolarHBondContact O-N 3.18Å; L97-T101 PolarHBondContact O-OG1 3.28Å; L97-L116 HydrophobicContact CD1-CD2 4.11Å; L97-L116 HydrophobicContact CD2-CD2 3.5Å; L97-L116 VanDerWaalsContact CD2-CD2 3.5Å; L97-L116 HydrophobicContact CD2-CG 3.72Å; L97-L116 HydrophobicContact CG-CD2 4.15Å; L97-L117 HydrophobicContact CD2-CD2 3.71Å; L97-L117 HydrophobicContact CD2-CG 4.44Å; L97-L120 HydrophobicContact CD2-CD1 3.54Å
98	Y	87.3	Confident	84.5	Confident	24 Å²	24	85 Å²	85	9%	0.094	43%	0.428	C	S	.	.	H	α-helix	trans	-64.4	-33	-176	179.4	-105.9	0	0	0	113.6	K73 D74 I77 F94 C104 L117	K73-Y98 HydrophobicContact CD-CE2 4.05Å; K73-Y98 VanDerWaalsContact CE-OH 3.26Å; K73-Y98 WeakPolarHBondContact CE-OH 3.17Å; K73-Y98 HydrophobicContact CG-CE2 4.09Å; K73-Y98 PolarHBondContact NZ-O 3.24Å; D74-Y98 WeakPolarHBondContact CA-OH 2.91Å; D74-Y98 PolarHBondContact N-OH 3.3Å; D74-Y98 WeakPolarHBondContact OD2-CE1 3.28Å; D74-Y98 PolarHBondContact OD2-OH 2.99Å; I77-Y98 HydrophobicContact CB-CE2 3.95Å; I77-Y98 HydrophobicContact CG1-CE2 3.98Å; I77-Y98 HydrophobicContact CG2-CD2 4.22Å; I77-Y98 HydrophobicContact CG2-CE2 3.86Å; F94-Y98 VanDerWaalsContact O-CB 3.26Å; F94-Y98 WeakPolarHBondContact O-CB 3.39Å; F94-Y98 PolarHBondContact O-N 3.18Å; Y98-C104 WeakPolarHBondContact O-CB 3.23Å; Y98-L117 HydrophobicContact CD2-CD1 4.03Å
99	Y	87.4	Confident	85.2	Confident	112 Å²	112	85.3 Å²	85.3	44%	0.439	42%	0.416	S	S	.	.	H	α-helix	trans	-99.3	-31.8	-179.7	-71.7	-71.3	0	0	0	114.5	H95 L97	H95-Y99 AromaticContact CD2-CE2 3.84Å; H95-Y99 AromaticContact CE1-CD2 3.66Å; H95-Y99 AromaticContact CE1-CE2 3.51Å; H95-Y99 AromaticContact ND1-CD2 3.82Å; H95-Y99 AromaticContact NE2-CD2 3.91Å; H95-Y99 AromaticContact NE2-CE2 3.34Å; H95-Y99 VanDerWaalsContact NE2-CE2 3.34Å; H95-Y99 WeakPolarHBondContact NE2-CE2 3.28Å; H95-Y99 WeakPolarHBondContact O-CD2 3.09Å; H95-Y99 PolarHBondContact O-N 2.04Å; L97-Y99 VanDerWaalsContact C-N 3.31Å; L97-Y99 PolarHBondContact O-N 2.92Å
100	N	87.4	Confident	85.7	Confident	117 Å²	117	79.1 Å²	79.1	63%	0.626	39%	0.386	S	S	*	.	H	α-helix	trans	-104.6	-13.8	-170.8	-56.5	-60	0	0	0	114.8	R96	R96-N100 WeakPolarHBondContact CG-ND2 3.46Å; R96-N100 WeakPolarHBondContact O-CB 3.33Å; R96-N100 PolarHBondContact O-N 2.84Å; R96-N100 PolarHBondContact O-ND2 3.5Å
