A0A087XHY3_POEFO Loading...

Regulator of G protein signaling 17

AlphaFold DB , UniProt , Accession A0A087XHY3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 209 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.9	Very low	39.1	Very low	243 Å²	243	144.2 Å²	144.2	100%	1.197	79%	0.791	S	S	*	*				0	147.4	0	-71.8	-140.5	174.2	0	0	108.7
2	P	43.8	Very low	39.7	Very low	101 Å²	101	149.8 Å²	149.8	66%	0.656	80%	0.802	S	S	*	*			trans	-94.5	165.4	-144.6	1.4	19	0	0	0	114.9
3	H	35.7	Very low	39.8	Very low	181 Å²	181	154.5 Å²	154.5	84%	0.838	80%	0.801	S	S	*	*			trans	42.9	150.8	138.9	-59.1	-59.7	0	0	0	120.3
4	S	37.5	Very low	39.6	Very low	92 Å²	92	158 Å²	158	64%	0.643	81%	0.812	S	S	*	*			cis	179.9	142.4	-16.2	-98.5	0	0	0	0	103.6
5	V	42.7	Very low	39.8	Very low	140 Å²	140	154.5 Å²	154.5	85%	0.848	82%	0.816	S	S	*	*			trans	40.6	123.6	139.4	-168.6	0	0	0	0	119.4
6	S	37.2	Very low	39.5	Very low	112 Å²	112	151.1 Å²	151.1	78%	0.783	82%	0.816	S	S	*	*				-171.8	118.1	119.6	-161.9	0	0	0	0	111.2
7	G	42.2	Very low	39.5	Very low	59 Å²	59	152.5 Å²	152.5	61%	0.608	82%	0.816	S	S	*	*			trans	-75	170.8	151.4	0	0	0	0	0	110.4
8	V	35.6	Very low	39.5	Very low	139 Å²	139	152.9 Å²	152.9	84%	0.842	82%	0.816	S	S	*	*			trans	176	116.8	137	162.7	0	0	0	0	107
9	E	41.4	Very low	39.2	Very low	177 Å²	177	153.7 Å²	153.7	83%	0.827	82%	0.815	S	S	*	*			trans	-65.9	148.2	164.4	-173.3	169.6	-163.4	0	0	110.1
10	M	31.8	Very low	39.3	Very low	145 Å²	145	150.6 Å²	150.6	71%	0.714	81%	0.811	S	S	*	*			trans	174	138.9	139.6	-99.2	178.5	-142.9	0	0	116.1
11	R	42.5	Very low	39.7	Very low	197 Å²	197	149 Å²	149	74%	0.743	81%	0.809	S	S	*	*			trans	91.2	101.4	138.1	-74.7	164.9	-177.2	174.6	1.1	120.7
12	K	45.9	Very low	39.7	Very low	211 Å²	211	143.5 Å²	143.5	92%	0.917	79%	0.792	S	S	*	*			trans	-57.2	131.2	141	-109.4	174.6	173.9	174.6	0	111.4
13	R	41.1	Very low	39.5	Very low	212 Å²	212	148.1 Å²	148.1	80%	0.8	81%	0.805	S	S	*	*			trans	-152.2	110.9	150.8	-72.6	-168	172.4	175.1	-5.2	107.4
14	Q	37.1	Very low	39.7	Very low	203 Å²	203	143.9 Å²	143.9	95%	0.949	80%	0.801	S	S	*	*				63.4	128.4	94.4	-87.5	-177.5	9.7	0	0	115.4
15	A	43.2	Very low	39.8	Very low	106 Å²	106	145.6 Å²	145.6	88%	0.876	81%	0.81	S	S	*	*			trans	-74.5	160.9	-165.6	0	0	0	0	0	115
16	A	33.7	Very low	40	Very low	99 Å²	99	142.6 Å²	142.6	82%	0.818	81%	0.807	S	S	*	*			trans	-145	133.1	154.9	0	0	0	0	0	110.8
17	H	40.7	Very low	40.1	Very low	175 Å²	175	145.9 Å²	145.9	81%	0.81	81%	0.81	S	S	*	*			trans	-74.6	134	179.6	-169.2	-72.2	0	0	0	110.5
18	I	38.7	Very low	40	Very low	160 Å²	160	149.2 Å²	149.2	82%	0.821	82%	0.821	S	S	*	*			trans	-144.6	84.3	166	-52.4	177	0	0	0	105.6
19	E	34.6	Very low	40.5	Very low	168 Å²	168	153.3 Å²	153.3	79%	0.785	82%	0.821	S	S	*	*				61.5	106.9	98.8	-143.2	171.3	-161.9	0	0	113.6
20	A	40.8	Very low	40.5	Very low	91 Å²	91	150.4 Å²	150.4	75%	0.752	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-81.8	147.8	-178.6	0	0	0	0	0	111.5
21	P	47.7	Very low	41.1	Very low	118 Å²	118	151 Å²	151	77%	0.766	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-71.7	153.7	178.1	-11	26.7	0	0	0	112.4
22	P	40.2	Very low	41.4	Very low	128 Å²	128	147.7 Å²	147.7	83%	0.831	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-70.9	143.8	-173.5	28.7	-33.3	0	0	0	112.9
23	Q	39	Very low	41.4	Very low	198 Å²	198	143.4 Å²	143.4	93%	0.925	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-65.2	128.3	175.5	-72.8	175	-16.8	0	0	111.6
24	A	40	Very low	41.6	Very low	91 Å²	91	138 Å²	138	75%	0.752	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-88.9	150.9	167.1	0	0	0	0	0	110.9
25	P	38.6	Very low	42.4	Very low	128 Å²	128	137.2 Å²	137.2	83%	0.831	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-83.3	131	-172.6	26.8	-20.6	0	0	0	112.7
26	G	47.4	Very low	42.2	Very low	77 Å²	77	136.1 Å²	136.1	79%	0.794	80%	0.801	S	S	*	*			trans	44	89.2	148.2	0	0	0	0	0	118.8
27	Q	40	Very low	42.9	Very low	182 Å²	182	144.5 Å²	144.5	85%	0.85	81%	0.811	S	S	*	*			trans	-114.2	138.5	149.9	-73.1	-165.5	-29.9	0	0	109.6	R29	Q27-R29 PolarHBondContact O-N 3.45Å
28	P	40.8	Very low	42.9	Very low	129 Å²	129	140 Å²	140	84%	0.838	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-71.5	129.6	177.4	18.8	-11.7	0	0	0	109.5
29	R	44.4	Very low	43.3	Very low	224 Å²	224	136.3 Å²	136.3	85%	0.845	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-62.6	140.8	175.7	-62.4	178.1	178.9	-178.8	-1.3	109.6	Q27 N31	Q27-R29 PolarHBondContact O-N 3.45Å; R29-N31 PolarHBondContact O-N 2.83Å
30	P	42.7	Very low	43.9	Very low	116 Å²	116	133.7 Å²	133.7	75%	0.753	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-66.1	130.7	159.4	28.9	-29.2	0	0	0	107.3	T32	P30-T32 PolarHBondContact O-N 3.41Å
31	N	42.9	Very low	43.8	Very low	159 Å²	159	134 Å²	134	85%	0.85	80%	0.795	S	S	*	*			trans	-60.5	96.7	178.9	-76.8	-20.6	0	0	0	110	R29 C33	R29-N31 PolarHBondContact O-N 2.83Å; N31-C33 VanDerWaalsContact C-N 3.26Å; N31-C33 PolarHBondContact O-N 3.3Å
32	T	48.8	Very low	44	Very low	127 Å²	127	138.1 Å²	138.1	78%	0.779	80%	0.801	S	S	*	*			trans	-66.1	92.4	154.6	-45.9	0	0	0	0	106.5	P30 C34	P30-T32 PolarHBondContact O-N 3.41Å; T32-C34 PolarHBondContact O-N 3.01Å
33	C	47.7	Very low	43.9	Very low	121 Å²	121	137 Å²	137	82%	0.818	79%	0.794	S	S	*	*			trans	-77.5	114.1	171.3	-162.6	0	0	0	0	108	N31	N31-C33 VanDerWaalsContact C-N 3.26Å; N31-C33 PolarHBondContact O-N 3.3Å
34	C	44.4	Very low	44.1	Very low	98 Å²	98	135 Å²	135	66%	0.662	79%	0.79	S	S	*	*			trans	-53.8	134.9	178.3	-58.2	0	0	0	0	111.6	T32 C36	T32-C34 PolarHBondContact O-N 3.01Å; C34-C36 PolarHBondContact O-N 2.77Å
35	L	53.5	Low	44.1	Very low	187 Å²	187	136.6 Å²	136.6	98%	0.979	78%	0.776	S	S	*	*			trans	-46.3	106	149.9	-72.6	149.2	0	0	0	108.4
36	C	38.8	Very low	44.4	Very low	82 Å²	82	136.9 Å²	136.9	55%	0.554	77%	0.771	S	S	*	*			trans	-124.2	112	164.5	80.8	0	0	0	0	108.8	C34 C38	C34-C36 PolarHBondContact O-N 2.77Å; C36-C38 HydrophobicContact CB-CB 4.44Å; C36-C38 PolarHBondContact O-N 2.95Å
37	W	48.9	Very low	43.9	Very low	275 Å²	275	141.9 Å²	141.9	100%	1.042	77%	0.773	S	S	*	*			trans	-73.2	39.6	168.6	-161.5	-72.4	0	0	0	110.1
38	C	41	Very low	43.8	Very low	81 Å²	81	138 Å²	138	55%	0.547	76%	0.758	S	S	.	*			trans	-115.8	108.7	-178.7	177.2	0	0	0	0	107.7	C36 C40	C36-C38 HydrophobicContact CB-CB 4.44Å; C36-C38 PolarHBondContact O-N 2.95Å; C38-C40 PolarHBondContact O-N 2.98Å
39	G	48.2	Very low	43.8	Very low	83 Å²	83	137.2 Å²	137.2	86%	0.856	74%	0.739	S	S	*	*	S	Bend	trans	-67.9	63	-178.8	0	0	0	0	0	114
40	C	47	Very low	43.7	Very low	113 Å²	113	133.8 Å²	133.8	76%	0.764	74%	0.736	S	S	*	*			trans	-140.2	17.2	173.3	-86	0	0	0	0	113.9	C38 K42	C38-C40 PolarHBondContact O-N 2.98Å; C40-K42 PolarHBondContact O-N 3.48Å
41	C	37.7	Very low	43.3	Very low	98 Å²	98	133.7 Å²	133.7	66%	0.662	73%	0.725	S	S	*	*			trans	-89.9	95.7	159.1	-79.4	0	0	0	0	108.5	C43	C41-C43 PolarHBondContact O-N 3.18Å
42	K	52.3	Low	42.8	Very low	204 Å²	204	132.3 Å²	132.3	89%	0.887	71%	0.708	S	S	*	*			trans	-64.7	85	153.2	-83.6	-171.1	174.9	-173	0	107	C40 L44	C40-K42 PolarHBondContact O-N 3.48Å; K42-L44 PolarHBondContact O-N 2.85Å
43	C	37.7	Very low	42	Very low	103 Å²	103	131.1 Å²	131.1	70%	0.696	71%	0.705	S	S	*	*			trans	-58.1	116	163.7	-57.9	0	0	0	0	106.4	C41 W45	C41-C43 PolarHBondContact O-N 3.18Å; C43-W45 PolarHBondContact O-N 2.8Å
44	L	43.7	Very low	41.6	Very low	158 Å²	158	133.4 Å²	133.4	83%	0.827	70%	0.704	S	S	*	*	S	Bend	trans	-69.3	55.3	178	-85.3	156.7	0	0	0	111.5	K42	K42-L44 PolarHBondContact O-N 2.85Å
45	W	39.1	Very low	41.4	Very low	123 Å²	123	138.3 Å²	138.3	47%	0.466	71%	0.708	S	S	.	*			trans	-154.7	93.7	171	-75.9	92	0	0	0	109	C43 R49 R52	C43-W45 PolarHBondContact O-N 2.8Å; W45-R49 HydrophobicContact CE3-CB 3.82Å; W45-R49 HydrophobicContact CE3-CG 4.09Å; W45-R49 HydrophobicContact CZ3-CB 3.65Å; W45-R49 HydrophobicContact CZ3-CG 3.58Å; W45-R52 VanDerWaalsContact CH2-NH1 3.34Å; W45-R52 VanDerWaalsContact CH2-NH2 3.32Å
46	N	44.7	Very low	40.8	Very low	134 Å²	134	138.6 Å²	138.6	72%	0.717	70%	0.704	S	S	*	*	S	Bend	trans	-178.7	47	147.1	-99.1	-12.5	0	0	0	113.8
47	E	37.6	Very low	40.5	Very low	182 Å²	182	141.2 Å²	141.2	85%	0.85	72%	0.718	S	S	*	*	S	Bend	trans	-146.3	-32.5	150	-76.9	-150.3	119.2	0	0	110.9	R49	E47-R49 PolarHBondContact O-N 3.3Å
48	D	37.1	Very low	39.7	Very low	100 Å²	100	133.7 Å²	133.7	54%	0.535	71%	0.706	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.5	10.1	-174.6	-70.8	-47.8	0	0	0	117.6	R52	D48-R52 PolarHBondContact O-NE 3.03Å; D48-R52 PolarHBondContact O-NH2 2.62Å
49	R	41.3	Very low	39.6	Very low	113 Å²	113	135.7 Å²	135.7	43%	0.426	72%	0.716	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.2	-25.4	-179.5	-165.6	172.7	-93.8	-140.8	-4.3	112.9	W45 E47 E130	W45-R49 HydrophobicContact CE3-CB 3.82Å; W45-R49 HydrophobicContact CE3-CG 4.09Å; W45-R49 HydrophobicContact CZ3-CB 3.65Å; W45-R49 HydrophobicContact CZ3-CG 3.58Å; E47-R49 PolarHBondContact O-N 3.3Å; R49-E130 IonicContact CZ-OE1 3.95Å; R49-E130 IonicContact NH1-OE1 3.13Å; R49-E130 PolarHBondContact NH1-OE1 3.02Å; R49-E130 IonicContact NH2-OE1 3.55Å
50	I	41.9	Very low	38.9	Very low	152 Å²	152	141.4 Å²	141.4	78%	0.779	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-74.4	-30.6	176.3	-62.8	-176.9	0	0	0	110.9	R52	I50-R52 VanDerWaalsContact C-N 3.34Å; I50-R52 PolarHBondContact O-N 3.39Å
51	E	35	Very low	39	Very low	114 Å²	114	144.7 Å²	144.7	53%	0.533	72%	0.724	S	S	.	*	G	3₁₀ helix	trans	-75.7	-11.6	178.6	-71	-164.5	160.5	0	0	115.4
52	R	32.7	Very low	38.9	Very low	131 Å²	131	147.4 Å²	147.4	49%	0.494	73%	0.732	S	S	.	*	G	3₁₀ helix	trans	-90.8	-12	-169.5	-128.6	173.5	-52.9	-162.6	3.8	115.2	W45 D48 I50 E54	W45-R52 VanDerWaalsContact CH2-NH1 3.34Å; W45-R52 VanDerWaalsContact CH2-NH2 3.32Å; D48-R52 PolarHBondContact O-NE 3.03Å; D48-R52 PolarHBondContact O-NH2 2.62Å; I50-R52 VanDerWaalsContact C-N 3.34Å; I50-R52 PolarHBondContact O-N 3.39Å; R52-E54 PolarHBondContact O-N 2.76Å
53	S	31.6	Very low	38.1	Very low	102 Å²	102	142.5 Å²	142.5	71%	0.713	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-68.4	-15.5	174.2	-153.6	0	0	0	0	112.1
54	E	40.4	Very low	38.7	Very low	168 Å²	168	145.8 Å²	145.8	79%	0.785	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-102.8	1.8	-175.4	-63.8	-171.6	150.3	0	0	115	R52	R52-E54 PolarHBondContact O-N 2.76Å
55	R	38.5	Very low	38.8	Very low	202 Å²	202	146.8 Å²	146.8	76%	0.762	73%	0.732	S	S	*	*			trans	-115.7	61.7	-178.7	-68.8	-174.3	-174.3	164.3	8.2	112.8
56	Q	41.3	Very low	38.8	Very low	192 Å²	192	144.7 Å²	144.7	90%	0.897	74%	0.742	S	S	*	*			trans	-139.3	62.1	158.4	-156.4	157.7	21.1	0	0	112.4
57	T	32.5	Very low	38.8	Very low	138 Å²	138	143 Å²	143	85%	0.847	75%	0.747	S	S	*	*			trans	-132.6	120.3	156.2	34	0	0	0	0	109.5
58	C	33	Very low	39.2	Very low	116 Å²	116	141 Å²	141	78%	0.784	74%	0.737	S	S	*	*			trans	-83.6	132.3	179.8	-178.6	0	0	0	0	110.1
59	T	38.3	Very low	40	Very low	124 Å²	124	144.9 Å²	144.9	76%	0.761	75%	0.752	S	S	*	*			trans	66.5	93.2	163.6	54	0	0	0	0	119.3
60	K	33.9	Very low	41.1	Very low	203 Å²	203	144.9 Å²	144.9	88%	0.883	76%	0.757	S	S	*	*				-169	128.8	121.3	-104.8	167.6	-178.2	173.9	0	109.8	D62	K60-D62 PolarHBondContact O-N 2.84Å
61	M	48.8	Very low	42.9	Very low	181 Å²	181	145.8 Å²	145.8	89%	0.892	75%	0.75	S	S	*	*			trans	-60.1	123	160.2	-90.7	151.8	65	0	0	107.4
62	D	34.8	Very low	45.3	Very low	155 Å²	155	140.7 Å²	140.7	83%	0.829	73%	0.727	S	S	*	*			trans	-165.4	129	139	-87.9	-32.4	0	0	0	109.5	K60	K60-D62 PolarHBondContact O-N 2.84Å
63	S	35.4	Very low	48	Very low	102 Å²	102	137.3 Å²	137.3	71%	0.713	72%	0.724	S	S	*	*			trans	61.6	108.1	157	-54.7	0	0	0	0	120	E65	S63-E65 VanDerWaalsContact C-N 3.26Å; S63-E65 PolarHBondContact O-N 3.28Å
