A0A096MXN1_PAPAN Loading...

Interleukin family protein

Immune regulatory cytokine. Multifunctional cytokine mainly produced by T-cells that plays a regulatory role in immune response, tissue homeostasis, host defense, and oncogenesis. Possesses antiviral functions and induces the type I interferon response during influenza infection. Signals through two receptor complexes IL20RA/IL20RB or IL20RB/IL22RA1. In turn, stimulates the JAK1-STAT3 and MAPK pathways and promotes the secretion of pro-inflammatory mediators including IL8 and MMP1. Intracellularly, maintains endoplasmic reticulum homeostasis by restricting the eIF2alpha-CHOP pathway-mediated stress signal. In addition, acts as a quality control mechanism for the ubiquitin proteasome system by alerting the cell to proteasome dysfunction through activation of PKR/EIF2AK2.

AlphaFold DB (A0A663DIF0), UniProt , Accession A0A096MXN1, Species PAPAN (Papio anubis, Olive baboon), Gene IL24, Length 207 aa.

Structure Viewer

Loading PAE data...

(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	38.4	Very low	32.1	Very low	240 Å²	240	172.9 Å²	172.9	100%	1.182	82%	0.819	S	S	*	*				0	89.6	0	-69.5	154.7	74.8	0	0	105.8
2	N	37.4	Very low	31.8	Very low	151 Å²	151	165.4 Å²	165.4	81%	0.807	80%	0.799	S	S	*	*				53.3	116.6	70.4	-147.7	6.9	0	0	0	113.5
3	F	30.8	Very low	31.6	Very low	183 Å²	183	164.8 Å²	164.8	80%	0.803	80%	0.801	S	S	*	*			trans	-167.9	107.2	136.5	-123.5	-101	0	0	0	111
4	Q	34.2	Very low	31.6	Very low	136 Å²	136	160.5 Å²	160.5	64%	0.636	81%	0.806	S	S	*	*			trans	51.2	110.6	142.6	-63.6	-174.4	-58.5	0	0	119.8
5	Q	33.9	Very low	31.6	Very low	170 Å²	170	157.1 Å²	157.1	79%	0.794	80%	0.803	S	S	*	*				47	107.5	84.1	-77.4	-177.1	-24.9	0	0	114.9
6	R	31.7	Very low	31.7	Very low	238 Å²	238	162 Å²	162	90%	0.898	81%	0.808	S	S	*	*				-176.8	99.8	124.4	-102.3	169.4	-176.6	-147.9	0.9	108.2
7	L	30.1	Very low	32.6	Very low	146 Å²	146	158.6 Å²	158.6	76%	0.764	80%	0.8	S	S	*	*				52.1	105.3	92.3	-99.9	140.2	0	0	0	113.1
8	Q	28.4	Very low	32.4	Very low	172 Å²	172	160.8 Å²	160.8	80%	0.804	80%	0.804	S	S	*	*				152.6	107.8	122.2	-83.2	172.1	-14.9	0	0	113.5
9	S	31.6	Very low	32.5	Very low	117 Å²	117	158.3 Å²	158.3	82%	0.818	80%	0.802	S	S	*	*			trans	-162.7	109.6	142.6	60	0	0	0	0	105.1
10	L	29.3	Very low	33.3	Very low	126 Å²	126	156.1 Å²	156.1	66%	0.66	80%	0.799	S	S	*	*			cis	59.6	118.1	37.1	-95.7	178.3	0	0	0	113.2
11	W	27.2	Very low	34.1	Very low	223 Å²	223	153.3 Å²	153.3	85%	0.845	79%	0.791	S	S	*	*			trans	82.4	132	169.1	-50.9	93.2	0	0	0	115.5
12	S	28.4	Very low	34.1	Very low	83 Å²	83	149 Å²	149	58%	0.58	77%	0.772	S	S	*	*			cis	173.5	151.7	-1	40.3	0	0	0	0	108.7
13	L	29.5	Very low	34.2	Very low	158 Å²	158	149.3 Å²	149.3	83%	0.827	77%	0.773	S	S	*	*			trans	60.8	113	144.3	-82.7	144.7	0	0	0	120.2
14	A	31.7	Very low	34.6	Very low	104 Å²	104	144.3 Å²	144.3	86%	0.86	77%	0.765	S	S	*	*			trans	-156.6	126.1	131.7	0	0	0	0	0	112
15	S	31.4	Very low	34.7	Very low	109 Å²	109	144.5 Å²	144.5	76%	0.762	78%	0.776	S	S	*	*			trans	-65	155.3	-173.7	-47.5	0	0	0	0	115.7
16	R	33	Very low	35.2	Very low	236 Å²	236	142.6 Å²	142.6	89%	0.891	78%	0.776	S	S	*	*			trans	-71.2	-171.2	157.5	-47.3	-180	165.9	-161.2	-3.4	109.9
17	P	47.1	Very low	35.8	Very low	104 Å²	104	136.4 Å²	136.4	68%	0.675	77%	0.769	S	S	*	*			cis	-147.6	-171.8	-3	38.5	-15.5	0	0	0	116.9
18	F	29.1	Very low	36.8	Very low	199 Å²	199	137.4 Å²	137.4	87%	0.873	77%	0.77	S	S	*	*			trans	95.7	115.1	142.2	-101.6	-87.3	0	0	0	122.2
19	C	34.5	Very low	37.5	Very low	113 Å²	113	137.4 Å²	137.4	76%	0.764	77%	0.772	S	S	*	*			trans	-63.8	-169.3	163.7	-52.8	0	0	0	0	112.8
20	P	47.5	Very low	38.5	Very low	114 Å²	114	139.8 Å²	139.8	74%	0.74	77%	0.77	S	S	*	*			cis	-148.4	-144.5	11.4	43	-17.6	0	0	0	112.4
21	P	51.4	Low	39.5	Very low	97 Å²	97	141.2 Å²	141.2	63%	0.63	78%	0.775	S	S	*	*			cis	-141.2	172.9	-13.2	38.9	-18.5	0	0	0	119.4
22	L	38.4	Very low	40.7	Very low	150 Å²	150	133.8 Å²	133.8	79%	0.785	76%	0.761	S	S	*	*			trans	68.9	131.9	143.5	-76.7	153.4	0	0	0	118.6
23	L	39.3	Very low	41.9	Very low	158 Å²	158	134.9 Å²	134.9	83%	0.827	76%	0.764	S	S	*	*			cis	-161.8	158.6	29.1	-94.3	141.6	0	0	0	105.9
24	A	38.8	Very low	43.1	Very low	77 Å²	77	133.8 Å²	133.8	64%	0.636	76%	0.758	S	S	*	*			cis	-171.2	176.7	38.2	0	0	0	0	0	109.8
25	T	35.5	Very low	44.4	Very low	140 Å²	140	132 Å²	132	86%	0.859	74%	0.738	S	S	*	*			trans	93.4	92.7	160.2	65.9	0	0	0	0	117.8
26	V	44.7	Very low	45.8	Very low	130 Å²	130	130.5 Å²	130.5	79%	0.788	73%	0.726	S	S	*	*			trans	-57.8	125.7	155.9	170.2	0	0	0	0	109.4	Q28	V26-Q28 HydrophobicContact CG1-CB 4.06Å
27	S	45.6	Very low	47.2	Very low	108 Å²	108	124 Å²	124	76%	0.755	71%	0.709	S	S	*	*			trans	-120.4	100.4	153.7	-179.1	0	0	0	0	108.1	M29	S27-M29 VanDerWaalsContact C-N 3.34Å; S27-M29 PolarHBondContact O-N 3.29Å
28	Q	49.8	Very low	48.4	Very low	168 Å²	168	120.4 Å²	120.4	79%	0.785	69%	0.691	S	S	*	*			trans	-83	78.3	178.2	-172.4	176.1	-8.2	0	0	108.1	V26	V26-Q28 HydrophobicContact CG1-CB 4.06Å
29	M	43.5	Very low	50.3	Low	171 Å²	171	116.1 Å²	116.1	84%	0.842	68%	0.676	S	S	*	*			trans	-133.1	45.3	179	-154	166.6	157.2	0	0	111.4	S27	S27-M29 VanDerWaalsContact C-N 3.34Å; S27-M29 PolarHBondContact O-N 3.29Å
30	Q	52.1	Low	52	Low	167 Å²	167	114.5 Å²	114.5	78%	0.78	66%	0.659	S	S	*	*	S	Bend	trans	-129.9	5.8	176.8	-102.6	179	-24.4	0	0	114.8
31	M	52	Low	53.1	Low	157 Å²	157	114.2 Å²	114.2	77%	0.773	65%	0.651	S	S	*	*	S	Bend	trans	-112.6	12.9	-170.6	-66.4	-62.8	-74.1	0	0	115.7
32	A	51.3	Low	53.9	Low	67 Å²	67	115.1 Å²	115.1	55%	0.554	65%	0.65	S	S	*	*	S	Bend	trans	-119.3	-17.6	-179.6	0	0	0	0	0	115.1	C36	A32-C36 PolarHBondContact O-SG 3.41Å
33	V	52.8	Low	55.1	Low	105 Å²	105	113.5 Å²	113.5	64%	0.636	64%	0.642	S	S	*	*	H	α-helix	trans	-81.8	-37.9	-177.3	-174.5	0	0	0	0	111.9	L37	V33-L37 HydrophobicContact CG1-CD1 4.12Å; V33-L37 PolarHBondContact O-N 3.01Å
34	L	55.1	Low	56	Low	135 Å²	135	114.9 Å²	114.9	71%	0.707	64%	0.636	S	S	*	*	H	α-helix	trans	-64.3	-46.6	176.5	-85.5	141.8	0	0	0	114.6	C36 L37 G38	L34-C36 VanDerWaalsContact C-N 3.35Å; L34-C36 PolarHBondContact O-N 3.17Å; L34-L37 PolarHBondContact O-N 3.33Å; L34-G38 PolarHBondContact O-N 2.87Å
35	P	59.8	Low	56.9	Low	68 Å²	68	115.3 Å²	115.3	44%	0.442	63%	0.634	S	S	.	*	H	α-helix	trans	-69.4	-31.6	-179.7	24.3	-32.8	0	0	0	112.8	G38 L39	P35-G38 PolarHBondContact O-N 3.32Å; P35-L39 WeakPolarHBondContact O-CB 3.5Å; P35-L39 PolarHBondContact O-N 2.97Å
36	C	61.3	Low	58	Low	76 Å²	76	115.8 Å²	115.8	51%	0.514	63%	0.627	S	S	.	*	H	α-helix	trans	-69.7	-41.8	176.8	-68.5	0	0	0	0	112.3	A32 L34 G38 L39 I40	A32-C36 PolarHBondContact O-SG 3.41Å; L34-C36 VanDerWaalsContact C-N 3.35Å; L34-C36 PolarHBondContact O-N 3.17Å; C36-G38 VanDerWaalsContact C-N 3.34Å; C36-L39 PolarHBondContact O-N 3.5Å; C36-I40 WeakPolarHBondContact O-CD1 3.16Å; C36-I40 VanDerWaalsContact O-CG1 3.24Å; C36-I40 WeakPolarHBondContact O-CG1 3.02Å; C36-I40 PolarHBondContact O-N 3.46Å
37	L	62.6	Low	58.4	Low	99 Å²	99	114 Å²	114	52%	0.518	62%	0.616	S	S	.	*	H	α-helix	trans	-62.8	-41.7	172.6	-80.9	161.9	0	0	0	111.4	V33 L34 I40 L41	V33-L37 HydrophobicContact CG1-CD1 4.12Å; V33-L37 PolarHBondContact O-N 3.01Å; L34-L37 PolarHBondContact O-N 3.33Å; L37-I40 PolarHBondContact O-N 3.38Å; L37-L41 WeakPolarHBondContact O-CB 3.49Å; L37-L41 WeakPolarHBondContact O-CG 3.42Å; L37-L41 PolarHBondContact O-N 3.5Å
38	G	72.1	Confident	58.8	Low	29 Å²	29	114.1 Å²	114.1	30%	0.299	61%	0.614	S	S	.	*	H	α-helix	trans	-60.6	-43.2	174.1	0	0	0	0	0	113	L34 P35 C36 L41 L42	L34-G38 PolarHBondContact O-N 2.87Å; P35-G38 PolarHBondContact O-N 3.32Å; C36-G38 VanDerWaalsContact C-N 3.34Å; G38-L41 PolarHBondContact O-N 2.95Å; G38-L42 WeakPolarHBondContact O-CB 3.4Å; G38-L42 WeakPolarHBondContact O-CD1 3.24Å; G38-L42 VanDerWaalsContact O-CG 3.24Å; G38-L42 WeakPolarHBondContact O-CG 3.43Å; G38-L42 PolarHBondContact O-N 3.23Å
39	L	68.3	Low	58.8	Low	109 Å²	109	109.2 Å²	109.2	57%	0.571	61%	0.608	S	S	*	*	H	α-helix	trans	-64.5	-43	176.1	-116.1	91.5	0	0	0	112.3	P35 C36 L41 L42 L43	P35-L39 WeakPolarHBondContact O-CB 3.5Å; P35-L39 PolarHBondContact O-N 2.97Å; C36-L39 PolarHBondContact O-N 3.5Å; L39-L41 VanDerWaalsContact C-N 3.35Å; L39-L42 PolarHBondContact O-N 3.34Å; L39-L43 WeakPolarHBondContact O-CB 3.37Å; L39-L43 WeakPolarHBondContact O-CD1 3.24Å; L39-L43 WeakPolarHBondContact O-CG 3.46Å; L39-L43 PolarHBondContact O-N 3.43Å
40	I	70.9	Confident	59.2	Low	79 Å²	79	107.2 Å²	107.2	41%	0.405	61%	0.606	S	S	.	*	H	α-helix	trans	-64.7	-41.4	178.7	-68.1	163.9	0	0	0	110.4	C36 L37 L43 W44	C36-I40 WeakPolarHBondContact O-CD1 3.16Å; C36-I40 VanDerWaalsContact O-CG1 3.24Å; C36-I40 WeakPolarHBondContact O-CG1 3.02Å; C36-I40 PolarHBondContact O-N 3.46Å; L37-I40 PolarHBondContact O-N 3.38Å; I40-L43 PolarHBondContact O-N 3.04Å; I40-W44 HydrophobicContact CG2-CD2 4.16Å; I40-W44 HydrophobicContact CG2-CH2 4.4Å; I40-W44 HydrophobicContact CG2-CZ2 3.92Å; I40-W44 PolarHBondContact O-N 2.97Å
41	L	69.4	Low	59.3	Low	109 Å²	109	107.2 Å²	107.2	57%	0.571	61%	0.606	S	S	*	*	H	α-helix	trans	-66.5	-37.9	176	-69.7	169	0	0	0	112.4	L37 G38 L39 W44 S45	L37-L41 WeakPolarHBondContact O-CB 3.49Å; L37-L41 WeakPolarHBondContact O-CG 3.42Å; L37-L41 PolarHBondContact O-N 3.5Å; G38-L41 PolarHBondContact O-N 2.95Å; L39-L41 VanDerWaalsContact C-N 3.35Å; L41-W44 HydrophobicContact CD2-CE3 4.47Å; L41-W44 PolarHBondContact O-N 2.82Å; L41-S45 PolarHBondContact O-N 2.87Å
42	L	67.8	Low	60.1	Low	115 Å²	115	101.6 Å²	101.6	60%	0.602	59%	0.588	S	S	*	*	H	α-helix	trans	-70	-31.5	174.3	-75.4	164.4	0	0	0	112.8	G38 L39 S45 Q46	G38-L42 WeakPolarHBondContact O-CB 3.4Å; G38-L42 WeakPolarHBondContact O-CD1 3.24Å; G38-L42 VanDerWaalsContact O-CG 3.24Å; G38-L42 WeakPolarHBondContact O-CG 3.43Å; G38-L42 PolarHBondContact O-N 3.23Å; L39-L42 PolarHBondContact O-N 3.34Å; L42-S45 PolarHBondContact O-OG 2.9Å; L42-Q46 WeakPolarHBondContact O-CG 3.21Å
43	L	65.4	Low	61.8	Low	116 Å²	116	103.5 Å²	103.5	61%	0.607	59%	0.585	S	S	*	*	H	α-helix	trans	-73.2	-32.9	173.1	-84.9	152	0	0	0	111.8	L39 I40 Q46	L39-L43 WeakPolarHBondContact O-CB 3.37Å; L39-L43 WeakPolarHBondContact O-CD1 3.24Å; L39-L43 WeakPolarHBondContact O-CG 3.46Å; L39-L43 PolarHBondContact O-N 3.43Å; I40-L43 PolarHBondContact O-N 3.04Å; L43-Q46 PolarHBondContact O-N 3.47Å
44	W	57.2	Low	63.8	Low	187 Å²	187	99.9 Å²	99.9	71%	0.708	56%	0.561	S	S	*	*	H	α-helix	trans	-75.7	-28.7	175.6	-71.7	-2.3	0	0	0	113.6	I40 L41 Q46	I40-W44 HydrophobicContact CG2-CD2 4.16Å; I40-W44 HydrophobicContact CG2-CH2 4.4Å; I40-W44 HydrophobicContact CG2-CZ2 3.92Å; I40-W44 PolarHBondContact O-N 2.97Å; L41-W44 HydrophobicContact CD2-CE3 4.47Å; L41-W44 PolarHBondContact O-N 2.82Å; W44-Q46 PolarHBondContact O-N 2.93Å
45	S	57.7	Low	65.7	Low	86 Å²	86	93.5 Å²	93.5	60%	0.601	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-13.4	174.1	65.2	0	0	0	0	113.6	L41 L42	L41-S45 PolarHBondContact O-N 2.87Å; L42-S45 PolarHBondContact O-OG 2.9Å
46	Q	58.2	Low	67.5	Low	150 Å²	150	94.2 Å²	94.2	70%	0.701	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	8.4	-178.6	-65.4	-79.9	23.1	0	0	113.1	L42 L43 W44 P48	L42-Q46 WeakPolarHBondContact O-CG 3.21Å; L43-Q46 PolarHBondContact O-N 3.47Å; W44-Q46 PolarHBondContact O-N 2.93Å; Q46-P48 WeakPolarHBondContact O-CD 3.42Å
47	V	54	Low	69.1	Low	94 Å²	94	90.6 Å²	90.6	57%	0.57	50%	0.501	S	S	*	.			trans	-62.3	109.4	168	179.6	0	0	0	0	105.7	G49	V47-G49 PolarHBondContact O-N 3.07Å
48	P	54.3	Low	70.5	Confident	110 Å²	110	86.9 Å²	86.9	71%	0.714	49%	0.487	S	S	*	.			trans	-58	117	168.1	-11.2	28.1	0	0	0	103.2	Q46 V50	Q46-P48 WeakPolarHBondContact O-CD 3.42Å; P48-V50 PolarHBondContact O-N 3.4Å
49	G	49.6	Very low	71.2	Confident	64 Å²	64	89.5 Å²	89.5	66%	0.66	50%	0.498	S	S	*	.			trans	-47.5	117.4	176.5	0	0	0	0	0	105.8	V47 Q51	V47-G49 PolarHBondContact O-N 3.07Å; G49-Q51 PolarHBondContact O-N 2.98Å
50	V	50.4	Low	72.5	Confident	130 Å²	130	84.7 Å²	84.7	79%	0.788	47%	0.474	S	S	*	.			trans	-47.2	113.3	176	171.2	0	0	0	0	103.9	P48 G52	P48-V50 PolarHBondContact O-N 3.4Å; V50-G52 PolarHBondContact O-N 2.86Å
51	Q	55.4	Low	73.6	Confident	167 Å²	167	85.5 Å²	85.5	78%	0.78	48%	0.476	S	S	*	.			trans	-57.7	99.6	169.8	-99.5	-178.5	-15.3	0	0	103.5	G49	G49-Q51 PolarHBondContact O-N 2.98Å
52	G	67.9	Low	74.9	Confident	38 Å²	38	80.3 Å²	80.3	39%	0.392	45%	0.448	S	S	.	.			trans	-75.5	138.6	-176.7	0	0	0	0	0	106.1	V50 E54	V50-G52 PolarHBondContact O-N 2.86Å; G52-E54 PolarHBondContact O-N 3.24Å; G52-E54 VanDerWaalsContact O-N 3.07Å
53	Q	86.9	Confident	76.1	Confident	108 Å²	108	80.2 Å²	80.2	51%	0.505	44%	0.443	S	S	.	.			trans	-56.3	119.4	174.7	-54.2	173.8	-30.3	0	0	109	Y205 K206 L207	Q53-Y205 HydrophobicContact CB-CE1 3.88Å; Q53-Y205 HydrophobicContact CB-CE2 4.36Å; Q53-Y205 WeakPolarHBondContact CB-OH 3.43Å; Q53-Y205 PolarHBondContact OE1-OH 3.32Å; Q53-K206 WeakPolarHBondContact CA-O 3.4Å; Q53-L207 HydrophobicContact CG-CD2 3.99Å
54	E	94.8	Very high	77.4	Confident	28 Å²	28	77.8 Å²	77.8	13%	0.131	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	158.3	-170.5	67.7	179.1	-158.2	0	0	111.2	G52 Q61 V62 K63 Y205 K206	G52-E54 PolarHBondContact O-N 3.24Å; G52-E54 VanDerWaalsContact O-N 3.07Å; E54-Q61 WeakPolarHBondContact OE1-CG 3.04Å; E54-V62 WeakPolarHBondContact CA-O 3.45Å; E54-V62 WeakPolarHBondContact CB-O 3.31Å; E54-K63 HydrophobicContact CB-CG 4.13Å; E54-K63 WeakPolarHBondContact OE2-CE 3.41Å; E54-K63 VanDerWaalsContact OE2-CG 3.28Å; E54-K63 WeakPolarHBondContact OE2-CG 3.48Å; E54-K63 IonicContact OE2-NZ 2.79Å; E54-Y205 WeakPolarHBondContact O-CA 3.43Å; E54-Y205 WeakPolarHBondContact O-CD2 3.47Å; E54-K206 PolarHBondContact N-O 2.81Å; E54-K206 PolarHBondContact O-N 3.15Å
55	F	96.7	Very high	79.2	Confident	2 Å²	2	69 Å²	69	1%	0.009	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	133.9	163.9	-62.9	-90.8	0	0	0	109.7	F57 Q61 V62 V65 P67 L70 M201 F204 Y205	F55-F57 HydrophobicContact CB-CD2 3.85Å; F55-F57 HydrophobicContact CB-CE2 3.33Å; F55-F57 HydrophobicContact CB-CZ 3.92Å; F55-F57 HydrophobicContact CD1-CE2 4.08Å; F55-F57 AromaticContact CD1-CZ 3.81Å; F55-F57 HydrophobicContact CD1-CZ 3.81Å; F55-F57 AromaticContact CG-CE2 3.83Å; F55-F57 HydrophobicContact CG-CE2 3.83Å; F55-F57 HydrophobicContact CG-CZ 4.04Å; F55-Q61 CarbonylContact O-C 3.57Å; F55-Q61 WeakPolarHBondContact O-CA 3.44Å; F55-V62 HydrophobicContact CB-CB 4.15Å; F55-V62 PolarHBondContact N-O 3.26Å; F55-V62 PolarHBondContact O-N 3.07Å; F55-V65 HydrophobicContact CD2-CB 4.44Å; F55-V65 HydrophobicContact CE2-CB 4.1Å; F55-V65 HydrophobicContact CE2-CG1 3.81Å; F55-P67 HydrophobicContact CE1-CG 4.39Å; F55-P67 HydrophobicContact CE2-CG 4.16Å; F55-P67 HydrophobicContact CZ-CB 4.19Å; F55-P67 HydrophobicContact CZ-CG 3.69Å; F55-L70 HydrophobicContact CZ-CD1 4.49Å; F55-M201 WeakPolarHBondContact CD1-O 3.1Å; F55-M201 HydrophobicContact CE1-CB 4.18Å; F55-M201 WeakPolarHBondContact CE1-O 3.48Å; F55-F204 CarbonylContact C-O 3.58Å; F55-F204 WeakPolarHBondContact CA-O 3.18Å; F55-Y205 AromaticContact CD1-CD2 3.84Å; F55-Y205 HydrophobicContact CD1-CD2 3.84Å; F55-Y205 HydrophobicContact CD1-CG 4.42Å; F55-Y205 AromaticContact CD2-CD2 3.82Å; F55-Y205 HydrophobicContact CD2-CD2 3.82Å; F55-Y205 HydrophobicContact CD2-CE2 4.18Å; F55-Y205 AromaticContact CE1-CD2 3.86Å; F55-Y205 HydrophobicContact CE1-CD2 3.86Å; F55-Y205 HydrophobicContact CE1-CG 4.31Å; F55-Y205 AromaticContact CE2-CD2 3.83Å; F55-Y205 HydrophobicContact CE2-CD2 3.83Å; F55-Y205 HydrophobicContact CE2-CE2 4.09Å; F55-Y205 AromaticContact CG-CD2 3.83Å; F55-Y205 HydrophobicContact CG-CD2 3.83Å; F55-Y205 AromaticContact CZ-CD2 3.86Å; F55-Y205 HydrophobicContact CZ-CD2 3.86Å; F55-Y205 HydrophobicContact CZ-CE2 4.44Å
56	Q	96.1	Very high	81	Confident	83 Å²	83	67.8 Å²	67.8	39%	0.388	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	91.6	173.9	-170.3	178.1	6.5	0	0	109.6	G58 F204 K206	Q56-G58 PolarHBondContact O-N 2.71Å; Q56-F204 PolarHBondContact N-O 2.92Å; Q56-K206 HydrophobicContact CB-CG 4.08Å