101	T	87.4	Confident	86.1	Confident	44 Å²	44	84.4 Å²	84.4	27%	0.27	41%	0.407	S	S	.	.			trans	-86.9	133.9	-176.8	-27.6	0	0	0	0	110.9	L97 E103 C104 S105	L97-T101 WeakPolarHBondContact CA-OG1 3.14Å; L97-T101 HydrophobicContact CD1-CG2 4.26Å; L97-T101 WeakPolarHBondContact CD1-OG1 3.34Å; L97-T101 WeakPolarHBondContact CG-OG1 3.05Å; L97-T101 VanDerWaalsContact O-CB 3.28Å; L97-T101 WeakPolarHBondContact O-CB 3.09Å; L97-T101 PolarHBondContact O-N 3.18Å; L97-T101 PolarHBondContact O-OG1 3.28Å; T101-E103 PolarHBondContact O-N 2.88Å; T101-C104 CarbonylContact O-C 3.6Å; T101-C104 WeakPolarHBondContact O-CA 3.24Å; T101-C104 PolarHBondContact O-N 3.49Å; T101-S105 PolarHBondContact O-N 2.98Å; T101-S105 PolarHBondContact O-OG 2.88Å
102	R	84.2	Confident	86.5	Confident	217 Å²	217	88.5 Å²	88.5	82%	0.819	41%	0.414	S	S	*	.	H	α-helix	trans	-56.1	-35.9	178.2	-66.3	-172.6	179	-143.7	1.3	113.2	C104 S105 T106	R102-C104 PolarHBondContact O-N 3.06Å; R102-S105 PolarHBondContact O-N 3.39Å; R102-T106 PolarHBondContact O-N 3.39Å
103	E	80.1	Confident	86.6	Confident	55 Å²	55	80 Å²	80	26%	0.257	38%	0.377	S	S	.	.	H	α-helix	trans	-63.9	-22.5	177.2	-60.2	-140.8	121.4	0	0	113.1	T101 Y109 R112 C113	T101-E103 PolarHBondContact O-N 2.88Å; E103-Y109 CarbonylContact O-C 3.42Å; E103-Y109 VanDerWaalsContact O-CB 3.28Å; E103-Y109 WeakPolarHBondContact O-CB 3.43Å; E103-R112 WeakPolarHBondContact OE1-CD 3.39Å; E103-R112 IonicContact OE1-CZ 3.68Å; E103-R112 IonicContact OE1-NE 3.72Å; E103-R112 IonicContact OE1-NH1 2.83Å; E103-R112 PolarHBondContact OE1-NH1 3.06Å; E103-R112 WeakPolarHBondContact OE2-CD 3.35Å; E103-C113 WeakPolarHBondContact O-CB 3.22Å
104	C	81.8	Confident	86.9	Confident	0 Å²	0	75.5 Å²	75.5	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-99.5	-5.1	176.5	-60.5	0	0	0	0	112.7	K73 Y98 T101 R102 Y110 C113	K73-C104 WeakPolarHBondContact CD-O 3.33Å; Y98-C104 WeakPolarHBondContact O-CB 3.23Å; T101-C104 CarbonylContact O-C 3.6Å; T101-C104 WeakPolarHBondContact O-CA 3.24Å; T101-C104 PolarHBondContact O-N 3.49Å; R102-C104 PolarHBondContact O-N 3.06Å; C104-Y110 WeakPolarHBondContact O-CE1 3.01Å; C104-C113 VanDerWaalsContact CA-SG 3.59Å; C104-C113 HydrophobicContact CB-CB 3.97Å; C104-C113 WeakPolarHBondContact CB-SG 2.94Å; C104-C113 WeakPolarHBondContact SG-CB 3.39Å; C104-C113 CovalentContact SG-SG 2.04Å; C104-C113 PolarHBondContact SG-SG 2.55Å
105	S	83.5	Confident	87.1	Confident	65 Å²	65	83.3 Å²	83.3	46%	0.455	39%	0.385	S	S	.	.	H	α-helix	trans	-95	-33	178.4	-51.2	0	0	0	0	112.7	T101 R102 Y110	T101-S105 PolarHBondContact O-N 2.98Å; T101-S105 PolarHBondContact O-OG 2.88Å; R102-S105 PolarHBondContact O-N 3.39Å; S105-Y110 PolarHBondContact O-OH 2.84Å