64	I	51.2	Low	50.8	Low	172 Å²	172	134.4 Å²	134.4	88%	0.882	70%	0.7	S	S	*	*			trans	-63.7	91	152.7	-59.2	165.3	0	0	0	106.5	A66	I64-A66 PolarHBondContact O-N 2.84Å
65	E	45.1	Very low	53.2	Low	178 Å²	178	134 Å²	134	83%	0.832	70%	0.698	S	S	*	*			trans	-76.8	114.3	154	-74.8	-179.5	167.8	0	0	105.6	S63 A67	S63-E65 VanDerWaalsContact C-N 3.26Å; S63-E65 PolarHBondContact O-N 3.28Å; E65-A67 PolarHBondContact O-N 3.29Å; E65-A67 VanDerWaalsContact O-N 3.14Å
66	A	40.2	Very low	55.8	Low	80 Å²	80	126.8 Å²	126.8	66%	0.661	67%	0.673	S	S	*	*			trans	-49	123.4	169.3	0	0	0	0	0	107.4	I64 E68	I64-A66 PolarHBondContact O-N 2.84Å; A66-E68 PolarHBondContact O-N 3.33Å
67	A	44.3	Very low	58.2	Low	99 Å²	99	117.7 Å²	117.7	82%	0.818	63%	0.63	S	S	*	*			trans	-56.2	96	165	0	0	0	0	0	106.3	E65 E69	E65-A67 PolarHBondContact O-N 3.29Å; E65-A67 VanDerWaalsContact O-N 3.14Å; A67-E69 PolarHBondContact O-N 3.06Å; A67-E69 VanDerWaalsContact O-N 3.08Å
68	E	46.7	Very low	61.1	Low	140 Å²	140	114.3 Å²	114.3	65%	0.654	61%	0.607	S	S	*	*			trans	-57.6	117.4	168.2	-79	-171.9	143.3	0	0	104.8	A66 Q70	A66-E68 PolarHBondContact O-N 3.33Å; E68-Q70 PolarHBondContact O-N 3.02Å; E68-Q70 PolarHBondContact OE2-NE2 3.48Å; E68-Q70 PolarHBondContact OE2-OE1 3.31Å
69	E	53.3	Low	64.1	Low	181 Å²	181	110.4 Å²	110.4	85%	0.846	58%	0.581	S	S	*	*			trans	-60.1	82.3	164.1	-75.2	177	159.2	0	0	106.7	A67 R71	A67-E69 PolarHBondContact O-N 3.06Å; A67-E69 VanDerWaalsContact O-N 3.08Å; E69-R71 PolarHBondContact O-N 3.37Å
70	Q	63.8	Low	66.8	Low	113 Å²	113	104.5 Å²	104.5	53%	0.528	55%	0.545	S	S	.	.			trans	-79.4	69.6	-175.2	-131.4	97.5	41.9	0	0	109.5	E68 E92	E68-Q70 PolarHBondContact O-N 3.02Å; E68-Q70 PolarHBondContact OE2-NE2 3.48Å; E68-Q70 PolarHBondContact OE2-OE1 3.31Å; Q70-E92 WeakPolarHBondContact O-CG 3.3Å
71	R	79.7	Confident	69.6	Low	171 Å²	171	97.2 Å²	97.2	65%	0.645	52%	0.522	S	S	*	.			trans	-26.7	119.8	157.9	-105.3	-163.9	-170	-165.2	6.5	111.6	E69 R202	E69-R71 PolarHBondContact O-N 3.37Å; R71-R202 VanDerWaalsContact C-NH2 3.25Å; R71-R202 VanDerWaalsContact CA-NH2 3.31Å; R71-R202 VanDerWaalsContact CB-CZ 3.49Å
72	P	86.3	Confident	71.7	Confident	6 Å²	6	98.6 Å²	98.6	4%	0.039	52%	0.517	C	S	.	.			trans	-62.2	138.7	-165.3	25.2	-37.8	0	0	0	112.2	E76 L77 W80 E92 I96 R202	P72-E76 WeakPolarHBondContact CA-OE2 3.47Å; P72-E76 HydrophobicContact CB-CG 4.3Å; P72-E76 WeakPolarHBondContact CB-OE2 3.49Å; P72-L77 HydrophobicContact CB-CD2 4.07Å; P72-L77 HydrophobicContact CB-CG 4.41Å; P72-L77 HydrophobicContact CG-CD2 3.77Å; P72-L77 HydrophobicContact CG-CG 4.38Å; P72-W80 HydrophobicContact CB-CH2 3.69Å; P72-W80 HydrophobicContact CB-CZ2 3.75Å; P72-W80 HydrophobicContact CG-CH2 3.68Å; P72-W80 HydrophobicContact CG-CZ2 4.27Å; P72-W80 HydrophobicContact CG-CZ3 4.47Å; P72-E92 HydrophobicContact CB-CB 4.31Å; P72-E92 HydrophobicContact CG-CB 4.37Å; P72-I96 HydrophobicContact CG-CD1 4.2Å; P72-R202 WeakPolarHBondContact O-CD 3.49Å; P72-R202 PolarHBondContact O-NE 3.05Å
73	S	89.3	Confident	74.6	Confident	61 Å²	61	92.9 Å²	92.9	43%	0.427	49%	0.489	S	S	.	.			trans	-66.5	162	-179.1	73.1	0	0	0	0	112.2	E75 E76 L77	S73-E75 VanDerWaalsContact C-N 3.28Å; S73-E75 PolarHBondContact O-N 3.2Å; S73-E76 PolarHBondContact N-OE2 3.42Å; S73-E76 PolarHBondContact O-N 2.93Å; S73-E76 VanDerWaalsContact OG-CB 3.26Å; S73-E76 WeakPolarHBondContact OG-CB 3.36Å; S73-E76 PolarHBondContact OG-N 3.49Å; S73-E76 VanDerWaalsContact OG-N 3.1Å; S73-L77 WeakPolarHBondContact O-CG 3.3Å; S73-L77 PolarHBondContact O-N 3.37Å
74	L	89.9	Confident	77.5	Confident	40 Å²	40	88.1 Å²	88.1	21%	0.209	46%	0.456	C	S	.	.	H	α-helix	trans	-62	-38.6	176.1	-177.7	61.2	0	0	0	111.8	E76 L77 L78 L199 R202 R203	L74-E76 VanDerWaalsContact C-N 3.34Å; L74-L77 PolarHBondContact O-N 3.28Å; L74-L78 HydrophobicContact CG-CD1 4.28Å; L74-L78 VanDerWaalsContact O-CG 3.25Å; L74-L78 WeakPolarHBondContact O-CG 3.4Å; L74-L78 PolarHBondContact O-N 3.44Å; L74-L199 HydrophobicContact CD1-CD2 3.98Å; L74-R202 HydrophobicContact CB-CB 4.24Å; L74-R202 HydrophobicContact CD1-CB 4.09Å; L74-R203 HydrophobicContact CD1-CG 4.12Å; L74-R203 HydrophobicContact CD2-CG 4.18Å
75	E	90.7	Very high	79.6	Confident	161 Å²	161	84.1 Å²	84.1	75%	0.752	43%	0.433	S	S	*	.	H	α-helix	trans	-62.4	-43.4	176.1	-179.2	173.2	-171.5	0	0	111.4	S73 L78 S79	S73-E75 VanDerWaalsContact C-N 3.28Å; S73-E75 PolarHBondContact O-N 3.2Å; E75-L78 PolarHBondContact O-N 2.54Å; E75-S79 PolarHBondContact O-N 3.29Å
76	E	92.3	Very high	82	Confident	50 Å²	50	79.7 Å²	79.7	23%	0.234	41%	0.414	C	S	.	.	H	α-helix	trans	-62.2	-47.8	177.1	-179.9	176.3	-168.9	0	0	111.6	P72 S73 L74 L78 S79 W80 S90	P72-E76 WeakPolarHBondContact CA-OE2 3.47Å; P72-E76 HydrophobicContact CB-CG 4.3Å; P72-E76 WeakPolarHBondContact CB-OE2 3.49Å; S73-E76 PolarHBondContact N-OE2 3.42Å; S73-E76 PolarHBondContact O-N 2.93Å; S73-E76 VanDerWaalsContact OG-CB 3.26Å; S73-E76 WeakPolarHBondContact OG-CB 3.36Å; S73-E76 PolarHBondContact OG-N 3.49Å; S73-E76 VanDerWaalsContact OG-N 3.1Å; L74-E76 VanDerWaalsContact C-N 3.34Å; E76-L78 VanDerWaalsContact C-N 3.31Å; E76-L78 PolarHBondContact O-N 3.03Å; E76-S79 WeakPolarHBondContact O-CA 3.38Å; E76-S79 VanDerWaalsContact O-CB 3.31Å; E76-S79 WeakPolarHBondContact O-CB 3.26Å; E76-S79 PolarHBondContact O-N 2.92Å; E76-S79 PolarHBondContact O-OG 3.07Å; E76-W80 HydrophobicContact CG-CZ2 3.87Å; E76-W80 PolarHBondContact O-N 2.91Å; E76-W80 VanDerWaalsContact O-N 3.11Å; E76-W80 PolarHBondContact O-NE1 3.3Å; E76-S90 VanDerWaalsContact OE1-CB 3.24Å; E76-S90 WeakPolarHBondContact OE1-CB 3.41Å; E76-S90 PolarHBondContact OE1-OG 2.97Å
77	L	93.6	Very high	84.7	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-55.2	-48.6	174.5	-67.7	-178.8	0	0	0	110.9	P72 S73 L74 S79 W80 A81 Y195 L198 L199 R202	P72-L77 HydrophobicContact CB-CD2 4.07Å; P72-L77 HydrophobicContact CB-CG 4.41Å; P72-L77 HydrophobicContact CG-CD2 3.77Å; P72-L77 HydrophobicContact CG-CG 4.38Å; S73-L77 WeakPolarHBondContact O-CG 3.3Å; S73-L77 PolarHBondContact O-N 3.37Å; L74-L77 PolarHBondContact O-N 3.28Å; L77-S79 PolarHBondContact O-N 3.03Å; L77-W80 HydrophobicContact CD2-CD2 4.31Å; L77-W80 HydrophobicContact CD2-CE3 3.62Å; L77-W80 HydrophobicContact CD2-CH2 3.69Å; L77-W80 HydrophobicContact CD2-CZ2 4.34Å; L77-W80 HydrophobicContact CD2-CZ3 3.28Å; L77-W80 WeakPolarHBondContact O-CB 3.38Å; L77-W80 PolarHBondContact O-N 3.43Å; L77-A81 PolarHBondContact O-N 3.33Å; L77-Y195 HydrophobicContact CD2-CE2 4.43Å; L77-Y195 PolarHBondContact O-OH 3.32Å; L77-L198 HydrophobicContact CD1-CB 4.26Å; L77-L199 HydrophobicContact CB-CD2 3.69Å; L77-L199 HydrophobicContact CD1-CD2 3.97Å; L77-L199 HydrophobicContact CD1-CG 4.41Å; L77-L199 HydrophobicContact CG-CD2 4.49Å; L77-R202 HydrophobicContact CD1-CB 4.19Å; L77-R202 HydrophobicContact CD1-CG 3.58Å
78	L	93.5	Very high	87.2	Confident	68 Å²	68	71.4 Å²	71.4	36%	0.356	35%	0.345	S	S	.	.	H	α-helix	trans	-62.1	-30.6	177.9	-67.8	173.4	0	0	0	112.9	L74 E75 E76 W80 L199	L74-L78 HydrophobicContact CG-CD1 4.28Å; L74-L78 VanDerWaalsContact O-CG 3.25Å; L74-L78 WeakPolarHBondContact O-CG 3.4Å; L74-L78 PolarHBondContact O-N 3.44Å; E75-L78 PolarHBondContact O-N 2.54Å; E76-L78 VanDerWaalsContact C-N 3.31Å; E76-L78 PolarHBondContact O-N 3.03Å; L78-W80 VanDerWaalsContact C-N 3.34Å; L78-L199 HydrophobicContact CD2-CD2 4.28Å
79	S	94.8	Very high	89.4	Confident	34 Å²	34	72.2 Å²	72.2	24%	0.238	34%	0.342	C	S	.	.	H	α-helix	trans	-66.9	-36	174.9	85.7	0	0	0	0	112	E75 E76 L77 A81 R82 S83	E75-S79 PolarHBondContact O-N 3.29Å; E76-S79 WeakPolarHBondContact O-CA 3.38Å; E76-S79 VanDerWaalsContact O-CB 3.31Å; E76-S79 WeakPolarHBondContact O-CB 3.26Å; E76-S79 PolarHBondContact O-N 2.92Å; E76-S79 PolarHBondContact O-OG 3.07Å; L77-S79 PolarHBondContact O-N 3.03Å; S79-A81 PolarHBondContact O-N 3Å; S79-R82 WeakPolarHBondContact O-CB 3.33Å; S79-R82 PolarHBondContact O-N 2.94Å; S79-R82 VanDerWaalsContact O-N 3.1Å; S79-S83 PolarHBondContact O-N 3.35Å; S79-S83 VanDerWaalsContact O-N 3.11Å
80	W	95.2	Very high	91.4	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-61.2	-48.2	177.9	-59.3	-8.6	0	0	0	110.3	P72 E76 L77 L78 R82 S83 M87 S90 E92 I96 F186 Y195	P72-W80 HydrophobicContact CB-CH2 3.69Å; P72-W80 HydrophobicContact CB-CZ2 3.75Å; P72-W80 HydrophobicContact CG-CH2 3.68Å; P72-W80 HydrophobicContact CG-CZ2 4.27Å; P72-W80 HydrophobicContact CG-CZ3 4.47Å; E76-W80 HydrophobicContact CG-CZ2 3.87Å; E76-W80 PolarHBondContact O-N 2.91Å; E76-W80 VanDerWaalsContact O-N 3.11Å; E76-W80 PolarHBondContact O-NE1 3.3Å; L77-W80 HydrophobicContact CD2-CD2 4.31Å; L77-W80 HydrophobicContact CD2-CE3 3.62Å; L77-W80 HydrophobicContact CD2-CH2 3.69Å; L77-W80 HydrophobicContact CD2-CZ2 4.34Å; L77-W80 HydrophobicContact CD2-CZ3 3.28Å; L77-W80 WeakPolarHBondContact O-CB 3.38Å; L77-W80 PolarHBondContact O-N 3.43Å; L78-W80 VanDerWaalsContact C-N 3.34Å; W80-R82 PolarHBondContact O-N 3.25Å; W80-S83 CarbonylContact O-C 3.33Å; W80-S83 PolarHBondContact O-N 3.08Å; W80-M87 HydrophobicContact CB-CB 3.8Å; W80-M87 HydrophobicContact CB-CG 4.01Å; W80-M87 HydrophobicContact CD2-CB 4.37Å; W80-M87 HydrophobicContact CD2-CG 3.93Å; W80-M87 HydrophobicContact CE3-CG 4.26Å; W80-M87 HydrophobicContact CG-CB 3.74Å; W80-M87 HydrophobicContact CG-CG 3.8Å; W80-S90 WeakPolarHBondContact CZ2-OG 3.27Å; W80-E92 HydrophobicContact CH2-CB 4.35Å; W80-E92 HydrophobicContact CZ2-CB 4.44Å; W80-I96 HydrophobicContact CH2-CD1 3.96Å; W80-I96 HydrophobicContact CZ3-CD1 4.1Å; W80-F186 WeakPolarHBondContact O-CZ 3.43Å; W80-Y195 HydrophobicContact CE3-CE2 4.1Å
81	A	93.3	Very high	92.8	Very high	49 Å²	49	63.4 Å²	63.4	41%	0.405	30%	0.304	S	S	.	.	H	α-helix	trans	-58.9	-21.1	177.5	0	0	0	0	0	114.4	L77 S79 L190 Y195	L77-A81 PolarHBondContact O-N 3.33Å; S79-A81 PolarHBondContact O-N 3Å; A81-L190 HydrophobicContact CB-CD1 4.41Å; A81-L190 HydrophobicContact CB-CD2 4.2Å; A81-Y195 WeakPolarHBondContact CB-OH 3.49Å
82	R	91.9	Very high	93.5	Very high	210 Å²	210	58 Å²	58	79%	0.792	29%	0.287	S	S	*	.	H	α-helix	trans	-90.1	-28	177.8	-65.1	173.3	-178	164.7	2	112.9	S79 W80	S79-R82 WeakPolarHBondContact O-CB 3.33Å; S79-R82 PolarHBondContact O-N 2.94Å; S79-R82 VanDerWaalsContact O-N 3.1Å; W80-R82 PolarHBondContact O-N 3.25Å
83	S	95.4	Very high	94	Very high	35 Å²	35	57.8 Å²	57.8	25%	0.245	29%	0.285	C	S	.	.			trans	-152.5	118.1	-175.1	177.3	0	0	0	0	111.6	S79 W80 E85 M86 M87	S79-S83 PolarHBondContact O-N 3.35Å; S79-S83 VanDerWaalsContact O-N 3.11Å; W80-S83 CarbonylContact O-C 3.33Å; W80-S83 PolarHBondContact O-N 3.08Å; S83-E85 PolarHBondContact O-N 3.4Å; S83-E85 PolarHBondContact OG-N 2.94Å; S83-M86 PolarHBondContact O-N 3.48Å; S83-M86 VanDerWaalsContact O-N 3.12Å; S83-M86 PolarHBondContact OG-N 3.22Å; S83-M87 PolarHBondContact O-N 3.08Å