57	F	96.4	Very high	82.7	Confident	0 Å²	0	61 Å²	61	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	82	174.9	-61.7	-76.9	0	0	0	109.1	F55 P59 C60 V62 S106 C107 V110 L152 M201 F204	F55-F57 HydrophobicContact CB-CD2 3.85Å; F55-F57 HydrophobicContact CB-CE2 3.33Å; F55-F57 HydrophobicContact CB-CZ 3.92Å; F55-F57 HydrophobicContact CD1-CE2 4.08Å; F55-F57 AromaticContact CD1-CZ 3.81Å; F55-F57 HydrophobicContact CD1-CZ 3.81Å; F55-F57 AromaticContact CG-CE2 3.83Å; F55-F57 HydrophobicContact CG-CE2 3.83Å; F55-F57 HydrophobicContact CG-CZ 4.04Å; F57-P59 WeakPolarHBondContact O-CD 3.4Å; F57-P59 VanDerWaalsContact O-N 3.11Å; F57-C60 HydrophobicContact CB-CB 4.41Å; F57-C60 PolarHBondContact N-O 3.5Å; F57-C60 PolarHBondContact O-N 3.15Å; F57-V62 HydrophobicContact CD2-CG2 4.21Å; F57-V62 HydrophobicContact CE2-CG2 4.34Å; F57-S106 WeakPolarHBondContact CA-OG 3.4Å; F57-S106 WeakPolarHBondContact CB-OG 3.29Å; F57-C107 HydrophobicContact CB-CB 4.21Å; F57-C107 WeakPolarHBondContact O-CB 3.41Å; F57-V110 HydrophobicContact CB-CG1 4.35Å; F57-V110 HydrophobicContact CD1-CB 4.36Å; F57-V110 HydrophobicContact CD1-CG1 3.91Å; F57-V110 HydrophobicContact CD2-CG1 4.1Å; F57-V110 HydrophobicContact CE1-CB 4.26Å; F57-V110 HydrophobicContact CE1-CG1 4.17Å; F57-V110 HydrophobicContact CE1-CG2 4.12Å; F57-V110 HydrophobicContact CE2-CG1 4.33Å; F57-V110 HydrophobicContact CE2-CG2 4.5Å; F57-V110 HydrophobicContact CG-CG1 3.87Å; F57-V110 HydrophobicContact CZ-CG1 4.39Å; F57-V110 HydrophobicContact CZ-CG2 4.04Å; F57-L152 HydrophobicContact CB-CD2 4.3Å; F57-L152 HydrophobicContact CD2-CD2 3.74Å; F57-L152 HydrophobicContact CE2-CD2 4.44Å; F57-L152 HydrophobicContact CG-CD2 4.29Å; F57-M201 HydrophobicContact CE1-CB 4.42Å; F57-M201 HydrophobicContact CE1-CG 4.34Å; F57-M201 HydrophobicContact CZ-CB 4.15Å; F57-M201 HydrophobicContact CZ-CE 4.26Å; F57-M201 HydrophobicContact CZ-CG 4.13Å; F57-F204 HydrophobicContact CD1-CB 3.63Å; F57-F204 AromaticContact CD1-CD1 3.98Å; F57-F204 HydrophobicContact CD1-CD1 3.98Å; F57-F204 AromaticContact CD1-CD2 3.64Å; F57-F204 HydrophobicContact CD1-CD2 3.64Å; F57-F204 HydrophobicContact CD1-CE2 4.31Å; F57-F204 AromaticContact CD1-CG 3.44Å; F57-F204 HydrophobicContact CD1-CG 3.44Å; F57-F204 VanDerWaalsContact CD1-CG 3.44Å; F57-F204 HydrophobicContact CE1-CB 3.59Å; F57-F204 AromaticContact CE1-CD2 3.46Å; F57-F204 HydrophobicContact CE1-CD2 3.46Å; F57-F204 VanDerWaalsContact CE1-CD2 3.46Å; F57-F204 HydrophobicContact CE1-CE2 4.31Å; F57-F204 AromaticContact CE1-CG 3.61Å; F57-F204 HydrophobicContact CE1-CG 3.61Å; F57-F204 HydrophobicContact CG-CB 4.29Å; F57-F204 HydrophobicContact CG-CG 4.4Å; F57-F204 HydrophobicContact CZ-CB 4.22Å
58	G	91.3	Very high	84.7	Confident	21 Å²	21	62.4 Å²	62.4	22%	0.216	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	-116.1	-173.3	0	0	0	0	0	111.7	Q56 C60 D103 S106	Q56-G58 PolarHBondContact O-N 2.71Å; G58-C60 VanDerWaalsContact C-N 3.25Å; G58-C60 PolarHBondContact O-N 2.96Å; G58-D103 WeakPolarHBondContact CA-O 3.31Å; G58-D103 PolarHBondContact N-O 3.27Å; G58-S106 PolarHBondContact N-OG 2.97Å
59	P	87.6	Confident	86.7	Confident	84 Å²	84	62.9 Å²	62.9	55%	0.545	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-12.4	179.6	31.7	-35.6	0	0	0	114.2	F57	F57-P59 WeakPolarHBondContact O-CD 3.4Å; F57-P59 VanDerWaalsContact O-N 3.11Å
60	C	93.7	Very high	89	Confident	8 Å²	8	60 Å²	60	5%	0.054	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	121.3	-173.1	-57.7	0	0	0	0	111.3	F57 G58 C107 L152	F57-C60 HydrophobicContact CB-CB 4.41Å; F57-C60 PolarHBondContact N-O 3.5Å; F57-C60 PolarHBondContact O-N 3.15Å; G58-C60 VanDerWaalsContact C-N 3.25Å; G58-C60 PolarHBondContact O-N 2.96Å; C60-C107 HydrophobicContact CB-CB 3.72Å; C60-C107 WeakPolarHBondContact CB-SG 3.32Å; C60-C107 WeakPolarHBondContact SG-CB 3.48Å; C60-C107 CovalentContact SG-SG 2.03Å; C60-C107 PolarHBondContact SG-SG 2.92Å; C60-L152 HydrophobicContact CB-CD2 3.84Å
61	Q	94.6	Very high	91.3	Very high	95 Å²	95	55.8 Å²	55.8	44%	0.444	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	133.7	174.7	-67.6	172.8	20	0	0	110.2	E54 F55	E54-Q61 WeakPolarHBondContact OE1-CG 3.04Å; F55-Q61 CarbonylContact O-C 3.57Å; F55-Q61 WeakPolarHBondContact O-CA 3.44Å
62	V	96.1	Very high	93.3	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	112	178.5	-177.5	0	0	0	0	109.9	E54 F55 F57 V65 I148 Q151 L152	E54-V62 WeakPolarHBondContact CA-O 3.45Å; E54-V62 WeakPolarHBondContact CB-O 3.31Å; F55-V62 HydrophobicContact CB-CB 4.15Å; F55-V62 PolarHBondContact N-O 3.26Å; F55-V62 PolarHBondContact O-N 3.07Å; F57-V62 HydrophobicContact CD2-CG2 4.21Å; F57-V62 HydrophobicContact CE2-CG2 4.34Å; V62-V65 HydrophobicContact CG1-CG2 4.01Å; V62-I148 HydrophobicContact CG1-CB 4.17Å; V62-I148 HydrophobicContact CG1-CG1 4.02Å; V62-I148 HydrophobicContact CG1-CG2 4.14Å; V62-I148 HydrophobicContact CG2-CG2 4.23Å; V62-Q151 HydrophobicContact CB-CB 4.43Å; V62-Q151 HydrophobicContact CG1-CB 4.29Å; V62-Q151 HydrophobicContact CG2-CB 4.06Å; V62-L152 HydrophobicContact CG2-CD2 3.96Å; V62-L152 HydrophobicContact CG2-CG 4.17Å
63	K	94.9	Very high	94.7	Very high	113 Å²	113	51.2 Å²	51.2	49%	0.491	27%	0.272	S	S	.	.			trans	-103.2	161.2	-178.4	-66	172.8	-178.9	170.6	0	111.3	E54 V65 Q151	E54-K63 HydrophobicContact CB-CG 4.13Å; E54-K63 WeakPolarHBondContact OE2-CE 3.41Å; E54-K63 VanDerWaalsContact OE2-CG 3.28Å; E54-K63 WeakPolarHBondContact OE2-CG 3.48Å; E54-K63 IonicContact OE2-NZ 2.79Å; K63-V65 VanDerWaalsContact C-N 3.28Å; K63-V65 PolarHBondContact O-N 3.18Å; K63-Q151 PolarHBondContact O-NE2 3.27Å
64	G	92.7	Very high	95.2	Very high	66 Å²	66	46.1 Å²	46.1	68%	0.68	25%	0.248	S	C	*	.	S	Bend	trans	76.4	11.6	172.8	0	0	0	0	0	115
65	V	94.7	Very high	95.4	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.012	27%	0.268	C	S	.	.			trans	-113.5	126.9	177	-177.9	0	0	0	0	108.9	F55 V62 K63 L70 L147 I148	F55-V65 HydrophobicContact CD2-CB 4.44Å; F55-V65 HydrophobicContact CE2-CB 4.1Å; F55-V65 HydrophobicContact CE2-CG1 3.81Å; V62-V65 HydrophobicContact CG1-CG2 4.01Å; K63-V65 VanDerWaalsContact C-N 3.28Å; K63-V65 PolarHBondContact O-N 3.18Å; V65-L70 HydrophobicContact CG1-CD1 4Å; V65-L70 HydrophobicContact CG1-CG 4.47Å; V65-L147 HydrophobicContact CG2-CB 4.46Å; V65-L147 HydrophobicContact CG2-CD2 3.69Å; V65-L147 HydrophobicContact CG2-CG 3.92Å; V65-I148 HydrophobicContact CB-CG1 4.34Å; V65-I148 HydrophobicContact CG1-CD1 3.96Å; V65-I148 HydrophobicContact CG1-CG1 4.06Å; V65-I148 HydrophobicContact CG2-CD1 4.46Å; V65-I148 HydrophobicContact CG2-CG1 3.66Å
66	V	94.4	Very high	95.3	Very high	60 Å²	60	53 Å²	53	36%	0.364	28%	0.279	S	S	.	.			trans	-103.5	113	179.1	-178.7	0	0	0	0	108.2	Q68 K69	V66-Q68 HydrophobicContact CG1-CB 4.21Å; V66-Q68 PolarHBondContact O-N 2.94Å; V66-Q68 VanDerWaalsContact O-N 3.15Å; V66-K69 HydrophobicContact CB-CB 4.42Å; V66-K69 HydrophobicContact CB-CD 4.21Å; V66-K69 HydrophobicContact CB-CG 4.07Å; V66-K69 HydrophobicContact CG1-CG 4.3Å; V66-K69 WeakPolarHBondContact O-CB 3.46Å; V66-K69 PolarHBondContact O-N 3.08Å
67	P	95.2	Very high	95.2	Very high	7 Å²	7	49.2 Å²	49.2	5%	0.045	26%	0.261	C	S	.	.	H	α-helix	trans	-55.8	-36	-176.4	-23.5	29.2	0	0	0	113.1	F55 K69 L70 W71 Q202 Y205	F55-P67 HydrophobicContact CE1-CG 4.39Å; F55-P67 HydrophobicContact CE2-CG 4.16Å; F55-P67 HydrophobicContact CZ-CB 4.19Å; F55-P67 HydrophobicContact CZ-CG 3.69Å; P67-K69 VanDerWaalsContact C-N 3.28Å; P67-K69 PolarHBondContact O-N 2.91Å; P67-L70 WeakPolarHBondContact O-CB 3.21Å; P67-L70 PolarHBondContact O-N 3.18Å; P67-W71 PolarHBondContact O-N 3.1Å; P67-Q202 VanDerWaalsContact CB-OE1 3.31Å; P67-Y205 VanDerWaalsContact CD-CE2 3.46Å; P67-Y205 VanDerWaalsContact CD-OH 3.31Å; P67-Y205 WeakPolarHBondContact CD-OH 3.35Å; P67-Y205 HydrophobicContact CG-CD1 3.76Å; P67-Y205 HydrophobicContact CG-CD2 3.51Å; P67-Y205 HydrophobicContact CG-CE1 3.67Å; P67-Y205 HydrophobicContact CG-CE2 3.45Å; P67-Y205 VanDerWaalsContact CG-CE2 3.45Å; P67-Y205 HydrophobicContact CG-CG 3.65Å; P67-Y205 VanDerWaalsContact CG-CZ 3.5Å
68	Q	95.8	Very high	95.2	Very high	124 Å²	124	51.8 Å²	51.8	58%	0.579	27%	0.273	S	S	*	.	H	α-helix	trans	-60.9	-35.4	177.6	-177.4	148	-2.6	0	0	113	V66 L70 W71 E72	V66-Q68 HydrophobicContact CG1-CB 4.21Å; V66-Q68 PolarHBondContact O-N 2.94Å; V66-Q68 VanDerWaalsContact O-N 3.15Å; Q68-L70 VanDerWaalsContact C-N 3.3Å; Q68-L70 PolarHBondContact O-N 3.01Å; Q68-W71 PolarHBondContact O-N 2.63Å; Q68-E72 HydrophobicContact CG-CG 4.27Å; Q68-E72 VanDerWaalsContact CG-OE1 3.32Å; Q68-E72 WeakPolarHBondContact CG-OE1 3.34Å; Q68-E72 PolarHBondContact NE2-OE1 2.87Å; Q68-E72 WeakPolarHBondContact O-CB 3.17Å; Q68-E72 VanDerWaalsContact O-CG 3.3Å; Q68-E72 WeakPolarHBondContact O-CG 3.44Å; Q68-E72 PolarHBondContact O-N 2.8Å
69	K	95.8	Very high	95.3	Very high	121 Å²	121	56.9 Å²	56.9	53%	0.526	30%	0.295	S	S	.	.	H	α-helix	trans	-66.4	-32.2	174.9	-69.5	-173.3	176.9	-180	0	112.5	V66 P67 A73	V66-K69 HydrophobicContact CB-CB 4.42Å; V66-K69 HydrophobicContact CB-CD 4.21Å; V66-K69 HydrophobicContact CB-CG 4.07Å; V66-K69 HydrophobicContact CG1-CG 4.3Å; V66-K69 WeakPolarHBondContact O-CB 3.46Å; V66-K69 PolarHBondContact O-N 3.08Å; P67-K69 VanDerWaalsContact C-N 3.28Å; P67-K69 PolarHBondContact O-N 2.91Å; K69-A73 WeakPolarHBondContact O-CB 3.35Å; K69-A73 PolarHBondContact O-N 3.32Å; K69-A73 VanDerWaalsContact O-N 3.16Å
70	L	97.8	Very high	95.5	Very high	4 Å²	4	55.1 Å²	55.1	2%	0.021	28%	0.283	C	S	.	.	H	α-helix	trans	-67.1	-47.1	173.8	-65.4	170	0	0	0	110.3	F55 V65 P67 Q68 A73 F74 L141 N144 F145 I148 L198	F55-L70 HydrophobicContact CZ-CD1 4.49Å; V65-L70 HydrophobicContact CG1-CD1 4Å; V65-L70 HydrophobicContact CG1-CG 4.47Å; P67-L70 WeakPolarHBondContact O-CB 3.21Å; P67-L70 PolarHBondContact O-N 3.18Å; Q68-L70 VanDerWaalsContact C-N 3.3Å; Q68-L70 PolarHBondContact O-N 3.01Å; L70-A73 PolarHBondContact O-N 3.14Å; L70-F74 PolarHBondContact O-N 3.18Å; L70-L141 HydrophobicContact CB-CD2 4.49Å; L70-L141 HydrophobicContact CD2-CD2 4.14Å; L70-L141 WeakPolarHBondContact O-CD2 3.43Å; L70-N144 HydrophobicContact CD2-CB 3.41Å; L70-N144 VanDerWaalsContact CD2-CB 3.41Å; L70-N144 HydrophobicContact CG-CB 4.47Å; L70-F145 HydrophobicContact CD2-CD1 4.2Å; L70-F145 HydrophobicContact CD2-CE1 4.05Å; L70-I148 HydrophobicContact CD1-CD1 4.26Å; L70-L198 HydrophobicContact CB-CD1 4.06Å; L70-L198 HydrophobicContact CB-CD2 3.83Å; L70-L198 HydrophobicContact CD1-CD2 3.9Å; L70-L198 HydrophobicContact CG-CD2 4.33Å
71	W	98.4	Very high	95.4	Very high	41 Å²	41	54.7 Å²	54.7	16%	0.155	28%	0.28	C	S	.	.	H	α-helix	trans	-63	-45.9	178.4	-79.9	111.2	0	0	0	112.8	P67 Q68 A73 F74 W75 D195 L198 T199	P67-W71 PolarHBondContact O-N 3.1Å; Q68-W71 PolarHBondContact O-N 2.63Å; W71-A73 VanDerWaalsContact C-N 3.33Å; W71-A73 PolarHBondContact O-N 3.28Å; W71-F74 HydrophobicContact CZ3-CD1 4.41Å; W71-F74 PolarHBondContact O-N 3.33Å; W71-W75 HydrophobicContact CB-CD2 4.38Å; W71-W75 HydrophobicContact CB-CE3 4.3Å; W71-W75 HydrophobicContact CB-CH2 4.1Å; W71-W75 HydrophobicContact CB-CZ2 4.17Å; W71-W75 HydrophobicContact CB-CZ3 4.16Å; W71-W75 HydrophobicContact CD2-CZ2 4.27Å; W71-W75 AromaticContact CE3-CE2 3.77Å; W71-W75 AromaticContact CE3-CZ2 3.97Å; W71-W75 HydrophobicContact CE3-CZ2 3.97Å; W71-W75 AromaticContact CE3-NE1 3.53Å; W71-W75 HydrophobicContact CG-CZ2 4.4Å; W71-W75 AromaticContact CZ3-NE1 3.9Å; W71-W75 WeakPolarHBondContact O-CB 3.32Å; W71-W75 VanDerWaalsContact O-CG 3.3Å; W71-W75 PolarHBondContact O-N 3.32Å; W71-D195 HydrophobicContact CH2-CB 3.86Å; W71-D195 WeakPolarHBondContact CH2-O 3.33Å; W71-D195 HydrophobicContact CZ3-CB 3.71Å; W71-L198 HydrophobicContact CD2-CB 4.41Å; W71-L198 HydrophobicContact CD2-CD1 4.13Å; W71-L198 HydrophobicContact CE3-CD1 4.22Å; W71-L198 HydrophobicContact CH2-CB 4.06Å; W71-L198 HydrophobicContact CZ2-CB 3.66Å; W71-T199 WeakPolarHBondContact CH2-OG1 3.02Å
72	E	97.9	Very high	95.5	Very high	101 Å²	101	53.3 Å²	53.3	47%	0.472	27%	0.274	S	S	.	.	H	α-helix	trans	-59.3	-43.6	176.4	-74.6	170.2	-174.1	0	0	111.9	Q68 F74 A76	Q68-E72 HydrophobicContact CG-CG 4.27Å; Q68-E72 VanDerWaalsContact CG-OE1 3.32Å; Q68-E72 WeakPolarHBondContact CG-OE1 3.34Å; Q68-E72 PolarHBondContact NE2-OE1 2.87Å; Q68-E72 WeakPolarHBondContact O-CB 3.17Å; Q68-E72 VanDerWaalsContact O-CG 3.3Å; Q68-E72 WeakPolarHBondContact O-CG 3.44Å; Q68-E72 PolarHBondContact O-N 2.8Å; E72-F74 VanDerWaalsContact C-N 3.35Å; E72-F74 PolarHBondContact O-N 3.37Å; E72-A76 WeakPolarHBondContact O-CB 3.31Å; E72-A76 PolarHBondContact O-N 3.49Å
73	A	96.9	Very high	95.4	Very high	8 Å²	8	57.5 Å²	57.5	7%	0.066	30%	0.303	C	S	.	.	H	α-helix	trans	-63	-41.8	176.9	0	0	0	0	0	111.8	K69 L70 W71 S137 T140 L141	K69-A73 WeakPolarHBondContact O-CB 3.35Å; K69-A73 PolarHBondContact O-N 3.32Å; K69-A73 VanDerWaalsContact O-N 3.16Å; L70-A73 PolarHBondContact O-N 3.14Å; W71-A73 VanDerWaalsContact C-N 3.33Å; W71-A73 PolarHBondContact O-N 3.28Å; A73-S137 VanDerWaalsContact O-CB 3.25Å; A73-S137 WeakPolarHBondContact O-CB 3.47Å; A73-S137 PolarHBondContact O-OG 2.84Å; A73-S137 VanDerWaalsContact O-OG 3.1Å; A73-T140 HydrophobicContact CB-CG2 3.75Å; A73-L141 HydrophobicContact CB-CD2 4.08Å; A73-L141 HydrophobicContact CB-CG 3.89Å
74	F	97.6	Very high	95.3	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-71	-47.1	178.3	-178	-111.8	0	0	0	112.8	L70 W71 E72 A76 V77 K78 L141 L191 V194 D195 L198	L70-F74 PolarHBondContact O-N 3.18Å; W71-F74 HydrophobicContact CZ3-CD1 4.41Å; W71-F74 PolarHBondContact O-N 3.33Å; E72-F74 VanDerWaalsContact C-N 3.35Å; E72-F74 PolarHBondContact O-N 3.37Å; F74-A76 PolarHBondContact O-N 3.01Å; F74-V77 CarbonylContact O-C 3.56Å; F74-V77 VanDerWaalsContact O-CG2 3.28Å; F74-V77 WeakPolarHBondContact O-CG2 3.42Å; F74-V77 PolarHBondContact O-N 3.34Å; F74-K78 HydrophobicContact CD1-CB 4.32Å; F74-K78 HydrophobicContact CD1-CD 4.49Å; F74-K78 HydrophobicContact CE1-CB 3.9Å; F74-K78 HydrophobicContact CE1-CD 3.82Å; F74-K78 HydrophobicContact CE1-CG 3.77Å; F74-K78 HydrophobicContact CZ-CB 4.13Å; F74-K78 HydrophobicContact CZ-CG 4.03Å; F74-K78 PolarHBondContact O-N 2.86Å; F74-L141 HydrophobicContact CB-CD1 4.35Å; F74-L141 HydrophobicContact CB-CD2 4.45Å; F74-L141 HydrophobicContact CD2-CD1 4.43Å; F74-L191 VanDerWaalsContact CE2-O 3.3Å; F74-L191 WeakPolarHBondContact CE2-O 3.42Å; F74-V194 HydrophobicContact CB-CG1 4.49Å; F74-V194 HydrophobicContact CD2-CB 3.71Å; F74-V194 HydrophobicContact CD2-CG1 3.75Å; F74-V194 HydrophobicContact CE2-CB 3.65Å; F74-V194 HydrophobicContact CE2-CG1 4.22Å; F74-V194 HydrophobicContact CG-CB 4.4Å; F74-V194 HydrophobicContact CG-CG1 4.1Å; F74-V194 HydrophobicContact CZ-CB 4.27Å; F74-D195 HydrophobicContact CD1-CB 3.98Å; F74-D195 HydrophobicContact CE1-CB 3.42Å; F74-D195 VanDerWaalsContact CE1-CB 3.42Å; F74-D195 HydrophobicContact CZ-CB 4.19Å; F74-L198 HydrophobicContact CB-CD1 4.09Å
75	W	97.9	Very high	95.3	Very high	145 Å²	145	54.8 Å²	54.8	55%	0.549	28%	0.275	S	S	.	.	H	α-helix	trans	-58.1	-33	179.1	-71.9	-29	0	0	0	112.7	W71 V77 K78	W71-W75 HydrophobicContact CB-CD2 4.38Å; W71-W75 HydrophobicContact CB-CE3 4.3Å; W71-W75 HydrophobicContact CB-CH2 4.1Å; W71-W75 HydrophobicContact CB-CZ2 4.17Å; W71-W75 HydrophobicContact CB-CZ3 4.16Å; W71-W75 HydrophobicContact CD2-CZ2 4.27Å; W71-W75 AromaticContact CE3-CE2 3.77Å; W71-W75 AromaticContact CE3-CZ2 3.97Å; W71-W75 HydrophobicContact CE3-CZ2 3.97Å; W71-W75 AromaticContact CE3-NE1 3.53Å; W71-W75 HydrophobicContact CG-CZ2 4.4Å; W71-W75 AromaticContact CZ3-NE1 3.9Å; W71-W75 WeakPolarHBondContact O-CB 3.32Å; W71-W75 VanDerWaalsContact O-CG 3.3Å; W71-W75 PolarHBondContact O-N 3.32Å; W75-V77 PolarHBondContact O-N 3.3Å; W75-V77 VanDerWaalsContact O-N 3.12Å; W75-K78 PolarHBondContact O-N 3.15Å
76	A	96.2	Very high	95.3	Very high	31 Å²	31	61.6 Å²	61.6	26%	0.256	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-16.5	176.5	0	0	0	0	0	114.5	E72 F74 S137	E72-A76 WeakPolarHBondContact O-CB 3.31Å; E72-A76 PolarHBondContact O-N 3.49Å; F74-A76 PolarHBondContact O-N 3.01Å; A76-S137 WeakPolarHBondContact CB-OG 3.34Å
77	V	93.8	Very high	95.3	Very high	2 Å²	2	61.1 Å²	61.1	1%	0.012	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.9	-5	179.9	-64.5	0	0	0	0	113.9	F74 W75 D79 T80 V81 T134 S137 F138	F74-V77 CarbonylContact O-C 3.56Å; F74-V77 VanDerWaalsContact O-CG2 3.28Å; F74-V77 WeakPolarHBondContact O-CG2 3.42Å; F74-V77 PolarHBondContact O-N 3.34Å; W75-V77 PolarHBondContact O-N 3.3Å; W75-V77 VanDerWaalsContact O-N 3.12Å; V77-D79 PolarHBondContact O-N 3.42Å; V77-T80 PolarHBondContact O-N 3.12Å; V77-V81 HydrophobicContact CB-CG2 4.2Å; V77-V81 HydrophobicContact CG2-CG2 4.36Å; V77-V81 VanDerWaalsContact O-CG2 3.26Å; V77-V81 WeakPolarHBondContact O-CG2 3.28Å; V77-V81 PolarHBondContact O-N 3.48Å; V77-T134 HydrophobicContact CG1-CG2 3.98Å; V77-S137 VanDerWaalsContact CG1-CB 3.44Å; V77-F138 HydrophobicContact CB-CZ 4.39Å; V77-F138 HydrophobicContact CG2-CE1 3.93Å; V77-F138 HydrophobicContact CG2-CZ 3.92Å