106	T	86.4	Confident	87.2	Confident	62 Å²	62	79.8 Å²	79.8	38%	0.38	37%	0.37	S	S	.	.	S	Bend	trans	-96.8	127.3	-176	-49	0	0	0	0	111.9	R102 A108 Y109 Y110	R102-T106 PolarHBondContact O-N 3.39Å; T106-A108 VanDerWaalsContact C-N 3.25Å; T106-A108 HydrophobicContact CG2-CB 4.27Å; T106-A108 PolarHBondContact O-N 3.44Å; T106-A108 VanDerWaalsContact O-N 3.14Å; T106-Y109 HydrophobicContact CG2-CD2 4.11Å; T106-Y109 HydrophobicContact CG2-CE2 4.23Å; T106-Y109 PolarHBondContact O-N 3.32Å; T106-Y110 WeakPolarHBondContact O-CD1 3.26Å; T106-Y110 WeakPolarHBondContact O-CE1 3.44Å
107	P	83.6	Confident	87.1	Confident	59 Å²	59	71.4 Å²	71.4	38%	0.383	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-54.2	-36.3	-177.4	-26.2	31.8	0	0	0	114.8	F66 Y109 Y110	F66-P107 HydrophobicContact CE1-CG 3.64Å; F66-P107 HydrophobicContact CZ-CG 3.89Å; P107-Y109 PolarHBondContact O-N 3.48Å; P107-Y109 VanDerWaalsContact O-N 3.09Å; P107-Y110 HydrophobicContact CB-CD2 4.41Å; P107-Y110 HydrophobicContact CB-CE2 4.07Å; P107-Y110 HydrophobicContact CG-CE2 4.29Å; P107-Y110 PolarHBondContact O-N 2.91Å
108	A	87.8	Confident	87.1	Confident	84 Å²	84	72.5 Å²	72.5	69%	0.694	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-58.1	-23.9	177.1	0	0	0	0	0	113.5	T106	T106-A108 VanDerWaalsContact C-N 3.25Å; T106-A108 HydrophobicContact CG2-CB 4.27Å; T106-A108 PolarHBondContact O-N 3.44Å; T106-A108 VanDerWaalsContact O-N 3.14Å
109	Y	88.5	Confident	87.2	Confident	117 Å²	117	78.8 Å²	78.8	46%	0.459	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-107.6	1.6	-175.8	-56.5	-51.7	0	0	0	114.1	E103 T106 P107 K111 R112 C113	E103-Y109 CarbonylContact O-C 3.42Å; E103-Y109 VanDerWaalsContact O-CB 3.28Å; E103-Y109 WeakPolarHBondContact O-CB 3.43Å; T106-Y109 HydrophobicContact CG2-CD2 4.11Å; T106-Y109 HydrophobicContact CG2-CE2 4.23Å; T106-Y109 PolarHBondContact O-N 3.32Å; P107-Y109 PolarHBondContact O-N 3.48Å; P107-Y109 VanDerWaalsContact O-N 3.09Å; Y109-K111 VanDerWaalsContact C-N 3.27Å; Y109-K111 PolarHBondContact O-N 2.9Å; Y109-R112 WeakPolarHBondContact O-CA 3.28Å; Y109-R112 WeakPolarHBondContact O-CB 3.35Å; Y109-R112 PolarHBondContact O-N 3.19Å; Y109-C113 PolarHBondContact O-N 3.21Å