84	F	97.4	Very high	94.4	Very high	2 Å²	2	57.5 Å²	57.5	1%	0.009	28%	0.275	C	S	.	.	H	α-helix	trans	-58.2	-35.7	171.5	-176.1	-133.7	0	0	0	111.8	M86 M87 L88 F97 Y178 M181 H182 F186	F84-M86 VanDerWaalsContact C-N 3.35Å; F84-M86 PolarHBondContact O-N 2.64Å; F84-M87 HydrophobicContact CD2-CE 3.44Å; F84-M87 VanDerWaalsContact CD2-CE 3.44Å; F84-M87 HydrophobicContact CE2-CE 3.18Å; F84-M87 HydrophobicContact CZ-CE 4.31Å; F84-M87 WeakPolarHBondContact O-CB 3.37Å; F84-M87 PolarHBondContact O-N 3.13Å; F84-L88 HydrophobicContact CD1-CD1 4.19Å; F84-L88 HydrophobicContact CD2-CG 4.35Å; F84-L88 HydrophobicContact CE1-CD1 3.74Å; F84-L88 HydrophobicContact CE1-CG 4.29Å; F84-L88 HydrophobicContact CE2-CD1 4.38Å; F84-L88 HydrophobicContact CE2-CD2 4.08Å; F84-L88 HydrophobicContact CE2-CG 4.06Å; F84-L88 HydrophobicContact CZ-CD1 3.84Å; F84-L88 HydrophobicContact CZ-CD2 4.03Å; F84-L88 HydrophobicContact CZ-CG 4Å; F84-L88 PolarHBondContact O-N 2.81Å; F84-F97 HydrophobicContact CE2-CD1 4.23Å; F84-F97 AromaticContact CE2-CE1 3.64Å; F84-F97 HydrophobicContact CE2-CE1 3.64Å; F84-F97 AromaticContact CE2-CZ 3.94Å; F84-F97 HydrophobicContact CE2-CZ 3.94Å; F84-F97 AromaticContact CZ-CE1 3.9Å; F84-F97 HydrophobicContact CZ-CE1 3.9Å; F84-F97 HydrophobicContact CZ-CZ 4.34Å; F84-Y178 AromaticContact CD1-CD2 3.94Å; F84-Y178 HydrophobicContact CD1-CD2 3.94Å; F84-Y178 HydrophobicContact CD1-CE1 4.25Å; F84-Y178 AromaticContact CD1-CE2 3.34Å; F84-Y178 HydrophobicContact CD1-CE2 3.34Å; F84-Y178 AromaticContact CD1-CZ 3.52Å; F84-Y178 AromaticContact CE1-CD2 3.68Å; F84-Y178 HydrophobicContact CE1-CD2 3.68Å; F84-Y178 AromaticContact CE1-CE2 3.58Å; F84-Y178 HydrophobicContact CE1-CE2 3.58Å; F84-Y178 HydrophobicContact CE1-CG 4.31Å; F84-Y178 HydrophobicContact CG-CE2 4.4Å; F84-M181 HydrophobicContact CE1-CB 4.12Å; F84-M181 HydrophobicContact CZ-CB 3.72Å; F84-M181 HydrophobicContact CZ-CE 4.28Å; F84-H182 HydrophobicContact CD1-CB 3.58Å; F84-H182 AromaticContact CD1-CD2 3.93Å; F84-H182 AromaticContact CD1-CG 3.9Å; F84-H182 HydrophobicContact CE1-CB 3.88Å; F84-H182 HydrophobicContact CG-CB 4.35Å; F84-H182 AromaticContact CG-CD2 3.91Å; F84-F186 HydrophobicContact CB-CD1 3.86Å; F84-F186 HydrophobicContact CB-CE1 3.71Å; F84-F186 HydrophobicContact CB-CG 4.34Å; F84-F186 HydrophobicContact CB-CZ 4.08Å; F84-F186 HydrophobicContact CD2-CB 3.92Å; F84-F186 AromaticContact CD2-CD1 3.84Å; F84-F186 HydrophobicContact CD2-CD1 3.84Å; F84-F186 AromaticContact CD2-CD2 3.33Å; F84-F186 HydrophobicContact CD2-CD2 3.33Å; F84-F186 HydrophobicContact CD2-CE1 4.13Å; F84-F186 AromaticContact CD2-CE2 3.67Å; F84-F186 HydrophobicContact CD2-CE2 3.67Å; F84-F186 AromaticContact CD2-CG 3.4Å; F84-F186 HydrophobicContact CD2-CG 3.4Å; F84-F186 VanDerWaalsContact CD2-CG 3.4Å; F84-F186 HydrophobicContact CD2-CZ 4.04Å; F84-F186 HydrophobicContact CE2-CB 3.94Å; F84-F186 AromaticContact CE2-CD2 3.75Å; F84-F186 HydrophobicContact CE2-CD2 3.75Å; F84-F186 HydrophobicContact CE2-CE2 4.41Å; F84-F186 AromaticContact CE2-CG 3.89Å; F84-F186 HydrophobicContact CE2-CG 3.89Å; F84-F186 HydrophobicContact CG-CD1 4.06Å; F84-F186 HydrophobicContact CG-CD2 4.33Å; F84-F186 HydrophobicContact CG-CE1 4.3Å; F84-F186 HydrophobicContact CG-CG 4.05Å
85	E	95.9	Very high	94.7	Very high	88 Å²	88	58.9 Å²	58.9	41%	0.411	28%	0.28	S	S	.	.	H	α-helix	trans	-62.7	-40.6	176.1	-170	-174.3	176.8	0	0	112.1	S83 M87 L88 R89	S83-E85 PolarHBondContact O-N 3.4Å; S83-E85 PolarHBondContact OG-N 2.94Å; E85-M87 VanDerWaalsContact C-N 3.29Å; E85-M87 PolarHBondContact O-N 3.4Å; E85-L88 PolarHBondContact O-N 3.41Å; E85-R89 WeakPolarHBondContact O-CG 3.45Å; E85-R89 PolarHBondContact O-N 3.29Å; E85-R89 IonicContact OE1-CZ 2.85Å; E85-R89 IonicContact OE1-NE 2.69Å; E85-R89 PolarHBondContact OE1-NE 2.75Å; E85-R89 IonicContact OE1-NH2 3.73Å; E85-R89 PolarHBondContact OE1-NH2 2.88Å
86	M	94.4	Very high	95	Very high	86 Å²	86	52.7 Å²	52.7	42%	0.424	25%	0.252	S	S	.	.	H	α-helix	trans	-65.2	-37	176.6	-66.2	-62.9	168.3	0	0	111.4	S83 F84 R89 S90	S83-M86 PolarHBondContact O-N 3.48Å; S83-M86 VanDerWaalsContact O-N 3.12Å; S83-M86 PolarHBondContact OG-N 3.22Å; F84-M86 VanDerWaalsContact C-N 3.35Å; F84-M86 PolarHBondContact O-N 2.64Å; M86-R89 PolarHBondContact O-N 3.01Å; M86-S90 PolarHBondContact O-N 2.95Å
87	M	96.4	Very high	95.3	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-63.7	-47.5	173.1	-171.9	-77	-68.6	0	0	111.5	W80 S83 F84 E85 R89 S90 F97 F186	W80-M87 HydrophobicContact CB-CB 3.8Å; W80-M87 HydrophobicContact CB-CG 4.01Å; W80-M87 HydrophobicContact CD2-CB 4.37Å; W80-M87 HydrophobicContact CD2-CG 3.93Å; W80-M87 HydrophobicContact CE3-CG 4.26Å; W80-M87 HydrophobicContact CG-CB 3.74Å; W80-M87 HydrophobicContact CG-CG 3.8Å; S83-M87 PolarHBondContact O-N 3.08Å; F84-M87 HydrophobicContact CD2-CE 3.44Å; F84-M87 VanDerWaalsContact CD2-CE 3.44Å; F84-M87 HydrophobicContact CE2-CE 3.18Å; F84-M87 HydrophobicContact CZ-CE 4.31Å; F84-M87 WeakPolarHBondContact O-CB 3.37Å; F84-M87 PolarHBondContact O-N 3.13Å; E85-M87 VanDerWaalsContact C-N 3.29Å; E85-M87 PolarHBondContact O-N 3.4Å; M87-R89 PolarHBondContact O-N 3.3Å; M87-S90 WeakPolarHBondContact O-CB 3.44Å; M87-S90 PolarHBondContact O-N 3.19Å; M87-S90 VanDerWaalsContact O-N 3.14Å; M87-F97 HydrophobicContact CE-CB 3.79Å; M87-F97 HydrophobicContact CE-CD1 3.42Å; M87-F97 VanDerWaalsContact CE-CD1 3.42Å; M87-F97 HydrophobicContact CE-CD2 4.18Å; M87-F97 HydrophobicContact CE-CE1 3.97Å; M87-F97 HydrophobicContact CE-CG 3.53Å; M87-F97 HydrophobicContact SD-CB 3.73Å; M87-F97 HydrophobicContact SD-CD1 4.37Å; M87-F97 HydrophobicContact SD-CG 4.18Å; M87-F186 HydrophobicContact CB-CE2 4.35Å; M87-F186 HydrophobicContact CE-CD2 4.12Å; M87-F186 HydrophobicContact CE-CE2 4.12Å; M87-F186 HydrophobicContact CG-CE2 4.36Å
88	L	96.6	Very high	95.5	Very high	4 Å²	4	52.8 Å²	52.8	2%	0.021	25%	0.25	C	C	.	.	H	α-helix	trans	-66.6	-22.4	179.4	-70.4	-174.7	0	0	0	113.8	F84 E85 R94 L110 W113 Y178	F84-L88 HydrophobicContact CD1-CD1 4.19Å; F84-L88 HydrophobicContact CD2-CG 4.35Å; F84-L88 HydrophobicContact CE1-CD1 3.74Å; F84-L88 HydrophobicContact CE1-CG 4.29Å; F84-L88 HydrophobicContact CE2-CD1 4.38Å; F84-L88 HydrophobicContact CE2-CD2 4.08Å; F84-L88 HydrophobicContact CE2-CG 4.06Å; F84-L88 HydrophobicContact CZ-CD1 3.84Å; F84-L88 HydrophobicContact CZ-CD2 4.03Å; F84-L88 HydrophobicContact CZ-CG 4Å; F84-L88 PolarHBondContact O-N 2.81Å; E85-L88 PolarHBondContact O-N 3.41Å; L88-R94 HydrophobicContact CD2-CG 4.43Å; L88-R94 VanDerWaalsContact O-CD 3.23Å; L88-R94 WeakPolarHBondContact O-CD 3.26Å; L88-R94 WeakPolarHBondContact O-CG 3.29Å; L88-R94 PolarHBondContact O-NH1 2.9Å; L88-L110 HydrophobicContact CD2-CD1 3.58Å; L88-W113 HydrophobicContact CB-CH2 4.11Å; L88-W113 HydrophobicContact CB-CZ3 4.27Å; L88-W113 HydrophobicContact CD1-CD2 4.19Å; L88-W113 HydrophobicContact CD1-CE3 4.29Å; L88-W113 HydrophobicContact CD1-CH2 3.98Å; L88-W113 HydrophobicContact CD1-CZ2 3.86Å; L88-W113 HydrophobicContact CD1-CZ3 4.18Å; L88-Y178 HydrophobicContact CD1-CD2 3.74Å; L88-Y178 HydrophobicContact CD1-CE2 3.69Å
89	R	94	Very high	95.7	Very high	157 Å²	157	53.5 Å²	53.5	59%	0.592	25%	0.254	S	S	*	.	H	α-helix	trans	-75.3	-32.4	173.7	-73.2	175	-174.6	-163.3	2.1	112.4	E85 M86 M87 R94	E85-R89 WeakPolarHBondContact O-CG 3.45Å; E85-R89 PolarHBondContact O-N 3.29Å; E85-R89 IonicContact OE1-CZ 2.85Å; E85-R89 IonicContact OE1-NE 2.69Å; E85-R89 PolarHBondContact OE1-NE 2.75Å; E85-R89 IonicContact OE1-NH2 3.73Å; E85-R89 PolarHBondContact OE1-NH2 2.88Å; M86-R89 PolarHBondContact O-N 3.01Å; M87-R89 PolarHBondContact O-N 3.3Å; R89-R94 PolarHBondContact O-NH1 2.75Å
90	S	94.8	Very high	95.9	Very high	12 Å²	12	52.3 Å²	52.3	8%	0.084	24%	0.244	C	C	.	.	S	Bend	trans	-70.9	133.1	176.4	173.1	0	0	0	0	111.3	E76 W80 M86 M87 E92 G93 R94	E76-S90 VanDerWaalsContact OE1-CB 3.24Å; E76-S90 WeakPolarHBondContact OE1-CB 3.41Å; E76-S90 PolarHBondContact OE1-OG 2.97Å; W80-S90 WeakPolarHBondContact CZ2-OG 3.27Å; M86-S90 PolarHBondContact O-N 2.95Å; M87-S90 WeakPolarHBondContact O-CB 3.44Å; M87-S90 PolarHBondContact O-N 3.19Å; M87-S90 VanDerWaalsContact O-N 3.14Å; S90-E92 PolarHBondContact OG-N 3.25Å; S90-E92 PolarHBondContact OG-OE2 2.89Å; S90-G93 PolarHBondContact OG-N 3.37Å; S90-R94 WeakPolarHBondContact O-CG 3.09Å; S90-R94 PolarHBondContact O-N 3.4Å; S90-R94 VanDerWaalsContact O-N 3.09Å
91	L	93.8	Very high	96	Very high	97 Å²	97	52.3 Å²	52.3	51%	0.508	24%	0.244	S	C	.	.	H	α-helix	trans	-66.1	-46.5	175.7	178.1	64.1	0	0	0	110.1	G93 R94 E95	L91-G93 VanDerWaalsContact C-N 3.34Å; L91-G93 PolarHBondContact O-N 3.49Å; L91-R94 PolarHBondContact O-N 2.68Å; L91-E95 WeakPolarHBondContact O-CG 3.43Å; L91-E95 PolarHBondContact O-N 2.95Å
92	E	94.2	Very high	96.2	Very high	59 Å²	59	55 Å²	55	28%	0.276	24%	0.244	S	C	.	.	H	α-helix	trans	-63.4	-41.6	178.1	-63.7	70.9	-158.3	0	0	110.9	Q70 P72 W80 S90 E95 I96	Q70-E92 WeakPolarHBondContact O-CG 3.3Å; P72-E92 HydrophobicContact CB-CB 4.31Å; P72-E92 HydrophobicContact CG-CB 4.37Å; W80-E92 HydrophobicContact CH2-CB 4.35Å; W80-E92 HydrophobicContact CZ2-CB 4.44Å; S90-E92 PolarHBondContact OG-N 3.25Å; S90-E92 PolarHBondContact OG-OE2 2.89Å; E92-E95 PolarHBondContact O-N 3.45Å; E92-I96 WeakPolarHBondContact O-CB 3.25Å; E92-I96 WeakPolarHBondContact O-CD1 3.32Å; E92-I96 VanDerWaalsContact O-CG1 3.3Å; E92-I96 WeakPolarHBondContact O-CG1 3.35Å; E92-I96 PolarHBondContact O-N 2.98Å
93	G	95.8	Very high	96.5	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-57.8	-49.7	175	0	0	0	0	0	111.7	S90 L91 E95 F97	S90-G93 PolarHBondContact OG-N 3.37Å; L91-G93 VanDerWaalsContact C-N 3.34Å; L91-G93 PolarHBondContact O-N 3.49Å; G93-E95 PolarHBondContact O-N 2.86Å; G93-F97 WeakPolarHBondContact O-CB 3.32Å; G93-F97 PolarHBondContact O-N 3.42Å
94	R	97.8	Very high	96.6	Very high	56 Å²	56	50 Å²	50	21%	0.211	24%	0.235	C	C	.	.	H	α-helix	trans	-59.8	-45.7	176.3	-71.6	-173.1	-62.2	-98.5	3.5	112.4	L88 R89 S90 L91 F97 R98 L110	L88-R94 HydrophobicContact CD2-CG 4.43Å; L88-R94 VanDerWaalsContact O-CD 3.23Å; L88-R94 WeakPolarHBondContact O-CD 3.26Å; L88-R94 WeakPolarHBondContact O-CG 3.29Å; L88-R94 PolarHBondContact O-NH1 2.9Å; R89-R94 PolarHBondContact O-NH1 2.75Å; S90-R94 WeakPolarHBondContact O-CG 3.09Å; S90-R94 PolarHBondContact O-N 3.4Å; S90-R94 VanDerWaalsContact O-N 3.09Å; L91-R94 PolarHBondContact O-N 2.68Å; R94-F97 PolarHBondContact O-N 2.93Å; R94-R98 VanDerWaalsContact O-CB 3.26Å; R94-R98 WeakPolarHBondContact O-CB 3.34Å; R94-R98 PolarHBondContact O-N 3.39Å; R94-L110 WeakPolarHBondContact O-CD2 3.47Å
95	E	96.6	Very high	96.6	Very high	69 Å²	69	60.2 Å²	60.2	32%	0.322	28%	0.275	S	S	.	.	H	α-helix	trans	-63.9	-47.9	-178.6	-74.4	-61.8	131.5	0	0	111.9	L91 E92 G93 F97 R98 D99	L91-E95 WeakPolarHBondContact O-CG 3.43Å; L91-E95 PolarHBondContact O-N 2.95Å; E92-E95 PolarHBondContact O-N 3.45Å; G93-E95 PolarHBondContact O-N 2.86Å; E95-F97 VanDerWaalsContact C-N 3.34Å; E95-F97 PolarHBondContact O-N 2.94Å; E95-R98 WeakPolarHBondContact O-CB 3.5Å; E95-R98 PolarHBondContact O-N 3.07Å; E95-R98 IonicContact OE1-CZ 3.24Å; E95-R98 IonicContact OE1-NH1 2.95Å; E95-R98 PolarHBondContact OE1-NH1 3.33Å; E95-R98 IonicContact OE1-NH2 2.75Å; E95-R98 IonicContact OE2-CZ 3.74Å; E95-R98 IonicContact OE2-NE 3.45Å; E95-R98 IonicContact OE2-NH1 3.75Å; E95-R98 PolarHBondContact OE2-NH1 3.47Å; E95-R98 IonicContact OE2-NH2 2.93Å; E95-R98 PolarHBondContact OE2-NH2 3.25Å; E95-D99 PolarHBondContact O-N 3.18Å
96	I	96.8	Very high	96.7	Very high	30 Å²	30	57 Å²	57	15%	0.154	26%	0.262	C	S	.	.	H	α-helix	trans	-63.9	-41.8	177.9	-70	164.3	0	0	0	111	P72 W80 E92 R98 D99 F100 F189 V194 L198	P72-I96 HydrophobicContact CG-CD1 4.2Å; W80-I96 HydrophobicContact CH2-CD1 3.96Å; W80-I96 HydrophobicContact CZ3-CD1 4.1Å; E92-I96 WeakPolarHBondContact O-CB 3.25Å; E92-I96 WeakPolarHBondContact O-CD1 3.32Å; E92-I96 VanDerWaalsContact O-CG1 3.3Å; E92-I96 WeakPolarHBondContact O-CG1 3.35Å; E92-I96 PolarHBondContact O-N 2.98Å; I96-R98 VanDerWaalsContact C-N 3.35Å; I96-D99 PolarHBondContact O-N 3.36Å; I96-F100 PolarHBondContact O-N 3.3Å; I96-F100 VanDerWaalsContact O-N 3.12Å; I96-F189 HydrophobicContact CG2-CE2 3.73Å; I96-F189 HydrophobicContact CG2-CZ 3.78Å; I96-V194 HydrophobicContact CG2-CG1 4.12Å; I96-L198 HydrophobicContact CD1-CD1 3.84Å; I96-L198 HydrophobicContact CD1-CD2 4.25Å; I96-L198 HydrophobicContact CG1-CD1 4.37Å; I96-L198 HydrophobicContact CG2-CD1 3.53Å