78	K	95.2	Very high	95.2	Very high	55 Å²	55	72.1 Å²	72.1	24%	0.239	35%	0.347	C	S	.	.	H	α-helix	trans	-52	-54.7	-172.5	175.3	174.9	173.6	145.1	0	112.1	F74 W75 T80 V81 Q82 D195	F74-K78 HydrophobicContact CD1-CB 4.32Å; F74-K78 HydrophobicContact CD1-CD 4.49Å; F74-K78 HydrophobicContact CE1-CB 3.9Å; F74-K78 HydrophobicContact CE1-CD 3.82Å; F74-K78 HydrophobicContact CE1-CG 3.77Å; F74-K78 HydrophobicContact CZ-CB 4.13Å; F74-K78 HydrophobicContact CZ-CG 4.03Å; F74-K78 PolarHBondContact O-N 2.86Å; W75-K78 PolarHBondContact O-N 3.15Å; K78-T80 PolarHBondContact O-N 2.76Å; K78-V81 PolarHBondContact O-N 3.23Å; K78-Q82 HydrophobicContact CG-CG 4.35Å; K78-Q82 WeakPolarHBondContact O-CB 2.74Å; K78-Q82 WeakPolarHBondContact O-CG 3.04Å; K78-Q82 PolarHBondContact O-N 3.14Å; K78-D195 IonicContact NZ-OD2 2.73Å; K78-D195 PolarHBondContact NZ-OD2 3.34Å
79	D	94.3	Very high	95.1	Very high	127 Å²	127	71.7 Å²	71.7	68%	0.679	36%	0.357	S	S	*	.	H	α-helix	trans	-65.3	-40.4	-175.8	-61.7	-20	0	0	0	111.6	V77 V81 S83	V77-D79 PolarHBondContact O-N 3.42Å; D79-V81 PolarHBondContact O-N 3.18Å; D79-S83 WeakPolarHBondContact O-CB 3.45Å; D79-S83 PolarHBondContact O-N 3.05Å; D79-S83 PolarHBondContact O-OG 3.07Å
80	T	91.3	Very high	95.1	Very high	47 Å²	47	67.5 Å²	67.5	29%	0.288	34%	0.342	S	S	.	.	H	α-helix	trans	-59.5	-47.1	176	-56.1	0	0	0	0	111.2	V77 K78 S83 Q84	V77-T80 PolarHBondContact O-N 3.12Å; K78-T80 PolarHBondContact O-N 2.76Å; T80-S83 PolarHBondContact O-OG 3.46Å; T80-Q84 VanDerWaalsContact O-CG 3.27Å; T80-Q84 WeakPolarHBondContact O-CG 3.36Å
81	V	92.3	Very high	95	Very high	0 Å²	0	72.9 Å²	72.9	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-74.3	-45.9	-176.4	178.5	0	0	0	0	111.5	V77 K78 D79 S83 Q84 D85 F138 L191 G192	V77-V81 HydrophobicContact CB-CG2 4.2Å; V77-V81 HydrophobicContact CG2-CG2 4.36Å; V77-V81 VanDerWaalsContact O-CG2 3.26Å; V77-V81 WeakPolarHBondContact O-CG2 3.28Å; V77-V81 PolarHBondContact O-N 3.48Å; K78-V81 PolarHBondContact O-N 3.23Å; D79-V81 PolarHBondContact O-N 3.18Å; V81-S83 VanDerWaalsContact C-N 3.32Å; V81-S83 PolarHBondContact O-N 3.37Å; V81-Q84 WeakPolarHBondContact O-CB 3.43Å; V81-Q84 PolarHBondContact O-N 3.26Å; V81-Q84 VanDerWaalsContact O-N 3.16Å; V81-D85 PolarHBondContact O-N 3.12Å; V81-F138 HydrophobicContact CG2-CE2 4.3Å; V81-F138 HydrophobicContact CG2-CZ 3.57Å; V81-L191 HydrophobicContact CG1-CB 3.54Å; V81-G192 VanDerWaalsContact CG1-N 3.3Å
82	Q	95.3	Very high	95.1	Very high	66 Å²	66	70.9 Å²	70.9	31%	0.308	35%	0.354	S	S	.	.	H	α-helix	trans	-70.7	-28.8	-177.3	-70	-175.2	-14.7	0	0	112.2	K78 Q84 D85 G192 D195	K78-Q82 HydrophobicContact CG-CG 4.35Å; K78-Q82 WeakPolarHBondContact O-CB 2.74Å; K78-Q82 WeakPolarHBondContact O-CG 3.04Å; K78-Q82 PolarHBondContact O-N 3.14Å; Q82-Q84 VanDerWaalsContact C-N 3.28Å; Q82-Q84 PolarHBondContact O-N 2.6Å; Q82-D85 PolarHBondContact O-N 3.43Å; Q82-G192 PolarHBondContact NE2-O 3.4Å; Q82-D195 PolarHBondContact NE2-OD2 3.29Å; Q82-D195 VanDerWaalsContact NE2-OD2 3.09Å
83	S	94.3	Very high	95.1	Very high	87 Å²	87	66.1 Å²	66.1	61%	0.608	33%	0.332	S	S	*	.	H	α-helix	trans	-69.1	-24.5	171.8	66.5	0	0	0	0	113.6	D79 T80 V81 D85	D79-S83 WeakPolarHBondContact O-CB 3.45Å; D79-S83 PolarHBondContact O-N 3.05Å; D79-S83 PolarHBondContact O-OG 3.07Å; T80-S83 PolarHBondContact O-OG 3.46Å; V81-S83 VanDerWaalsContact C-N 3.32Å; V81-S83 PolarHBondContact O-N 3.37Å; S83-D85 VanDerWaalsContact C-N 3.33Å
84	Q	92.7	Very high	95	Very high	92 Å²	92	68.8 Å²	68.8	43%	0.43	34%	0.343	S	S	.	.	H	α-helix	trans	-81.6	-14.4	175.4	-67.4	170.6	11.8	0	0	112.3	T80 V81 Q82 N86 T188	T80-Q84 VanDerWaalsContact O-CG 3.27Å; T80-Q84 WeakPolarHBondContact O-CG 3.36Å; V81-Q84 WeakPolarHBondContact O-CB 3.43Å; V81-Q84 PolarHBondContact O-N 3.26Å; V81-Q84 VanDerWaalsContact O-N 3.16Å; Q82-Q84 VanDerWaalsContact C-N 3.28Å; Q82-Q84 PolarHBondContact O-N 2.6Å; Q84-N86 PolarHBondContact O-N 3.06Å; Q84-T188 HydrophobicContact CB-CG2 3.64Å
85	D	94.3	Very high	95	Very high	31 Å²	31	74.7 Å²	74.7	17%	0.166	37%	0.371	C	S	.	.			trans	-83.8	95.1	176.3	-176.7	9	0	0	0	111.5	V81 Q82 S83 I87 T188 K189	V81-D85 PolarHBondContact O-N 3.12Å; Q82-D85 PolarHBondContact O-N 3.43Å; S83-D85 VanDerWaalsContact C-N 3.33Å; D85-I87 VanDerWaalsContact C-N 3.32Å; D85-I87 PolarHBondContact O-N 3.25Å; D85-I87 PolarHBondContact OD1-N 3.45Å; D85-I87 VanDerWaalsContact OD1-N 3.08Å; D85-T188 HydrophobicContact CB-CG2 4.28Å; D85-K189 IonicContact OD1-NZ 3.18Å; D85-K189 PolarHBondContact OD1-NZ 3.05Å; D85-K189 IonicContact OD2-NZ 2.81Å; D85-K189 PolarHBondContact OD2-NZ 3.33Å
86	N	94.3	Very high	94.9	Very high	144 Å²	144	73.1 Å²	73.1	77%	0.77	37%	0.37	S	S	*	.			trans	-80.7	-8.9	179.8	-64.6	-54.7	0	0	0	113.8	Q84 R88	Q84-N86 PolarHBondContact O-N 3.06Å; N86-R88 PolarHBondContact O-N 3.19Å
87	I	95	Very high	95	Very high	51 Å²	51	71.7 Å²	71.7	26%	0.262	36%	0.357	S	S	.	.			trans	-102.2	83.3	-170	-53.8	-178.2	0	0	0	110.4	D85 S89 V90 L181 A185 K189	D85-I87 VanDerWaalsContact C-N 3.32Å; D85-I87 PolarHBondContact O-N 3.25Å; D85-I87 PolarHBondContact OD1-N 3.45Å; D85-I87 VanDerWaalsContact OD1-N 3.08Å; I87-S89 VanDerWaalsContact C-N 3.32Å; I87-S89 PolarHBondContact O-N 3.04Å; I87-V90 HydrophobicContact CG2-CB 4.12Å; I87-V90 HydrophobicContact CG2-CG2 4.1Å; I87-L181 HydrophobicContact CD1-CD2 3.86Å; I87-L181 HydrophobicContact CG2-CD2 4.18Å; I87-A185 HydrophobicContact CD1-CB 3.67Å; I87-K189 WeakPolarHBondContact O-CE 3.36Å; I87-K189 PolarHBondContact O-NZ 3.07Å
88	R	92.3	Very high	95.2	Very high	238 Å²	238	72.4 Å²	72.4	90%	0.898	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-15.3	-177.8	-60.6	-174.3	-177.8	177.7	0.9	114.9	N86 V90	N86-R88 PolarHBondContact O-N 3.19Å; R88-V90 VanDerWaalsContact C-N 3.34Å
89	S	93.7	Very high	95.3	Very high	114 Å²	114	74.8 Å²	74.8	80%	0.797	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-14.2	-176.3	53.7	0	0	0	0	114.2	I87	I87-S89 VanDerWaalsContact C-N 3.32Å; I87-S89 PolarHBondContact O-N 3.04Å
90	V	95.1	Very high	95.3	Very high	33 Å²	33	75.3 Å²	75.3	20%	0.2	38%	0.376	C	S	.	.			trans	-119.3	129.9	-177.6	178.2	0	0	0	0	109.2	I87 R88 L92 L181 K189	I87-V90 HydrophobicContact CG2-CB 4.12Å; I87-V90 HydrophobicContact CG2-CG2 4.1Å; R88-V90 VanDerWaalsContact C-N 3.34Å; V90-L92 HydrophobicContact CG1-CD2 4.37Å; V90-L181 HydrophobicContact CB-CD2 4.26Å; V90-L181 HydrophobicContact CG1-CD1 4.2Å; V90-L181 HydrophobicContact CG1-CD2 4.25Å; V90-L181 HydrophobicContact CG1-CG 4.39Å; V90-L181 HydrophobicContact CG2-CD2 4.11Å; V90-K189 HydrophobicContact CG1-CD 4.41Å; V90-K189 WeakPolarHBondContact O-CD 3.37Å; V90-K189 WeakPolarHBondContact O-CE 3.17Å; V90-K189 PolarHBondContact O-NZ 3.43Å
91	R	97.3	Very high	95.6	Very high	117 Å²	117	73.9 Å²	73.9	44%	0.442	37%	0.367	S	S	.	.			trans	-115	134.3	169.2	-176.7	173.4	172.8	159.1	3.8	108.8	L93 Q94 E193	R91-L93 PolarHBondContact NE-O 3.22Å; R91-Q94 HydrophobicContact CB-CG 4.39Å; R91-Q94 WeakPolarHBondContact O-CG 3.41Å; R91-Q94 PolarHBondContact O-NE2 3.44Å; R91-E193 VanDerWaalsContact CA-OE1 3.29Å; R91-E193 WeakPolarHBondContact CA-OE1 3.42Å
92	L	98.5	Very high	95.8	Very high	0 Å²	0	76.3 Å²	76.3	0%	0	38%	0.384	C	S	.	.	S	Bend	trans	-85.3	-50.8	-179.7	-55.5	179.4	0	0	0	111.1	V90 Q94 F174 A177 F178 L181 K189 A190 E193	V90-L92 HydrophobicContact CG1-CD2 4.37Å; L92-Q94 PolarHBondContact O-N 2.87Å; L92-F174 HydrophobicContact CB-CD2 3.78Å; L92-F174 HydrophobicContact CB-CE2 3.7Å; L92-F174 HydrophobicContact CD1-CE2 4.35Å; L92-A177 HydrophobicContact CD2-CB 3.91Å; L92-F178 HydrophobicContact CD1-CD2 3.97Å; L92-F178 HydrophobicContact CD2-CB 4.25Å; L92-L181 HydrophobicContact CD2-CD1 4.2Å; L92-K189 HydrophobicContact CD1-CB 4.12Å; L92-K189 HydrophobicContact CD1-CD 4.05Å; L92-K189 HydrophobicContact CD1-CG 3.75Å; L92-K189 HydrophobicContact CD2-CD 3.93Å; L92-K189 HydrophobicContact CG-CD 3.58Å; L92-K189 HydrophobicContact CG-CG 3.77Å; L92-A190 HydrophobicContact CD1-CB 3.8Å; L92-E193 WeakPolarHBondContact CA-OE2 3.19Å; L92-E193 WeakPolarHBondContact CB-OE2 3.26Å; L92-E193 PolarHBondContact N-OE1 3.45Å; L92-E193 PolarHBondContact N-OE2 2.81Å
93	L	98.3	Very high	95.6	Very high	0 Å²	0	78.6 Å²	78.6	0%	0	40%	0.398	C	S	.	.	S	Bend	trans	-84.5	68.6	175.1	-67.3	172.5	0	0	0	109.5	R91 V97 L98 L113 F174 E193 I196 L197	R91-L93 PolarHBondContact NE-O 3.22Å; L93-V97 HydrophobicContact CD2-CG1 4.42Å; L93-L98 HydrophobicContact CB-CD1 3.98Å; L93-L98 HydrophobicContact CD2-CD1 4.26Å; L93-L98 HydrophobicContact CD2-CD2 4.44Å; L93-L113 HydrophobicContact CD2-CD1 4.42Å; L93-L113 HydrophobicContact CD2-CD2 4.04Å; L93-F174 HydrophobicContact CD2-CD2 3.69Å; L93-F174 HydrophobicContact CD2-CE2 4.02Å; L93-F174 HydrophobicContact CD2-CG 4.5Å; L93-F174 HydrophobicContact CG-CD2 4.11Å; L93-F174 HydrophobicContact CG-CE2 4.19Å; L93-E193 HydrophobicContact CD1-CB 4.27Å; L93-E193 WeakPolarHBondContact CD1-O 3.4Å; L93-E193 PolarHBondContact N-OE2 2.67Å; L93-I196 HydrophobicContact CB-CB 4.34Å; L93-I196 HydrophobicContact CB-CG2 3.76Å; L93-I196 HydrophobicContact CD1-CB 4.07Å; L93-I196 HydrophobicContact CD1-CG2 4.16Å; L93-L197 HydrophobicContact CD1-CB 3.82Å
94	Q	96.4	Very high	95.5	Very high	65 Å²	65	75.9 Å²	75.9	30%	0.304	38%	0.382	S	S	.	.			trans	-68.6	166.1	179.4	-54.6	176.3	6.2	0	0	111.5	R91 L92 E96 V97 L98	R91-Q94 HydrophobicContact CB-CG 4.39Å; R91-Q94 WeakPolarHBondContact O-CG 3.41Å; R91-Q94 PolarHBondContact O-NE2 3.44Å; L92-Q94 PolarHBondContact O-N 2.87Å; Q94-E96 VanDerWaalsContact C-N 3.25Å; Q94-E96 VanDerWaalsContact CB-OE2 3.22Å; Q94-E96 WeakPolarHBondContact CB-OE2 3.34Å; Q94-E96 PolarHBondContact O-N 3.48Å; Q94-V97 HydrophobicContact CB-CG2 4.3Å; Q94-V97 WeakPolarHBondContact O-CB 3.45Å; Q94-V97 PolarHBondContact O-N 3.49Å; Q94-V97 VanDerWaalsContact O-N 3.08Å; Q94-L98 PolarHBondContact O-N 2.86Å
95	Q	96.3	Very high	95.6	Very high	124 Å²	124	72.7 Å²	72.7	58%	0.579	37%	0.367	S	S	*	.	H	α-helix	trans	-59.5	-40.1	178.7	-73.1	-175.3	-12	0	0	111.2	V97 L98 Q99	Q95-V97 PolarHBondContact O-N 3.26Å; Q95-V97 VanDerWaalsContact O-N 3.12Å; Q95-L98 PolarHBondContact O-N 2.9Å; Q95-L98 VanDerWaalsContact O-N 3.14Å; Q95-Q99 HydrophobicContact CB-CB 4.48Å; Q95-Q99 WeakPolarHBondContact O-CA 3.39Å; Q95-Q99 WeakPolarHBondContact O-CB 3.45Å; Q95-Q99 PolarHBondContact O-N 3.44Å
96	E	95.9	Very high	95.7	Very high	112 Å²	112	71.2 Å²	71.2	52%	0.523	36%	0.359	S	S	.	.	H	α-helix	trans	-60.7	-25.6	178.7	-60.1	77.5	-173.6	0	0	112.5	Q94 R170 L173	Q94-E96 VanDerWaalsContact C-N 3.25Å; Q94-E96 VanDerWaalsContact CB-OE2 3.22Å; Q94-E96 WeakPolarHBondContact CB-OE2 3.34Å; Q94-E96 PolarHBondContact O-N 3.48Å; E96-R170 PolarHBondContact O-NH1 3.32Å; E96-R170 VanDerWaalsContact O-NH1 3.15Å; E96-L173 HydrophobicContact CB-CD1 3.8Å
97	V	98.1	Very high	95.8	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-76.2	-46.5	176.7	-176.2	0	0	0	0	110.8	L93 Q94 Q95 L109 L173 F174	L93-V97 HydrophobicContact CD2-CG1 4.42Å; Q94-V97 HydrophobicContact CB-CG2 4.3Å; Q94-V97 WeakPolarHBondContact O-CB 3.45Å; Q94-V97 PolarHBondContact O-N 3.49Å; Q94-V97 VanDerWaalsContact O-N 3.08Å; Q95-V97 PolarHBondContact O-N 3.26Å; Q95-V97 VanDerWaalsContact O-N 3.12Å; V97-L109 WeakPolarHBondContact O-CD2 2.96Å; V97-L173 HydrophobicContact CG2-CB 4.05Å; V97-F174 HydrophobicContact CG1-CB 4.12Å; V97-F174 HydrophobicContact CG2-CB 4.04Å
98	L	98.3	Very high	95.9	Very high	18 Å²	18	62.4 Å²	62.4	9%	0.094	31%	0.312	C	S	.	.	H	α-helix	trans	-112.5	-18.8	-164.3	-60.9	-179.7	0	0	0	115.2	L93 Q94 Q95 V101 L109 L113 I196 W200	L93-L98 HydrophobicContact CB-CD1 3.98Å; L93-L98 HydrophobicContact CD2-CD1 4.26Å; L93-L98 HydrophobicContact CD2-CD2 4.44Å; Q94-L98 PolarHBondContact O-N 2.86Å; Q95-L98 PolarHBondContact O-N 2.9Å; Q95-L98 VanDerWaalsContact O-N 3.14Å; L98-V101 WeakPolarHBondContact O-CG2 3.39Å; L98-L109 HydrophobicContact CD2-CD2 4.34Å; L98-L113 HydrophobicContact CD2-CD1 4.06Å; L98-I196 HydrophobicContact CD1-CG2 3.77Å; L98-W200 HydrophobicContact CB-CG 4.17Å; L98-W200 HydrophobicContact CD1-CB 4.02Å; L98-W200 HydrophobicContact CD1-CG 4.18Å; L98-W200 HydrophobicContact CD2-CD2 3.8Å; L98-W200 HydrophobicContact CD2-CE3 4.16Å; L98-W200 HydrophobicContact CD2-CG 3.98Å; L98-W200 HydrophobicContact CG-CG 4.34Å; L98-W200 PolarHBondContact O-NE1 2.92Å
99	Q	96.4	Very high	96.1	Very high	104 Å²	104	51.1 Å²	51.1	49%	0.486	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	139.7	-176.7	-166.7	179.1	11.6	0	0	111	Q95 V101 R170	Q95-Q99 HydrophobicContact CB-CB 4.48Å; Q95-Q99 WeakPolarHBondContact O-CA 3.39Å; Q95-Q99 WeakPolarHBondContact O-CB 3.45Å; Q95-Q99 PolarHBondContact O-N 3.44Å; Q99-V101 PolarHBondContact O-N 3.03Å; Q99-V101 VanDerWaalsContact O-N 3.15Å; Q99-R170 PolarHBondContact O-NH1 2.03Å
100	N	96.2	Very high	96.4	Very high	138 Å²	138	45.7 Å²	45.7	74%	0.738	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.5	35.4	177.7	-54.9	-30.5	0	0	0	112.5	S102 R170	N100-S102 PolarHBondContact O-N 3.2Å; N100-R170 PolarHBondContact O-NH2 2.96Å
101	V	97.2	Very high	96.5	Very high	18 Å²	18	46.1 Å²	46.1	11%	0.109	23%	0.231	C	C	.	.			trans	-72.1	124.8	169.4	177.5	0	0	0	0	106.9	L98 Q99 E105 L109 W200	L98-V101 WeakPolarHBondContact O-CG2 3.39Å; Q99-V101 PolarHBondContact O-N 3.03Å; Q99-V101 VanDerWaalsContact O-N 3.15Å; V101-E105 HydrophobicContact CG1-CB 3.7Å; V101-L109 HydrophobicContact CB-CD2 4.48Å; V101-L109 HydrophobicContact CG1-CD2 4.05Å; V101-L109 HydrophobicContact CG2-CD2 3.6Å; V101-W200 HydrophobicContact CB-CZ2 4.3Å; V101-W200 HydrophobicContact CG1-CZ2 4.08Å; V101-W200 HydrophobicContact CG2-CZ2 4.42Å
102	S	95.1	Very high	96.5	Very high	51 Å²	51	42.3 Å²	42.3	36%	0.357	22%	0.221	S	C	.	.			trans	-70.6	158.4	178.8	71	0	0	0	0	111.1	N100 A104 E105 S106	N100-S102 PolarHBondContact O-N 3.2Å; S102-A104 PolarHBondContact O-N 3.06Å; S102-E105 PolarHBondContact O-N 2.8Å; S102-E105 VanDerWaalsContact O-N 3.08Å; S102-E105 WeakPolarHBondContact OG-CB 3.25Å; S102-E105 VanDerWaalsContact OG-CG 3.26Å; S102-E105 WeakPolarHBondContact OG-CG 3.05Å; S102-E105 PolarHBondContact OG-N 3.42Å; S102-S106 PolarHBondContact O-N 3.2Å
103	D	92.9	Very high	96.5	Very high	113 Å²	113	42.3 Å²	42.3	60%	0.604	22%	0.221	S	C	*	.	H	α-helix	trans	-54.3	-42.9	175.6	-70.5	-23.3	0	0	0	111.3	G58 E105 S106	G58-D103 WeakPolarHBondContact CA-O 3.31Å; G58-D103 PolarHBondContact N-O 3.27Å; D103-E105 PolarHBondContact O-N 3Å; D103-S106 WeakPolarHBondContact O-CB 3.18Å; D103-S106 PolarHBondContact O-N 3.05Å; D103-S106 PolarHBondContact O-OG 3.38Å
104	A	90.6	Very high	96.5	Very high	31 Å²	31	42.3 Å²	42.3	26%	0.256	22%	0.221	S	C	.	.	H	α-helix	trans	-65.9	-35.7	178.6	0	0	0	0	0	113.3	S102 Y108 I163	S102-A104 PolarHBondContact O-N 3.06Å; A104-Y108 WeakPolarHBondContact O-CD2 3.45Å; A104-I163 HydrophobicContact CB-CD1 3.93Å; A104-I163 HydrophobicContact CB-CG2 4.15Å; A104-I163 WeakPolarHBondContact O-CG2 3.47Å
105	E	95.3	Very high	96.6	Very high	24 Å²	24	42.6 Å²	42.6	11%	0.112	22%	0.222	C	C	.	.	H	α-helix	trans	-72.1	-30.7	175.4	-75.1	175.3	-176.8	0	0	112.6	V101 S102 D103 C107 Y108 L109 I163 S166 R170	V101-E105 HydrophobicContact CG1-CB 3.7Å; S102-E105 PolarHBondContact O-N 2.8Å; S102-E105 VanDerWaalsContact O-N 3.08Å; S102-E105 WeakPolarHBondContact OG-CB 3.25Å; S102-E105 VanDerWaalsContact OG-CG 3.26Å; S102-E105 WeakPolarHBondContact OG-CG 3.05Å; S102-E105 PolarHBondContact OG-N 3.42Å; D103-E105 PolarHBondContact O-N 3Å; E105-C107 VanDerWaalsContact C-N 3.34Å; E105-C107 PolarHBondContact O-N 3.39Å; E105-Y108 PolarHBondContact O-N 2.86Å; E105-Y108 VanDerWaalsContact O-N 3.12Å; E105-L109 PolarHBondContact O-N 3.41Å; E105-I163 HydrophobicContact CB-CG2 4.48Å; E105-I163 HydrophobicContact CG-CG2 3.95Å; E105-S166 VanDerWaalsContact CD-OG 3.3Å; E105-S166 WeakPolarHBondContact OE1-CB 3.38Å; E105-S166 PolarHBondContact OE1-OG 2.98Å; E105-R170 IonicContact OE2-CZ 3.85Å; E105-R170 IonicContact OE2-NE 3.48Å; E105-R170 PolarHBondContact OE2-NE 3.05Å; E105-R170 IonicContact OE2-NH2 3.74Å; E105-R170 PolarHBondContact OE2-NH2 3.37Å