110	Y	88.1	Confident	87.1	Confident	18 Å²	18	75.1 Å²	75.1	7%	0.071	36%	0.359	C	S	.	.	H	α-helix	trans	-57.9	-36.2	-177.3	-71.6	-5.3	0	0	0	113.6	K73 F76 I77 C104 S105 T106 P107 R112 C113 A114	K73-Y110 HydrophobicContact CB-CE1 4.33Å; K73-Y110 HydrophobicContact CB-CE2 3.71Å; K73-Y110 HydrophobicContact CD-CE1 4.13Å; K73-Y110 HydrophobicContact CG-CD1 4.39Å; K73-Y110 HydrophobicContact CG-CD2 4.5Å; K73-Y110 HydrophobicContact CG-CE1 3.88Å; K73-Y110 HydrophobicContact CG-CE2 4.01Å; F76-Y110 HydrophobicContact CB-CD2 4.48Å; F76-Y110 HydrophobicContact CD1-CD2 4.39Å; F76-Y110 HydrophobicContact CG-CD2 4.48Å; I77-Y110 HydrophobicContact CD1-CG 4.41Å; I77-Y110 WeakPolarHBondContact CD1-O 3.16Å; C104-Y110 WeakPolarHBondContact O-CE1 3.01Å; S105-Y110 PolarHBondContact O-OH 2.84Å; T106-Y110 WeakPolarHBondContact O-CD1 3.26Å; T106-Y110 WeakPolarHBondContact O-CE1 3.44Å; P107-Y110 HydrophobicContact CB-CD2 4.41Å; P107-Y110 HydrophobicContact CB-CE2 4.07Å; P107-Y110 HydrophobicContact CG-CE2 4.29Å; P107-Y110 PolarHBondContact O-N 2.91Å; Y110-R112 VanDerWaalsContact C-N 3.26Å; Y110-R112 PolarHBondContact O-N 3.45Å; Y110-C113 PolarHBondContact O-N 3.19Å; Y110-A114 WeakPolarHBondContact O-CB 3.46Å; Y110-A114 PolarHBondContact O-N 3.14Å
111	K	89.1	Confident	86.9	Confident	128 Å²	128	70.3 Å²	70.3	56%	0.557	34%	0.335	S	S	*	.	H	α-helix	trans	-60.8	-35.7	174	-70	-176.9	-179.7	178	0	112.5	F76 Y109 R115	F76-K111 HydrophobicContact CE1-CG 3.85Å; F76-K111 HydrophobicContact CZ-CG 3.67Å; Y109-K111 VanDerWaalsContact C-N 3.27Å; Y109-K111 PolarHBondContact O-N 2.9Å; K111-R115 VanDerWaalsContact O-CG 3.31Å; K111-R115 WeakPolarHBondContact O-CG 3.45Å; K111-R115 PolarHBondContact O-N 3.19Å
112	R	91.6	Very high	86.8	Confident	144 Å²	144	73.2 Å²	73.2	54%	0.543	35%	0.352	S	S	.	.	H	α-helix	trans	-75.4	-42	178	-169.7	-176.8	-91.7	-163.6	-6	110.9	E103 Y109 Y110 R115 L116	E103-R112 WeakPolarHBondContact OE1-CD 3.39Å; E103-R112 IonicContact OE1-CZ 3.68Å; E103-R112 IonicContact OE1-NE 3.72Å; E103-R112 IonicContact OE1-NH1 2.83Å; E103-R112 PolarHBondContact OE1-NH1 3.06Å; E103-R112 WeakPolarHBondContact OE2-CD 3.35Å; Y109-R112 WeakPolarHBondContact O-CA 3.28Å; Y109-R112 WeakPolarHBondContact O-CB 3.35Å; Y109-R112 PolarHBondContact O-N 3.19Å; Y110-R112 VanDerWaalsContact C-N 3.26Å; Y110-R112 PolarHBondContact O-N 3.45Å; R112-R115 PolarHBondContact O-N 2.66Å; R112-L116 WeakPolarHBondContact O-CB 3.15Å; R112-L116 PolarHBondContact O-N 3.32Å