97	F	98.3	Very high	96.9	Very high	0 Å²	0	55 Å²	55	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-67.7	-37	177.2	-174	-124.9	0	0	0	111.6	F84 M87 G93 R94 E95 D99 F100 L101 L110 M181 F186 F189	F84-F97 HydrophobicContact CE2-CD1 4.23Å; F84-F97 AromaticContact CE2-CE1 3.64Å; F84-F97 HydrophobicContact CE2-CE1 3.64Å; F84-F97 AromaticContact CE2-CZ 3.94Å; F84-F97 HydrophobicContact CE2-CZ 3.94Å; F84-F97 AromaticContact CZ-CE1 3.9Å; F84-F97 HydrophobicContact CZ-CE1 3.9Å; F84-F97 HydrophobicContact CZ-CZ 4.34Å; M87-F97 HydrophobicContact CE-CB 3.79Å; M87-F97 HydrophobicContact CE-CD1 3.42Å; M87-F97 VanDerWaalsContact CE-CD1 3.42Å; M87-F97 HydrophobicContact CE-CD2 4.18Å; M87-F97 HydrophobicContact CE-CE1 3.97Å; M87-F97 HydrophobicContact CE-CG 3.53Å; M87-F97 HydrophobicContact SD-CB 3.73Å; M87-F97 HydrophobicContact SD-CD1 4.37Å; M87-F97 HydrophobicContact SD-CG 4.18Å; G93-F97 WeakPolarHBondContact O-CB 3.32Å; G93-F97 PolarHBondContact O-N 3.42Å; R94-F97 PolarHBondContact O-N 2.93Å; E95-F97 VanDerWaalsContact C-N 3.34Å; E95-F97 PolarHBondContact O-N 2.94Å; F97-D99 PolarHBondContact O-N 3.16Å; F97-F100 HydrophobicContact CD2-CD1 4.14Å; F97-F100 HydrophobicContact CE2-CD1 4.04Å; F97-F100 HydrophobicContact CE2-CE1 4.48Å; F97-F100 WeakPolarHBondContact O-CB 3.13Å; F97-F100 PolarHBondContact O-N 2.63Å; F97-L101 HydrophobicContact CD1-CD1 3.8Å; F97-L101 HydrophobicContact CD1-CG 4.26Å; F97-L101 HydrophobicContact CD2-CG 4.42Å; F97-L101 HydrophobicContact CE1-CD1 3.56Å; F97-L101 HydrophobicContact CE1-CD2 4.23Å; F97-L101 HydrophobicContact CE1-CG 4.02Å; F97-L101 HydrophobicContact CE2-CD2 4.1Å; F97-L101 HydrophobicContact CE2-CG 4.17Å; F97-L101 HydrophobicContact CG-CD1 4.44Å; F97-L101 HydrophobicContact CG-CG 4.46Å; F97-L101 HydrophobicContact CZ-CD1 4.01Å; F97-L101 HydrophobicContact CZ-CD2 3.79Å; F97-L101 HydrophobicContact CZ-CG 3.98Å; F97-L101 VanDerWaalsContact O-CG 3.29Å; F97-L101 WeakPolarHBondContact O-CG 3.41Å; F97-L101 PolarHBondContact O-N 2.85Å; F97-L110 HydrophobicContact CD1-CD2 4.11Å; F97-M181 HydrophobicContact CE1-CB 4.46Å; F97-M181 HydrophobicContact CE1-SD 4.01Å; F97-M181 HydrophobicContact CZ-CB 4.45Å; F97-F186 HydrophobicContact CE2-CB 4.36Å; F97-F186 HydrophobicContact CE2-CD2 4.3Å; F97-F186 HydrophobicContact CZ-CB 4.22Å; F97-F189 HydrophobicContact CD2-CB 3.85Å; F97-F189 AromaticContact CD2-CD1 3.94Å; F97-F189 HydrophobicContact CD2-CD1 3.94Å; F97-F189 HydrophobicContact CD2-CD2 4.05Å; F97-F189 AromaticContact CD2-CG 3.66Å; F97-F189 HydrophobicContact CD2-CG 3.66Å; F97-F189 HydrophobicContact CE2-CB 3.74Å; F97-F189 HydrophobicContact CE2-CD1 4.43Å; F97-F189 HydrophobicContact CE2-CG 4.08Å
98	R	98.3	Very high	97	Very high	53 Å²	53	56.6 Å²	56.6	20%	0.2	26%	0.26	C	S	.	.	H	α-helix	trans	-59.2	-46.9	174	-169.5	-179.6	70.1	-165.8	6.7	111.3	R94 E95 I96 F100 L101 R102 E107 L110	R94-R98 VanDerWaalsContact O-CB 3.26Å; R94-R98 WeakPolarHBondContact O-CB 3.34Å; R94-R98 PolarHBondContact O-N 3.39Å; E95-R98 WeakPolarHBondContact O-CB 3.5Å; E95-R98 PolarHBondContact O-N 3.07Å; E95-R98 IonicContact OE1-CZ 3.24Å; E95-R98 IonicContact OE1-NH1 2.95Å; E95-R98 PolarHBondContact OE1-NH1 3.33Å; E95-R98 IonicContact OE1-NH2 2.75Å; E95-R98 IonicContact OE2-CZ 3.74Å; E95-R98 IonicContact OE2-NE 3.45Å; E95-R98 IonicContact OE2-NH1 3.75Å; E95-R98 PolarHBondContact OE2-NH1 3.47Å; E95-R98 IonicContact OE2-NH2 2.93Å; E95-R98 PolarHBondContact OE2-NH2 3.25Å; I96-R98 VanDerWaalsContact C-N 3.35Å; R98-F100 VanDerWaalsContact C-N 3.3Å; R98-F100 PolarHBondContact O-N 3.07Å; R98-L101 PolarHBondContact O-N 3.26Å; R98-R102 WeakPolarHBondContact O-CB 3.38Å; R98-R102 PolarHBondContact O-N 2.91Å; R98-E107 HydrophobicContact CG-CB 4.28Å; R98-L110 HydrophobicContact CB-CD2 3.76Å; R98-L110 HydrophobicContact CG-CD2 4.32Å
99	D	97.8	Very high	97.1	Very high	82 Å²	82	57.3 Å²	57.3	44%	0.439	26%	0.264	S	S	.	.	H	α-helix	trans	-63.1	-38.6	178.6	-74.6	-18.5	0	0	0	111.9	E95 I96 F97 R102 S103	E95-D99 PolarHBondContact O-N 3.18Å; I96-D99 PolarHBondContact O-N 3.36Å; F97-D99 PolarHBondContact O-N 3.16Å; D99-R102 PolarHBondContact O-N 3.12Å; D99-R102 IonicContact OD1-CZ 2.75Å; D99-R102 IonicContact OD1-NH1 3.52Å; D99-R102 PolarHBondContact OD1-NH1 2.94Å; D99-S103 PolarHBondContact O-N 3.35Å; D99-S103 VanDerWaalsContact O-N 3.16Å
100	F	98.3	Very high	97.3	Very high	9 Å²	9	49.9 Å²	49.9	4%	0.039	24%	0.236	C	C	.	.	H	α-helix	trans	-60.5	-50.7	170.8	171.1	-95.1	0	0	0	111.6	I96 F97 R98 R102 S103 E104 S185 R188 F189	I96-F100 PolarHBondContact O-N 3.3Å; I96-F100 VanDerWaalsContact O-N 3.12Å; F97-F100 HydrophobicContact CD2-CD1 4.14Å; F97-F100 HydrophobicContact CE2-CD1 4.04Å; F97-F100 HydrophobicContact CE2-CE1 4.48Å; F97-F100 WeakPolarHBondContact O-CB 3.13Å; F97-F100 PolarHBondContact O-N 2.63Å; R98-F100 VanDerWaalsContact C-N 3.3Å; R98-F100 PolarHBondContact O-N 3.07Å; F100-R102 VanDerWaalsContact C-N 3.29Å; F100-R102 PolarHBondContact O-N 3.37Å; F100-S103 WeakPolarHBondContact O-CB 3.42Å; F100-S103 PolarHBondContact O-N 3.42Å; F100-S103 VanDerWaalsContact O-N 3.14Å; F100-S103 PolarHBondContact O-OG 3.39Å; F100-E104 WeakPolarHBondContact CE1-OE2 3.31Å; F100-E104 HydrophobicContact CZ-CG 4.41Å; F100-E104 WeakPolarHBondContact CZ-OE1 3.47Å; F100-E104 WeakPolarHBondContact CZ-OE2 3.45Å; F100-E104 PolarHBondContact O-N 3.16Å; F100-S185 WeakPolarHBondContact CE1-O 3.44Å; F100-R188 HydrophobicContact CZ-CB 3.96Å; F100-F189 HydrophobicContact CB-CD2 3.73Å; F100-F189 HydrophobicContact CB-CE2 4.3Å; F100-F189 HydrophobicContact CD1-CB 3.66Å; F100-F189 HydrophobicContact CD1-CD2 4.07Å; F100-F189 HydrophobicContact CD1-CG 4.29Å; F100-F189 HydrophobicContact CD2-CB 4.42Å; F100-F189 HydrophobicContact CD2-CD2 4.09Å; F100-F189 HydrophobicContact CE1-CB 3.68Å; F100-F189 HydrophobicContact CE2-CB 4.43Å; F100-F189 HydrophobicContact CG-CB 4.05Å; F100-F189 AromaticContact CG-CD2 3.67Å; F100-F189 HydrophobicContact CG-CD2 3.67Å; F100-F189 HydrophobicContact CG-CG 4.33Å; F100-F189 HydrophobicContact CZ-CB 4.08Å
101	L	98.4	Very high	97.5	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61.3	-36.6	179	-69.1	175.8	0	0	0	112.5	F97 R98 S103 E104 Y105 S106 E107 L110 M181	F97-L101 HydrophobicContact CD1-CD1 3.8Å; F97-L101 HydrophobicContact CD1-CG 4.26Å; F97-L101 HydrophobicContact CD2-CG 4.42Å; F97-L101 HydrophobicContact CE1-CD1 3.56Å; F97-L101 HydrophobicContact CE1-CD2 4.23Å; F97-L101 HydrophobicContact CE1-CG 4.02Å; F97-L101 HydrophobicContact CE2-CD2 4.1Å; F97-L101 HydrophobicContact CE2-CG 4.17Å; F97-L101 HydrophobicContact CG-CD1 4.44Å; F97-L101 HydrophobicContact CG-CG 4.46Å; F97-L101 HydrophobicContact CZ-CD1 4.01Å; F97-L101 HydrophobicContact CZ-CD2 3.79Å; F97-L101 HydrophobicContact CZ-CG 3.98Å; F97-L101 VanDerWaalsContact O-CG 3.29Å; F97-L101 WeakPolarHBondContact O-CG 3.41Å; F97-L101 PolarHBondContact O-N 2.85Å; R98-L101 PolarHBondContact O-N 3.26Å; L101-S103 VanDerWaalsContact C-N 3.32Å; L101-S103 PolarHBondContact O-N 3.46Å; L101-E104 CarbonylContact O-C 3.52Å; L101-E104 VanDerWaalsContact O-C 3.25Å; L101-E104 WeakPolarHBondContact O-CA 3.45Å; L101-E104 PolarHBondContact O-N 3.2Å; L101-Y105 PolarHBondContact O-N 3.15Å; L101-S106 WeakPolarHBondContact CD2-OG 3.31Å; L101-S106 PolarHBondContact O-N 2.99Å; L101-S106 PolarHBondContact O-OG 3.36Å; L101-E107 HydrophobicContact CB-CB 4.12Å; L101-L110 HydrophobicContact CD1-CB 3.62Å; L101-L110 HydrophobicContact CD1-CD2 4.22Å; L101-M181 HydrophobicContact CD1-SD 4.06Å
102	R	98.2	Very high	97.8	Very high	106 Å²	106	46.7 Å²	46.7	40%	0.4	22%	0.218	S	C	.	.	H	α-helix	trans	-61.3	-41.5	175.5	-174.9	-177.8	-65.9	136.9	7.4	111.4	R98 D99 F100 E104 Y105 E107	R98-R102 WeakPolarHBondContact O-CB 3.38Å; R98-R102 PolarHBondContact O-N 2.91Å; D99-R102 PolarHBondContact O-N 3.12Å; D99-R102 IonicContact OD1-CZ 2.75Å; D99-R102 IonicContact OD1-NH1 3.52Å; D99-R102 PolarHBondContact OD1-NH1 2.94Å; F100-R102 VanDerWaalsContact C-N 3.29Å; F100-R102 PolarHBondContact O-N 3.37Å; R102-E104 PolarHBondContact O-N 3.34Å; R102-E104 VanDerWaalsContact O-N 3.11Å; R102-Y105 PolarHBondContact O-N 2.99Å; R102-E107 HydrophobicContact CB-CB 4.28Å; R102-E107 HydrophobicContact CB-CG 4.44Å; R102-E107 WeakPolarHBondContact CB-OE2 3.36Å; R102-E107 IonicContact CZ-OE2 3.78Å; R102-E107 VanDerWaalsContact CZ-OE2 3.24Å; R102-E107 IonicContact NE-OE1 2.68Å; R102-E107 PolarHBondContact NE-OE1 3.34Å; R102-E107 IonicContact NE-OE2 3.47Å; R102-E107 PolarHBondContact NE-OE2 3.11Å; R102-E107 IonicContact NH2-OE2 2.7Å; R102-E107 PolarHBondContact NH2-OE2 3.45Å
103	S	97.6	Very high	98	Very high	80 Å²	80	45.4 Å²	45.4	56%	0.559	21%	0.211	S	C	*	.	H	α-helix	trans	-61.8	-18.8	175.9	80.4	0	0	0	0	113.1	D99 F100 L101	D99-S103 PolarHBondContact O-N 3.35Å; D99-S103 VanDerWaalsContact O-N 3.16Å; F100-S103 WeakPolarHBondContact O-CB 3.42Å; F100-S103 PolarHBondContact O-N 3.42Å; F100-S103 VanDerWaalsContact O-N 3.14Å; F100-S103 PolarHBondContact O-OG 3.39Å; L101-S103 VanDerWaalsContact C-N 3.32Å; L101-S103 PolarHBondContact O-N 3.46Å
104	E	97.2	Very high	98.1	Very high	61 Å²	61	47.6 Å²	47.6	29%	0.285	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.7	15	179.1	-54.7	-171.5	149.3	0	0	112.9	F100 L101 R102 S106 R188	F100-E104 WeakPolarHBondContact CE1-OE2 3.31Å; F100-E104 HydrophobicContact CZ-CG 4.41Å; F100-E104 WeakPolarHBondContact CZ-OE1 3.47Å; F100-E104 WeakPolarHBondContact CZ-OE2 3.45Å; F100-E104 PolarHBondContact O-N 3.16Å; L101-E104 CarbonylContact O-C 3.52Å; L101-E104 VanDerWaalsContact O-C 3.25Å; L101-E104 WeakPolarHBondContact O-CA 3.45Å; L101-E104 PolarHBondContact O-N 3.2Å; R102-E104 PolarHBondContact O-N 3.34Å; R102-E104 VanDerWaalsContact O-N 3.11Å; E104-S106 PolarHBondContact O-N 3.37Å; E104-R188 IonicContact OE1-CZ 2.64Å; E104-R188 IonicContact OE1-NH1 3.42Å; E104-R188 PolarHBondContact OE1-NH1 3.19Å; E104-R188 IonicContact OE2-CZ 3.35Å; E104-R188 IonicContact OE2-NH1 3.37Å; E104-R188 PolarHBondContact OE2-NH1 2.69Å; E104-R188 IonicContact OE2-NH2 3.42Å; E104-R188 PolarHBondContact OE2-NH2 3.45Å
105	Y	97.1	Very high	98.2	Very high	216 Å²	216	46.1 Å²	46.1	85%	0.847	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.7	37	178.1	-51	-87	0	0	0	113.9	L101 R102	L101-Y105 PolarHBondContact O-N 3.15Å; R102-Y105 PolarHBondContact O-N 2.99Å
106	S	98.4	Very high	98.3	Very high	19 Å²	19	42.9 Å²	42.9	13%	0.133	21%	0.207	C	C	.	.			trans	-131.2	17.6	-176.4	61.1	0	0	0	0	113.5	L101 E104 D108 N109	L101-S106 WeakPolarHBondContact CD2-OG 3.31Å; L101-S106 PolarHBondContact O-N 2.99Å; L101-S106 PolarHBondContact O-OG 3.36Å; E104-S106 PolarHBondContact O-N 3.37Å; S106-D108 VanDerWaalsContact C-N 3.26Å; S106-D108 PolarHBondContact O-N 3.04Å; S106-N109 WeakPolarHBondContact O-CB 3.49Å; S106-N109 PolarHBondContact O-N 2.93Å; S106-N109 PolarHBondContact O-ND2 3.07Å
107	E	98.6	Very high	98.3	Very high	45 Å²	45	43.9 Å²	43.9	21%	0.21	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-27.1	-178.1	67.7	179.4	162.8	0	0	113.4	R98 L101 R102 N109 L110 L111	R98-E107 HydrophobicContact CG-CB 4.28Å; L101-E107 HydrophobicContact CB-CB 4.12Å; R102-E107 HydrophobicContact CB-CB 4.28Å; R102-E107 HydrophobicContact CB-CG 4.44Å; R102-E107 WeakPolarHBondContact CB-OE2 3.36Å; R102-E107 IonicContact CZ-OE2 3.78Å; R102-E107 VanDerWaalsContact CZ-OE2 3.24Å; R102-E107 IonicContact NE-OE1 2.68Å; R102-E107 PolarHBondContact NE-OE1 3.34Å; R102-E107 IonicContact NE-OE2 3.47Å; R102-E107 PolarHBondContact NE-OE2 3.11Å; R102-E107 IonicContact NH2-OE2 2.7Å; R102-E107 PolarHBondContact NH2-OE2 3.45Å; E107-N109 PolarHBondContact O-N 3.45Å; E107-N109 VanDerWaalsContact O-N 3.14Å; E107-L110 PolarHBondContact O-N 2.75Å; E107-L111 HydrophobicContact CG-CD1 4.47Å; E107-L111 PolarHBondContact O-N 3.14Å; E107-L111 VanDerWaalsContact O-N 3.08Å