106	S	97.1	Very high	96.7	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-55.7	-43.8	-169.1	71.5	0	0	0	0	112.9	F57 G58 S102 D103 Y108 L109 V110 F204	F57-S106 WeakPolarHBondContact CA-OG 3.4Å; F57-S106 WeakPolarHBondContact CB-OG 3.29Å; G58-S106 PolarHBondContact N-OG 2.97Å; S102-S106 PolarHBondContact O-N 3.2Å; D103-S106 WeakPolarHBondContact O-CB 3.18Å; D103-S106 PolarHBondContact O-N 3.05Å; D103-S106 PolarHBondContact O-OG 3.38Å; S106-Y108 PolarHBondContact O-N 3.16Å; S106-L109 PolarHBondContact O-N 2.85Å; S106-V110 WeakPolarHBondContact O-CB 3.06Å; S106-V110 WeakPolarHBondContact O-CG1 3.33Å; S106-V110 PolarHBondContact O-N 3.31Å; S106-F204 VanDerWaalsContact CB-CE1 3.48Å
107	C	96.2	Very high	96.8	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-60.2	-44.5	179	-178.1	0	0	0	0	112.6	F57 C60 E105 V110 H111	F57-C107 HydrophobicContact CB-CB 4.21Å; F57-C107 WeakPolarHBondContact O-CB 3.41Å; C60-C107 HydrophobicContact CB-CB 3.72Å; C60-C107 WeakPolarHBondContact CB-SG 3.32Å; C60-C107 WeakPolarHBondContact SG-CB 3.48Å; C60-C107 CovalentContact SG-SG 2.03Å; C60-C107 PolarHBondContact SG-SG 2.92Å; E105-C107 VanDerWaalsContact C-N 3.34Å; E105-C107 PolarHBondContact O-N 3.39Å; C107-V110 WeakPolarHBondContact O-CG1 3.45Å; C107-H111 WeakPolarHBondContact O-CB 3.22Å; C107-H111 PolarHBondContact O-N 3.13Å
108	Y	96.4	Very high	96.8	Very high	11 Å²	11	34.3 Å²	34.3	4%	0.043	18%	0.184	C	C	.	.	H	α-helix	trans	-66.5	-44.4	179.5	-67.7	-87.4	0	0	0	111.7	A104 E105 S106 T112 P154 S155 M160 I163 R164 A167	A104-Y108 WeakPolarHBondContact O-CD2 3.45Å; E105-Y108 PolarHBondContact O-N 2.86Å; E105-Y108 VanDerWaalsContact O-N 3.12Å; S106-Y108 PolarHBondContact O-N 3.16Å; Y108-T112 WeakPolarHBondContact O-CB 3.39Å; Y108-T112 PolarHBondContact O-N 3.15Å; Y108-T112 PolarHBondContact O-OG1 3.33Å; Y108-P154 HydrophobicContact CD1-CB 3.67Å; Y108-P154 HydrophobicContact CD1-CG 4.23Å; Y108-P154 HydrophobicContact CE1-CB 3.22Å; Y108-P154 HydrophobicContact CE1-CG 4.09Å; Y108-P154 HydrophobicContact CE2-CB 4.14Å; Y108-P154 HydrophobicContact CG-CB 4.28Å; Y108-P154 VanDerWaalsContact CZ-CB 3.41Å; Y108-S155 PolarHBondContact OH-N 3.36Å; Y108-S155 PolarHBondContact OH-O 3.1Å; Y108-M160 HydrophobicContact CE2-CG 3.76Å; Y108-M160 HydrophobicContact CE2-SD 4.11Å; Y108-M160 WeakPolarHBondContact OH-CG 3.32Å; Y108-I163 HydrophobicContact CD2-CG2 3.95Å; Y108-I163 HydrophobicContact CE2-CG2 4.01Å; Y108-R164 HydrophobicContact CD1-CB 3.91Å; Y108-R164 HydrophobicContact CD1-CG 3.79Å; Y108-R164 HydrophobicContact CE1-CB 3.89Å; Y108-R164 HydrophobicContact CE1-CG 4Å; Y108-A167 VanDerWaalsContact CB-CB 3.5Å; Y108-A167 HydrophobicContact CG-CB 4.49Å
109	L	97.8	Very high	96.7	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-68.1	-48.8	-176.5	-178.1	59.9	0	0	0	111	V97 L98 V101 E105 S106 H111 T112 L113 A167 R170 F171 W200	V97-L109 WeakPolarHBondContact O-CD2 2.96Å; L98-L109 HydrophobicContact CD2-CD2 4.34Å; V101-L109 HydrophobicContact CB-CD2 4.48Å; V101-L109 HydrophobicContact CG1-CD2 4.05Å; V101-L109 HydrophobicContact CG2-CD2 3.6Å; E105-L109 PolarHBondContact O-N 3.41Å; S106-L109 PolarHBondContact O-N 2.85Å; L109-H111 VanDerWaalsContact C-N 3.34Å; L109-H111 PolarHBondContact O-N 3.01Å; L109-T112 PolarHBondContact O-N 3.08Å; L109-L113 HydrophobicContact CD1-CD1 4.06Å; L109-L113 HydrophobicContact CD1-CG 4.22Å; L109-L113 HydrophobicContact CG-CD1 3.92Å; L109-L113 HydrophobicContact CG-CG 4.5Å; L109-L113 WeakPolarHBondContact O-CB 3.41Å; L109-L113 WeakPolarHBondContact O-CG 3.42Å; L109-L113 PolarHBondContact O-N 3.06Å; L109-A167 HydrophobicContact CB-CB 4.22Å; L109-R170 HydrophobicContact CD1-CB 4.14Å; L109-F171 HydrophobicContact CD1-CB 4.26Å; L109-W200 HydrophobicContact CB-CH2 4.37Å; L109-W200 HydrophobicContact CD2-CH2 4.23Å; L109-W200 HydrophobicContact CD2-CZ2 4.04Å; L109-W200 HydrophobicContact CG-CH2 4.29Å
110	V	98.2	Very high	96.7	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-62.7	-42.6	178.6	70.5	0	0	0	0	110.7	F57 S106 C107 T112 L113 L114 L152 W200 M201	F57-V110 HydrophobicContact CB-CG1 4.35Å; F57-V110 HydrophobicContact CD1-CB 4.36Å; F57-V110 HydrophobicContact CD1-CG1 3.91Å; F57-V110 HydrophobicContact CD2-CG1 4.1Å; F57-V110 HydrophobicContact CE1-CB 4.26Å; F57-V110 HydrophobicContact CE1-CG1 4.17Å; F57-V110 HydrophobicContact CE1-CG2 4.12Å; F57-V110 HydrophobicContact CE2-CG1 4.33Å; F57-V110 HydrophobicContact CE2-CG2 4.5Å; F57-V110 HydrophobicContact CG-CG1 3.87Å; F57-V110 HydrophobicContact CZ-CG1 4.39Å; F57-V110 HydrophobicContact CZ-CG2 4.04Å; S106-V110 WeakPolarHBondContact O-CB 3.06Å; S106-V110 WeakPolarHBondContact O-CG1 3.33Å; S106-V110 PolarHBondContact O-N 3.31Å; C107-V110 WeakPolarHBondContact O-CG1 3.45Å; V110-T112 PolarHBondContact O-N 2.78Å; V110-L113 PolarHBondContact O-N 3.37Å; V110-L114 HydrophobicContact CG2-CD1 3.85Å; V110-L114 HydrophobicContact CG2-CG 4.04Å; V110-L114 WeakPolarHBondContact O-CB 3.3Å; V110-L114 WeakPolarHBondContact O-CG 3.44Å; V110-L114 PolarHBondContact O-N 3.43Å; V110-L152 HydrophobicContact CG1-CD1 3.58Å; V110-L152 HydrophobicContact CG1-CD2 3.65Å; V110-L152 HydrophobicContact CG1-CG 4.27Å; V110-L152 HydrophobicContact CG2-CD1 4.42Å; V110-W200 HydrophobicContact CB-CH2 3.79Å; V110-W200 HydrophobicContact CB-CZ3 3.6Å; V110-W200 HydrophobicContact CG2-CZ3 3.85Å; V110-M201 HydrophobicContact CG2-CE 4.3Å; V110-M201 HydrophobicContact CG2-CG 4.07Å; V110-M201 HydrophobicContact CG2-SD 4.22Å
111	H	97.6	Very high	96.7	Very high	43 Å²	43	29.4 Å²	29.4	20%	0.199	16%	0.157	C	C	.	.	H	α-helix	trans	-56.7	-50.3	175.9	178.9	-91.1	0	0	0	111.5	C107 L109 L113 L114 E115 L152	C107-H111 WeakPolarHBondContact O-CB 3.22Å; C107-H111 PolarHBondContact O-N 3.13Å; L109-H111 VanDerWaalsContact C-N 3.34Å; L109-H111 PolarHBondContact O-N 3.01Å; H111-L113 PolarHBondContact O-N 2.86Å; H111-L114 PolarHBondContact O-N 3.18Å; H111-E115 IonicContact CE1-OE1 2.78Å; H111-E115 WeakPolarHBondContact O-CB 3.4Å; H111-E115 WeakPolarHBondContact O-CG 3.05Å; H111-E115 PolarHBondContact O-N 2.99Å; H111-L152 HydrophobicContact CB-CB 4.08Å; H111-L152 HydrophobicContact CB-CD1 4.09Å; H111-L152 PolarHBondContact CD2-O 3.23Å
112	T	97.6	Very high	96.6	Very high	37 Å²	37	29.3 Å²	29.3	23%	0.227	16%	0.155	C	C	.	.	H	α-helix	trans	-67	-38.3	-177.3	-49.1	0	0	0	0	112.3	Y108 L109 V110 F116 F171	Y108-T112 WeakPolarHBondContact O-CB 3.39Å; Y108-T112 PolarHBondContact O-N 3.15Å; Y108-T112 PolarHBondContact O-OG1 3.33Å; L109-T112 PolarHBondContact O-N 3.08Å; V110-T112 PolarHBondContact O-N 2.78Å; T112-F116 PolarHBondContact O-N 3.35Å; T112-F116 VanDerWaalsContact O-N 3.12Å; T112-F171 HydrophobicContact CG2-CB 4.17Å; T112-F171 HydrophobicContact CG2-CD1 3.57Å; T112-F171 HydrophobicContact CG2-CD2 3.63Å; T112-F171 HydrophobicContact CG2-CE1 3.76Å; T112-F171 HydrophobicContact CG2-CE2 3.82Å; T112-F171 HydrophobicContact CG2-CG 3.49Å; T112-F171 VanDerWaalsContact CG2-CG 3.49Å; T112-F171 HydrophobicContact CG2-CZ 3.88Å
113	L	98.7	Very high	96.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-63.3	-52.4	173.7	-73.7	169.7	0	0	0	110.6	L93 L98 L109 V110 H111 E115 F116 Y117 F171 F174 L197	L93-L113 HydrophobicContact CD2-CD1 4.42Å; L93-L113 HydrophobicContact CD2-CD2 4.04Å; L98-L113 HydrophobicContact CD2-CD1 4.06Å; L109-L113 HydrophobicContact CD1-CD1 4.06Å; L109-L113 HydrophobicContact CD1-CG 4.22Å; L109-L113 HydrophobicContact CG-CD1 3.92Å; L109-L113 HydrophobicContact CG-CG 4.5Å; L109-L113 WeakPolarHBondContact O-CB 3.41Å; L109-L113 WeakPolarHBondContact O-CG 3.42Å; L109-L113 PolarHBondContact O-N 3.06Å; V110-L113 PolarHBondContact O-N 3.37Å; H111-L113 PolarHBondContact O-N 2.86Å; L113-E115 VanDerWaalsContact C-N 3.33Å; L113-E115 PolarHBondContact O-N 2.99Å; L113-F116 WeakPolarHBondContact O-CB 3.46Å; L113-F116 PolarHBondContact O-N 3.45Å; L113-Y117 VanDerWaalsContact O-CD2 3.31Å; L113-Y117 WeakPolarHBondContact O-CD2 3.35Å; L113-Y117 PolarHBondContact O-N 2.82Å; L113-F171 HydrophobicContact CD2-CD2 4.1Å; L113-F174 HydrophobicContact CD2-CD1 3.93Å; L113-F174 HydrophobicContact CD2-CD2 4.36Å; L113-F174 HydrophobicContact CD2-CE1 4.24Å; L113-F174 HydrophobicContact CD2-CG 4Å; L113-L197 HydrophobicContact CD1-CD1 4.09Å
114	L	98.5	Very high	96.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.7	-41.3	-179.2	-65.2	179.8	0	0	0	112	V110 H111 F116 Y117 L118 F145 I148 L152 L197 M201	V110-L114 HydrophobicContact CG2-CD1 3.85Å; V110-L114 HydrophobicContact CG2-CG 4.04Å; V110-L114 WeakPolarHBondContact O-CB 3.3Å; V110-L114 WeakPolarHBondContact O-CG 3.44Å; V110-L114 PolarHBondContact O-N 3.43Å; H111-L114 PolarHBondContact O-N 3.18Å; L114-F116 VanDerWaalsContact C-N 3.31Å; L114-F116 PolarHBondContact O-N 3.37Å; L114-Y117 PolarHBondContact O-N 3.09Å; L114-L118 WeakPolarHBondContact O-CB 3.28Å; L114-L118 VanDerWaalsContact O-CG 3.26Å; L114-L118 WeakPolarHBondContact O-CG 3.31Å; L114-L118 PolarHBondContact O-N 3.29Å; L114-F145 HydrophobicContact CD2-CB 4.26Å; L114-F145 HydrophobicContact CD2-CD1 3.99Å; L114-F145 HydrophobicContact CD2-CD2 3.33Å; L114-F145 HydrophobicContact CD2-CE1 4.11Å; L114-F145 HydrophobicContact CD2-CE2 3.49Å; L114-F145 VanDerWaalsContact CD2-CE2 3.49Å; L114-F145 HydrophobicContact CD2-CG 3.61Å; L114-F145 HydrophobicContact CD2-CZ 3.88Å; L114-I148 HydrophobicContact CD1-CB 3.86Å; L114-I148 HydrophobicContact CD1-CG2 3.37Å; L114-L152 HydrophobicContact CD1-CD1 3.9Å; L114-L197 HydrophobicContact CD2-CD2 4.16Å; L114-M201 HydrophobicContact CD1-CE 4.48Å; L114-M201 HydrophobicContact CD2-CE 4.49Å; L114-M201 HydrophobicContact CD2-SD 4.26Å
115	E	97.9	Very high	95.3	Very high	70 Å²	70	30.1 Å²	30.1	33%	0.327	14%	0.143	S	C	.	.	H	α-helix	trans	-58.1	-42.9	173.1	-80.4	-142.6	136.8	0	0	112.3	H111 L113 L118 K119	H111-E115 IonicContact CE1-OE1 2.78Å; H111-E115 WeakPolarHBondContact O-CB 3.4Å; H111-E115 WeakPolarHBondContact O-CG 3.05Å; H111-E115 PolarHBondContact O-N 2.99Å; L113-E115 VanDerWaalsContact C-N 3.33Å; L113-E115 PolarHBondContact O-N 2.99Å; E115-L118 PolarHBondContact O-N 2.89Å; E115-K119 VanDerWaalsContact O-CB 3.28Å; E115-K119 WeakPolarHBondContact O-CB 3.36Å; E115-K119 WeakPolarHBondContact O-CG 3.45Å; E115-K119 PolarHBondContact O-N 3.46Å; E115-K119 IonicContact OE1-NZ 2.64Å; E115-K119 PolarHBondContact OE1-NZ 3.3Å; E115-K119 IonicContact OE2-NZ 2.85Å; E115-K119 PolarHBondContact OE2-NZ 2.91Å
116	F	98.5	Very high	94.2	Very high	23 Å²	23	34.4 Å²	34.4	10%	0.101	16%	0.163	C	C	.	.	H	α-helix	trans	-63.6	-44.7	176.6	-179.1	-87.5	0	0	0	111.5	T112 L113 L114 L118 T120 V121 F171 F174 F178	T112-F116 PolarHBondContact O-N 3.35Å; T112-F116 VanDerWaalsContact O-N 3.12Å; L113-F116 WeakPolarHBondContact O-CB 3.46Å; L113-F116 PolarHBondContact O-N 3.45Å; L114-F116 VanDerWaalsContact C-N 3.31Å; L114-F116 PolarHBondContact O-N 3.37Å; F116-L118 VanDerWaalsContact C-N 3.33Å; F116-L118 PolarHBondContact O-N 3.4Å; F116-T120 HydrophobicContact CE1-CG2 4.38Å; F116-T120 HydrophobicContact CE2-CG2 4.16Å; F116-T120 HydrophobicContact CZ-CG2 3.91Å; F116-T120 WeakPolarHBondContact O-CA 3.47Å; F116-T120 VanDerWaalsContact O-CB 3.23Å; F116-T120 WeakPolarHBondContact O-CB 3.47Å; F116-T120 PolarHBondContact O-N 3.31Å; F116-V121 HydrophobicContact CD1-CG2 3.96Å; F116-V121 HydrophobicContact CE1-CG2 3.73Å; F116-V121 PolarHBondContact O-N 3Å; F116-F171 HydrophobicContact CB-CE2 3.88Å; F116-F171 HydrophobicContact CB-CZ 4.15Å; F116-F171 HydrophobicContact CD2-CE2 4.3Å; F116-F171 AromaticContact CD2-CZ 3.99Å; F116-F171 HydrophobicContact CD2-CZ 3.99Å; F116-F171 HydrophobicContact CG-CE2 4.2Å; F116-F171 HydrophobicContact CG-CZ 4.33Å; F116-F174 AromaticContact CD1-CE1 3.42Å; F116-F174 HydrophobicContact CD1-CE1 3.42Å; F116-F174 VanDerWaalsContact CD1-CE1 3.42Å; F116-F174 AromaticContact CD1-CZ 3.73Å; F116-F174 HydrophobicContact CD1-CZ 3.73Å; F116-F174 HydrophobicContact CD2-CE1 4.47Å; F116-F174 AromaticContact CE1-CE1 3.53Å; F116-F174 HydrophobicContact CE1-CE1 3.53Å; F116-F174 AromaticContact CE1-CZ 3.67Å; F116-F174 HydrophobicContact CE1-CZ 3.67Å; F116-F174 AromaticContact CG-CE1 3.92Å; F116-F174 HydrophobicContact CG-CE1 3.92Å; F116-F174 HydrophobicContact CZ-CE1 4.12Å; F116-F178 AromaticContact CE1-CD2 3.8Å; F116-F178 HydrophobicContact CE1-CD2 3.8Å; F116-F178 AromaticContact CE1-CE2 3.81Å; F116-F178 HydrophobicContact CE1-CE2 3.81Å; F116-F178 HydrophobicContact CE1-CG 4.25Å; F116-F178 HydrophobicContact CE1-CZ 4.27Å; F116-F178 AromaticContact CZ-CD1 3.82Å; F116-F178 HydrophobicContact CZ-CD1 3.82Å; F116-F178 AromaticContact CZ-CD2 3.75Å; F116-F178 HydrophobicContact CZ-CD2 3.75Å; F116-F178 AromaticContact CZ-CE1 3.9Å; F116-F178 HydrophobicContact CZ-CE1 3.9Å; F116-F178 AromaticContact CZ-CE2 3.83Å; F116-F178 HydrophobicContact CZ-CE2 3.83Å; F116-F178 AromaticContact CZ-CG 3.76Å; F116-F178 HydrophobicContact CZ-CG 3.76Å; F116-F178 AromaticContact CZ-CZ 3.91Å; F116-F178 HydrophobicContact CZ-CZ 3.91Å
117	Y	98.4	Very high	93	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.195	C	C	.	.	I	π-helix	trans	-59.5	-44.2	176.2	-88.2	-95	0	0	0	111.7	L113 L114 V121 F122 F145 F174 A190 V194 L197	L113-Y117 VanDerWaalsContact O-CD2 3.31Å; L113-Y117 WeakPolarHBondContact O-CD2 3.35Å; L113-Y117 PolarHBondContact O-N 2.82Å; L114-Y117 PolarHBondContact O-N 3.09Å; Y117-V121 HydrophobicContact CD1-CB 3.97Å; Y117-V121 HydrophobicContact CD1-CG1 4.1Å; Y117-V121 HydrophobicContact CD1-CG2 4.01Å; Y117-V121 HydrophobicContact CE1-CG1 4.4Å; Y117-V121 HydrophobicContact CE1-CG2 4.39Å; Y117-V121 HydrophobicContact CG-CB 4.43Å; Y117-V121 HydrophobicContact CG-CG2 4.25Å; Y117-V121 CarbonylContact O-C 3.55Å; Y117-V121 WeakPolarHBondContact O-CA 3.3Å; Y117-V121 WeakPolarHBondContact O-CB 3.45Å; Y117-V121 PolarHBondContact O-N 3.2Å; Y117-F122 HydrophobicContact CD1-CZ 4.39Å; Y117-F122 PolarHBondContact O-N 3.45Å; Y117-F145 HydrophobicContact CG-CE2 4.35Å; Y117-F174 HydrophobicContact CE2-CZ 4.22Å; Y117-A190 HydrophobicContact CE1-CB 4.34Å; Y117-A190 WeakPolarHBondContact CE1-O 3.32Å; Y117-A190 PolarHBondContact OH-O 2.87Å; Y117-V194 HydrophobicContact CD1-CG2 4.34Å; Y117-V194 HydrophobicContact CE1-CG2 3.69Å; Y117-L197 HydrophobicContact CD2-CD2 4.07Å; Y117-L197 HydrophobicContact CE2-CD2 3.84Å
118	L	97.4	Very high	91.8	Very high	39 Å²	39	45.9 Å²	45.9	20%	0.204	22%	0.216	C	C	.	.	I	π-helix	trans	-67.3	-51	179.3	-69.2	168.1	0	0	0	112.4	L114 E115 F116 F122 A142 F145 V146 A149	L114-L118 WeakPolarHBondContact O-CB 3.28Å; L114-L118 VanDerWaalsContact O-CG 3.26Å; L114-L118 WeakPolarHBondContact O-CG 3.31Å; L114-L118 PolarHBondContact O-N 3.29Å; E115-L118 PolarHBondContact O-N 2.89Å; F116-L118 VanDerWaalsContact C-N 3.33Å; F116-L118 PolarHBondContact O-N 3.4Å; L118-F122 HydrophobicContact CD2-CD2 4.2Å; L118-A142 HydrophobicContact CD2-CB 4.28Å; L118-F145 HydrophobicContact CD1-CB 4.43Å; L118-F145 HydrophobicContact CD2-CB 4Å; L118-F145 HydrophobicContact CG-CB 4.28Å; L118-V146 HydrophobicContact CD1-CG2 4.01Å; L118-V146 HydrophobicContact CD2-CG2 3.65Å; L118-V146 HydrophobicContact CG-CG2 4.49Å; L118-A149 HydrophobicContact CD1-CB 4.24Å
119	K	96.9	Very high	90.8	Very high	120 Å²	120	46.6 Å²	46.6	52%	0.522	22%	0.221	S	C	.	.	I	π-helix	trans	-78.7	-25.6	-172.3	-66.2	174.3	-175	169.3	0	113	E115 K123	E115-K119 VanDerWaalsContact O-CB 3.28Å; E115-K119 WeakPolarHBondContact O-CB 3.36Å; E115-K119 WeakPolarHBondContact O-CG 3.45Å; E115-K119 PolarHBondContact O-N 3.46Å; E115-K119 IonicContact OE1-NZ 2.64Å; E115-K119 PolarHBondContact OE1-NZ 3.3Å; E115-K119 IonicContact OE2-NZ 2.85Å; E115-K119 PolarHBondContact OE2-NZ 2.91Å; K119-K123 WeakPolarHBondContact O-CD 3.4Å
120	T	96.3	Very high	89.7	Confident	38 Å²	38	53.3 Å²	53.3	23%	0.233	26%	0.262	C	S	.	.	I	π-helix	trans	-117.9	-54.6	-174.9	-54.8	0	0	0	0	112.1	F116 N124 F178	F116-T120 HydrophobicContact CE1-CG2 4.38Å; F116-T120 HydrophobicContact CE2-CG2 4.16Å; F116-T120 HydrophobicContact CZ-CG2 3.91Å; F116-T120 WeakPolarHBondContact O-CA 3.47Å; F116-T120 VanDerWaalsContact O-CB 3.23Å; F116-T120 WeakPolarHBondContact O-CB 3.47Å; F116-T120 PolarHBondContact O-N 3.31Å; T120-N124 WeakPolarHBondContact O-CB 3.2Å; T120-N124 PolarHBondContact O-N 3.35Å; T120-N124 PolarHBondContact O-ND2 3.06Å; T120-F178 HydrophobicContact CG2-CE1 4.49Å; T120-F178 HydrophobicContact CG2-CZ 4.23Å