113	C	88.8	Confident	86.7	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-56.2	-49.7	171.6	177.7	0	0	0	0	111.3	I77 E103 C104 Y109 Y110 R115 L116 L117	I77-C113 HydrophobicContact CD1-CB 3.99Å; E103-C113 WeakPolarHBondContact O-CB 3.22Å; C104-C113 VanDerWaalsContact CA-SG 3.59Å; C104-C113 HydrophobicContact CB-CB 3.97Å; C104-C113 WeakPolarHBondContact CB-SG 2.94Å; C104-C113 WeakPolarHBondContact SG-CB 3.39Å; C104-C113 CovalentContact SG-SG 2.04Å; C104-C113 PolarHBondContact SG-SG 2.55Å; Y109-C113 PolarHBondContact O-N 3.21Å; Y110-C113 PolarHBondContact O-N 3.19Å; C113-R115 VanDerWaalsContact C-N 3.33Å; C113-R115 PolarHBondContact O-N 3.33Å; C113-L116 WeakPolarHBondContact O-CB 3.46Å; C113-L116 PolarHBondContact O-N 3Å; C113-L116 VanDerWaalsContact O-N 3.08Å; C113-L117 WeakPolarHBondContact O-CB 3.31Å; C113-L117 VanDerWaalsContact O-CG 3.24Å; C113-L117 WeakPolarHBondContact O-CG 3.45Å; C113-L117 PolarHBondContact O-N 2.93Å; C113-L117 VanDerWaalsContact SG-CD1 3.57Å
114	A	90.3	Very high	86.7	Confident	3 Å²	3	65.5 Å²	65.5	3%	0.025	34%	0.336	C	S	.	.	H	α-helix	trans	-57.3	-44.3	177.7	0	0	0	0	0	112.2	I77 F80 T81 Y110 L116 L117 T118	I77-A114 HydrophobicContact CD1-CB 3.92Å; F80-A114 HydrophobicContact CB-CB 3.63Å; T81-A114 HydrophobicContact CG2-CB 4.21Å; Y110-A114 WeakPolarHBondContact O-CB 3.46Å; Y110-A114 PolarHBondContact O-N 3.14Å; A114-L116 VanDerWaalsContact C-N 3.34Å; A114-L116 PolarHBondContact O-N 3.21Å; A114-L117 PolarHBondContact O-N 2.9Å; A114-T118 PolarHBondContact O-N 2.9Å; A114-T118 PolarHBondContact O-OG1 3.17Å
115	R	90.9	Very high	86.4	Confident	176 Å²	176	72.1 Å²	72.1	66%	0.664	37%	0.37	S	S	*	.	H	α-helix	trans	-63.9	-37.1	175.7	-71.7	172.1	-180	-175.9	-0.9	113.2	K111 R112 C113 R119	K111-R115 VanDerWaalsContact O-CG 3.31Å; K111-R115 WeakPolarHBondContact O-CG 3.45Å; K111-R115 PolarHBondContact O-N 3.19Å; R112-R115 PolarHBondContact O-N 2.66Å; C113-R115 VanDerWaalsContact C-N 3.33Å; C113-R115 PolarHBondContact O-N 3.33Å; R115-R119 WeakPolarHBondContact O-CB 3.37Å; R115-R119 WeakPolarHBondContact O-CG 3.49Å; R115-R119 PolarHBondContact O-N 3.25Å; R115-R119 PolarHBondContact O-NE 3.04Å
116	L	89.4	Confident	85.8	Confident	44 Å²	44	69.5 Å²	69.5	23%	0.23	35%	0.352	C	S	.	.	H	α-helix	trans	-65.3	-46.9	175.6	-179.7	61.7	0	0	0	110.3	L97 R112 C113 A114 R119 L120	L97-L116 HydrophobicContact CD1-CD2 4.11Å; L97-L116 HydrophobicContact CD2-CD2 3.5Å; L97-L116 VanDerWaalsContact CD2-CD2 3.5Å; L97-L116 HydrophobicContact CD2-CG 3.72Å; L97-L116 HydrophobicContact CG-CD2 4.15Å; R112-L116 WeakPolarHBondContact O-CB 3.15Å; R112-L116 PolarHBondContact O-N 3.32Å; C113-L116 WeakPolarHBondContact O-CB 3.46Å; C113-L116 PolarHBondContact O-N 3Å; C113-L116 VanDerWaalsContact O-N 3.08Å; A114-L116 VanDerWaalsContact C-N 3.34Å; A114-L116 PolarHBondContact O-N 3.21Å; L116-R119 PolarHBondContact O-N 2.9Å; L116-L120 HydrophobicContact CG-CD1 4.38Å; L116-L120 WeakPolarHBondContact O-CG 3.19Å; L116-L120 PolarHBondContact O-N 2.78Å