108	D	98.7	Very high	98.3	Very high	34 Å²	34	47.8 Å²	47.8	18%	0.182	23%	0.23	C	C	.	.	H	α-helix	trans	-59.1	-28.4	179	-62.2	-56.8	0	0	0	112.6	S106 L110 L111 F112 Y139 K146 V148	S106-D108 VanDerWaalsContact C-N 3.26Å; S106-D108 PolarHBondContact O-N 3.04Å; D108-L110 VanDerWaalsContact C-N 3.35Å; D108-L110 PolarHBondContact O-N 2.88Å; D108-L111 PolarHBondContact O-N 3.14Å; D108-F112 VanDerWaalsContact O-CB 3.24Å; D108-F112 WeakPolarHBondContact O-CB 3.44Å; D108-F112 PolarHBondContact O-N 3.16Å; D108-Y139 HydrophobicContact CB-CD1 4.43Å; D108-Y139 HydrophobicContact CB-CE1 4.39Å; D108-K146 HydrophobicContact CB-CB 4.23Å; D108-K146 WeakPolarHBondContact OD1-CB 3.28Å; D108-K146 WeakPolarHBondContact OD1-CD 3.32Å; D108-K146 VanDerWaalsContact OD1-CG 3.26Å; D108-K146 WeakPolarHBondContact OD1-CG 3.46Å; D108-V148 HydrophobicContact CB-CG1 4.32Å
109	N	98.8	Very high	98.4	Very high	19 Å²	19	45.4 Å²	45.4	10%	0.102	22%	0.22	C	C	.	.	H	α-helix	trans	-60.4	-43.7	173.9	-68.6	-47.4	0	0	0	112.1	S106 E107 W113 I177 M181	S106-N109 WeakPolarHBondContact O-CB 3.49Å; S106-N109 PolarHBondContact O-N 2.93Å; S106-N109 PolarHBondContact O-ND2 3.07Å; E107-N109 PolarHBondContact O-N 3.45Å; E107-N109 VanDerWaalsContact O-N 3.14Å; N109-W113 WeakPolarHBondContact O-CB 3.44Å; N109-W113 PolarHBondContact O-N 3.48Å; N109-W113 VanDerWaalsContact O-N 3.13Å; N109-I177 HydrophobicContact CB-CG2 3.65Å; N109-I177 WeakPolarHBondContact O-CG2 3.35Å; N109-M181 HydrophobicContact CB-CG 3.74Å; N109-M181 HydrophobicContact CB-SD 3.68Å
110	L	98.8	Very high	98.4	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-73.8	-41.1	178.7	178.9	62.1	0	0	0	110.8	L88 R94 F97 R98 L101 E107 D108 F112 W113 L114 M181	L88-L110 HydrophobicContact CD2-CD1 3.58Å; R94-L110 WeakPolarHBondContact O-CD2 3.47Å; F97-L110 HydrophobicContact CD1-CD2 4.11Å; R98-L110 HydrophobicContact CB-CD2 3.76Å; R98-L110 HydrophobicContact CG-CD2 4.32Å; L101-L110 HydrophobicContact CD1-CB 3.62Å; L101-L110 HydrophobicContact CD1-CD2 4.22Å; E107-L110 PolarHBondContact O-N 2.75Å; D108-L110 VanDerWaalsContact C-N 3.35Å; D108-L110 PolarHBondContact O-N 2.88Å; L110-F112 PolarHBondContact O-N 3.04Å; L110-W113 PolarHBondContact O-N 3.44Å; L110-L114 HydrophobicContact CD1-CD1 4.3Å; L110-L114 HydrophobicContact CD1-CG 4.28Å; L110-L114 HydrophobicContact CG-CD1 4.05Å; L110-L114 HydrophobicContact CG-CG 4.46Å; L110-L114 VanDerWaalsContact O-CG 3.31Å; L110-L114 WeakPolarHBondContact O-CG 3.46Å; L110-L114 PolarHBondContact O-N 3.45Å; L110-M181 HydrophobicContact CB-SD 3.94Å; L110-M181 HydrophobicContact CD1-CE 4.46Å
111	L	98.8	Very high	98.4	Very high	42 Å²	42	51 Å²	51	22%	0.22	24%	0.241	C	C	.	.	H	α-helix	trans	-62.3	-43.6	178.5	-64	178.5	0	0	0	111.8	E107 D108 L114 A115 Y139	E107-L111 HydrophobicContact CG-CD1 4.47Å; E107-L111 PolarHBondContact O-N 3.14Å; E107-L111 VanDerWaalsContact O-N 3.08Å; D108-L111 PolarHBondContact O-N 3.14Å; L111-L114 PolarHBondContact O-N 3.01Å; L111-A115 WeakPolarHBondContact O-CB 3.43Å; L111-A115 PolarHBondContact O-N 3.31Å; L111-Y139 HydrophobicContact CB-CE1 3.93Å; L111-Y139 WeakPolarHBondContact CB-OH 3.49Å
112	F	98.9	Very high	98.3	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-58.9	-47.7	172.2	170.9	-106.6	0	0	0	111.7	D108 L110 L114 A115 C116 I135 Y139 V140 V148 Y170 A173 I177	D108-F112 VanDerWaalsContact O-CB 3.24Å; D108-F112 WeakPolarHBondContact O-CB 3.44Å; D108-F112 PolarHBondContact O-N 3.16Å; L110-F112 PolarHBondContact O-N 3.04Å; F112-L114 VanDerWaalsContact C-N 3.3Å; F112-L114 PolarHBondContact O-N 3.31Å; F112-A115 PolarHBondContact O-N 3.27Å; F112-C116 VanDerWaalsContact CE2-SG 3.59Å; F112-C116 VanDerWaalsContact CZ-SG 3.56Å; F112-C116 PolarHBondContact O-N 2.87Å; F112-C116 PolarHBondContact O-SG 3.43Å; F112-I135 HydrophobicContact CD2-CG2 4.02Å; F112-I135 HydrophobicContact CE2-CG2 3.79Å; F112-Y139 HydrophobicContact CB-CD1 3.86Å; F112-Y139 HydrophobicContact CB-CD2 4.3Å; F112-Y139 HydrophobicContact CB-CE1 4.4Å; F112-Y139 HydrophobicContact CB-CG 3.81Å; F112-Y139 VanDerWaalsContact CD2-CB 3.46Å; F112-Y139 HydrophobicContact CD2-CD2 4.07Å; F112-Y139 AromaticContact CD2-CG 3.85Å; F112-Y139 HydrophobicContact CD2-CG 3.85Å; F112-Y139 HydrophobicContact CG-CG 4.29Å; F112-V140 HydrophobicContact CE2-CG2 4.2Å; F112-V148 HydrophobicContact CB-CG1 3.83Å; F112-V148 HydrophobicContact CD1-CG2 4.06Å; F112-V148 HydrophobicContact CD2-CG2 4.31Å; F112-V148 HydrophobicContact CE1-CG2 4.36Å; F112-V148 HydrophobicContact CG-CG1 4.24Å; F112-V148 HydrophobicContact CG-CG2 4.02Å; F112-Y170 HydrophobicContact CE2-CD1 4.38Å; F112-Y170 HydrophobicContact CZ-CD1 4.46Å; F112-A173 HydrophobicContact CE1-CB 4.14Å; F112-A173 HydrophobicContact CZ-CB 3.75Å; F112-I177 HydrophobicContact CD1-CB 3.97Å; F112-I177 HydrophobicContact CD1-CG1 3.67Å; F112-I177 HydrophobicContact CD1-CG2 4.1Å; F112-I177 HydrophobicContact CE1-CB 4.18Å; F112-I177 HydrophobicContact CE1-CG1 3.71Å
113	W	98.8	Very high	98.3	Very high	32 Å²	32	53.4 Å²	53.4	12%	0.121	27%	0.265	C	S	.	.	H	α-helix	trans	-59.2	-42.1	179.5	-175	91.7	0	0	0	111.8	L88 N109 L110 C116 E117 Q174 Y178 M181	L88-W113 HydrophobicContact CB-CH2 4.11Å; L88-W113 HydrophobicContact CB-CZ3 4.27Å; L88-W113 HydrophobicContact CD1-CD2 4.19Å; L88-W113 HydrophobicContact CD1-CE3 4.29Å; L88-W113 HydrophobicContact CD1-CH2 3.98Å; L88-W113 HydrophobicContact CD1-CZ2 3.86Å; L88-W113 HydrophobicContact CD1-CZ3 4.18Å; N109-W113 WeakPolarHBondContact O-CB 3.44Å; N109-W113 PolarHBondContact O-N 3.48Å; N109-W113 VanDerWaalsContact O-N 3.13Å; L110-W113 PolarHBondContact O-N 3.44Å; W113-C116 WeakPolarHBondContact O-CB 3.22Å; W113-C116 PolarHBondContact O-N 2.81Å; W113-E117 HydrophobicContact CD2-CG 4.28Å; W113-E117 HydrophobicContact CE3-CG 3.9Å; W113-E117 HydrophobicContact CH2-CG 3.53Å; W113-E117 HydrophobicContact CZ2-CG 3.93Å; W113-E117 HydrophobicContact CZ3-CG 3.52Å; W113-E117 PolarHBondContact O-N 3.01Å; W113-E117 VanDerWaalsContact O-N 3.13Å; W113-Q174 HydrophobicContact CG-CG 4.12Å; W113-Q174 PolarHBondContact O-NE2 3.41Å; W113-Y178 AromaticContact NE1-CD2 3.76Å; W113-M181 HydrophobicContact CB-CE 4Å; W113-M181 HydrophobicContact CG-CE 4.26Å
114	L	98.6	Very high	98.3	Very high	45 Å²	45	53.7 Å²	53.7	24%	0.236	26%	0.261	C	S	.	.	H	α-helix	trans	-68.6	-40.5	177.1	-67.9	170.3	0	0	0	112.6	L110 L111 F112 C116 E117 E118	L110-L114 HydrophobicContact CD1-CD1 4.3Å; L110-L114 HydrophobicContact CD1-CG 4.28Å; L110-L114 HydrophobicContact CG-CD1 4.05Å; L110-L114 HydrophobicContact CG-CG 4.46Å; L110-L114 VanDerWaalsContact O-CG 3.31Å; L110-L114 WeakPolarHBondContact O-CG 3.46Å; L110-L114 PolarHBondContact O-N 3.45Å; L111-L114 PolarHBondContact O-N 3.01Å; F112-L114 VanDerWaalsContact C-N 3.3Å; F112-L114 PolarHBondContact O-N 3.31Å; L114-C116 PolarHBondContact O-N 3.05Å; L114-E117 WeakPolarHBondContact O-CB 3.48Å; L114-E117 PolarHBondContact O-N 3.4Å; L114-E117 VanDerWaalsContact O-N 3.12Å; L114-E118 PolarHBondContact O-N 3.45Å
115	A	98.8	Very high	98.3	Very high	25 Å²	25	55.9 Å²	55.9	21%	0.207	28%	0.28	C	S	.	.	H	α-helix	trans	-61	-36.5	176.1	0	0	0	0	0	111.5	L111 F112 E118 L119 I135 Y139	L111-A115 WeakPolarHBondContact O-CB 3.43Å; L111-A115 PolarHBondContact O-N 3.31Å; F112-A115 PolarHBondContact O-N 3.27Å; A115-E118 PolarHBondContact O-N 3.18Å; A115-L119 WeakPolarHBondContact O-CB 3.44Å; A115-L119 PolarHBondContact O-N 3.08Å; A115-I135 HydrophobicContact CB-CD1 4.03Å; A115-I135 HydrophobicContact CB-CG1 3.82Å; A115-I135 WeakPolarHBondContact O-CD1 3.42Å; A115-Y139 HydrophobicContact CB-CE2 4.32Å
116	C	98.8	Very high	98.4	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.014	27%	0.268	C	S	.	.	H	α-helix	trans	-66.7	-40.7	173	-63.8	0	0	0	0	112.6	F112 W113 L114 E118 L119 K120 Y170 Q174	F112-C116 VanDerWaalsContact CE2-SG 3.59Å; F112-C116 VanDerWaalsContact CZ-SG 3.56Å; F112-C116 PolarHBondContact O-N 2.87Å; F112-C116 PolarHBondContact O-SG 3.43Å; W113-C116 WeakPolarHBondContact O-CB 3.22Å; W113-C116 PolarHBondContact O-N 2.81Å; L114-C116 PolarHBondContact O-N 3.05Å; C116-E118 VanDerWaalsContact C-N 3.31Å; C116-E118 PolarHBondContact O-N 3.42Å; C116-L119 PolarHBondContact O-N 2.98Å; C116-K120 WeakPolarHBondContact O-CG 3.24Å; C116-K120 PolarHBondContact O-N 3.49Å; C116-K120 VanDerWaalsContact O-N 3.08Å; C116-Y170 VanDerWaalsContact SG-CB 3.55Å; C116-Q174 HydrophobicContact CB-CB 4.1Å; C116-Q174 VanDerWaalsContact CB-CD 3.44Å; C116-Q174 HydrophobicContact CB-CG 3.77Å
117	E	98.3	Very high	98.4	Very high	51 Å²	51	49.8 Å²	49.8	24%	0.238	27%	0.27	C	S	.	.	H	α-helix	trans	-59.1	-42.8	173.4	-72.8	-59.2	112.3	0	0	111.9	W113 L114 K120 K121 Q174	W113-E117 HydrophobicContact CD2-CG 4.28Å; W113-E117 HydrophobicContact CE3-CG 3.9Å; W113-E117 HydrophobicContact CH2-CG 3.53Å; W113-E117 HydrophobicContact CZ2-CG 3.93Å; W113-E117 HydrophobicContact CZ3-CG 3.52Å; W113-E117 PolarHBondContact O-N 3.01Å; W113-E117 VanDerWaalsContact O-N 3.13Å; L114-E117 WeakPolarHBondContact O-CB 3.48Å; L114-E117 PolarHBondContact O-N 3.4Å; L114-E117 VanDerWaalsContact O-N 3.12Å; E117-K120 PolarHBondContact O-N 3.14Å; E117-K120 WeakPolarHBondContact OE1-CE 3.39Å; E117-K120 IonicContact OE1-NZ 3.03Å; E117-K120 PolarHBondContact OE1-NZ 3.35Å; E117-K121 WeakPolarHBondContact O-CG 3.26Å; E117-Q174 PolarHBondContact OE1-NE2 2.86Å
118	E	98.2	Very high	98.4	Very high	82 Å²	82	48.1 Å²	48.1	38%	0.383	26%	0.263	S	S	.	.	H	α-helix	trans	-70.9	-34.7	179	-68.9	-53.9	112.4	0	0	112.8	L114 A115 C116 K121	L114-E118 PolarHBondContact O-N 3.45Å; A115-E118 PolarHBondContact O-N 3.18Å; C116-E118 VanDerWaalsContact C-N 3.31Å; C116-E118 PolarHBondContact O-N 3.42Å; E118-K121 PolarHBondContact O-N 3.45Å; E118-K121 IonicContact OE1-NZ 2.82Å; E118-K121 PolarHBondContact OE1-NZ 3.35Å
119	L	98.7	Very high	98.4	Very high	2 Å²	2	49 Å²	49	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-62.7	-44.6	173.6	-179.5	68.3	0	0	0	111	A115 C116 K121 E122 V128 K131 A132 I135 N167 Y170	A115-L119 WeakPolarHBondContact O-CB 3.44Å; A115-L119 PolarHBondContact O-N 3.08Å; C116-L119 PolarHBondContact O-N 2.98Å; L119-K121 PolarHBondContact O-N 3.13Å; L119-K121 VanDerWaalsContact O-N 3.15Å; L119-E122 VanDerWaalsContact O-CB 3.25Å; L119-E122 WeakPolarHBondContact O-CB 3.48Å; L119-E122 PolarHBondContact O-N 2.84Å; L119-V128 HydrophobicContact CD1-CG1 4.27Å; L119-K131 HydrophobicContact CD1-CB 3.7Å; L119-A132 HydrophobicContact CD1-CB 4.37Å; L119-A132 HydrophobicContact CD2-CB 4.31Å; L119-I135 HydrophobicContact CB-CD1 3.88Å; L119-I135 HydrophobicContact CD2-CD1 4.06Å; L119-I135 HydrophobicContact CG-CD1 4.42Å; L119-N167 HydrophobicContact CG-CB 4.33Å; L119-N167 WeakPolarHBondContact O-CB 3.17Å; L119-Y170 HydrophobicContact CD2-CD2 3.54Å; L119-Y170 HydrophobicContact CD2-CE2 3.81Å
120	K	98.4	Very high	98.3	Very high	71 Å²	71	52.6 Å²	52.6	31%	0.309	28%	0.284	S	S	.	.	H	α-helix	trans	-59.7	-27.5	-178.7	-76.3	-176.3	-60.3	-171.8	0	113.8	C116 E117 E122 N167	C116-K120 WeakPolarHBondContact O-CG 3.24Å; C116-K120 PolarHBondContact O-N 3.49Å; C116-K120 VanDerWaalsContact O-N 3.08Å; E117-K120 PolarHBondContact O-N 3.14Å; E117-K120 WeakPolarHBondContact OE1-CE 3.39Å; E117-K120 IonicContact OE1-NZ 3.03Å; E117-K120 PolarHBondContact OE1-NZ 3.35Å; K120-E122 VanDerWaalsContact C-N 3.33Å; K120-N167 VanDerWaalsContact CG-O 3.31Å; K120-N167 WeakPolarHBondContact CG-O 3.47Å