121	V	96.3	Very high	89	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.281	C	S	.	.	I	π-helix	trans	-74.3	-62.2	-169.7	-174.5	0	0	0	0	111.7	F116 Y117 K123 N124 Y125 F178 A190 L191	F116-V121 HydrophobicContact CD1-CG2 3.96Å; F116-V121 HydrophobicContact CE1-CG2 3.73Å; F116-V121 PolarHBondContact O-N 3Å; Y117-V121 HydrophobicContact CD1-CB 3.97Å; Y117-V121 HydrophobicContact CD1-CG1 4.1Å; Y117-V121 HydrophobicContact CD1-CG2 4.01Å; Y117-V121 HydrophobicContact CE1-CG1 4.4Å; Y117-V121 HydrophobicContact CE1-CG2 4.39Å; Y117-V121 HydrophobicContact CG-CB 4.43Å; Y117-V121 HydrophobicContact CG-CG2 4.25Å; Y117-V121 CarbonylContact O-C 3.55Å; Y117-V121 WeakPolarHBondContact O-CA 3.3Å; Y117-V121 WeakPolarHBondContact O-CB 3.45Å; Y117-V121 PolarHBondContact O-N 3.2Å; V121-K123 PolarHBondContact O-N 3.46Å; V121-N124 PolarHBondContact O-N 3.35Å; V121-Y125 WeakPolarHBondContact O-CB 3.28Å; V121-Y125 PolarHBondContact O-N 3.29Å; V121-F178 HydrophobicContact CG2-CE2 4.47Å; V121-A190 HydrophobicContact CG1-CB 4.05Å; V121-A190 HydrophobicContact CG2-CB 3.81Å; V121-L191 HydrophobicContact CG1-CD1 4.4Å; V121-L191 HydrophobicContact CG1-CD2 3.49Å; V121-L191 VanDerWaalsContact CG1-CD2 3.49Å; V121-L191 HydrophobicContact CG1-CG 3.54Å
122	F	94.1	Very high	88.3	Confident	16 Å²	16	60.8 Å²	60.8	7%	0.07	31%	0.305	C	S	.	.	I	π-helix	trans	-66.6	-37.9	-177.2	-64.9	-46	0	0	0	112.7	Y117 L118 N124 Y125 H126 F138 L141 A142 F145 L191	Y117-F122 HydrophobicContact CD1-CZ 4.39Å; Y117-F122 PolarHBondContact O-N 3.45Å; L118-F122 HydrophobicContact CD2-CD2 4.2Å; F122-N124 VanDerWaalsContact C-N 3.32Å; F122-N124 PolarHBondContact O-N 2.85Å; F122-Y125 PolarHBondContact O-N 3.19Å; F122-H126 PolarHBondContact O-N 3.26Å; F122-H126 VanDerWaalsContact O-N 3.08Å; F122-F138 HydrophobicContact CD1-CD1 4.25Å; F122-F138 AromaticContact CE1-CD1 3.82Å; F122-F138 HydrophobicContact CE1-CD1 3.82Å; F122-F138 HydrophobicContact CE1-CE1 4.46Å; F122-L141 HydrophobicContact CE1-CB 4.45Å; F122-L141 HydrophobicContact CZ-CB 3.97Å; F122-A142 HydrophobicContact CB-CB 4.41Å; F122-A142 HydrophobicContact CD2-CB 3.81Å; F122-A142 HydrophobicContact CE2-CB 4.25Å; F122-A142 HydrophobicContact CG-CB 4.14Å; F122-F145 AromaticContact CE2-CD2 3.58Å; F122-F145 HydrophobicContact CE2-CD2 3.58Å; F122-F145 AromaticContact CE2-CE2 3.96Å; F122-F145 HydrophobicContact CE2-CE2 3.96Å; F122-F145 HydrophobicContact CE2-CG 4.28Å; F122-F145 HydrophobicContact CZ-CD2 4.22Å; F122-F145 HydrophobicContact CZ-CE2 4.16Å; F122-L191 HydrophobicContact CD1-CD2 3.77Å; F122-L191 HydrophobicContact CE1-CD2 3.54Å
123	K	91.3	Very high	87.7	Confident	139 Å²	139	66.8 Å²	66.8	60%	0.604	32%	0.323	S	S	*	.	H	α-helix	trans	-56.3	-44.8	175.9	-177.1	-179.8	178.1	-178.6	0	112.3	K119 V121	K119-K123 WeakPolarHBondContact O-CD 3.4Å; V121-K123 PolarHBondContact O-N 3.46Å
124	N	87.5	Confident	87	Confident	58 Å²	58	66.9 Å²	66.9	31%	0.31	32%	0.324	S	S	.	.	H	α-helix	trans	-82.4	-27.8	-177.2	-72.5	-68.4	0	0	0	112.8	T120 V121 F122 R128 L187	T120-N124 WeakPolarHBondContact O-CB 3.2Å; T120-N124 PolarHBondContact O-N 3.35Å; T120-N124 PolarHBondContact O-ND2 3.06Å; V121-N124 PolarHBondContact O-N 3.35Å; F122-N124 VanDerWaalsContact C-N 3.32Å; F122-N124 PolarHBondContact O-N 2.85Å; N124-R128 WeakPolarHBondContact O-CG 3.19Å; N124-L187 HydrophobicContact CB-CD1 3.62Å; N124-L187 HydrophobicContact CB-CD2 3.95Å; N124-L187 HydrophobicContact CB-CG 4.47Å
125	Y	74.2	Confident	86.5	Confident	14 Å²	14	68.7 Å²	68.7	6%	0.055	33%	0.333	C	S	.	.	H	α-helix	trans	-72.5	-39	178	-172.8	-91.5	0	0	0	113.3	V121 F122 N127 R128 T129 T134 F138 L191	V121-Y125 WeakPolarHBondContact O-CB 3.28Å; V121-Y125 PolarHBondContact O-N 3.29Å; F122-Y125 PolarHBondContact O-N 3.19Å; Y125-N127 PolarHBondContact O-N 3.41Å; Y125-N127 VanDerWaalsContact O-N 3.15Å; Y125-R128 PolarHBondContact O-N 2.88Å; Y125-T129 HydrophobicContact CE1-CG2 3.93Å; Y125-T129 WeakPolarHBondContact CE1-OG1 3.37Å; Y125-T129 WeakPolarHBondContact CE2-OG1 3.48Å; Y125-T129 PolarHBondContact O-N 3.05Å; Y125-T129 PolarHBondContact OH-OG1 3.36Å; Y125-T129 VanDerWaalsContact OH-OG1 3.04Å; Y125-T134 HydrophobicContact CE1-CG2 3.91Å; Y125-T134 WeakPolarHBondContact OH-CG2 2.96Å; Y125-F138 AromaticContact CD1-CD2 3.51Å; Y125-F138 HydrophobicContact CD1-CD2 3.51Å; Y125-F138 AromaticContact CD1-CE2 3.65Å; Y125-F138 HydrophobicContact CD1-CE2 3.65Å; Y125-F138 HydrophobicContact CD1-CG 4.29Å; Y125-F138 AromaticContact CE1-CD2 3.15Å; Y125-F138 HydrophobicContact CE1-CD2 3.15Å; Y125-F138 AromaticContact CE1-CE2 3.01Å; Y125-F138 HydrophobicContact CE1-CE2 3.01Å; Y125-F138 HydrophobicContact CE1-CG 4.3Å; Y125-F138 HydrophobicContact CE1-CZ 4.07Å; Y125-F138 HydrophobicContact CE2-CE2 4.23Å; Y125-F138 HydrophobicContact CG-CE2 4.47Å; Y125-F138 AromaticContact CZ-CD2 3.97Å; Y125-F138 AromaticContact CZ-CE2 3.3Å; Y125-F138 WeakPolarHBondContact OH-CE2 3.36Å; Y125-L191 HydrophobicContact CD1-CD1 4.24Å; Y125-L191 HydrophobicContact CD2-CD1 3.06Å; Y125-L191 HydrophobicContact CE2-CD1 3.52Å; Y125-L191 HydrophobicContact CG-CD1 3.44Å; Y125-L191 VanDerWaalsContact CG-CD1 3.44Å
126	H	70.9	Confident	86.2	Confident	114 Å²	114	72.6 Å²	72.6	53%	0.528	35%	0.349	S	S	.	.	H	α-helix	trans	-55.6	-33.9	177.7	-172.2	73.3	0	0	0	112.2	F122 R128	F122-H126 PolarHBondContact O-N 3.26Å; F122-H126 VanDerWaalsContact O-N 3.08Å; H126-R128 PolarHBondContact O-N 2.93Å
127	N	71.9	Confident	86	Confident	125 Å²	125	72 Å²	72	67%	0.668	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-11.3	178.8	-64.5	-13.4	0	0	0	114	Y125	Y125-N127 PolarHBondContact O-N 3.41Å; Y125-N127 VanDerWaalsContact O-N 3.15Å
128	R	71.9	Confident	85.7	Confident	116 Å²	116	72.5 Å²	72.5	44%	0.438	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113	-22.8	-168.3	-68.3	176.4	170.5	-137.1	-14.8	114.1	N124 Y125 H126 E184	N124-R128 WeakPolarHBondContact O-CG 3.19Å; Y125-R128 PolarHBondContact O-N 2.88Å; H126-R128 PolarHBondContact O-N 2.93Å; R128-E184 IonicContact CZ-OE1 3.14Å; R128-E184 IonicContact NH1-OE1 3.85Å; R128-E184 PolarHBondContact NH1-OE1 3.3Å; R128-E184 IonicContact NH2-OE1 2.81Å; R128-E184 PolarHBondContact NH2-OE1 3.26Å
129	T	74.7	Confident	85.5	Confident	26 Å²	26	73 Å²	73	16%	0.16	36%	0.357	C	S	.	.			trans	-106.8	129.9	-171.7	-64.6	0	0	0	0	112.1	Y125 E131 T134	Y125-T129 HydrophobicContact CE1-CG2 3.93Å; Y125-T129 WeakPolarHBondContact CE1-OG1 3.37Å; Y125-T129 WeakPolarHBondContact CE2-OG1 3.48Å; Y125-T129 PolarHBondContact O-N 3.05Å; Y125-T129 PolarHBondContact OH-OG1 3.36Å; Y125-T129 VanDerWaalsContact OH-OG1 3.04Å; T129-E131 HydrophobicContact CG2-CB 4.11Å; T129-T134 HydrophobicContact CG2-CG2 3.83Å
130	V	74.9	Confident	85.4	Confident	142 Å²	142	69.7 Å²	69.7	86%	0.861	35%	0.347	S	S	*	.			trans	-101.3	-8	178.1	-62.7	0	0	0	0	113.4	V132	V130-V132 PolarHBondContact O-N 3.48Å
131	E	83.8	Confident	85.4	Confident	86 Å²	86	67.9 Å²	67.9	40%	0.402	34%	0.336	S	S	.	.			trans	-76.5	113.3	179.9	-171.6	-171.7	179.3	0	0	111.1	T129 R133 T134 L135	T129-E131 HydrophobicContact CG2-CB 4.11Å; E131-R133 VanDerWaalsContact C-N 3.33Å; E131-R133 PolarHBondContact O-N 2.74Å; E131-T134 WeakPolarHBondContact O-CB 3.36Å; E131-T134 PolarHBondContact O-N 2.87Å; E131-T134 VanDerWaalsContact O-N 3.13Å; E131-T134 PolarHBondContact OE2-OG1 3.24Å; E131-L135 WeakPolarHBondContact O-CG 3.36Å; E131-L135 PolarHBondContact O-N 3.49Å
132	V	83.3	Confident	85.5	Confident	114 Å²	114	68.8 Å²	68.8	69%	0.691	34%	0.343	S	S	*	.	H	α-helix	trans	-57.3	-42	-175.5	176.7	0	0	0	0	112.8	V130 T134 L135 K136	V130-V132 PolarHBondContact O-N 3.48Å; V132-T134 VanDerWaalsContact C-N 3.3Å; V132-T134 PolarHBondContact O-N 2.97Å; V132-L135 PolarHBondContact O-N 3.26Å; V132-K136 WeakPolarHBondContact O-CB 3.25Å; V132-K136 PolarHBondContact O-N 3.06Å
133	R	83.8	Confident	85.6	Confident	163 Å²	163	73.3 Å²	73.3	62%	0.615	37%	0.368	S	S	*	.	H	α-helix	trans	-59.7	-45.9	178.9	-177.7	179.2	179.8	170.7	1	110.7	E131 K136 S137	E131-R133 VanDerWaalsContact C-N 3.33Å; E131-R133 PolarHBondContact O-N 2.74Å; R133-K136 PolarHBondContact O-N 3.12Å; R133-S137 PolarHBondContact O-N 3.37Å
134	T	84.4	Confident	85.9	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.006	35%	0.345	C	S	.	.	H	α-helix	trans	-66.7	-43.4	-179.1	-61.6	0	0	0	0	111.6	V77 Y125 T129 E131 V132 K136 S137 F138	V77-T134 HydrophobicContact CG1-CG2 3.98Å; Y125-T134 HydrophobicContact CE1-CG2 3.91Å; Y125-T134 WeakPolarHBondContact OH-CG2 2.96Å; T129-T134 HydrophobicContact CG2-CG2 3.83Å; E131-T134 WeakPolarHBondContact O-CB 3.36Å; E131-T134 PolarHBondContact O-N 2.87Å; E131-T134 VanDerWaalsContact O-N 3.13Å; E131-T134 PolarHBondContact OE2-OG1 3.24Å; V132-T134 VanDerWaalsContact C-N 3.3Å; V132-T134 PolarHBondContact O-N 2.97Å; T134-K136 VanDerWaalsContact C-N 3.33Å; T134-K136 PolarHBondContact O-N 3.18Å; T134-S137 PolarHBondContact O-N 3.2Å; T134-F138 HydrophobicContact CG2-CD2 3.7Å; T134-F138 HydrophobicContact CG2-CE2 3.3Å; T134-F138 HydrophobicContact CG2-CZ 4.38Å; T134-F138 WeakPolarHBondContact O-CD2 3.35Å; T134-F138 PolarHBondContact O-N 3.21Å
135	L	87.9	Confident	86.4	Confident	38 Å²	38	65.1 Å²	65.1	20%	0.199	33%	0.33	C	S	.	.	H	α-helix	trans	-59.1	-41.2	172.7	-70.9	174.1	0	0	0	112.8	E131 V132 S139	E131-L135 WeakPolarHBondContact O-CG 3.36Å; E131-L135 PolarHBondContact O-N 3.49Å; V132-L135 PolarHBondContact O-N 3.26Å; L135-S139 WeakPolarHBondContact O-CB 3.49Å; L135-S139 PolarHBondContact O-N 3.25Å; L135-S139 PolarHBondContact O-OG 3.27Å
136	K	91.9	Very high	87.6	Confident	152 Å²	152	68.1 Å²	68.1	66%	0.661	35%	0.35	S	S	*	.	H	α-helix	trans	-63.9	-49.3	178.4	-175.7	179.3	178.8	-178.8	0	111.2	V132 R133 T134 F138 S139 T140	V132-K136 WeakPolarHBondContact O-CB 3.25Å; V132-K136 PolarHBondContact O-N 3.06Å; R133-K136 PolarHBondContact O-N 3.12Å; T134-K136 VanDerWaalsContact C-N 3.33Å; T134-K136 PolarHBondContact O-N 3.18Å; K136-F138 PolarHBondContact O-N 3.1Å; K136-S139 PolarHBondContact O-N 3.16Å; K136-T140 PolarHBondContact O-N 2.86Å; K136-T140 PolarHBondContact O-OG1 3.06Å
137	S	93.6	Very high	88.8	Confident	11 Å²	11	65.7 Å²	65.7	8%	0.077	34%	0.341	C	S	.	.	H	α-helix	trans	-57.9	-46	177.6	-81.3	0	0	0	0	112.5	A73 A76 V77 R133 T134 S139 T140 L141	A73-S137 VanDerWaalsContact O-CB 3.25Å; A73-S137 WeakPolarHBondContact O-CB 3.47Å; A73-S137 PolarHBondContact O-OG 2.84Å; A73-S137 VanDerWaalsContact O-OG 3.1Å; A76-S137 WeakPolarHBondContact CB-OG 3.34Å; V77-S137 VanDerWaalsContact CG1-CB 3.44Å; R133-S137 PolarHBondContact O-N 3.37Å; T134-S137 PolarHBondContact O-N 3.2Å; S137-S139 PolarHBondContact O-N 3.46Å; S137-T140 WeakPolarHBondContact O-CB 3.21Å; S137-T140 PolarHBondContact O-N 3.16Å; S137-L141 PolarHBondContact O-N 2.84Å
138	F	91.8	Very high	90	Very high	11 Å²	11	59.8 Å²	59.8	5%	0.048	31%	0.309	C	S	.	.	H	α-helix	trans	-69	-34	177.5	-69.9	-51.5	0	0	0	113.6	V77 V81 F122 Y125 T134 K136 T140 L141 A142 L191	V77-F138 HydrophobicContact CB-CZ 4.39Å; V77-F138 HydrophobicContact CG2-CE1 3.93Å; V77-F138 HydrophobicContact CG2-CZ 3.92Å; V81-F138 HydrophobicContact CG2-CE2 4.3Å; V81-F138 HydrophobicContact CG2-CZ 3.57Å; F122-F138 HydrophobicContact CD1-CD1 4.25Å; F122-F138 AromaticContact CE1-CD1 3.82Å; F122-F138 HydrophobicContact CE1-CD1 3.82Å; F122-F138 HydrophobicContact CE1-CE1 4.46Å; Y125-F138 AromaticContact CD1-CD2 3.51Å; Y125-F138 HydrophobicContact CD1-CD2 3.51Å; Y125-F138 AromaticContact CD1-CE2 3.65Å; Y125-F138 HydrophobicContact CD1-CE2 3.65Å; Y125-F138 HydrophobicContact CD1-CG 4.29Å; Y125-F138 AromaticContact CE1-CD2 3.15Å; Y125-F138 HydrophobicContact CE1-CD2 3.15Å; Y125-F138 AromaticContact CE1-CE2 3.01Å; Y125-F138 HydrophobicContact CE1-CE2 3.01Å; Y125-F138 HydrophobicContact CE1-CG 4.3Å; Y125-F138 HydrophobicContact CE1-CZ 4.07Å; Y125-F138 HydrophobicContact CE2-CE2 4.23Å; Y125-F138 HydrophobicContact CG-CE2 4.47Å; Y125-F138 AromaticContact CZ-CD2 3.97Å; Y125-F138 AromaticContact CZ-CE2 3.3Å; Y125-F138 WeakPolarHBondContact OH-CE2 3.36Å; T134-F138 HydrophobicContact CG2-CD2 3.7Å; T134-F138 HydrophobicContact CG2-CE2 3.3Å; T134-F138 HydrophobicContact CG2-CZ 4.38Å; T134-F138 WeakPolarHBondContact O-CD2 3.35Å; T134-F138 PolarHBondContact O-N 3.21Å; K136-F138 PolarHBondContact O-N 3.1Å; F138-T140 VanDerWaalsContact C-N 3.32Å; F138-L141 HydrophobicContact CD1-CD1 3.96Å; F138-L141 HydrophobicContact CE1-CD1 4.33Å; F138-L141 PolarHBondContact O-N 3.43Å; F138-A142 VanDerWaalsContact O-CB 3.26Å; F138-A142 WeakPolarHBondContact O-CB 3.48Å; F138-A142 PolarHBondContact O-N 2.8Å; F138-L191 HydrophobicContact CD1-CD2 4.08Å; F138-L191 HydrophobicContact CE1-CB 4.49Å; F138-L191 HydrophobicContact CE1-CD1 4.49Å; F138-L191 HydrophobicContact CE1-CD2 3.64Å; F138-L191 HydrophobicContact CE1-CG 4.43Å; F138-L191 HydrophobicContact CZ-CB 4.45Å; F138-L191 HydrophobicContact CZ-CD1 4.11Å; F138-L191 HydrophobicContact CZ-CD2 4.08Å; F138-L191 HydrophobicContact CZ-CG 4.46Å
139	S	93.3	Very high	91.2	Very high	50 Å²	50	55 Å²	55	35%	0.35	30%	0.295	S	S	.	.	H	α-helix	trans	-63.2	-41.1	172.3	-59.3	0	0	0	0	111.1	L135 K136 S137 A142 N143	L135-S139 WeakPolarHBondContact O-CB 3.49Å; L135-S139 PolarHBondContact O-N 3.25Å; L135-S139 PolarHBondContact O-OG 3.27Å; K136-S139 PolarHBondContact O-N 3.16Å; S137-S139 PolarHBondContact O-N 3.46Å; S139-A142 PolarHBondContact O-N 2.9Å; S139-N143 VanDerWaalsContact O-CB 3.31Å; S139-N143 WeakPolarHBondContact O-CB 3.27Å; S139-N143 PolarHBondContact O-N 3.43Å; S139-N143 PolarHBondContact O-ND2 3.4Å
140	T	95.7	Very high	92.2	Very high	50 Å²	50	57.2 Å²	57.2	31%	0.307	31%	0.311	S	S	.	.	H	α-helix	trans	-60.9	-47.2	173.9	-61.7	0	0	0	0	111.4	A73 K136 S137 F138 N144	A73-T140 HydrophobicContact CB-CG2 3.75Å; K136-T140 PolarHBondContact O-N 2.86Å; K136-T140 PolarHBondContact O-OG1 3.06Å; S137-T140 WeakPolarHBondContact O-CB 3.21Å; S137-T140 PolarHBondContact O-N 3.16Å; F138-T140 VanDerWaalsContact C-N 3.32Å; T140-N144 PolarHBondContact O-N 3.45Å; T140-N144 VanDerWaalsContact O-N 3.16Å; T140-N144 PolarHBondContact O-ND2 3.05Å
141	L	97.2	Very high	93.2	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-60.8	-51	176.6	-73.5	168.8	0	0	0	111.7	L70 A73 F74 F122 S137 F138 N143 N144 F145	L70-L141 HydrophobicContact CB-CD2 4.49Å; L70-L141 HydrophobicContact CD2-CD2 4.14Å; L70-L141 WeakPolarHBondContact O-CD2 3.43Å; A73-L141 HydrophobicContact CB-CD2 4.08Å; A73-L141 HydrophobicContact CB-CG 3.89Å; F74-L141 HydrophobicContact CB-CD1 4.35Å; F74-L141 HydrophobicContact CB-CD2 4.45Å; F74-L141 HydrophobicContact CD2-CD1 4.43Å; F122-L141 HydrophobicContact CE1-CB 4.45Å; F122-L141 HydrophobicContact CZ-CB 3.97Å; S137-L141 PolarHBondContact O-N 2.84Å; F138-L141 HydrophobicContact CD1-CD1 3.96Å; F138-L141 HydrophobicContact CE1-CD1 4.33Å; F138-L141 PolarHBondContact O-N 3.43Å; L141-N143 PolarHBondContact O-N 3.17Å; L141-N144 PolarHBondContact O-N 3.22Å; L141-F145 WeakPolarHBondContact O-CB 3.29Å; L141-F145 WeakPolarHBondContact O-CD1 3.39Å; L141-F145 WeakPolarHBondContact O-CG 3.15Å; L141-F145 PolarHBondContact O-N 3.45Å
142	A	96.8	Very high	93.7	Very high	18 Å²	18	49.2 Å²	49.2	15%	0.149	26%	0.264	C	S	.	.	H	α-helix	trans	-59.4	-44.7	-178.9	0	0	0	0	0	111.9	L118 F122 F138 S139 N144 F145 V146	L118-A142 HydrophobicContact CD2-CB 4.28Å; F122-A142 HydrophobicContact CB-CB 4.41Å; F122-A142 HydrophobicContact CD2-CB 3.81Å; F122-A142 HydrophobicContact CE2-CB 4.25Å; F122-A142 HydrophobicContact CG-CB 4.14Å; F138-A142 VanDerWaalsContact O-CB 3.26Å; F138-A142 WeakPolarHBondContact O-CB 3.48Å; F138-A142 PolarHBondContact O-N 2.8Å; S139-A142 PolarHBondContact O-N 2.9Å; A142-N144 PolarHBondContact O-N 3.5Å; A142-F145 PolarHBondContact O-N 3.42Å; A142-F145 VanDerWaalsContact O-N 3.17Å; A142-V146 WeakPolarHBondContact O-CG2 3.41Å; A142-V146 PolarHBondContact O-N 3.4Å
143	N	97.3	Very high	93.7	Very high	111 Å²	111	51.5 Å²	51.5	59%	0.594	27%	0.267	S	S	*	.	H	α-helix	trans	-64.3	-40.5	178.9	-74.2	-31.9	0	0	0	112.5	S139 L141 V146 L147	S139-N143 VanDerWaalsContact O-CB 3.31Å; S139-N143 WeakPolarHBondContact O-CB 3.27Å; S139-N143 PolarHBondContact O-N 3.43Å; S139-N143 PolarHBondContact O-ND2 3.4Å; L141-N143 PolarHBondContact O-N 3.17Å; N143-V146 PolarHBondContact O-N 2.76Å; N143-L147 PolarHBondContact O-N 3.46Å