117	L	87.9	Confident	84.9	Confident	6 Å²	6	70.3 Å²	70.3	3%	0.031	36%	0.36	C	S	.	.	H	α-helix	trans	-60.3	-49.7	175.7	-67.2	171.6	0	0	0	110.9	I77 T81 F94 L97 Y98 C113 A114 R119 L120 A121	I77-L117 HydrophobicContact CG2-CD1 3.44Å; I77-L117 VanDerWaalsContact CG2-CD1 3.44Å; T81-L117 HydrophobicContact CG2-CB 3.92Å; T81-L117 HydrophobicContact CG2-CD1 4.48Å; F94-L117 HydrophobicContact CD1-CB 4.33Å; F94-L117 HydrophobicContact CD1-CD2 3.34Å; F94-L117 HydrophobicContact CD1-CG 4.37Å; F94-L117 HydrophobicContact CE1-CB 3.66Å; F94-L117 HydrophobicContact CE1-CD2 3.5Å; F94-L117 VanDerWaalsContact CE1-CD2 3.5Å; F94-L117 HydrophobicContact CE1-CG 4.15Å; F94-L117 WeakPolarHBondContact CE1-O 3.26Å; F94-L117 HydrophobicContact CG-CD2 4.34Å; F94-L117 WeakPolarHBondContact CZ-O 3.06Å; L97-L117 HydrophobicContact CD2-CD2 3.71Å; L97-L117 HydrophobicContact CD2-CG 4.44Å; Y98-L117 HydrophobicContact CD2-CD1 4.03Å; C113-L117 WeakPolarHBondContact O-CB 3.31Å; C113-L117 VanDerWaalsContact O-CG 3.24Å; C113-L117 WeakPolarHBondContact O-CG 3.45Å; C113-L117 PolarHBondContact O-N 2.93Å; C113-L117 VanDerWaalsContact SG-CD1 3.57Å; A114-L117 PolarHBondContact O-N 2.9Å; L117-R119 VanDerWaalsContact C-N 3.32Å; L117-R119 PolarHBondContact O-N 3.48Å; L117-L120 PolarHBondContact O-N 3.26Å; L117-A121 PolarHBondContact O-N 3.38Å
118	T	88.8	Confident	83.9	Confident	47 Å²	47	75.2 Å²	75.2	29%	0.288	38%	0.378	S	S	.	.	H	α-helix	trans	-59.1	-41.3	176.6	-56.1	0	0	0	0	112.4	A114 L120 A121 V122	A114-T118 PolarHBondContact O-N 2.9Å; A114-T118 PolarHBondContact O-OG1 3.17Å; T118-L120 PolarHBondContact O-N 3.36Å; T118-A121 WeakPolarHBondContact O-CB 3.34Å; T118-A121 PolarHBondContact O-N 2.55Å; T118-A121 VanDerWaalsContact O-N 3.1Å; T118-V122 WeakPolarHBondContact O-CG2 3.09Å; T118-V122 PolarHBondContact O-N 3.34Å; T118-V122 VanDerWaalsContact O-N 3.16Å
119	R	87.8	Confident	82.2	Confident	156 Å²	156	78 Å²	78	59%	0.589	39%	0.387	S	S	*	.	H	α-helix	trans	-64.6	-39	178.1	-80.7	-175.9	-65.8	-161.6	4.8	113.3	R115 L116 L117 A121 S123	R115-R119 WeakPolarHBondContact O-CB 3.37Å; R115-R119 WeakPolarHBondContact O-CG 3.49Å; R115-R119 PolarHBondContact O-N 3.25Å; R115-R119 PolarHBondContact O-NE 3.04Å; L116-R119 PolarHBondContact O-N 2.9Å; L117-R119 VanDerWaalsContact C-N 3.32Å; L117-R119 PolarHBondContact O-N 3.48Å; R119-A121 PolarHBondContact O-N 2.86Å; R119-S123 WeakPolarHBondContact O-CB 2.89Å; R119-S123 PolarHBondContact O-N 3.41Å