121	K	97.9	Very high	98.3	Very high	137 Å²	137	55.6 Å²	55.6	60%	0.596	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-16.2	177.1	-62.5	169.3	-168.4	169.5	0	112.8	E117 E118 L119	E117-K121 WeakPolarHBondContact O-CG 3.26Å; E118-K121 PolarHBondContact O-N 3.45Å; E118-K121 IonicContact OE1-NZ 2.82Å; E118-K121 PolarHBondContact OE1-NZ 3.35Å; L119-K121 PolarHBondContact O-N 3.13Å; L119-K121 VanDerWaalsContact O-N 3.15Å
122	E	98.1	Very high	98.3	Very high	37 Å²	37	53.6 Å²	53.6	17%	0.173	29%	0.286	C	S	.	.			trans	-74.9	137	-178.9	-171.8	56	-104	0	0	111.2	L119 K120 N124 A127 V128 K131 N167	L119-E122 VanDerWaalsContact O-CB 3.25Å; L119-E122 WeakPolarHBondContact O-CB 3.48Å; L119-E122 PolarHBondContact O-N 2.84Å; K120-E122 VanDerWaalsContact C-N 3.33Å; E122-N124 WeakPolarHBondContact OE1-CB 3.31Å; E122-N124 PolarHBondContact OE1-N 3.38Å; E122-A127 VanDerWaalsContact CD-CB 3.47Å; E122-A127 HydrophobicContact CG-CB 3.73Å; E122-V128 HydrophobicContact CB-CG2 3.95Å; E122-V128 HydrophobicContact CG-CB 4.48Å; E122-V128 HydrophobicContact CG-CG2 3.62Å; E122-K131 HydrophobicContact CB-CD 4.39Å; E122-K131 HydrophobicContact CG-CD 4.34Å; E122-K131 IonicContact OE2-NZ 3.33Å; E122-K131 PolarHBondContact OE2-NZ 2.78Å; E122-N167 PolarHBondContact O-ND2 2.64Å
123	T	96.5	Very high	98.3	Very high	121 Å²	121	58.6 Å²	58.6	74%	0.742	31%	0.305	S	S	*	.			trans	-123.5	-17.7	-179.2	56.9	0	0	0	0	112.4	P125	T123-P125 WeakPolarHBondContact O-CD 3.25Å
124	N	98.1	Very high	98.3	Very high	86 Å²	86	60 Å²	60	46%	0.46	32%	0.315	S	S	.	.			trans	-76	118.9	175.5	-179.5	-46.8	0	0	0	109.9	E122 S126 A127 V128	E122-N124 WeakPolarHBondContact OE1-CB 3.31Å; E122-N124 PolarHBondContact OE1-N 3.38Å; N124-S126 VanDerWaalsContact C-N 3.29Å; N124-S126 PolarHBondContact O-N 3.2Å; N124-S126 WeakPolarHBondContact OD1-CB 3.43Å; N124-S126 PolarHBondContact OD1-N 3.02Å; N124-A127 HydrophobicContact CB-CB 3.97Å; N124-A127 PolarHBondContact O-N 3.22Å; N124-A127 PolarHBondContact OD1-N 2.8Å; N124-V128 WeakPolarHBondContact O-CG2 3.23Å; N124-V128 PolarHBondContact O-N 3.44Å
125	P	97.8	Very high	98.3	Very high	106 Å²	106	58.3 Å²	58.3	69%	0.688	31%	0.306	S	S	*	.	H	α-helix	trans	-57.3	-37.4	-176	-27.2	35.8	0	0	0	114.4	T123 V128 D129	T123-P125 WeakPolarHBondContact O-CD 3.25Å; P125-V128 PolarHBondContact O-N 3.1Å; P125-D129 VanDerWaalsContact O-CB 3.3Å; P125-D129 WeakPolarHBondContact O-CB 3.16Å; P125-D129 PolarHBondContact O-N 3.44Å
126	S	98.1	Very high	98.3	Very high	85 Å²	85	59 Å²	59	59%	0.594	30%	0.303	S	S	*	.	H	α-helix	trans	-69	-36.4	177.9	-173.9	0	0	0	0	111.9	N124 E130	N124-S126 VanDerWaalsContact C-N 3.29Å; N124-S126 PolarHBondContact O-N 3.2Å; N124-S126 WeakPolarHBondContact OD1-CB 3.43Å; N124-S126 PolarHBondContact OD1-N 3.02Å; S126-E130 PolarHBondContact O-N 2.92Å
127	A	98.2	Very high	98.3	Very high	22 Å²	22	64.4 Å²	64.4	18%	0.182	33%	0.328	C	S	.	.	H	α-helix	trans	-75.6	-35.1	177.8	0	0	0	0	0	111.8	E122 N124 K131	E122-A127 VanDerWaalsContact CD-CB 3.47Å; E122-A127 HydrophobicContact CG-CB 3.73Å; N124-A127 HydrophobicContact CB-CB 3.97Å; N124-A127 PolarHBondContact O-N 3.22Å; N124-A127 PolarHBondContact OD1-N 2.8Å; A127-K131 VanDerWaalsContact O-CB 3.26Å; A127-K131 WeakPolarHBondContact O-CB 3.43Å; A127-K131 VanDerWaalsContact O-CG 3.29Å; A127-K131 WeakPolarHBondContact O-CG 3.33Å; A127-K131 PolarHBondContact O-N 3.24Å
128	V	98.6	Very high	98.3	Very high	10 Å²	10	64.8 Å²	64.8	6%	0.061	33%	0.332	C	S	.	.	H	α-helix	trans	-57.8	-51.6	170.4	171	0	0	0	0	109.6	L119 E122 N124 P125 E130 K131 A132 N167	L119-V128 HydrophobicContact CD1-CG1 4.27Å; E122-V128 HydrophobicContact CB-CG2 3.95Å; E122-V128 HydrophobicContact CG-CB 4.48Å; E122-V128 HydrophobicContact CG-CG2 3.62Å; N124-V128 WeakPolarHBondContact O-CG2 3.23Å; N124-V128 PolarHBondContact O-N 3.44Å; P125-V128 PolarHBondContact O-N 3.1Å; V128-E130 PolarHBondContact O-N 3.36Å; V128-K131 PolarHBondContact O-N 3.12Å; V128-A132 WeakPolarHBondContact O-CB 3.4Å; V128-A132 PolarHBondContact O-N 3.19Å; V128-N167 HydrophobicContact CG1-CB 4.24Å; V128-N167 HydrophobicContact CG2-CB 4.04Å
129	D	98.5	Very high	98.4	Very high	52 Å²	52	61.9 Å²	61.9	28%	0.278	32%	0.317	S	S	.	.	H	α-helix	trans	-60.6	-45	-178.8	-179.2	77.5	0	0	0	112.1	P125 R133 P165	P125-D129 VanDerWaalsContact O-CB 3.3Å; P125-D129 WeakPolarHBondContact O-CB 3.16Å; P125-D129 PolarHBondContact O-N 3.44Å; D129-R133 WeakPolarHBondContact O-CG 3.49Å; D129-R133 PolarHBondContact O-N 2.99Å; D129-R133 IonicContact OD1-CZ 3.12Å; D129-R133 IonicContact OD1-NH1 2.84Å; D129-R133 PolarHBondContact OD1-NH1 3.35Å; D129-R133 IonicContact OD1-NH2 2.76Å; D129-R133 PolarHBondContact OD1-NH2 3.49Å; D129-R133 IonicContact OD2-CZ 3.67Å; D129-R133 IonicContact OD2-NH1 2.62Å; D129-R133 PolarHBondContact OD2-NH1 3.3Å; D129-R133 IonicContact OD2-NH2 3.93Å; D129-P165 WeakPolarHBondContact OD1-CG 3.24Å
130	E	98.5	Very high	98.4	Very high	96 Å²	96	61.8 Å²	61.8	45%	0.449	32%	0.317	S	S	.	.	H	α-helix	trans	-61.7	-55.2	174.4	-174.2	-169.6	151.2	0	0	111.8	R49 S126 V128 A132 R133 I134	R49-E130 IonicContact CZ-OE1 3.95Å; R49-E130 IonicContact NH1-OE1 3.13Å; R49-E130 PolarHBondContact NH1-OE1 3.02Å; R49-E130 IonicContact NH2-OE1 3.55Å; S126-E130 PolarHBondContact O-N 2.92Å; V128-E130 PolarHBondContact O-N 3.36Å; E130-A132 VanDerWaalsContact C-N 3.32Å; E130-A132 PolarHBondContact O-N 3.22Å; E130-R133 PolarHBondContact O-N 3.5Å; E130-I134 HydrophobicContact CG-CD1 3.88Å; E130-I134 WeakPolarHBondContact O-CG1 3.42Å; E130-I134 PolarHBondContact O-N 3.22Å
131	K	98.7	Very high	98.4	Very high	63 Å²	63	59 Å²	59	27%	0.274	31%	0.307	S	S	.	.	H	α-helix	trans	-61.4	-41.4	-177.3	-75.6	174.9	174	174.5	0	111.5	L119 E122 A127 V128 R133 I134 I135	L119-K131 HydrophobicContact CD1-CB 3.7Å; E122-K131 HydrophobicContact CB-CD 4.39Å; E122-K131 HydrophobicContact CG-CD 4.34Å; E122-K131 IonicContact OE2-NZ 3.33Å; E122-K131 PolarHBondContact OE2-NZ 2.78Å; A127-K131 VanDerWaalsContact O-CB 3.26Å; A127-K131 WeakPolarHBondContact O-CB 3.43Å; A127-K131 VanDerWaalsContact O-CG 3.29Å; A127-K131 WeakPolarHBondContact O-CG 3.33Å; A127-K131 PolarHBondContact O-N 3.24Å; V128-K131 PolarHBondContact O-N 3.12Å; K131-R133 PolarHBondContact O-N 3.01Å; K131-I134 PolarHBondContact O-N 2.97Å; K131-I135 VanDerWaalsContact O-CG1 3.3Å; K131-I135 WeakPolarHBondContact O-CG1 3.48Å; K131-I135 PolarHBondContact O-N 3.08Å
132	A	98.7	Very high	98.3	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-61.8	-43.8	179.9	0	0	0	0	0	111.6	L119 V128 E130 I135 Y136 P165 M169 Y170	L119-A132 HydrophobicContact CD1-CB 4.37Å; L119-A132 HydrophobicContact CD2-CB 4.31Å; V128-A132 WeakPolarHBondContact O-CB 3.4Å; V128-A132 PolarHBondContact O-N 3.19Å; E130-A132 VanDerWaalsContact C-N 3.32Å; E130-A132 PolarHBondContact O-N 3.22Å; A132-I135 PolarHBondContact O-N 2.69Å; A132-Y136 PolarHBondContact O-N 2.77Å; A132-Y136 VanDerWaalsContact O-N 3.08Å; A132-P165 HydrophobicContact CB-CB 3.72Å; A132-M169 HydrophobicContact CB-SD 3.72Å; A132-Y170 HydrophobicContact CB-CE2 4.29Å; A132-Y170 PolarHBondContact O-OH 3.26Å
133	R	98.6	Very high	98.3	Very high	105 Å²	105	63.6 Å²	63.6	40%	0.396	34%	0.337	S	S	.	.	H	α-helix	trans	-69	-36.5	176.4	-68.3	-157.9	-174.6	84.9	16.2	112.8	D129 E130 K131 Y136 E137	D129-R133 WeakPolarHBondContact O-CG 3.49Å; D129-R133 PolarHBondContact O-N 2.99Å; D129-R133 IonicContact OD1-CZ 3.12Å; D129-R133 IonicContact OD1-NH1 2.84Å; D129-R133 PolarHBondContact OD1-NH1 3.35Å; D129-R133 IonicContact OD1-NH2 2.76Å; D129-R133 PolarHBondContact OD1-NH2 3.49Å; D129-R133 IonicContact OD2-CZ 3.67Å; D129-R133 IonicContact OD2-NH1 2.62Å; D129-R133 PolarHBondContact OD2-NH1 3.3Å; D129-R133 IonicContact OD2-NH2 3.93Å; E130-R133 PolarHBondContact O-N 3.5Å; K131-R133 PolarHBondContact O-N 3.01Å; R133-Y136 WeakPolarHBondContact O-CB 3.37Å; R133-Y136 PolarHBondContact O-N 3.08Å; R133-E137 WeakPolarHBondContact O-CG 3.29Å; R133-E137 PolarHBondContact O-N 3.21Å
134	I	98.7	Very high	98.3	Very high	62 Å²	62	58.6 Å²	58.6	32%	0.318	31%	0.307	S	S	.	.	H	α-helix	trans	-60.1	-47.1	173.4	-69.3	168.4	0	0	0	110.6	E130 K131 Y136 E137 D138	E130-I134 HydrophobicContact CG-CD1 3.88Å; E130-I134 WeakPolarHBondContact O-CG1 3.42Å; E130-I134 PolarHBondContact O-N 3.22Å; K131-I134 PolarHBondContact O-N 2.97Å; I134-Y136 VanDerWaalsContact C-N 3.25Å; I134-Y136 PolarHBondContact O-N 2.72Å; I134-E137 PolarHBondContact O-N 3.13Å; I134-D138 WeakPolarHBondContact O-CB 3.49Å; I134-D138 PolarHBondContact O-N 2.86Å
135	I	98.9	Very high	98.3	Very high	9 Å²	9	60.6 Å²	60.6	5%	0.046	33%	0.325	C	S	.	.	H	α-helix	trans	-59.2	-40	177.5	-69.1	164.4	0	0	0	111.1	F112 A115 L119 K131 A132 Y139 Y170	F112-I135 HydrophobicContact CD2-CG2 4.02Å; F112-I135 HydrophobicContact CE2-CG2 3.79Å; A115-I135 HydrophobicContact CB-CD1 4.03Å; A115-I135 HydrophobicContact CB-CG1 3.82Å; A115-I135 WeakPolarHBondContact O-CD1 3.42Å; L119-I135 HydrophobicContact CB-CD1 3.88Å; L119-I135 HydrophobicContact CD2-CD1 4.06Å; L119-I135 HydrophobicContact CG-CD1 4.42Å; K131-I135 VanDerWaalsContact O-CG1 3.3Å; K131-I135 WeakPolarHBondContact O-CG1 3.48Å; K131-I135 PolarHBondContact O-N 3.08Å; A132-I135 PolarHBondContact O-N 2.69Å; I135-Y139 HydrophobicContact CG2-CD2 4.4Å; I135-Y139 PolarHBondContact O-N 2.64Å; I135-Y170 HydrophobicContact CB-CE2 3.81Å; I135-Y170 HydrophobicContact CD1-CD2 4.31Å; I135-Y170 HydrophobicContact CD1-CE2 4.15Å; I135-Y170 HydrophobicContact CG2-CD1 4.4Å; I135-Y170 HydrophobicContact CG2-CD2 3.93Å; I135-Y170 HydrophobicContact CG2-CE1 4.07Å; I135-Y170 HydrophobicContact CG2-CE2 3.58Å; I135-Y170 HydrophobicContact CG2-CG 4.34Å
136	Y	98.8	Very high	98.4	Very high	41 Å²	41	58.4 Å²	58.4	16%	0.161	30%	0.304	C	S	.	.	I	π-helix	trans	-61.8	-53.9	177.2	-179.1	-96.4	0	0	0	111.8	A132 R133 I134 D138 V140 S141 I158 N159 L162 Y170	A132-Y136 PolarHBondContact O-N 2.77Å; A132-Y136 VanDerWaalsContact O-N 3.08Å; R133-Y136 WeakPolarHBondContact O-CB 3.37Å; R133-Y136 PolarHBondContact O-N 3.08Å; I134-Y136 VanDerWaalsContact C-N 3.25Å; I134-Y136 PolarHBondContact O-N 2.72Å; Y136-D138 VanDerWaalsContact C-N 3.31Å; Y136-D138 PolarHBondContact O-N 2.71Å; Y136-V140 HydrophobicContact CD2-CB 3.68Å; Y136-V140 HydrophobicContact CD2-CG1 3.75Å; Y136-V140 HydrophobicContact CD2-CG2 4.44Å; Y136-V140 HydrophobicContact CE2-CB 4.01Å; Y136-V140 HydrophobicContact CE2-CG1 3.66Å; Y136-V140 HydrophobicContact CG-CB 4.38Å; Y136-V140 WeakPolarHBondContact O-CA 3.46Å; Y136-V140 PolarHBondContact O-N 3.15Å; Y136-S141 PolarHBondContact O-N 3.24Å; Y136-I158 HydrophobicContact CD2-CG2 3.79Å; Y136-I158 HydrophobicContact CE2-CG2 4.18Å; Y136-N159 WeakPolarHBondContact CE2-OD1 3.36Å; Y136-N159 PolarHBondContact OH-OD1 2.77Å; Y136-N159 VanDerWaalsContact OH-OD1 3.07Å; Y136-L162 HydrophobicContact CD1-CD1 4.02Å; Y136-L162 HydrophobicContact CD2-CD1 3.65Å; Y136-L162 HydrophobicContact CD2-CD2 4.21Å; Y136-L162 HydrophobicContact CD2-CG 4.27Å; Y136-L162 HydrophobicContact CE1-CD1 3.99Å; Y136-L162 HydrophobicContact CE2-CD1 3.63Å; Y136-L162 HydrophobicContact CG-CD1 3.85Å; Y136-L162 HydrophobicContact CG-CD2 4.04Å; Y136-L162 HydrophobicContact CG-CG 4.49Å; Y136-Y170 WeakPolarHBondContact CB-OH 3.44Å; Y136-Y170 PolarHBondContact N-OH 3Å
137	E	98.7	Very high	98.4	Very high	114 Å²	114	58 Å²	58	53%	0.533	29%	0.293	S	S	.	.	I	π-helix	trans	-62.6	-39.4	-178.5	-68.7	-58.4	146.7	0	0	111.9	R133 I134 S144	R133-E137 WeakPolarHBondContact O-CG 3.29Å; R133-E137 PolarHBondContact O-N 3.21Å; I134-E137 PolarHBondContact O-N 3.13Å; E137-S144 WeakPolarHBondContact O-CB 3.3Å