144	N	97.8	Very high	93.3	Very high	25 Å²	25	45.2 Å²	45.2	13%	0.134	25%	0.248	C	C	.	.	H	α-helix	trans	-67.2	-38.9	173.7	-76.8	-88.9	0	0	0	111	L70 T140 L141 A142 V146 L147 I148	L70-N144 HydrophobicContact CD2-CB 3.41Å; L70-N144 VanDerWaalsContact CD2-CB 3.41Å; L70-N144 HydrophobicContact CG-CB 4.47Å; T140-N144 PolarHBondContact O-N 3.45Å; T140-N144 VanDerWaalsContact O-N 3.16Å; T140-N144 PolarHBondContact O-ND2 3.05Å; L141-N144 PolarHBondContact O-N 3.22Å; A142-N144 PolarHBondContact O-N 3.5Å; N144-V146 VanDerWaalsContact C-N 3.32Å; N144-V146 PolarHBondContact O-N 2.88Å; N144-L147 WeakPolarHBondContact O-CB 3.4Å; N144-L147 PolarHBondContact O-N 2.92Å; N144-L147 VanDerWaalsContact O-N 3.16Å; N144-I148 WeakPolarHBondContact O-CG1 3.48Å; N144-I148 PolarHBondContact O-N 3.37Å
145	F	98.2	Very high	93	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64.4	-36.9	176.5	-79.9	20.9	0	0	0	112	L70 L114 Y117 L118 F122 L141 A142 I148 A149 L197 L198	L70-F145 HydrophobicContact CD2-CD1 4.2Å; L70-F145 HydrophobicContact CD2-CE1 4.05Å; L114-F145 HydrophobicContact CD2-CB 4.26Å; L114-F145 HydrophobicContact CD2-CD1 3.99Å; L114-F145 HydrophobicContact CD2-CD2 3.33Å; L114-F145 HydrophobicContact CD2-CE1 4.11Å; L114-F145 HydrophobicContact CD2-CE2 3.49Å; L114-F145 VanDerWaalsContact CD2-CE2 3.49Å; L114-F145 HydrophobicContact CD2-CG 3.61Å; L114-F145 HydrophobicContact CD2-CZ 3.88Å; Y117-F145 HydrophobicContact CG-CE2 4.35Å; L118-F145 HydrophobicContact CD1-CB 4.43Å; L118-F145 HydrophobicContact CD2-CB 4Å; L118-F145 HydrophobicContact CG-CB 4.28Å; F122-F145 AromaticContact CE2-CD2 3.58Å; F122-F145 HydrophobicContact CE2-CD2 3.58Å; F122-F145 AromaticContact CE2-CE2 3.96Å; F122-F145 HydrophobicContact CE2-CE2 3.96Å; F122-F145 HydrophobicContact CE2-CG 4.28Å; F122-F145 HydrophobicContact CZ-CD2 4.22Å; F122-F145 HydrophobicContact CZ-CE2 4.16Å; L141-F145 WeakPolarHBondContact O-CB 3.29Å; L141-F145 WeakPolarHBondContact O-CD1 3.39Å; L141-F145 WeakPolarHBondContact O-CG 3.15Å; L141-F145 PolarHBondContact O-N 3.45Å; A142-F145 PolarHBondContact O-N 3.42Å; A142-F145 VanDerWaalsContact O-N 3.17Å; F145-I148 HydrophobicContact CD1-CD1 4.26Å; F145-I148 PolarHBondContact O-N 3.36Å; F145-A149 WeakPolarHBondContact O-CB 3.48Å; F145-A149 PolarHBondContact O-N 3.22Å; F145-L197 HydrophobicContact CE2-CD2 3.86Å; F145-L197 HydrophobicContact CZ-CD2 3.92Å; F145-L198 HydrophobicContact CE1-CD2 4.08Å; F145-L198 HydrophobicContact CZ-CD2 4.29Å
146	V	97.8	Very high	92.4	Very high	77 Å²	77	53.1 Å²	53.1	47%	0.467	29%	0.288	S	S	.	.	H	α-helix	trans	-60.2	-47.8	170.6	169.8	0	0	0	0	110.4	L118 A142 N143 N144 I148 A149 S150	L118-V146 HydrophobicContact CD1-CG2 4.01Å; L118-V146 HydrophobicContact CD2-CG2 3.65Å; L118-V146 HydrophobicContact CG-CG2 4.49Å; A142-V146 WeakPolarHBondContact O-CG2 3.41Å; A142-V146 PolarHBondContact O-N 3.4Å; N143-V146 PolarHBondContact O-N 2.76Å; N144-V146 VanDerWaalsContact C-N 3.32Å; N144-V146 PolarHBondContact O-N 2.88Å; V146-I148 VanDerWaalsContact C-N 3.33Å; V146-I148 PolarHBondContact O-N 2.67Å; V146-A149 PolarHBondContact O-N 2.64Å; V146-S150 WeakPolarHBondContact O-CB 3.48Å; V146-S150 PolarHBondContact O-N 3.02Å; V146-S150 PolarHBondContact O-OG 3.37Å
147	L	97.3	Very high	91.7	Very high	64 Å²	64	52 Å²	52	34%	0.335	29%	0.285	S	S	.	.	H	α-helix	trans	-60.1	-43.7	178.7	178.2	58.5	0	0	0	111.7	V65 N143 N144 S150 Q151	V65-L147 HydrophobicContact CG2-CB 4.46Å; V65-L147 HydrophobicContact CG2-CD2 3.69Å; V65-L147 HydrophobicContact CG2-CG 3.92Å; N143-L147 PolarHBondContact O-N 3.46Å; N144-L147 WeakPolarHBondContact O-CB 3.4Å; N144-L147 PolarHBondContact O-N 2.92Å; N144-L147 VanDerWaalsContact O-N 3.16Å; L147-S150 PolarHBondContact O-N 3.42Å; L147-S150 PolarHBondContact O-OG 2.92Å; L147-Q151 PolarHBondContact O-NE2 3.5Å
148	I	97.7	Very high	90.6	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-63.2	-54.2	176.8	-61.5	163.8	0	0	0	110	V62 V65 L70 L114 N144 F145 V146 S150 Q151 L152 M201	V62-I148 HydrophobicContact CG1-CB 4.17Å; V62-I148 HydrophobicContact CG1-CG1 4.02Å; V62-I148 HydrophobicContact CG1-CG2 4.14Å; V62-I148 HydrophobicContact CG2-CG2 4.23Å; V65-I148 HydrophobicContact CB-CG1 4.34Å; V65-I148 HydrophobicContact CG1-CD1 3.96Å; V65-I148 HydrophobicContact CG1-CG1 4.06Å; V65-I148 HydrophobicContact CG2-CD1 4.46Å; V65-I148 HydrophobicContact CG2-CG1 3.66Å; L70-I148 HydrophobicContact CD1-CD1 4.26Å; L114-I148 HydrophobicContact CD1-CB 3.86Å; L114-I148 HydrophobicContact CD1-CG2 3.37Å; N144-I148 WeakPolarHBondContact O-CG1 3.48Å; N144-I148 PolarHBondContact O-N 3.37Å; F145-I148 HydrophobicContact CD1-CD1 4.26Å; F145-I148 PolarHBondContact O-N 3.36Å; V146-I148 VanDerWaalsContact C-N 3.33Å; V146-I148 PolarHBondContact O-N 2.67Å; I148-S150 PolarHBondContact O-N 2.87Å; I148-Q151 PolarHBondContact O-N 2.78Å; I148-L152 HydrophobicContact CG2-CD1 3.8Å; I148-L152 HydrophobicContact CG2-CG 4.31Å; I148-L152 WeakPolarHBondContact O-CG 3.44Å; I148-L152 PolarHBondContact O-N 3.41Å; I148-M201 HydrophobicContact CD1-CE 3.59Å; I148-M201 HydrophobicContact CG2-CE 4.31Å
149	A	96.8	Very high	89.6	Confident	16 Å²	16	66.7 Å²	66.7	13%	0.132	36%	0.357	C	S	.	.	H	α-helix	trans	-55.2	-38.6	179.5	0	0	0	0	0	112.5	L118 F145 V146 Q151 L152	L118-A149 HydrophobicContact CD1-CB 4.24Å; F145-A149 WeakPolarHBondContact O-CB 3.48Å; F145-A149 PolarHBondContact O-N 3.22Å; V146-A149 PolarHBondContact O-N 2.64Å; A149-Q151 PolarHBondContact O-N 3.2Å; A149-L152 PolarHBondContact O-N 2.89Å
150	S	96.1	Very high	89	Confident	72 Å²	72	66.1 Å²	66.1	50%	0.503	35%	0.35	S	S	.	.	H	α-helix	trans	-66	-23.1	-179.7	74.3	0	0	0	0	114.4	V146 L147 I148	V146-S150 WeakPolarHBondContact O-CB 3.48Å; V146-S150 PolarHBondContact O-N 3.02Å; V146-S150 PolarHBondContact O-OG 3.37Å; L147-S150 PolarHBondContact O-N 3.42Å; L147-S150 PolarHBondContact O-OG 2.92Å; I148-S150 PolarHBondContact O-N 2.87Å
151	Q	95.8	Very high	88.5	Confident	57 Å²	57	68.8 Å²	68.8	27%	0.266	36%	0.357	S	S	.	.	H	α-helix	trans	-99	-12.3	179.6	-68.2	178.6	71.6	0	0	112.9	V62 K63 L147 I148 A149 Q153	V62-Q151 HydrophobicContact CB-CB 4.43Å; V62-Q151 HydrophobicContact CG1-CB 4.29Å; V62-Q151 HydrophobicContact CG2-CB 4.06Å; K63-Q151 PolarHBondContact O-NE2 3.27Å; L147-Q151 PolarHBondContact O-NE2 3.5Å; I148-Q151 PolarHBondContact O-N 2.78Å; A149-Q151 PolarHBondContact O-N 3.2Å; Q151-Q153 VanDerWaalsContact C-N 3.34Å; Q151-Q153 PolarHBondContact O-N 2.87Å
152	L	94	Very high	88	Confident	4 Å²	4	72.7 Å²	72.7	2%	0.021	38%	0.384	C	S	.	.			trans	-80.8	84.1	172.9	-66.1	166.1	0	0	0	108.5	F57 C60 V62 V110 H111 L114 I148 A149 P154	F57-L152 HydrophobicContact CB-CD2 4.3Å; F57-L152 HydrophobicContact CD2-CD2 3.74Å; F57-L152 HydrophobicContact CE2-CD2 4.44Å; F57-L152 HydrophobicContact CG-CD2 4.29Å; C60-L152 HydrophobicContact CB-CD2 3.84Å; V62-L152 HydrophobicContact CG2-CD2 3.96Å; V62-L152 HydrophobicContact CG2-CG 4.17Å; V110-L152 HydrophobicContact CG1-CD1 3.58Å; V110-L152 HydrophobicContact CG1-CD2 3.65Å; V110-L152 HydrophobicContact CG1-CG 4.27Å; V110-L152 HydrophobicContact CG2-CD1 4.42Å; H111-L152 HydrophobicContact CB-CB 4.08Å; H111-L152 HydrophobicContact CB-CD1 4.09Å; H111-L152 PolarHBondContact CD2-O 3.23Å; L114-L152 HydrophobicContact CD1-CD1 3.9Å; I148-L152 HydrophobicContact CG2-CD1 3.8Å; I148-L152 HydrophobicContact CG2-CG 4.31Å; I148-L152 WeakPolarHBondContact O-CG 3.44Å; I148-L152 PolarHBondContact O-N 3.41Å; A149-L152 PolarHBondContact O-N 2.89Å; L152-P154 WeakPolarHBondContact O-CD 3.38Å
153	Q	83.3	Confident	87.8	Confident	161 Å²	161	73.8 Å²	73.8	75%	0.752	39%	0.387	S	S	*	.			trans	-100.2	85.1	172.5	-67.2	-171.1	4.9	0	0	110	Q151	Q151-Q153 VanDerWaalsContact C-N 3.34Å; Q151-Q153 PolarHBondContact O-N 2.87Å
154	P	75.7	Confident	87.5	Confident	32 Å²	32	72.5 Å²	72.5	21%	0.208	37%	0.374	C	S	.	.			trans	-64	140.7	176.2	20.8	-28.6	0	0	0	111.7	Y108 L152	Y108-P154 HydrophobicContact CD1-CB 3.67Å; Y108-P154 HydrophobicContact CD1-CG 4.23Å; Y108-P154 HydrophobicContact CE1-CB 3.22Å; Y108-P154 HydrophobicContact CE1-CG 4.09Å; Y108-P154 HydrophobicContact CE2-CB 4.14Å; Y108-P154 HydrophobicContact CG-CB 4.28Å; Y108-P154 VanDerWaalsContact CZ-CB 3.41Å; L152-P154 WeakPolarHBondContact O-CD 3.38Å
155	S	76.4	Confident	87.3	Confident	35 Å²	35	73.8 Å²	73.8	25%	0.245	38%	0.381	C	S	.	.			trans	-56.2	138.8	173.1	176.2	0	0	0	0	111.3	Y108 E157	Y108-S155 PolarHBondContact OH-N 3.36Å; Y108-S155 PolarHBondContact OH-O 3.1Å; S155-E157 WeakPolarHBondContact OG-CB 3.45Å; S155-E157 VanDerWaalsContact OG-CG 3.29Å; S155-E157 WeakPolarHBondContact OG-CG 3.31Å; S155-E157 PolarHBondContact OG-N 3.28Å; S155-E157 PolarHBondContact OG-OE2 3.34Å
156	Q	76	Confident	87.2	Confident	170 Å²	170	75.5 Å²	75.5	79%	0.794	39%	0.393	S	S	*	.			trans	-97	5	174.9	-62.9	-168.2	19	0	0	113
157	E	78.1	Confident	87.1	Confident	129 Å²	129	71.9 Å²	71.9	60%	0.603	37%	0.371	S	S	*	.			trans	-63	147.4	-176.3	-67.7	165	162.7	0	0	112.5	S155 E159 M160	S155-E157 WeakPolarHBondContact OG-CB 3.45Å; S155-E157 VanDerWaalsContact OG-CG 3.29Å; S155-E157 WeakPolarHBondContact OG-CG 3.31Å; S155-E157 PolarHBondContact OG-N 3.28Å; S155-E157 PolarHBondContact OG-OE2 3.34Å; E157-E159 PolarHBondContact O-N 3.22Å; E157-M160 WeakPolarHBondContact O-CB 3.01Å; E157-M160 PolarHBondContact O-N 2.87Å
158	N	68.9	Low	87.1	Confident	149 Å²	149	72.9 Å²	72.9	80%	0.797	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-60	-31.2	-176.7	-77.4	-18.5	0	0	0	113.2	M160 F161	N158-M160 PolarHBondContact O-N 3.19Å; N158-F161 VanDerWaalsContact O-CB 3.28Å; N158-F161 WeakPolarHBondContact O-CB 3.47Å; N158-F161 PolarHBondContact O-N 2.95Å
159	E	72.3	Confident	87.1	Confident	180 Å²	180	81.2 Å²	81.2	84%	0.841	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-63.3	-22.3	178.3	-61.9	-174.2	175.7	0	0	112.7	E157	E157-E159 PolarHBondContact O-N 3.22Å
160	M	81.1	Confident	87.2	Confident	39 Å²	39	82.5 Å²	82.5	19%	0.192	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-92.9	1.8	-176.9	-156.9	60.4	82.6	0	0	113	Y108 E157 N158 S162 I163 R164	Y108-M160 HydrophobicContact CE2-CG 3.76Å; Y108-M160 HydrophobicContact CE2-SD 4.11Å; Y108-M160 WeakPolarHBondContact OH-CG 3.32Å; E157-M160 WeakPolarHBondContact O-CB 3.01Å; E157-M160 PolarHBondContact O-N 2.87Å; N158-M160 PolarHBondContact O-N 3.19Å; M160-S162 PolarHBondContact O-N 3.29Å; M160-I163 HydrophobicContact CG-CB 4.43Å; M160-I163 PolarHBondContact O-N 3.46Å; M160-I163 HydrophobicContact SD-CB 3.87Å; M160-I163 HydrophobicContact SD-CD1 3.34Å; M160-I163 WeakPolarHBondContact SD-CD1 3.14Å; M160-I163 HydrophobicContact SD-CG1 4.18Å; M160-I163 HydrophobicContact SD-CG2 3.96Å; M160-R164 PolarHBondContact O-N 3.38Å
161	F	83.4	Confident	87.3	Confident	106 Å²	106	79.7 Å²	79.7	47%	0.465	39%	0.385	S	S	.	.	H	α-helix	trans	-58.8	-45.4	-175.6	-170.5	-89.8	0	0	0	112.7	N158 I163 R164 D165	N158-F161 VanDerWaalsContact O-CB 3.28Å; N158-F161 WeakPolarHBondContact O-CB 3.47Å; N158-F161 PolarHBondContact O-N 2.95Å; F161-I163 VanDerWaalsContact C-N 3.34Å; F161-I163 PolarHBondContact O-N 2.96Å; F161-R164 PolarHBondContact O-N 3.45Å; F161-D165 WeakPolarHBondContact CE1-OD2 3.26Å; F161-D165 WeakPolarHBondContact O-CB 3.27Å; F161-D165 PolarHBondContact O-N 2.92Å
162	S	87.9	Confident	87.5	Confident	81 Å²	81	80 Å²	80	57%	0.566	39%	0.388	S	S	*	.	H	α-helix	trans	-64.1	-38.1	-179.4	58.1	0	0	0	0	112.7	M160 S166	M160-S162 PolarHBondContact O-N 3.29Å; S162-S166 WeakPolarHBondContact O-CB 3.49Å; S162-S166 PolarHBondContact O-N 3.07Å
163	I	91.8	Very high	87.7	Confident	42 Å²	42	82.5 Å²	82.5	22%	0.215	40%	0.402	C	S	.	.	H	α-helix	trans	-68.6	-45.8	178.1	-69.8	162.6	0	0	0	110.2	A104 E105 Y108 M160 F161 D165 S166 A167	A104-I163 HydrophobicContact CB-CD1 3.93Å; A104-I163 HydrophobicContact CB-CG2 4.15Å; A104-I163 WeakPolarHBondContact O-CG2 3.47Å; E105-I163 HydrophobicContact CB-CG2 4.48Å; E105-I163 HydrophobicContact CG-CG2 3.95Å; Y108-I163 HydrophobicContact CD2-CG2 3.95Å; Y108-I163 HydrophobicContact CE2-CG2 4.01Å; M160-I163 HydrophobicContact CG-CB 4.43Å; M160-I163 PolarHBondContact O-N 3.46Å; M160-I163 HydrophobicContact SD-CB 3.87Å; M160-I163 HydrophobicContact SD-CD1 3.34Å; M160-I163 WeakPolarHBondContact SD-CD1 3.14Å; M160-I163 HydrophobicContact SD-CG1 4.18Å; M160-I163 HydrophobicContact SD-CG2 3.96Å; F161-I163 VanDerWaalsContact C-N 3.34Å; F161-I163 PolarHBondContact O-N 2.96Å; I163-D165 VanDerWaalsContact C-N 3.34Å; I163-D165 PolarHBondContact O-N 3.32Å; I163-S166 PolarHBondContact O-N 3.36Å; I163-A167 PolarHBondContact O-N 2.87Å
164	R	91.4	Very high	88.4	Confident	84 Å²	84	74.9 Å²	74.9	32%	0.317	37%	0.366	S	S	.	.	H	α-helix	trans	-60.6	-43.2	175.5	-177.7	172.2	64.9	-153.2	0.5	111.8	Y108 M160 F161 A167 H168	Y108-R164 HydrophobicContact CD1-CB 3.91Å; Y108-R164 HydrophobicContact CD1-CG 3.79Å; Y108-R164 HydrophobicContact CE1-CB 3.89Å; Y108-R164 HydrophobicContact CE1-CG 4Å; M160-R164 PolarHBondContact O-N 3.38Å; F161-R164 PolarHBondContact O-N 3.45Å; R164-A167 PolarHBondContact O-N 3.47Å; R164-H168 VanDerWaalsContact O-CB 3.31Å; R164-H168 WeakPolarHBondContact O-CB 3.3Å; R164-H168 PolarHBondContact O-N 3.22Å
165	D	93.6	Very high	89.5	Confident	52 Å²	52	78.2 Å²	78.2	28%	0.278	37%	0.374	S	S	.	.	H	α-helix	trans	-63.5	-41.6	177.1	-86.3	5.9	0	0	0	112.1	F161 I163 H168 R169	F161-D165 WeakPolarHBondContact CE1-OD2 3.26Å; F161-D165 WeakPolarHBondContact O-CB 3.27Å; F161-D165 PolarHBondContact O-N 2.92Å; I163-D165 VanDerWaalsContact C-N 3.34Å; I163-D165 PolarHBondContact O-N 3.32Å; D165-H168 PolarHBondContact O-N 3.04Å; D165-R169 VanDerWaalsContact O-CG 3.27Å; D165-R169 WeakPolarHBondContact O-CG 3.39Å; D165-R169 PolarHBondContact O-N 3.34Å
166	S	95.6	Very high	90.6	Very high	35 Å²	35	83.8 Å²	83.8	25%	0.245	39%	0.39	C	S	.	.	H	α-helix	trans	-60.9	-51	175.6	-175.1	0	0	0	0	111.5	E105 S162 I163 H168 R169 R170	E105-S166 VanDerWaalsContact CD-OG 3.3Å; E105-S166 WeakPolarHBondContact OE1-CB 3.38Å; E105-S166 PolarHBondContact OE1-OG 2.98Å; S162-S166 WeakPolarHBondContact O-CB 3.49Å; S162-S166 PolarHBondContact O-N 3.07Å; I163-S166 PolarHBondContact O-N 3.36Å; S166-H168 VanDerWaalsContact C-N 3.29Å; S166-H168 PolarHBondContact O-N 3.04Å; S166-R169 PolarHBondContact O-N 2.77Å; S166-R170 PolarHBondContact O-N 2.94Å; S166-R170 VanDerWaalsContact O-N 3.13Å
167	A	96.6	Very high	91.6	Very high	1 Å²	1	75.9 Å²	75.9	1%	0.008	35%	0.353	C	S	.	.	H	α-helix	trans	-59.3	-40.2	175.5	0	0	0	0	0	112	Y108 L109 I163 R164 R170 F171	Y108-A167 VanDerWaalsContact CB-CB 3.5Å; Y108-A167 HydrophobicContact CG-CB 4.49Å; L109-A167 HydrophobicContact CB-CB 4.22Å; I163-A167 PolarHBondContact O-N 2.87Å; R164-A167 PolarHBondContact O-N 3.47Å; A167-R170 PolarHBondContact O-N 3.24Å; A167-F171 PolarHBondContact O-N 2.97Å
168	H	96.9	Very high	92.6	Very high	85 Å²	85	70.3 Å²	70.3	39%	0.394	33%	0.327	S	S	.	.	H	α-helix	trans	-64.2	-42.2	176.7	-171.5	66.1	0	0	0	112.2	R164 D165 S166 R170 F171 L172	R164-H168 VanDerWaalsContact O-CB 3.31Å; R164-H168 WeakPolarHBondContact O-CB 3.3Å; R164-H168 PolarHBondContact O-N 3.22Å; D165-H168 PolarHBondContact O-N 3.04Å; S166-H168 VanDerWaalsContact C-N 3.29Å; S166-H168 PolarHBondContact O-N 3.04Å; H168-R170 VanDerWaalsContact C-N 3.33Å; H168-R170 PolarHBondContact O-N 3.37Å; H168-F171 WeakPolarHBondContact O-CB 3.34Å; H168-F171 PolarHBondContact O-N 2.91Å; H168-L172 WeakPolarHBondContact O-CG 3.31Å; H168-L172 PolarHBondContact O-N 3.47Å
169	R	98.3	Very high	93.9	Very high	175 Å²	175	70.1 Å²	70.1	66%	0.66	32%	0.319	S	S	*	.	H	α-helix	trans	-59.8	-42.5	176.1	-73.7	171	-172.6	-171.5	3.9	111.7	D165 S166 L172 L173	D165-R169 VanDerWaalsContact O-CG 3.27Å; D165-R169 WeakPolarHBondContact O-CG 3.39Å; D165-R169 PolarHBondContact O-N 3.34Å; S166-R169 PolarHBondContact O-N 2.77Å; R169-L172 WeakPolarHBondContact O-CB 3.45Å; R169-L172 PolarHBondContact O-N 3.12Å; R169-L173 PolarHBondContact O-N 3.06Å
170	R	98.4	Very high	95.1	Very high	43 Å²	43	68 Å²	68	16%	0.162	31%	0.31	C	S	.	.	H	α-helix	trans	-61.4	-45.7	173.9	-67.1	174.7	179.9	-93	12.5	111.5	E96 Q99 N100 E105 L109 S166 A167 H168 L172 L173 F174	E96-R170 PolarHBondContact O-NH1 3.32Å; E96-R170 VanDerWaalsContact O-NH1 3.15Å; Q99-R170 PolarHBondContact O-NH1 2.03Å; N100-R170 PolarHBondContact O-NH2 2.96Å; E105-R170 IonicContact OE2-CZ 3.85Å; E105-R170 IonicContact OE2-NE 3.48Å; E105-R170 PolarHBondContact OE2-NE 3.05Å; E105-R170 IonicContact OE2-NH2 3.74Å; E105-R170 PolarHBondContact OE2-NH2 3.37Å; L109-R170 HydrophobicContact CD1-CB 4.14Å; S166-R170 PolarHBondContact O-N 2.94Å; S166-R170 VanDerWaalsContact O-N 3.13Å; A167-R170 PolarHBondContact O-N 3.24Å; H168-R170 VanDerWaalsContact C-N 3.33Å; H168-R170 PolarHBondContact O-N 3.37Å; R170-L172 VanDerWaalsContact C-N 3.28Å; R170-L172 PolarHBondContact O-N 2.91Å; R170-L173 WeakPolarHBondContact O-CB 3.47Å; R170-L173 PolarHBondContact O-N 3.4Å; R170-L173 VanDerWaalsContact O-N 3.1Å; R170-F174 PolarHBondContact O-N 3.43Å