120	L	86	Confident	81.9	Confident	36 Å²	36	76.1 Å²	76.1	19%	0.188	38%	0.383	C	S	.	.	H	α-helix	trans	-64.9	-34.1	173.8	-71.6	170.2	0	0	0	110.7	F94 L97 L116 L117 T118 V122 S123 C126	F94-L120 HydrophobicContact CD2-CB 4.38Å; F94-L120 HydrophobicContact CE1-CB 4.26Å; F94-L120 HydrophobicContact CE2-CB 3.34Å; F94-L120 HydrophobicContact CE2-CD1 4.38Å; F94-L120 HydrophobicContact CE2-CG 4.49Å; F94-L120 HydrophobicContact CZ-CB 3.26Å; F94-L120 HydrophobicContact CZ-CD1 4.36Å; F94-L120 HydrophobicContact CZ-CG 4.45Å; L97-L120 HydrophobicContact CD2-CD1 3.54Å; L116-L120 HydrophobicContact CG-CD1 4.38Å; L116-L120 WeakPolarHBondContact O-CG 3.19Å; L116-L120 PolarHBondContact O-N 2.78Å; L117-L120 PolarHBondContact O-N 3.26Å; T118-L120 PolarHBondContact O-N 3.36Å; L120-V122 PolarHBondContact O-N 2.77Å; L120-S123 WeakPolarHBondContact O-CB 2.65Å; L120-S123 PolarHBondContact O-N 2.91Å; L120-C126 WeakPolarHBondContact O-CB 3.36Å; L120-C126 PolarHBondContact O-SG 3.41Å
121	A	83.9	Confident	81.5	Confident	16 Å²	16	79.1 Å²	79.1	13%	0.132	40%	0.4	C	S	.	.	H	α-helix	trans	-64.6	-42.6	-179.8	0	0	0	0	0	111.8	V84 F86 F94 L117 T118 R119	V84-A121 HydrophobicContact CB-CB 4.1Å; V84-A121 HydrophobicContact CG1-CB 3.51Å; F86-A121 HydrophobicContact CD1-CB 3.97Å; F86-A121 HydrophobicContact CE1-CB 3.44Å; F86-A121 VanDerWaalsContact CE1-CB 3.44Å; F86-A121 HydrophobicContact CZ-CB 4.49Å; F94-A121 HydrophobicContact CZ-CB 4.2Å; L117-A121 PolarHBondContact O-N 3.38Å; T118-A121 WeakPolarHBondContact O-CB 3.34Å; T118-A121 PolarHBondContact O-N 2.55Å; T118-A121 VanDerWaalsContact O-N 3.1Å; R119-A121 PolarHBondContact O-N 2.86Å
122	V	84.1	Confident	81.1	Confident	104 Å²	104	76.4 Å²	76.4	63%	0.63	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	2.6	-178.4	-55.1	0	0	0	0	112.9	T118 L120	T118-V122 WeakPolarHBondContact O-CG2 3.09Å; T118-V122 PolarHBondContact O-N 3.34Å; T118-V122 VanDerWaalsContact O-N 3.16Å; L120-V122 PolarHBondContact O-N 2.77Å