138	D	98.6	Very high	98.4	Very high	59 Å²	59	57 Å²	57	32%	0.316	29%	0.285	S	S	.	.	I	π-helix	trans	-76.9	-37.8	-178	-78.9	-14.4	0	0	0	112.8	I134 Y136 S144 K146	I134-D138 WeakPolarHBondContact O-CB 3.49Å; I134-D138 PolarHBondContact O-N 2.86Å; Y136-D138 VanDerWaalsContact C-N 3.31Å; Y136-D138 PolarHBondContact O-N 2.71Å; D138-S144 WeakPolarHBondContact O-CB 3.39Å; D138-S144 PolarHBondContact O-OG 3.31Å; D138-K146 VanDerWaalsContact O-CB 3.32Å; D138-K146 WeakPolarHBondContact O-CB 3.46Å
139	Y	98.8	Very high	98.3	Very high	21 Å²	21	60.9 Å²	60.9	8%	0.082	31%	0.312	C	S	.	.	I	π-helix	trans	-126.2	-18.9	-167.2	-58.4	-73.7	0	0	0	115.3	D108 L111 F112 A115 I135 K146 E147 V148	D108-Y139 HydrophobicContact CB-CD1 4.43Å; D108-Y139 HydrophobicContact CB-CE1 4.39Å; L111-Y139 HydrophobicContact CB-CE1 3.93Å; L111-Y139 WeakPolarHBondContact CB-OH 3.49Å; F112-Y139 HydrophobicContact CB-CD1 3.86Å; F112-Y139 HydrophobicContact CB-CD2 4.3Å; F112-Y139 HydrophobicContact CB-CE1 4.4Å; F112-Y139 HydrophobicContact CB-CG 3.81Å; F112-Y139 VanDerWaalsContact CD2-CB 3.46Å; F112-Y139 HydrophobicContact CD2-CD2 4.07Å; F112-Y139 AromaticContact CD2-CG 3.85Å; F112-Y139 HydrophobicContact CD2-CG 3.85Å; F112-Y139 HydrophobicContact CG-CG 4.29Å; A115-Y139 HydrophobicContact CB-CE2 4.32Å; I135-Y139 HydrophobicContact CG2-CD2 4.4Å; I135-Y139 PolarHBondContact O-N 2.64Å; Y139-K146 HydrophobicContact CD1-CB 4.18Å; Y139-K146 HydrophobicContact CE1-CB 4.26Å; Y139-K146 HydrophobicContact CE1-CD 4.2Å; Y139-E147 WeakPolarHBondContact O-CA 3.33Å; Y139-V148 HydrophobicContact CD1-CG1 4.42Å; Y139-V148 WeakPolarHBondContact O-CG2 3.44Å; Y139-V148 PolarHBondContact O-N 3.34Å
140	V	98.6	Very high	98.3	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.302	C	S	.	.	I	π-helix	trans	-109	-33.6	-173.1	-176.3	0	0	0	0	112.5	F112 Y136 I142 L150 R155 I158 Y170	F112-V140 HydrophobicContact CE2-CG2 4.2Å; Y136-V140 HydrophobicContact CD2-CB 3.68Å; Y136-V140 HydrophobicContact CD2-CG1 3.75Å; Y136-V140 HydrophobicContact CD2-CG2 4.44Å; Y136-V140 HydrophobicContact CE2-CB 4.01Å; Y136-V140 HydrophobicContact CE2-CG1 3.66Å; Y136-V140 HydrophobicContact CG-CB 4.38Å; Y136-V140 WeakPolarHBondContact O-CA 3.46Å; Y136-V140 PolarHBondContact O-N 3.15Å; V140-I142 PolarHBondContact O-N 2.79Å; V140-L150 HydrophobicContact CG1-CD1 4.29Å; V140-L150 HydrophobicContact CG2-CD1 4.3Å; V140-R155 HydrophobicContact CG1-CG 4.05Å; V140-I158 HydrophobicContact CG1-CD1 4.09Å; V140-I158 HydrophobicContact CG1-CG2 4.15Å; V140-I158 HydrophobicContact CG2-CD1 4.19Å; V140-Y170 HydrophobicContact CG2-CE1 4.03Å
141	S	98.1	Very high	98.3	Very high	13 Å²	13	59.1 Å²	59.1	9%	0.091	31%	0.306	C	S	.	.	S	Bend	trans	-57.1	129.6	177.7	-178.5	0	0	0	0	110.7	Y136 L143 S144	Y136-S141 PolarHBondContact O-N 3.24Å; S141-L143 PolarHBondContact O-N 3.06Å; S141-L143 PolarHBondContact OG-N 3.25Å; S141-S144 VanDerWaalsContact O-CB 3.27Å; S141-S144 WeakPolarHBondContact O-CB 3.22Å; S141-S144 PolarHBondContact O-N 2.86Å
142	I	96.7	Very high	98.2	Very high	119 Å²	119	60 Å²	60	61%	0.61	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-7.9	176.3	64.1	169.5	0	0	0	113.6	V140	V140-I142 PolarHBondContact O-N 2.79Å
143	L	97.6	Very high	98.2	Very high	151 Å²	151	69 Å²	69	79%	0.791	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-6.2	176.3	-56.5	-178.2	0	0	0	111.7	S141	S141-L143 PolarHBondContact O-N 3.06Å; S141-L143 PolarHBondContact OG-N 3.25Å
144	S	98.1	Very high	98.2	Very high	17 Å²	17	64.3 Å²	64.3	12%	0.119	34%	0.337	C	S	.	.			trans	-73.6	135.6	-179.5	-177.2	0	0	0	0	111.1	E137 D138 S141 K146 E147	E137-S144 WeakPolarHBondContact O-CB 3.3Å; D138-S144 WeakPolarHBondContact O-CB 3.39Å; D138-S144 PolarHBondContact O-OG 3.31Å; S141-S144 VanDerWaalsContact O-CB 3.27Å; S141-S144 WeakPolarHBondContact O-CB 3.22Å; S141-S144 PolarHBondContact O-N 2.86Å; S144-K146 PolarHBondContact O-N 3.27Å; S144-K146 PolarHBondContact OG-N 3.43Å; S144-E147 PolarHBondContact O-N 3.12Å
145	P	97.7	Very high	98.2	Very high	128 Å²	128	63.6 Å²	63.6	83%	0.831	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-13.7	169	30.3	-35.5	0	0	0	113.3
146	K	98.3	Very high	98.1	Very high	60 Å²	60	68.5 Å²	68.5	26%	0.261	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	20.4	179.8	-58.3	178.4	-179.2	-179.4	0	112.2	D108 D138 Y139 S144 V148	D108-K146 HydrophobicContact CB-CB 4.23Å; D108-K146 WeakPolarHBondContact OD1-CB 3.28Å; D108-K146 WeakPolarHBondContact OD1-CD 3.32Å; D108-K146 VanDerWaalsContact OD1-CG 3.26Å; D108-K146 WeakPolarHBondContact OD1-CG 3.46Å; D138-K146 VanDerWaalsContact O-CB 3.32Å; D138-K146 WeakPolarHBondContact O-CB 3.46Å; Y139-K146 HydrophobicContact CD1-CB 4.18Å; Y139-K146 HydrophobicContact CE1-CB 4.26Å; Y139-K146 HydrophobicContact CE1-CD 4.2Å; S144-K146 PolarHBondContact O-N 3.27Å; S144-K146 PolarHBondContact OG-N 3.43Å; K146-V148 PolarHBondContact O-N 2.99Å
147	E	98.4	Very high	98.1	Very high	75 Å²	75	67.8 Å²	67.8	35%	0.35	36%	0.359	S	S	.	.			trans	-55.2	126.4	-179.2	-175.4	-174.4	-173.6	0	0	110.9	Y139 S144 R155	Y139-E147 WeakPolarHBondContact O-CA 3.33Å; S144-E147 PolarHBondContact O-N 3.12Å; E147-R155 IonicContact OE1-CZ 2.86Å; E147-R155 IonicContact OE1-NE 2.62Å; E147-R155 IonicContact OE1-NH2 2.71Å; E147-R155 PolarHBondContact OE1-NH2 3.47Å
148	V	98.6	Very high	98.1	Very high	3 Å²	3	62.6 Å²	62.6	2%	0.018	33%	0.334	C	S	.	.			trans	-87.6	146.7	172.8	-63.9	0	0	0	0	110.9	D108 F112 Y139 K146 L150 I177	D108-V148 HydrophobicContact CB-CG1 4.32Å; F112-V148 HydrophobicContact CB-CG1 3.83Å; F112-V148 HydrophobicContact CD1-CG2 4.06Å; F112-V148 HydrophobicContact CD2-CG2 4.31Å; F112-V148 HydrophobicContact CE1-CG2 4.36Å; F112-V148 HydrophobicContact CG-CG1 4.24Å; F112-V148 HydrophobicContact CG-CG2 4.02Å; Y139-V148 HydrophobicContact CD1-CG1 4.42Å; Y139-V148 WeakPolarHBondContact O-CG2 3.44Å; Y139-V148 PolarHBondContact O-N 3.34Å; K146-V148 PolarHBondContact O-N 2.99Å; V148-L150 HydrophobicContact CG2-CD1 4.18Å; V148-L150 HydrophobicContact CG2-CD2 4.27Å; V148-L150 HydrophobicContact CG2-CG 4Å; V148-L150 PolarHBondContact O-N 2.95Å; V148-I177 HydrophobicContact CB-CD1 3.8Å; V148-I177 HydrophobicContact CB-CG1 4.26Å; V148-I177 HydrophobicContact CG2-CD1 4.02Å; V148-I177 HydrophobicContact CG2-CG1 4.1Å
149	S	97.6	Very high	98	Very high	90 Å²	90	62.8 Å²	62.8	63%	0.629	34%	0.335	S	S	*	.			trans	-74	100.3	-178.1	178.4	0	0	0	0	111.4
150	L	98.1	Very high	98	Very high	11 Å²	11	68.5 Å²	68.5	6%	0.058	36%	0.363	C	S	.	.			trans	-112.2	145.3	176.3	-60.2	175.2	0	0	0	112.9	V140 V148 R155 I158 A173 Q176 I177	V140-L150 HydrophobicContact CG1-CD1 4.29Å; V140-L150 HydrophobicContact CG2-CD1 4.3Å; V148-L150 HydrophobicContact CG2-CD1 4.18Å; V148-L150 HydrophobicContact CG2-CD2 4.27Å; V148-L150 HydrophobicContact CG2-CG 4Å; V148-L150 PolarHBondContact O-N 2.95Å; L150-R155 PolarHBondContact O-NH1 3.03Å; L150-I158 HydrophobicContact CD1-CD1 4.06Å; L150-A173 HydrophobicContact CD1-CB 3.98Å; L150-A173 HydrophobicContact CD2-CB 3.81Å; L150-Q176 VanDerWaalsContact CA-OE1 3.27Å; L150-Q176 HydrophobicContact CD2-CG 4.36Å; L150-I177 HydrophobicContact CD2-CD1 3.76Å; L150-I177 HydrophobicContact CD2-CG1 3.77Å
151	D	97.9	Very high	97.9	Very high	101 Å²	101	70.7 Å²	70.7	54%	0.54	38%	0.378	S	S	.	.			trans	-60.9	146.5	170	-73.1	-17.6	0	0	0	110.6	R153 V154 R155 Q176	D151-R153 VanDerWaalsContact C-N 3.28Å; D151-R153 PolarHBondContact O-N 3.07Å; D151-V154 HydrophobicContact CB-CG2 4.1Å; D151-V154 PolarHBondContact O-N 3.42Å; D151-R155 PolarHBondContact O-N 2.95Å; D151-Q176 PolarHBondContact OD2-NE2 2.88Å
152	S	97.6	Very high	97.8	Very high	82 Å²	82	71.9 Å²	71.9	57%	0.573	38%	0.383	S	S	*	.	H	α-helix	trans	-56.3	-42.6	-177.1	60.6	0	0	0	0	112.6	V154 R155 E156	S152-V154 VanDerWaalsContact C-N 3.32Å; S152-V154 PolarHBondContact O-N 3.19Å; S152-R155 PolarHBondContact O-N 3.49Å; S152-E156 WeakPolarHBondContact O-CB 3.48Å; S152-E156 WeakPolarHBondContact O-CG 3.24Å; S152-E156 PolarHBondContact O-N 3.09Å
153	R	97.9	Very high	97.7	Very high	188 Å²	188	72.3 Å²	72.3	71%	0.709	39%	0.391	S	S	*	.	H	α-helix	trans	-60	-41.3	177.8	-179.3	-178.2	172.3	-166	-5.2	112.3	D151 E156 G157	D151-R153 VanDerWaalsContact C-N 3.28Å; D151-R153 PolarHBondContact O-N 3.07Å; R153-E156 PolarHBondContact O-N 2.99Å; R153-G157 PolarHBondContact O-N 3.14Å
154	V	98.3	Very high	97.7	Very high	7 Å²	7	73.1 Å²	73.1	4%	0.042	39%	0.391	C	S	.	.	H	α-helix	trans	-67.8	-45.5	-179.8	178.2	0	0	0	0	109.8	D151 S152 E156 G157 I158 E172 A173	D151-V154 HydrophobicContact CB-CG2 4.1Å; D151-V154 PolarHBondContact O-N 3.42Å; S152-V154 VanDerWaalsContact C-N 3.32Å; S152-V154 PolarHBondContact O-N 3.19Å; V154-E156 VanDerWaalsContact C-N 3.34Å; V154-E156 PolarHBondContact O-N 3.46Å; V154-G157 PolarHBondContact O-N 2.91Å; V154-I158 HydrophobicContact CG1-CD1 4.44Å; V154-I158 PolarHBondContact O-N 3.4Å; V154-I158 VanDerWaalsContact O-N 3.1Å; V154-E172 HydrophobicContact CG1-CB 4.49Å; V154-E172 HydrophobicContact CG1-CG 4.34Å; V154-E172 HydrophobicContact CG2-CG 3.95Å; V154-A173 HydrophobicContact CG1-CB 3.59Å
155	R	98.4	Very high	97.7	Very high	47 Å²	47	73.4 Å²	73.4	18%	0.177	39%	0.392	C	S	.	.	H	α-helix	trans	-60.8	-42.1	175.5	-169.8	-176.6	-73.7	101.9	-7.6	111.7	V140 E147 L150 D151 S152 G157 I158 N159	V140-R155 HydrophobicContact CG1-CG 4.05Å; E147-R155 IonicContact OE1-CZ 2.86Å; E147-R155 IonicContact OE1-NE 2.62Å; E147-R155 IonicContact OE1-NH2 2.71Å; E147-R155 PolarHBondContact OE1-NH2 3.47Å; L150-R155 PolarHBondContact O-NH1 3.03Å; D151-R155 PolarHBondContact O-N 2.95Å; S152-R155 PolarHBondContact O-N 3.49Å; R155-G157 VanDerWaalsContact C-N 3.34Å; R155-G157 PolarHBondContact O-N 2.88Å; R155-I158 PolarHBondContact O-N 3.4Å; R155-N159 VanDerWaalsContact O-CG 3.24Å; R155-N159 PolarHBondContact O-N 3.19Å; R155-N159 PolarHBondContact O-ND2 2.82Å
156	E	97.8	Very high	97.7	Very high	111 Å²	111	69.3 Å²	69.3	52%	0.519	37%	0.367	S	S	.	.	H	α-helix	trans	-61.7	-39.2	175.4	-77.7	171.7	-159.4	0	0	112.7	S152 R153 V154 N159 Q160	S152-E156 WeakPolarHBondContact O-CB 3.48Å; S152-E156 WeakPolarHBondContact O-CG 3.24Å; S152-E156 PolarHBondContact O-N 3.09Å; R153-E156 PolarHBondContact O-N 2.99Å; V154-E156 VanDerWaalsContact C-N 3.34Å; V154-E156 PolarHBondContact O-N 3.46Å; E156-N159 PolarHBondContact O-N 2.99Å; E156-Q160 WeakPolarHBondContact O-CG 3.49Å; E156-Q160 PolarHBondContact O-N 3.35Å; E156-Q160 PolarHBondContact O-NE2 2.73Å
157	G	98.2	Very high	97.7	Very high	27 Å²	27	68.9 Å²	68.9	28%	0.278	37%	0.368	S	S	.	.	H	α-helix	trans	-60.6	-47.9	174.3	0	0	0	0	0	112.1	R153 V154 R155 N159 Q160 S161	R153-G157 PolarHBondContact O-N 3.14Å; V154-G157 PolarHBondContact O-N 2.91Å; R155-G157 VanDerWaalsContact C-N 3.34Å; R155-G157 PolarHBondContact O-N 2.88Å; G157-N159 VanDerWaalsContact C-N 3.34Å; G157-N159 PolarHBondContact O-N 2.7Å; G157-Q160 PolarHBondContact O-N 3.42Å; G157-S161 PolarHBondContact O-N 3.26Å; G157-S161 VanDerWaalsContact O-N 3.16Å; G157-S161 PolarHBondContact O-OG 2.62Å
158	I	98.4	Very high	97.7	Very high	4 Å²	4	68.2 Å²	68.2	2%	0.021	37%	0.369	C	S	.	.	H	α-helix	trans	-58.1	-46.8	175.6	-68.8	165.1	0	0	0	111.1	Y136 V140 L150 V154 R155 Q160 S161 L162 M169 Y170 A173	Y136-I158 HydrophobicContact CD2-CG2 3.79Å; Y136-I158 HydrophobicContact CE2-CG2 4.18Å; V140-I158 HydrophobicContact CG1-CD1 4.09Å; V140-I158 HydrophobicContact CG1-CG2 4.15Å; V140-I158 HydrophobicContact CG2-CD1 4.19Å; L150-I158 HydrophobicContact CD1-CD1 4.06Å; V154-I158 HydrophobicContact CG1-CD1 4.44Å; V154-I158 PolarHBondContact O-N 3.4Å; V154-I158 VanDerWaalsContact O-N 3.1Å; R155-I158 PolarHBondContact O-N 3.4Å; I158-Q160 PolarHBondContact O-N 2.61Å; I158-S161 PolarHBondContact O-N 3.35Å; I158-L162 PolarHBondContact O-N 3.43Å; I158-L162 VanDerWaalsContact O-N 3.07Å; I158-M169 HydrophobicContact CG2-CE 4.08Å; I158-Y170 HydrophobicContact CB-CE1 4.45Å; I158-Y170 HydrophobicContact CD1-CD1 3.72Å; I158-Y170 HydrophobicContact CD1-CE1 3.94Å; I158-Y170 HydrophobicContact CG1-CD1 3.9Å; I158-Y170 HydrophobicContact CG1-CE1 4.03Å; I158-Y170 HydrophobicContact CG2-CD1 4.31Å; I158-Y170 HydrophobicContact CG2-CE1 3.56Å; I158-A173 HydrophobicContact CD1-CB 3.77Å