171	F	98.6	Very high	95.9	Very high	14 Å²	14	67.4 Å²	67.4	6%	0.061	31%	0.307	C	S	.	.	H	α-helix	trans	-59.5	-37.2	174.6	171.9	-104.4	0	0	0	112.7	L109 T112 L113 F116 A167 H168 L173 F174 R175	L109-F171 HydrophobicContact CD1-CB 4.26Å; T112-F171 HydrophobicContact CG2-CB 4.17Å; T112-F171 HydrophobicContact CG2-CD1 3.57Å; T112-F171 HydrophobicContact CG2-CD2 3.63Å; T112-F171 HydrophobicContact CG2-CE1 3.76Å; T112-F171 HydrophobicContact CG2-CE2 3.82Å; T112-F171 HydrophobicContact CG2-CG 3.49Å; T112-F171 VanDerWaalsContact CG2-CG 3.49Å; T112-F171 HydrophobicContact CG2-CZ 3.88Å; L113-F171 HydrophobicContact CD2-CD2 4.1Å; F116-F171 HydrophobicContact CB-CE2 3.88Å; F116-F171 HydrophobicContact CB-CZ 4.15Å; F116-F171 HydrophobicContact CD2-CE2 4.3Å; F116-F171 AromaticContact CD2-CZ 3.99Å; F116-F171 HydrophobicContact CD2-CZ 3.99Å; F116-F171 HydrophobicContact CG-CE2 4.2Å; F116-F171 HydrophobicContact CG-CZ 4.33Å; A167-F171 PolarHBondContact O-N 2.97Å; H168-F171 WeakPolarHBondContact O-CB 3.34Å; H168-F171 PolarHBondContact O-N 2.91Å; F171-L173 VanDerWaalsContact C-N 3.26Å; F171-L173 PolarHBondContact O-N 3.05Å; F171-F174 HydrophobicContact CD2-CD1 4.08Å; F171-F174 AromaticContact CE2-CD1 3.9Å; F171-F174 HydrophobicContact CE2-CD1 3.9Å; F171-F174 HydrophobicContact CE2-CE1 4.22Å; F171-F174 WeakPolarHBondContact O-CB 3.26Å; F171-F174 PolarHBondContact O-N 3.29Å; F171-R175 HydrophobicContact CE1-CB 4.34Å; F171-R175 HydrophobicContact CZ-CB 4.39Å; F171-R175 WeakPolarHBondContact O-CB 3.47Å; F171-R175 PolarHBondContact O-N 3.25Å
172	L	98.6	Very high	96.5	Very high	62 Å²	62	67.4 Å²	67.4	33%	0.325	31%	0.312	S	S	.	.	H	α-helix	trans	-64.8	-28.5	176.7	-71.2	178.3	0	0	0	113	H168 R169 R170 R176	H168-L172 WeakPolarHBondContact O-CG 3.31Å; H168-L172 PolarHBondContact O-N 3.47Å; R169-L172 WeakPolarHBondContact O-CB 3.45Å; R169-L172 PolarHBondContact O-N 3.12Å; R170-L172 VanDerWaalsContact C-N 3.28Å; R170-L172 PolarHBondContact O-N 2.91Å; L172-R176 VanDerWaalsContact O-CB 3.23Å; L172-R176 WeakPolarHBondContact O-CB 3.21Å; L172-R176 PolarHBondContact O-N 3.38Å
173	L	98.6	Very high	96.8	Very high	58 Å²	58	67.4 Å²	67.4	30%	0.304	31%	0.305	S	S	.	.	H	α-helix	trans	-65.1	-50.7	172.4	-61.3	175.9	0	0	0	110.7	E96 V97 R169 R170 F171 R175 R176 A177	E96-L173 HydrophobicContact CB-CD1 3.8Å; V97-L173 HydrophobicContact CG2-CB 4.05Å; R169-L173 PolarHBondContact O-N 3.06Å; R170-L173 WeakPolarHBondContact O-CB 3.47Å; R170-L173 PolarHBondContact O-N 3.4Å; R170-L173 VanDerWaalsContact O-N 3.1Å; F171-L173 VanDerWaalsContact C-N 3.26Å; F171-L173 PolarHBondContact O-N 3.05Å; L173-R175 VanDerWaalsContact C-N 3.34Å; L173-R175 PolarHBondContact O-N 2.94Å; L173-R176 PolarHBondContact O-N 3.13Å; L173-A177 PolarHBondContact O-N 2.82Å
174	F	98.8	Very high	96.8	Very high	0 Å²	0	70.4 Å²	70.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-55	-49.4	173.3	164	-94.8	0	0	0	111.4	L92 L93 V97 L113 F116 Y117 R170 F171 R176 A177 F178	L92-F174 HydrophobicContact CB-CD2 3.78Å; L92-F174 HydrophobicContact CB-CE2 3.7Å; L92-F174 HydrophobicContact CD1-CE2 4.35Å; L93-F174 HydrophobicContact CD2-CD2 3.69Å; L93-F174 HydrophobicContact CD2-CE2 4.02Å; L93-F174 HydrophobicContact CD2-CG 4.5Å; L93-F174 HydrophobicContact CG-CD2 4.11Å; L93-F174 HydrophobicContact CG-CE2 4.19Å; V97-F174 HydrophobicContact CG1-CB 4.12Å; V97-F174 HydrophobicContact CG2-CB 4.04Å; L113-F174 HydrophobicContact CD2-CD1 3.93Å; L113-F174 HydrophobicContact CD2-CD2 4.36Å; L113-F174 HydrophobicContact CD2-CE1 4.24Å; L113-F174 HydrophobicContact CD2-CG 4Å; F116-F174 AromaticContact CD1-CE1 3.42Å; F116-F174 HydrophobicContact CD1-CE1 3.42Å; F116-F174 VanDerWaalsContact CD1-CE1 3.42Å; F116-F174 AromaticContact CD1-CZ 3.73Å; F116-F174 HydrophobicContact CD1-CZ 3.73Å; F116-F174 HydrophobicContact CD2-CE1 4.47Å; F116-F174 AromaticContact CE1-CE1 3.53Å; F116-F174 HydrophobicContact CE1-CE1 3.53Å; F116-F174 AromaticContact CE1-CZ 3.67Å; F116-F174 HydrophobicContact CE1-CZ 3.67Å; F116-F174 AromaticContact CG-CE1 3.92Å; F116-F174 HydrophobicContact CG-CE1 3.92Å; F116-F174 HydrophobicContact CZ-CE1 4.12Å; Y117-F174 HydrophobicContact CE2-CZ 4.22Å; R170-F174 PolarHBondContact O-N 3.43Å; F171-F174 HydrophobicContact CD2-CD1 4.08Å; F171-F174 AromaticContact CE2-CD1 3.9Å; F171-F174 HydrophobicContact CE2-CD1 3.9Å; F171-F174 HydrophobicContact CE2-CE1 4.22Å; F171-F174 WeakPolarHBondContact O-CB 3.26Å; F171-F174 PolarHBondContact O-N 3.29Å; F174-R176 VanDerWaalsContact C-N 3.32Å; F174-R176 PolarHBondContact O-N 3.33Å; F174-A177 PolarHBondContact O-N 3.45Å; F174-F178 PolarHBondContact O-N 2.99Å
175	R	98.5	Very high	97	Very high	103 Å²	103	67.7 Å²	67.7	39%	0.389	31%	0.313	S	S	.	.	H	α-helix	trans	-64.1	-35.6	-179.1	-172.2	179.6	-179.7	-162.7	1.2	112.4	F171 L173 K179	F171-R175 HydrophobicContact CE1-CB 4.34Å; F171-R175 HydrophobicContact CZ-CB 4.39Å; F171-R175 WeakPolarHBondContact O-CB 3.47Å; F171-R175 PolarHBondContact O-N 3.25Å; L173-R175 VanDerWaalsContact C-N 3.34Å; L173-R175 PolarHBondContact O-N 2.94Å; R175-K179 WeakPolarHBondContact O-CG 3.47Å; R175-K179 PolarHBondContact O-N 3.5Å; R175-K179 VanDerWaalsContact O-N 3.07Å
176	R	98.4	Very high	97.2	Very high	152 Å²	152	65.2 Å²	65.2	57%	0.574	30%	0.3	S	S	*	.	H	α-helix	trans	-65.6	-48.5	175.7	-178.4	-174.7	-68.5	141.9	-2.5	110.4	L172 L173 F174 F178 K179 Q180	L172-R176 VanDerWaalsContact O-CB 3.23Å; L172-R176 WeakPolarHBondContact O-CB 3.21Å; L172-R176 PolarHBondContact O-N 3.38Å; L173-R176 PolarHBondContact O-N 3.13Å; F174-R176 VanDerWaalsContact C-N 3.32Å; F174-R176 PolarHBondContact O-N 3.33Å; R176-F178 VanDerWaalsContact C-N 3.29Å; R176-F178 PolarHBondContact O-N 3.5Å; R176-K179 PolarHBondContact O-N 2.93Å; R176-Q180 WeakPolarHBondContact O-CG 3.47Å; R176-Q180 PolarHBondContact O-N 3.23Å
177	A	98.3	Very high	97.2	Very high	3 Å²	3	63.7 Å²	63.7	3%	0.025	29%	0.289	C	S	.	.	H	α-helix	trans	-59.1	-42	176.5	0	0	0	0	0	111.4	L92 L173 F174 K179 Q180	L92-A177 HydrophobicContact CD2-CB 3.91Å; L173-A177 PolarHBondContact O-N 2.82Å; F174-A177 PolarHBondContact O-N 3.45Å; A177-K179 VanDerWaalsContact C-N 3.34Å; A177-K179 PolarHBondContact O-N 3.06Å; A177-Q180 PolarHBondContact O-N 2.83Å
178	F	98.4	Very high	97.1	Very high	13 Å²	13	64.8 Å²	64.8	6%	0.057	30%	0.296	C	S	.	.	H	α-helix	trans	-58.9	-44.8	176	-175.2	-80.6	0	0	0	111.9	L92 F116 T120 V121 F174 R176 Q180 L181 I183 A186 L187 A190	L92-F178 HydrophobicContact CD1-CD2 3.97Å; L92-F178 HydrophobicContact CD2-CB 4.25Å; F116-F178 AromaticContact CE1-CD2 3.8Å; F116-F178 HydrophobicContact CE1-CD2 3.8Å; F116-F178 AromaticContact CE1-CE2 3.81Å; F116-F178 HydrophobicContact CE1-CE2 3.81Å; F116-F178 HydrophobicContact CE1-CG 4.25Å; F116-F178 HydrophobicContact CE1-CZ 4.27Å; F116-F178 AromaticContact CZ-CD1 3.82Å; F116-F178 HydrophobicContact CZ-CD1 3.82Å; F116-F178 AromaticContact CZ-CD2 3.75Å; F116-F178 HydrophobicContact CZ-CD2 3.75Å; F116-F178 AromaticContact CZ-CE1 3.9Å; F116-F178 HydrophobicContact CZ-CE1 3.9Å; F116-F178 AromaticContact CZ-CE2 3.83Å; F116-F178 HydrophobicContact CZ-CE2 3.83Å; F116-F178 AromaticContact CZ-CG 3.76Å; F116-F178 HydrophobicContact CZ-CG 3.76Å; F116-F178 AromaticContact CZ-CZ 3.91Å; F116-F178 HydrophobicContact CZ-CZ 3.91Å; T120-F178 HydrophobicContact CG2-CE1 4.49Å; T120-F178 HydrophobicContact CG2-CZ 4.23Å; V121-F178 HydrophobicContact CG2-CE2 4.47Å; F174-F178 PolarHBondContact O-N 2.99Å; R176-F178 VanDerWaalsContact C-N 3.29Å; R176-F178 PolarHBondContact O-N 3.5Å; F178-Q180 VanDerWaalsContact C-N 3.27Å; F178-Q180 PolarHBondContact O-N 3.27Å; F178-L181 PolarHBondContact O-N 2.94Å; F178-I183 HydrophobicContact CE1-CD1 4.08Å; F178-I183 HydrophobicContact CZ-CD1 4.28Å; F178-A186 HydrophobicContact CD1-CB 3.98Å; F178-A186 HydrophobicContact CD2-CB 3.92Å; F178-A186 HydrophobicContact CE1-CB 3.71Å; F178-A186 HydrophobicContact CE2-CB 3.65Å; F178-A186 WeakPolarHBondContact CE2-O 3.41Å; F178-A186 HydrophobicContact CG-CB 4.08Å; F178-A186 HydrophobicContact CZ-CB 3.53Å; F178-A186 WeakPolarHBondContact O-CB 3.26Å; F178-L187 HydrophobicContact CZ-CD2 4.16Å; F178-L187 HydrophobicContact CZ-CG 4.47Å; F178-A190 HydrophobicContact CD2-CB 4.31Å; F178-A190 HydrophobicContact CE2-CB 4.02Å
179	K	97.7	Very high	97.2	Very high	144 Å²	144	60.9 Å²	60.9	63%	0.626	28%	0.278	S	S	*	.	H	α-helix	trans	-72.4	-14	-179.3	-76.6	-175.7	172.4	-167.8	0	114.8	R175 R176 A177 L181	R175-K179 WeakPolarHBondContact O-CG 3.47Å; R175-K179 PolarHBondContact O-N 3.5Å; R175-K179 VanDerWaalsContact O-N 3.07Å; R176-K179 PolarHBondContact O-N 2.93Å; A177-K179 VanDerWaalsContact C-N 3.34Å; A177-K179 PolarHBondContact O-N 3.06Å; K179-L181 VanDerWaalsContact C-N 3.27Å
180	Q	96.9	Very high	97.2	Very high	137 Å²	137	52.6 Å²	52.6	64%	0.64	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78	-17.1	176.2	-74.8	172	-7.8	0	0	112.5	R176 A177 F178	R176-Q180 WeakPolarHBondContact O-CG 3.47Å; R176-Q180 PolarHBondContact O-N 3.23Å; A177-Q180 PolarHBondContact O-N 2.83Å; F178-Q180 VanDerWaalsContact C-N 3.27Å; F178-Q180 PolarHBondContact O-N 3.27Å
181	L	97.6	Very high	97.1	Very high	25 Å²	25	50.5 Å²	50.5	13%	0.131	24%	0.239	C	C	.	.	S	Bend	trans	-94.8	154.2	177.4	-57.4	-178.2	0	0	0	110.1	I87 V90 L92 F178 K179 A185 A186 K189	I87-L181 HydrophobicContact CD1-CD2 3.86Å; I87-L181 HydrophobicContact CG2-CD2 4.18Å; V90-L181 HydrophobicContact CB-CD2 4.26Å; V90-L181 HydrophobicContact CG1-CD1 4.2Å; V90-L181 HydrophobicContact CG1-CD2 4.25Å; V90-L181 HydrophobicContact CG1-CG 4.39Å; V90-L181 HydrophobicContact CG2-CD2 4.11Å; L92-L181 HydrophobicContact CD2-CD1 4.2Å; F178-L181 PolarHBondContact O-N 2.94Å; K179-L181 VanDerWaalsContact C-N 3.27Å; L181-A185 HydrophobicContact CB-CB 4.48Å; L181-A186 HydrophobicContact CB-CB 3.94Å; L181-K189 HydrophobicContact CD1-CB 4.35Å; L181-K189 HydrophobicContact CD1-CD 3.59Å
182	D	95.9	Very high	97	Very high	106 Å²	106	50 Å²	50	57%	0.567	24%	0.237	S	C	*	.			trans	-57	147.4	163.4	176.7	70.7	0	0	0	109.9	E184 A185 A186	D182-E184 PolarHBondContact O-N 3.02Å; D182-E184 VanDerWaalsContact O-N 3.14Å; D182-E184 WeakPolarHBondContact OD2-CG 3.47Å; D182-E184 PolarHBondContact OD2-N 3.41Å; D182-A185 PolarHBondContact O-N 3.17Å; D182-A185 VanDerWaalsContact O-N 3.15Å; D182-A186 WeakPolarHBondContact O-CB 3.31Å; D182-A186 PolarHBondContact O-N 3.19Å
183	I	93.7	Very high	97	Very high	82 Å²	82	47.7 Å²	47.7	42%	0.421	23%	0.225	S	C	.	.	H	α-helix	trans	-55.7	-36.9	-172.8	-172.2	58.4	0	0	0	112.5	F178 L187	F178-I183 HydrophobicContact CE1-CD1 4.08Å; F178-I183 HydrophobicContact CZ-CD1 4.28Å; I183-L187 HydrophobicContact CD1-CD1 4.42Å; I183-L187 HydrophobicContact CD1-CG 4.31Å; I183-L187 HydrophobicContact CG1-CD1 4.18Å; I183-L187 WeakPolarHBondContact O-CG 3.36Å; I183-L187 PolarHBondContact O-N 3.41Å; I183-L187 VanDerWaalsContact O-N 3.07Å
184	E	92.8	Very high	97	Very high	104 Å²	104	45 Å²	45	49%	0.486	21%	0.21	S	C	.	.	H	α-helix	trans	-69.8	-47.5	-178.9	-46.4	-146.1	127.5	0	0	110.9	R128 D182 A186 L187 T188	R128-E184 IonicContact CZ-OE1 3.14Å; R128-E184 IonicContact NH1-OE1 3.85Å; R128-E184 PolarHBondContact NH1-OE1 3.3Å; R128-E184 IonicContact NH2-OE1 2.81Å; R128-E184 PolarHBondContact NH2-OE1 3.26Å; D182-E184 PolarHBondContact O-N 3.02Å; D182-E184 VanDerWaalsContact O-N 3.14Å; D182-E184 WeakPolarHBondContact OD2-CG 3.47Å; D182-E184 PolarHBondContact OD2-N 3.41Å; E184-A186 VanDerWaalsContact C-N 3.3Å; E184-A186 PolarHBondContact O-N 3.08Å; E184-L187 PolarHBondContact O-N 3.07Å; E184-T188 PolarHBondContact O-N 3.35Å; E184-T188 PolarHBondContact O-OG1 3.21Å
185	A	95.4	Very high	96.9	Very high	27 Å²	27	46 Å²	46	22%	0.223	22%	0.216	C	C	.	.	H	α-helix	trans	-63.6	-37.7	177	0	0	0	0	0	111.8	I87 L181 D182 K189	I87-A185 HydrophobicContact CD1-CB 3.67Å; L181-A185 HydrophobicContact CB-CB 4.48Å; D182-A185 PolarHBondContact O-N 3.17Å; D182-A185 VanDerWaalsContact O-N 3.15Å; A185-K189 WeakPolarHBondContact O-CB 3.47Å; A185-K189 PolarHBondContact O-N 2.88Å
186	A	97.1	Very high	96.9	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.2	-43.9	177.5	0	0	0	0	0	111.9	F178 L181 D182 E184 A190	F178-A186 HydrophobicContact CD1-CB 3.98Å; F178-A186 HydrophobicContact CD2-CB 3.92Å; F178-A186 HydrophobicContact CE1-CB 3.71Å; F178-A186 HydrophobicContact CE2-CB 3.65Å; F178-A186 WeakPolarHBondContact CE2-O 3.41Å; F178-A186 HydrophobicContact CG-CB 4.08Å; F178-A186 HydrophobicContact CZ-CB 3.53Å; F178-A186 WeakPolarHBondContact O-CB 3.26Å; L181-A186 HydrophobicContact CB-CB 3.94Å; D182-A186 WeakPolarHBondContact O-CB 3.31Å; D182-A186 PolarHBondContact O-N 3.19Å; E184-A186 VanDerWaalsContact C-N 3.3Å; E184-A186 PolarHBondContact O-N 3.08Å; A186-A190 VanDerWaalsContact O-CB 3.32Å; A186-A190 WeakPolarHBondContact O-CB 3.23Å; A186-A190 PolarHBondContact O-N 3.01Å
187	L	96.1	Very high	97	Very high	3 Å²	3	35.5 Å²	35.5	2%	0.016	18%	0.179	C	C	.	.	H	α-helix	trans	-65.2	-49	177.5	-69.7	169.5	0	0	0	111.4	N124 F178 I183 E184 K189 A190 L191	N124-L187 HydrophobicContact CB-CD1 3.62Å; N124-L187 HydrophobicContact CB-CD2 3.95Å; N124-L187 HydrophobicContact CB-CG 4.47Å; F178-L187 HydrophobicContact CZ-CD2 4.16Å; F178-L187 HydrophobicContact CZ-CG 4.47Å; I183-L187 HydrophobicContact CD1-CD1 4.42Å; I183-L187 HydrophobicContact CD1-CG 4.31Å; I183-L187 HydrophobicContact CG1-CD1 4.18Å; I183-L187 WeakPolarHBondContact O-CG 3.36Å; I183-L187 PolarHBondContact O-N 3.41Å; I183-L187 VanDerWaalsContact O-N 3.07Å; E184-L187 PolarHBondContact O-N 3.07Å; L187-K189 VanDerWaalsContact C-N 3.34Å; L187-K189 PolarHBondContact O-N 3.47Å; L187-A190 PolarHBondContact O-N 3.35Å; L187-L191 WeakPolarHBondContact O-CG 3.34Å; L187-L191 PolarHBondContact O-N 3.43Å
188	T	94.9	Very high	97	Very high	25 Å²	25	35.6 Å²	35.6	15%	0.153	18%	0.178	C	C	.	.	H	α-helix	trans	-60.2	-45.2	177.8	-61	0	0	0	0	111.2	Q84 D85 E184 L191 G192	Q84-T188 HydrophobicContact CB-CG2 3.64Å; D85-T188 HydrophobicContact CB-CG2 4.28Å; E184-T188 PolarHBondContact O-N 3.35Å; E184-T188 PolarHBondContact O-OG1 3.21Å; T188-L191 PolarHBondContact O-N 3.4Å; T188-G192 PolarHBondContact O-N 3.16Å
189	K	97.9	Very high	97	Very high	3 Å²	3	38.5 Å²	38.5	1%	0.013	20%	0.197	C	C	.	.	H	α-helix	trans	-62.1	-46.9	176.8	-179.5	172.1	-63	-49.9	0	112.3	D85 I87 V90 L92 L181 A185 L187 L191 G192 E193	D85-K189 IonicContact OD1-NZ 3.18Å; D85-K189 PolarHBondContact OD1-NZ 3.05Å; D85-K189 IonicContact OD2-NZ 2.81Å; D85-K189 PolarHBondContact OD2-NZ 3.33Å; I87-K189 WeakPolarHBondContact O-CE 3.36Å; I87-K189 PolarHBondContact O-NZ 3.07Å; V90-K189 HydrophobicContact CG1-CD 4.41Å; V90-K189 WeakPolarHBondContact O-CD 3.37Å; V90-K189 WeakPolarHBondContact O-CE 3.17Å; V90-K189 PolarHBondContact O-NZ 3.43Å; L92-K189 HydrophobicContact CD1-CB 4.12Å; L92-K189 HydrophobicContact CD1-CD 4.05Å; L92-K189 HydrophobicContact CD1-CG 3.75Å; L92-K189 HydrophobicContact CD2-CD 3.93Å; L92-K189 HydrophobicContact CG-CD 3.58Å; L92-K189 HydrophobicContact CG-CG 3.77Å; L181-K189 HydrophobicContact CD1-CB 4.35Å; L181-K189 HydrophobicContact CD1-CD 3.59Å; A185-K189 WeakPolarHBondContact O-CB 3.47Å; A185-K189 PolarHBondContact O-N 2.88Å; L187-K189 VanDerWaalsContact C-N 3.34Å; L187-K189 PolarHBondContact O-N 3.47Å; K189-L191 VanDerWaalsContact C-N 3.29Å; K189-L191 PolarHBondContact O-N 2.9Å; K189-G192 PolarHBondContact O-N 3.37Å; K189-G192 VanDerWaalsContact O-N 3.07Å; K189-E193 HydrophobicContact CG-CG 4.38Å; K189-E193 WeakPolarHBondContact O-CG 3.41Å; K189-E193 PolarHBondContact O-N 2.87Å
190	A	97.9	Very high	97	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-59.6	-41.5	178.8	0	0	0	0	0	111.8	L92 Y117 V121 F178 A186 L187 E193	L92-A190 HydrophobicContact CD1-CB 3.8Å; Y117-A190 HydrophobicContact CE1-CB 4.34Å; Y117-A190 WeakPolarHBondContact CE1-O 3.32Å; Y117-A190 PolarHBondContact OH-O 2.87Å; V121-A190 HydrophobicContact CG1-CB 4.05Å; V121-A190 HydrophobicContact CG2-CB 3.81Å; F178-A190 HydrophobicContact CD2-CB 4.31Å; F178-A190 HydrophobicContact CE2-CB 4.02Å; A186-A190 VanDerWaalsContact O-CB 3.32Å; A186-A190 WeakPolarHBondContact O-CB 3.23Å; A186-A190 PolarHBondContact O-N 3.01Å; L187-A190 PolarHBondContact O-N 3.35Å; A190-E193 PolarHBondContact O-N 3.41Å