123	S	83.5	Confident	80.5	Confident	27 Å²	27	72.4 Å²	72.4	19%	0.189	38%	0.382	C	S	.	.	S	Bend	trans	-68.6	138.8	179.7	-177.4	0	0	0	0	109.7	R119 L120 L125 C126 S127	R119-S123 WeakPolarHBondContact O-CB 2.89Å; R119-S123 PolarHBondContact O-N 3.41Å; L120-S123 WeakPolarHBondContact O-CB 2.65Å; L120-S123 PolarHBondContact O-N 2.91Å; S123-L125 PolarHBondContact O-N 2.83Å; S123-L125 VanDerWaalsContact O-N 3.08Å; S123-C126 CarbonylContact O-C 3.59Å; S123-C126 PolarHBondContact O-N 3Å; S123-S127 PolarHBondContact O-N 2.96Å
124	P	78.3	Confident	80	Confident	84 Å²	84	76.9 Å²	76.9	55%	0.545	41%	0.406	S	S	.	.	H	α-helix	trans	-58.1	-24.9	176.2	24.2	-34.1	0	0	0	112.5	C126 S127 Q128	P124-C126 PolarHBondContact O-N 2.83Å; P124-S127 WeakPolarHBondContact CA-OG 3.1Å; P124-Q128 WeakPolarHBondContact O-CB 3.32Å; P124-Q128 PolarHBondContact O-N 2.94Å
125	L	75.3	Confident	79.3	Confident	138 Å²	138	81.9 Å²	81.9	72%	0.723	43%	0.431	S	S	*	.	H	α-helix	trans	-67.4	-21.8	174.2	-62.7	174.4	0	0	0	113.6	S123	S123-L125 PolarHBondContact O-N 2.83Å; S123-L125 VanDerWaalsContact O-N 3.08Å
126	C	72.6	Confident	78.5	Confident	11 Å²	11	75.1 Å²	75.1	7%	0.074	42%	0.415	C	S	.	.	H	α-helix	trans	-112.1	-14.9	-179.6	-60.1	0	0	0	0	113	S87 C90 L120 S123 P124	S87-C126 WeakPolarHBondContact CB-O 3.35Å; C90-C126 HydrophobicContact CB-CB 3.66Å; C90-C126 WeakPolarHBondContact CB-SG 3.16Å; C90-C126 WeakPolarHBondContact SG-CA 3.28Å; C90-C126 WeakPolarHBondContact SG-CB 3.28Å; C90-C126 CovalentContact SG-SG 2.02Å; C90-C126 PolarHBondContact SG-SG 2.69Å; L120-C126 WeakPolarHBondContact O-CB 3.36Å; L120-C126 PolarHBondContact O-SG 3.41Å; S123-C126 CarbonylContact O-C 3.59Å; S123-C126 PolarHBondContact O-N 3Å; P124-C126 PolarHBondContact O-N 2.83Å
127	S	67.6	Low	77.6	Confident	79 Å²	79	77.5 Å²	77.5	55%	0.552	43%	0.429	S	S	*	.	H	α-helix	trans	-96.6	-11.2	174.9	81.8	0	0	0	0	113.3	S123 P124 T129	S123-S127 PolarHBondContact O-N 2.96Å; P124-S127 WeakPolarHBondContact CA-OG 3.1Å; S127-T129 PolarHBondContact O-N 2.86Å; S127-T129 VanDerWaalsContact O-N 3.1Å
128	Q	61.9	Low	76.8	Confident	161 Å²	161	83.5 Å²	83.5	75%	0.752	46%	0.462	S	S	*	.			trans	-85	70.2	176.5	-169.1	170.3	109.2	0	0	108.7	P124	P124-Q128 WeakPolarHBondContact O-CB 3.32Å; P124-Q128 PolarHBondContact O-N 2.94Å
129	T	51.5	Low	75.7	Confident	143 Å²	143	86.8 Å²	86.8	88%	0.877	48%	0.478	S	S	*	.			trans	-142.7	0	165.7	55.4	0	0	0	0	109.3	S87 S127	S87-T129 WeakPolarHBondContact OG-CG2 3.21Å; S87-T129 PolarHBondContact OG-OG1 2.99Å; S127-T129 PolarHBondContact O-N 2.86Å; S127-T129 VanDerWaalsContact O-N 3.1Å

Retrieved 129 of 129 residues in 137.2 ms (Link to these results)

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