191	L	96.6	Very high	97.1	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.7	-41	173.5	-68.4	169.4	0	0	0	112.1	F74 V81 V121 F122 Y125 F138 L187 T188 K189 E193 V194	F74-L191 VanDerWaalsContact CE2-O 3.3Å; F74-L191 WeakPolarHBondContact CE2-O 3.42Å; V81-L191 HydrophobicContact CG1-CB 3.54Å; V121-L191 HydrophobicContact CG1-CD1 4.4Å; V121-L191 HydrophobicContact CG1-CD2 3.49Å; V121-L191 VanDerWaalsContact CG1-CD2 3.49Å; V121-L191 HydrophobicContact CG1-CG 3.54Å; F122-L191 HydrophobicContact CD1-CD2 3.77Å; F122-L191 HydrophobicContact CE1-CD2 3.54Å; Y125-L191 HydrophobicContact CD1-CD1 4.24Å; Y125-L191 HydrophobicContact CD2-CD1 3.06Å; Y125-L191 HydrophobicContact CE2-CD1 3.52Å; Y125-L191 HydrophobicContact CG-CD1 3.44Å; Y125-L191 VanDerWaalsContact CG-CD1 3.44Å; F138-L191 HydrophobicContact CD1-CD2 4.08Å; F138-L191 HydrophobicContact CE1-CB 4.49Å; F138-L191 HydrophobicContact CE1-CD1 4.49Å; F138-L191 HydrophobicContact CE1-CD2 3.64Å; F138-L191 HydrophobicContact CE1-CG 4.43Å; F138-L191 HydrophobicContact CZ-CB 4.45Å; F138-L191 HydrophobicContact CZ-CD1 4.11Å; F138-L191 HydrophobicContact CZ-CD2 4.08Å; F138-L191 HydrophobicContact CZ-CG 4.46Å; L187-L191 WeakPolarHBondContact O-CG 3.34Å; L187-L191 PolarHBondContact O-N 3.43Å; T188-L191 PolarHBondContact O-N 3.4Å; K189-L191 VanDerWaalsContact C-N 3.29Å; K189-L191 PolarHBondContact O-N 2.9Å; L191-E193 PolarHBondContact O-N 2.79Å; L191-V194 WeakPolarHBondContact O-CB 3.23Å; L191-V194 VanDerWaalsContact O-CG2 3.3Å; L191-V194 WeakPolarHBondContact O-CG2 3.28Å; L191-V194 PolarHBondContact O-N 3.38Å
192	G	96.4	Very high	97.1	Very high	3 Å²	3	28.1 Å²	28.1	3%	0.031	15%	0.15	C	C	.	.	H	α-helix	trans	-63.9	-26.7	178.6	0	0	0	0	0	113.4	V81 Q82 T188 K189	V81-G192 VanDerWaalsContact CG1-N 3.3Å; Q82-G192 PolarHBondContact NE2-O 3.4Å; T188-G192 PolarHBondContact O-N 3.16Å; K189-G192 PolarHBondContact O-N 3.37Å; K189-G192 VanDerWaalsContact O-N 3.07Å
193	E	98.5	Very high	97.1	Very high	14 Å²	14	29 Å²	29	7%	0.065	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	10.2	179.4	-69.5	-170.7	-161.3	0	0	114.1	R91 L92 L93 K189 A190 L191 D195 I196 L197	R91-E193 VanDerWaalsContact CA-OE1 3.29Å; R91-E193 WeakPolarHBondContact CA-OE1 3.42Å; L92-E193 WeakPolarHBondContact CA-OE2 3.19Å; L92-E193 WeakPolarHBondContact CB-OE2 3.26Å; L92-E193 PolarHBondContact N-OE1 3.45Å; L92-E193 PolarHBondContact N-OE2 2.81Å; L93-E193 HydrophobicContact CD1-CB 4.27Å; L93-E193 WeakPolarHBondContact CD1-O 3.4Å; L93-E193 PolarHBondContact N-OE2 2.67Å; K189-E193 HydrophobicContact CG-CG 4.38Å; K189-E193 WeakPolarHBondContact O-CG 3.41Å; K189-E193 PolarHBondContact O-N 2.87Å; A190-E193 PolarHBondContact O-N 3.41Å; L191-E193 PolarHBondContact O-N 2.79Å; E193-D195 PolarHBondContact O-N 2.69Å; E193-I196 HydrophobicContact CB-CD1 3.92Å; E193-I196 HydrophobicContact CG-CD1 3.77Å; E193-I196 WeakPolarHBondContact O-CB 3.14Å; E193-I196 PolarHBondContact O-N 3.06Å; E193-L197 PolarHBondContact O-N 3.04Å
194	V	98.5	Very high	97.3	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61.4	-31.2	176.5	168.2	0	0	0	0	111.8	F74 Y117 L191 I196 L197 L198	F74-V194 HydrophobicContact CB-CG1 4.49Å; F74-V194 HydrophobicContact CD2-CB 3.71Å; F74-V194 HydrophobicContact CD2-CG1 3.75Å; F74-V194 HydrophobicContact CE2-CB 3.65Å; F74-V194 HydrophobicContact CE2-CG1 4.22Å; F74-V194 HydrophobicContact CG-CB 4.4Å; F74-V194 HydrophobicContact CG-CG1 4.1Å; F74-V194 HydrophobicContact CZ-CB 4.27Å; Y117-V194 HydrophobicContact CD1-CG2 4.34Å; Y117-V194 HydrophobicContact CE1-CG2 3.69Å; L191-V194 WeakPolarHBondContact O-CB 3.23Å; L191-V194 VanDerWaalsContact O-CG2 3.3Å; L191-V194 WeakPolarHBondContact O-CG2 3.28Å; L191-V194 PolarHBondContact O-N 3.38Å; V194-I196 VanDerWaalsContact C-N 3.28Å; V194-I196 PolarHBondContact O-N 2.73Å; V194-L197 PolarHBondContact O-N 3.08Å; V194-L198 HydrophobicContact CG1-CD1 3.97Å; V194-L198 HydrophobicContact CG1-CG 3.93Å; V194-L198 VanDerWaalsContact O-CG 3.31Å; V194-L198 WeakPolarHBondContact O-CG 3.42Å; V194-L198 PolarHBondContact O-N 3.3Å
195	D	98.3	Very high	97.4	Very high	22 Å²	22	22.5 Å²	22.5	12%	0.118	12%	0.117	C	C	.	.	H	α-helix	trans	-60	-37.1	172.3	47.1	6.9	0	0	0	113	W71 F74 K78 Q82 E193 L198 T199	W71-D195 HydrophobicContact CH2-CB 3.86Å; W71-D195 WeakPolarHBondContact CH2-O 3.33Å; W71-D195 HydrophobicContact CZ3-CB 3.71Å; F74-D195 HydrophobicContact CD1-CB 3.98Å; F74-D195 HydrophobicContact CE1-CB 3.42Å; F74-D195 VanDerWaalsContact CE1-CB 3.42Å; F74-D195 HydrophobicContact CZ-CB 4.19Å; K78-D195 IonicContact NZ-OD2 2.73Å; K78-D195 PolarHBondContact NZ-OD2 3.34Å; Q82-D195 PolarHBondContact NE2-OD2 3.29Å; Q82-D195 VanDerWaalsContact NE2-OD2 3.09Å; E193-D195 PolarHBondContact O-N 2.69Å; D195-L198 PolarHBondContact O-N 3.37Å; D195-T199 VanDerWaalsContact O-CB 3.25Å; D195-T199 WeakPolarHBondContact O-CB 3.47Å; D195-T199 PolarHBondContact O-N 2.8Å; D195-T199 PolarHBondContact O-OG1 3.36Å
196	I	98.6	Very high	97.2	Very high	35 Å²	35	26 Å²	26	18%	0.179	13%	0.128	C	C	.	.	H	α-helix	trans	-63.6	-45.6	175.5	-57.9	169.2	0	0	0	109.8	L93 L98 E193 V194 T199 W200	L93-I196 HydrophobicContact CB-CB 4.34Å; L93-I196 HydrophobicContact CB-CG2 3.76Å; L93-I196 HydrophobicContact CD1-CB 4.07Å; L93-I196 HydrophobicContact CD1-CG2 4.16Å; L98-I196 HydrophobicContact CD1-CG2 3.77Å; E193-I196 HydrophobicContact CB-CD1 3.92Å; E193-I196 HydrophobicContact CG-CD1 3.77Å; E193-I196 WeakPolarHBondContact O-CB 3.14Å; E193-I196 PolarHBondContact O-N 3.06Å; V194-I196 VanDerWaalsContact C-N 3.28Å; V194-I196 PolarHBondContact O-N 2.73Å; I196-T199 PolarHBondContact O-N 3.31Å; I196-W200 PolarHBondContact O-N 2.96Å
197	L	98.8	Very high	96.3	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-62.4	-47.7	177.4	179.9	60	0	0	0	111.6	L93 L113 L114 Y117 F145 E193 V194 T199 W200 M201	L93-L197 HydrophobicContact CD1-CB 3.82Å; L113-L197 HydrophobicContact CD1-CD1 4.09Å; L114-L197 HydrophobicContact CD2-CD2 4.16Å; Y117-L197 HydrophobicContact CD2-CD2 4.07Å; Y117-L197 HydrophobicContact CE2-CD2 3.84Å; F145-L197 HydrophobicContact CE2-CD2 3.86Å; F145-L197 HydrophobicContact CZ-CD2 3.92Å; E193-L197 PolarHBondContact O-N 3.04Å; V194-L197 PolarHBondContact O-N 3.08Å; L197-T199 VanDerWaalsContact C-N 3.35Å; L197-T199 PolarHBondContact O-N 2.95Å; L197-W200 HydrophobicContact CD1-CE3 4.13Å; L197-W200 PolarHBondContact O-N 3.22Å; L197-M201 HydrophobicContact CD1-CG 4.29Å; L197-M201 HydrophobicContact CD1-SD 4.09Å; L197-M201 HydrophobicContact CD2-SD 4.47Å; L197-M201 HydrophobicContact CG-SD 3.86Å; L197-M201 VanDerWaalsContact O-CG 3.31Å; L197-M201 WeakPolarHBondContact O-CG 3.41Å; L197-M201 PolarHBondContact O-N 3.39Å
198	L	98.6	Very high	96.3	Very high	4 Å²	4	35.1 Å²	35.1	2%	0.021	17%	0.174	C	C	.	.	H	α-helix	trans	-63.4	-40.8	179.4	-67.4	-176.6	0	0	0	111.8	L70 W71 F74 F145 V194 D195 W200 M201 Q202	L70-L198 HydrophobicContact CB-CD1 4.06Å; L70-L198 HydrophobicContact CB-CD2 3.83Å; L70-L198 HydrophobicContact CD1-CD2 3.9Å; L70-L198 HydrophobicContact CG-CD2 4.33Å; W71-L198 HydrophobicContact CD2-CB 4.41Å; W71-L198 HydrophobicContact CD2-CD1 4.13Å; W71-L198 HydrophobicContact CE3-CD1 4.22Å; W71-L198 HydrophobicContact CH2-CB 4.06Å; W71-L198 HydrophobicContact CZ2-CB 3.66Å; F74-L198 HydrophobicContact CB-CD1 4.09Å; F145-L198 HydrophobicContact CE1-CD2 4.08Å; F145-L198 HydrophobicContact CZ-CD2 4.29Å; V194-L198 HydrophobicContact CG1-CD1 3.97Å; V194-L198 HydrophobicContact CG1-CG 3.93Å; V194-L198 VanDerWaalsContact O-CG 3.31Å; V194-L198 WeakPolarHBondContact O-CG 3.42Å; V194-L198 PolarHBondContact O-N 3.3Å; D195-L198 PolarHBondContact O-N 3.37Å; L198-W200 VanDerWaalsContact C-N 3.31Å; L198-W200 PolarHBondContact O-N 3.15Å; L198-M201 PolarHBondContact O-N 2.76Å; L198-Q202 WeakPolarHBondContact O-CB 3.48Å; L198-Q202 PolarHBondContact O-N 3.14Å
199	T	98.6	Very high	96.4	Very high	74 Å²	74	35.6 Å²	35.6	45%	0.454	18%	0.175	S	C	.	.	H	α-helix	trans	-60.5	-43.1	176.1	-60	0	0	0	0	111.1	W71 D195 I196 L197	W71-T199 WeakPolarHBondContact CH2-OG1 3.02Å; D195-T199 VanDerWaalsContact O-CB 3.25Å; D195-T199 WeakPolarHBondContact O-CB 3.47Å; D195-T199 PolarHBondContact O-N 2.8Å; D195-T199 PolarHBondContact O-OG1 3.36Å; I196-T199 PolarHBondContact O-N 3.31Å; L197-T199 VanDerWaalsContact C-N 3.35Å; L197-T199 PolarHBondContact O-N 2.95Å
200	W	98.6	Very high	96.3	Very high	10 Å²	10	37.4 Å²	37.4	4%	0.038	18%	0.184	C	C	.	.	H	α-helix	trans	-67.2	-45.3	176.6	176.1	76.1	0	0	0	111.9	L98 V101 L109 V110 I196 L197 L198 Q202 Q203 F204	L98-W200 HydrophobicContact CB-CG 4.17Å; L98-W200 HydrophobicContact CD1-CB 4.02Å; L98-W200 HydrophobicContact CD1-CG 4.18Å; L98-W200 HydrophobicContact CD2-CD2 3.8Å; L98-W200 HydrophobicContact CD2-CE3 4.16Å; L98-W200 HydrophobicContact CD2-CG 3.98Å; L98-W200 HydrophobicContact CG-CG 4.34Å; L98-W200 PolarHBondContact O-NE1 2.92Å; V101-W200 HydrophobicContact CB-CZ2 4.3Å; V101-W200 HydrophobicContact CG1-CZ2 4.08Å; V101-W200 HydrophobicContact CG2-CZ2 4.42Å; L109-W200 HydrophobicContact CB-CH2 4.37Å; L109-W200 HydrophobicContact CD2-CH2 4.23Å; L109-W200 HydrophobicContact CD2-CZ2 4.04Å; L109-W200 HydrophobicContact CG-CH2 4.29Å; V110-W200 HydrophobicContact CB-CH2 3.79Å; V110-W200 HydrophobicContact CB-CZ3 3.6Å; V110-W200 HydrophobicContact CG2-CZ3 3.85Å; I196-W200 PolarHBondContact O-N 2.96Å; L197-W200 HydrophobicContact CD1-CE3 4.13Å; L197-W200 PolarHBondContact O-N 3.22Å; L198-W200 VanDerWaalsContact C-N 3.31Å; L198-W200 PolarHBondContact O-N 3.15Å; W200-Q202 VanDerWaalsContact C-N 3.28Å; W200-Q202 PolarHBondContact O-N 2.81Å; W200-Q203 VanDerWaalsContact O-CB 3.31Å; W200-Q203 WeakPolarHBondContact O-CB 3.36Å; W200-Q203 WeakPolarHBondContact O-CG 3.34Å; W200-Q203 PolarHBondContact O-N 2.85Å; W200-F204 HydrophobicContact CD2-CE2 4.19Å; W200-F204 AromaticContact CE2-CE2 3.68Å; W200-F204 HydrophobicContact CH2-CE2 4.36Å; W200-F204 AromaticContact CZ2-CE2 3.77Å; W200-F204 HydrophobicContact CZ2-CE2 3.77Å; W200-F204 HydrophobicContact CZ2-CZ 4.13Å; W200-F204 AromaticContact NE1-CE2 3.9Å; W200-F204 WeakPolarHBondContact O-CD2 3.42Å
201	M	98.3	Very high	96.2	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-60.5	-37	177	-70.2	171.1	64.6	0	0	112.6	F55 F57 V110 L114 I148 L197 L198 Q203 F204	F55-M201 WeakPolarHBondContact CD1-O 3.1Å; F55-M201 HydrophobicContact CE1-CB 4.18Å; F55-M201 WeakPolarHBondContact CE1-O 3.48Å; F57-M201 HydrophobicContact CE1-CB 4.42Å; F57-M201 HydrophobicContact CE1-CG 4.34Å; F57-M201 HydrophobicContact CZ-CB 4.15Å; F57-M201 HydrophobicContact CZ-CE 4.26Å; F57-M201 HydrophobicContact CZ-CG 4.13Å; V110-M201 HydrophobicContact CG2-CE 4.3Å; V110-M201 HydrophobicContact CG2-CG 4.07Å; V110-M201 HydrophobicContact CG2-SD 4.22Å; L114-M201 HydrophobicContact CD1-CE 4.48Å; L114-M201 HydrophobicContact CD2-CE 4.49Å; L114-M201 HydrophobicContact CD2-SD 4.26Å; I148-M201 HydrophobicContact CD1-CE 3.59Å; I148-M201 HydrophobicContact CG2-CE 4.31Å; L197-M201 HydrophobicContact CD1-CG 4.29Å; L197-M201 HydrophobicContact CD1-SD 4.09Å; L197-M201 HydrophobicContact CD2-SD 4.47Å; L197-M201 HydrophobicContact CG-SD 3.86Å; L197-M201 VanDerWaalsContact O-CG 3.31Å; L197-M201 WeakPolarHBondContact O-CG 3.41Å; L197-M201 PolarHBondContact O-N 3.39Å; L198-M201 PolarHBondContact O-N 2.76Å; M201-Q203 PolarHBondContact O-N 2.72Å; M201-Q203 VanDerWaalsContact O-N 3.14Å; M201-F204 PolarHBondContact O-N 3.39Å
202	Q	97.3	Very high	96.2	Very high	76 Å²	76	42.1 Å²	42.1	36%	0.355	21%	0.207	S	C	.	.	H	α-helix	trans	-57.1	-27.8	178.8	-166.4	83	40.6	0	0	112.7	P67 L198 W200 F204 Y205	P67-Q202 VanDerWaalsContact CB-OE1 3.31Å; L198-Q202 WeakPolarHBondContact O-CB 3.48Å; L198-Q202 PolarHBondContact O-N 3.14Å; W200-Q202 VanDerWaalsContact C-N 3.28Å; W200-Q202 PolarHBondContact O-N 2.81Å; Q202-F204 PolarHBondContact O-N 3.32Å; Q202-Y205 WeakPolarHBondContact O-CB 3.49Å; Q202-Y205 PolarHBondContact O-N 2.97Å; Q202-Y205 VanDerWaalsContact O-N 3.1Å
203	Q	96.8	Very high	96.2	Very high	126 Å²	126	44.7 Å²	44.7	59%	0.589	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-24.2	177.5	-59.3	178	-12	0	0	112.6	W200 M201	W200-Q203 VanDerWaalsContact O-CB 3.31Å; W200-Q203 WeakPolarHBondContact O-CB 3.36Å; W200-Q203 WeakPolarHBondContact O-CG 3.34Å; W200-Q203 PolarHBondContact O-N 2.85Å; M201-Q203 PolarHBondContact O-N 2.72Å; M201-Q203 VanDerWaalsContact O-N 3.14Å
204	F	96.9	Very high	96	Very high	12 Å²	12	46.9 Å²	46.9	5%	0.053	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	0.7	-179.1	-58.7	-83.2	0	0	0	112.8	F55 Q56 F57 S106 W200 M201 Q202	F55-F204 CarbonylContact C-O 3.58Å; F55-F204 WeakPolarHBondContact CA-O 3.18Å; Q56-F204 PolarHBondContact N-O 2.92Å; F57-F204 HydrophobicContact CD1-CB 3.63Å; F57-F204 AromaticContact CD1-CD1 3.98Å; F57-F204 HydrophobicContact CD1-CD1 3.98Å; F57-F204 AromaticContact CD1-CD2 3.64Å; F57-F204 HydrophobicContact CD1-CD2 3.64Å; F57-F204 HydrophobicContact CD1-CE2 4.31Å; F57-F204 AromaticContact CD1-CG 3.44Å; F57-F204 HydrophobicContact CD1-CG 3.44Å; F57-F204 VanDerWaalsContact CD1-CG 3.44Å; F57-F204 HydrophobicContact CE1-CB 3.59Å; F57-F204 AromaticContact CE1-CD2 3.46Å; F57-F204 HydrophobicContact CE1-CD2 3.46Å; F57-F204 VanDerWaalsContact CE1-CD2 3.46Å; F57-F204 HydrophobicContact CE1-CE2 4.31Å; F57-F204 AromaticContact CE1-CG 3.61Å; F57-F204 HydrophobicContact CE1-CG 3.61Å; F57-F204 HydrophobicContact CG-CB 4.29Å; F57-F204 HydrophobicContact CG-CG 4.4Å; F57-F204 HydrophobicContact CZ-CB 4.22Å; S106-F204 VanDerWaalsContact CB-CE1 3.48Å; W200-F204 HydrophobicContact CD2-CE2 4.19Å; W200-F204 AromaticContact CE2-CE2 3.68Å; W200-F204 HydrophobicContact CH2-CE2 4.36Å; W200-F204 AromaticContact CZ2-CE2 3.77Å; W200-F204 HydrophobicContact CZ2-CE2 3.77Å; W200-F204 HydrophobicContact CZ2-CZ 4.13Å; W200-F204 AromaticContact NE1-CE2 3.9Å; W200-F204 WeakPolarHBondContact O-CD2 3.42Å; M201-F204 PolarHBondContact O-N 3.39Å; Q202-F204 PolarHBondContact O-N 3.32Å
205	Y	96.1	Very high	95.8	Very high	36 Å²	36	50.5 Å²	50.5	14%	0.141	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	124.7	177.2	-161.9	-111.6	0	0	0	110.8	Q53 E54 F55 P67 Q202	Q53-Y205 HydrophobicContact CB-CE1 3.88Å; Q53-Y205 HydrophobicContact CB-CE2 4.36Å; Q53-Y205 WeakPolarHBondContact CB-OH 3.43Å; Q53-Y205 PolarHBondContact OE1-OH 3.32Å; E54-Y205 WeakPolarHBondContact O-CA 3.43Å; E54-Y205 WeakPolarHBondContact O-CD2 3.47Å; F55-Y205 AromaticContact CD1-CD2 3.84Å; F55-Y205 HydrophobicContact CD1-CD2 3.84Å; F55-Y205 HydrophobicContact CD1-CG 4.42Å; F55-Y205 AromaticContact CD2-CD2 3.82Å; F55-Y205 HydrophobicContact CD2-CD2 3.82Å; F55-Y205 HydrophobicContact CD2-CE2 4.18Å; F55-Y205 AromaticContact CE1-CD2 3.86Å; F55-Y205 HydrophobicContact CE1-CD2 3.86Å; F55-Y205 HydrophobicContact CE1-CG 4.31Å; F55-Y205 AromaticContact CE2-CD2 3.83Å; F55-Y205 HydrophobicContact CE2-CD2 3.83Å; F55-Y205 HydrophobicContact CE2-CE2 4.09Å; F55-Y205 AromaticContact CG-CD2 3.83Å; F55-Y205 HydrophobicContact CG-CD2 3.83Å; F55-Y205 AromaticContact CZ-CD2 3.86Å; F55-Y205 HydrophobicContact CZ-CD2 3.86Å; F55-Y205 HydrophobicContact CZ-CE2 4.44Å; P67-Y205 VanDerWaalsContact CD-CE2 3.46Å; P67-Y205 VanDerWaalsContact CD-OH 3.31Å; P67-Y205 WeakPolarHBondContact CD-OH 3.35Å; P67-Y205 HydrophobicContact CG-CD1 3.76Å; P67-Y205 HydrophobicContact CG-CD2 3.51Å; P67-Y205 HydrophobicContact CG-CE1 3.67Å; P67-Y205 HydrophobicContact CG-CE2 3.45Å; P67-Y205 VanDerWaalsContact CG-CE2 3.45Å; P67-Y205 HydrophobicContact CG-CG 3.65Å; P67-Y205 VanDerWaalsContact CG-CZ 3.5Å; Q202-Y205 WeakPolarHBondContact O-CB 3.49Å; Q202-Y205 PolarHBondContact O-N 2.97Å; Q202-Y205 VanDerWaalsContact O-N 3.1Å
206	K	90.9	Very high	95.6	Very high	102 Å²	102	52.8 Å²	52.8	44%	0.443	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	146	179.6	-55.9	-57.8	-178.2	-168.9	0	110.2	Q53 E54 Q56	Q53-K206 WeakPolarHBondContact CA-O 3.4Å; E54-K206 PolarHBondContact N-O 2.81Å; E54-K206 PolarHBondContact O-N 3.15Å; Q56-K206 HydrophobicContact CB-CG 4.08Å
207	L	77.9	Confident	95.3	Very high	157 Å²	157	54.5 Å²	54.5	82%	0.822	27%	0.266	S	S	*	.			trans	-92.9	0	174.5	-67.5	177	0	0	0	110.2	Q53	Q53-L207 HydrophobicContact CG-CD2 3.99Å

Retrieved 207 of 207 residues in 129.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).