159	N	97.5	Very high	97.7	Very high	64 Å²	64	69.1 Å²	69.1	34%	0.342	37%	0.373	S	S	.	.	H	α-helix	trans	-58.9	-35.8	-178.7	-73.7	-19	0	0	0	112.7	Y136 R155 E156 G157	Y136-N159 WeakPolarHBondContact CE2-OD1 3.36Å; Y136-N159 PolarHBondContact OH-OD1 2.77Å; Y136-N159 VanDerWaalsContact OH-OD1 3.07Å; R155-N159 VanDerWaalsContact O-CG 3.24Å; R155-N159 PolarHBondContact O-N 3.19Å; R155-N159 PolarHBondContact O-ND2 2.82Å; E156-N159 PolarHBondContact O-N 2.99Å; G157-N159 VanDerWaalsContact C-N 3.34Å; G157-N159 PolarHBondContact O-N 2.7Å
160	Q	97.6	Very high	97.7	Very high	141 Å²	141	65 Å²	65	66%	0.659	34%	0.344	S	S	*	.	H	α-helix	trans	-69.3	-43.3	175.5	-68.6	168.1	47.6	0	0	111.2	E156 G157 I158 L162 T163	E156-Q160 WeakPolarHBondContact O-CG 3.49Å; E156-Q160 PolarHBondContact O-N 3.35Å; E156-Q160 PolarHBondContact O-NE2 2.73Å; G157-Q160 PolarHBondContact O-N 3.42Å; I158-Q160 PolarHBondContact O-N 2.61Å; Q160-L162 VanDerWaalsContact C-N 3.26Å; Q160-L162 PolarHBondContact O-N 3.2Å; Q160-T163 PolarHBondContact O-N 3.49Å; Q160-T163 PolarHBondContact O-OG1 3Å
161	S	96.8	Very high	97.7	Very high	46 Å²	46	69.5 Å²	69.5	32%	0.322	37%	0.365	S	S	.	.	H	α-helix	trans	-66.3	-19.5	178.9	-65	0	0	0	0	114.3	G157 I158 T163 E164	G157-S161 PolarHBondContact O-N 3.26Å; G157-S161 VanDerWaalsContact O-N 3.16Å; G157-S161 PolarHBondContact O-OG 2.62Å; I158-S161 PolarHBondContact O-N 3.35Å; S161-T163 PolarHBondContact O-N 3.35Å; S161-T163 VanDerWaalsContact O-N 3.13Å; S161-E164 CarbonylContact O-C 3.04Å; S161-E164 PolarHBondContact O-N 2.8Å; S161-E164 VanDerWaalsContact O-N 3.08Å; S161-E164 VanDerWaalsContact O-O 3.07Å
162	L	95.7	Very high	97.8	Very high	37 Å²	37	69.8 Å²	69.8	19%	0.194	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-19.8	176.6	-76	175.5	0	0	0	114.4	Y136 I158 Q160 E164 M169	Y136-L162 HydrophobicContact CD1-CD1 4.02Å; Y136-L162 HydrophobicContact CD2-CD1 3.65Å; Y136-L162 HydrophobicContact CD2-CD2 4.21Å; Y136-L162 HydrophobicContact CD2-CG 4.27Å; Y136-L162 HydrophobicContact CE1-CD1 3.99Å; Y136-L162 HydrophobicContact CE2-CD1 3.63Å; Y136-L162 HydrophobicContact CG-CD1 3.85Å; Y136-L162 HydrophobicContact CG-CD2 4.04Å; Y136-L162 HydrophobicContact CG-CG 4.49Å; I158-L162 PolarHBondContact O-N 3.43Å; I158-L162 VanDerWaalsContact O-N 3.07Å; Q160-L162 VanDerWaalsContact C-N 3.26Å; Q160-L162 PolarHBondContact O-N 3.2Å; L162-E164 VanDerWaalsContact C-N 3.3Å; L162-M169 HydrophobicContact CD2-CE 3.92Å; L162-M169 HydrophobicContact CG-CE 4.23Å
163	T	96.2	Very high	97.8	Very high	128 Å²	128	66 Å²	66	79%	0.785	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-37.9	174.7	-49.1	0	0	0	0	111.2	Q160 S161	Q160-T163 PolarHBondContact O-N 3.49Å; Q160-T163 PolarHBondContact O-OG1 3Å; S161-T163 PolarHBondContact O-N 3.35Å; S161-T163 VanDerWaalsContact O-N 3.13Å
164	E	96.8	Very high	97.9	Very high	169 Å²	169	57.5 Å²	57.5	79%	0.79	30%	0.304	S	S	*	.	S	Bend	trans	-140.9	82.7	177.7	-170.9	176.7	-171.5	0	0	108.8	S161 L162	S161-E164 CarbonylContact O-C 3.04Å; S161-E164 PolarHBondContact O-N 2.8Å; S161-E164 VanDerWaalsContact O-N 3.08Å; S161-E164 VanDerWaalsContact O-O 3.07Å; L162-E164 VanDerWaalsContact C-N 3.3Å
165	P	97.8	Very high	97.9	Very high	22 Å²	22	62.4 Å²	62.4	14%	0.143	33%	0.33	C	S	.	.			trans	-61.6	140.1	-175.2	-25.6	36.3	0	0	0	112.7	D129 A132 M169	D129-P165 WeakPolarHBondContact OD1-CG 3.24Å; A132-P165 HydrophobicContact CB-CB 3.72Å; P165-M169 HydrophobicContact CB-SD 3.84Å
166	S	98.1	Very high	97.9	Very high	43 Å²	43	62.2 Å²	62.2	30%	0.301	33%	0.331	S	S	.	.			trans	-123.5	160.7	173.4	80.4	0	0	0	0	110.7	T168 M169	S166-T168 PolarHBondContact O-N 3.18Å; S166-T168 PolarHBondContact OG-N 3.33Å; S166-T168 PolarHBondContact OG-OG1 3.38Å; S166-M169 VanDerWaalsContact O-CG 3.31Å; S166-M169 WeakPolarHBondContact O-CG 3.29Å; S166-M169 PolarHBondContact O-N 3.32Å; S166-M169 PolarHBondContact OG-N 3.48Å; S166-M169 VanDerWaalsContact OG-N 3.16Å
167	N	98.1	Very high	97.9	Very high	50 Å²	50	57 Å²	57	27%	0.267	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-8.7	177.1	63.3	-8.6	0	0	0	113.9	L119 K120 E122 V128	L119-N167 HydrophobicContact CG-CB 4.33Å; L119-N167 WeakPolarHBondContact O-CB 3.17Å; K120-N167 VanDerWaalsContact CG-O 3.31Å; K120-N167 WeakPolarHBondContact CG-O 3.47Å; E122-N167 PolarHBondContact O-ND2 2.64Å; V128-N167 HydrophobicContact CG1-CB 4.24Å; V128-N167 HydrophobicContact CG2-CB 4.04Å
168	T	98.1	Very high	98	Very high	62 Å²	62	58.1 Å²	58.1	38%	0.38	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	1.5	179.6	56.3	0	0	0	0	113.6	S166 Y170 E171	S166-T168 PolarHBondContact O-N 3.18Å; S166-T168 PolarHBondContact OG-N 3.33Å; S166-T168 PolarHBondContact OG-OG1 3.38Å; T168-Y170 PolarHBondContact O-N 3.17Å; T168-E171 WeakPolarHBondContact CB-OE1 3.36Å; T168-E171 VanDerWaalsContact CG2-OE1 3.24Å; T168-E171 WeakPolarHBondContact CG2-OE1 3.37Å; T168-E171 WeakPolarHBondContact O-CG 3.5Å; T168-E171 PolarHBondContact O-N 2.82Å; T168-E171 VanDerWaalsContact O-N 3.12Å
169	M	98.4	Very high	98	Very high	21 Å²	21	59.9 Å²	59.9	10%	0.103	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-16.7	-172.1	70.9	-176.4	-78.9	0	0	115	A132 I158 L162 P165 S166	A132-M169 HydrophobicContact CB-SD 3.72Å; I158-M169 HydrophobicContact CG2-CE 4.08Å; L162-M169 HydrophobicContact CD2-CE 3.92Å; L162-M169 HydrophobicContact CG-CE 4.23Å; P165-M169 HydrophobicContact CB-SD 3.84Å; S166-M169 VanDerWaalsContact O-CG 3.31Å; S166-M169 WeakPolarHBondContact O-CG 3.29Å; S166-M169 PolarHBondContact O-N 3.32Å; S166-M169 PolarHBondContact OG-N 3.48Å; S166-M169 VanDerWaalsContact OG-N 3.16Å
170	Y	98.8	Very high	98	Very high	4 Å²	4	60.1 Å²	60.1	2%	0.016	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	5.2	-179.8	-63.5	-65	0	0	0	114.5	F112 C116 L119 A132 I135 Y136 V140 I158 T168 E172 A173 Q174	F112-Y170 HydrophobicContact CE2-CD1 4.38Å; F112-Y170 HydrophobicContact CZ-CD1 4.46Å; C116-Y170 VanDerWaalsContact SG-CB 3.55Å; L119-Y170 HydrophobicContact CD2-CD2 3.54Å; L119-Y170 HydrophobicContact CD2-CE2 3.81Å; A132-Y170 HydrophobicContact CB-CE2 4.29Å; A132-Y170 PolarHBondContact O-OH 3.26Å; I135-Y170 HydrophobicContact CB-CE2 3.81Å; I135-Y170 HydrophobicContact CD1-CD2 4.31Å; I135-Y170 HydrophobicContact CD1-CE2 4.15Å; I135-Y170 HydrophobicContact CG2-CD1 4.4Å; I135-Y170 HydrophobicContact CG2-CD2 3.93Å; I135-Y170 HydrophobicContact CG2-CE1 4.07Å; I135-Y170 HydrophobicContact CG2-CE2 3.58Å; I135-Y170 HydrophobicContact CG2-CG 4.34Å; Y136-Y170 WeakPolarHBondContact CB-OH 3.44Å; Y136-Y170 PolarHBondContact N-OH 3Å; V140-Y170 HydrophobicContact CG2-CE1 4.03Å; I158-Y170 HydrophobicContact CB-CE1 4.45Å; I158-Y170 HydrophobicContact CD1-CD1 3.72Å; I158-Y170 HydrophobicContact CD1-CE1 3.94Å; I158-Y170 HydrophobicContact CG1-CD1 3.9Å; I158-Y170 HydrophobicContact CG1-CE1 4.03Å; I158-Y170 HydrophobicContact CG2-CD1 4.31Å; I158-Y170 HydrophobicContact CG2-CE1 3.56Å; T168-Y170 PolarHBondContact O-N 3.17Å; Y170-E172 VanDerWaalsContact C-N 3.34Å; Y170-E172 PolarHBondContact O-N 3.01Å; Y170-A173 PolarHBondContact O-N 3.2Å; Y170-Q174 VanDerWaalsContact O-CB 3.25Å; Y170-Q174 WeakPolarHBondContact O-CB 3.28Å; Y170-Q174 PolarHBondContact O-N 2.81Å
171	E	98.4	Very high	98.1	Very high	106 Å²	106	53.4 Å²	53.4	50%	0.495	28%	0.283	S	S	.	.	H	α-helix	trans	-55.6	-43.1	-174.1	-77.9	178.5	175.1	0	0	113.8	T168 L175	T168-E171 WeakPolarHBondContact CB-OE1 3.36Å; T168-E171 VanDerWaalsContact CG2-OE1 3.24Å; T168-E171 WeakPolarHBondContact CG2-OE1 3.37Å; T168-E171 WeakPolarHBondContact O-CG 3.5Å; T168-E171 PolarHBondContact O-N 2.82Å; T168-E171 VanDerWaalsContact O-N 3.12Å; E171-L175 WeakPolarHBondContact O-CB 3.3Å; E171-L175 PolarHBondContact O-N 3.45Å
172	E	98.5	Very high	98.1	Very high	107 Å²	107	55 Å²	55	50%	0.5	29%	0.286	S	S	.	.	H	α-helix	trans	-66.8	-44.5	178.9	-171	175.5	-177	0	0	111.7	V154 Y170 L175 Q176	V154-E172 HydrophobicContact CG1-CB 4.49Å; V154-E172 HydrophobicContact CG1-CG 4.34Å; V154-E172 HydrophobicContact CG2-CG 3.95Å; Y170-E172 VanDerWaalsContact C-N 3.34Å; Y170-E172 PolarHBondContact O-N 3.01Å; E172-L175 PolarHBondContact O-N 3.4Å; E172-Q176 PolarHBondContact O-N 3.42Å
173	A	98.8	Very high	98.3	Very high	1 Å²	1	62.7 Å²	62.7	1%	0.008	31%	0.312	C	S	.	.	H	α-helix	trans	-65.9	-41.8	176.7	0	0	0	0	0	112.2	F112 L150 V154 I158 Y170 L175 Q176 I177	F112-A173 HydrophobicContact CE1-CB 4.14Å; F112-A173 HydrophobicContact CZ-CB 3.75Å; L150-A173 HydrophobicContact CD1-CB 3.98Å; L150-A173 HydrophobicContact CD2-CB 3.81Å; V154-A173 HydrophobicContact CG1-CB 3.59Å; I158-A173 HydrophobicContact CD1-CB 3.77Å; Y170-A173 PolarHBondContact O-N 3.2Å; A173-L175 VanDerWaalsContact C-N 3.31Å; A173-L175 PolarHBondContact O-N 3.26Å; A173-Q176 WeakPolarHBondContact O-CB 3.34Å; A173-Q176 PolarHBondContact O-N 3.33Å; A173-I177 WeakPolarHBondContact O-CG1 3.33Å; A173-I177 PolarHBondContact O-N 3.47Å
174	Q	98.8	Very high	98.4	Very high	10 Å²	10	60.2 Å²	60.2	5%	0.047	29%	0.294	C	S	.	.	H	α-helix	trans	-60.5	-42.4	177.2	-169.2	-172.9	27.6	0	0	111	W113 C116 E117 Y170 I177 Y178	W113-Q174 HydrophobicContact CG-CG 4.12Å; W113-Q174 PolarHBondContact O-NE2 3.41Å; C116-Q174 HydrophobicContact CB-CB 4.1Å; C116-Q174 VanDerWaalsContact CB-CD 3.44Å; C116-Q174 HydrophobicContact CB-CG 3.77Å; E117-Q174 PolarHBondContact OE1-NE2 2.86Å; Y170-Q174 VanDerWaalsContact O-CB 3.25Å; Y170-Q174 WeakPolarHBondContact O-CB 3.28Å; Y170-Q174 PolarHBondContact O-N 2.81Å; Q174-I177 PolarHBondContact O-N 2.79Å; Q174-Y178 VanDerWaalsContact O-CB 3.28Å; Q174-Y178 WeakPolarHBondContact O-CB 3.43Å; Q174-Y178 PolarHBondContact O-N 3.47Å
175	L	98.6	Very high	98.4	Very high	110 Å²	110	52.3 Å²	52.3	58%	0.576	26%	0.258	S	S	*	.	H	α-helix	trans	-64.8	-39.4	175.6	178.8	61.1	0	0	0	112.3	E171 E172 A173 T179	E171-L175 WeakPolarHBondContact O-CB 3.3Å; E171-L175 PolarHBondContact O-N 3.45Å; E172-L175 PolarHBondContact O-N 3.4Å; A173-L175 VanDerWaalsContact C-N 3.31Å; A173-L175 PolarHBondContact O-N 3.26Å; L175-T179 WeakPolarHBondContact O-CB 3.33Å; L175-T179 PolarHBondContact O-N 2.88Å; L175-T179 PolarHBondContact O-OG1 3.25Å
176	Q	98.7	Very high	98.5	Very high	44 Å²	44	51.8 Å²	51.8	21%	0.206	25%	0.253	C	S	.	.	H	α-helix	trans	-61.7	-49.4	175.6	172.6	158.5	77.4	0	0	111.6	L150 D151 E172 A173 T179 L180	L150-Q176 VanDerWaalsContact CA-OE1 3.27Å; L150-Q176 HydrophobicContact CD2-CG 4.36Å; D151-Q176 PolarHBondContact OD2-NE2 2.88Å; E172-Q176 PolarHBondContact O-N 3.42Å; A173-Q176 WeakPolarHBondContact O-CB 3.34Å; A173-Q176 PolarHBondContact O-N 3.33Å; Q176-T179 WeakPolarHBondContact O-CB 3.49Å; Q176-T179 PolarHBondContact O-N 3.21Å; Q176-L180 PolarHBondContact O-N 3.43Å
177	I	98.8	Very high	98.5	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-68.3	-37.5	179.7	-62.4	-55.1	0	0	0	111.9	N109 F112 V148 L150 A173 Q174 T179 L180 M181	N109-I177 HydrophobicContact CB-CG2 3.65Å; N109-I177 WeakPolarHBondContact O-CG2 3.35Å; F112-I177 HydrophobicContact CD1-CB 3.97Å; F112-I177 HydrophobicContact CD1-CG1 3.67Å; F112-I177 HydrophobicContact CD1-CG2 4.1Å; F112-I177 HydrophobicContact CE1-CB 4.18Å; F112-I177 HydrophobicContact CE1-CG1 3.71Å; V148-I177 HydrophobicContact CB-CD1 3.8Å; V148-I177 HydrophobicContact CB-CG1 4.26Å; V148-I177 HydrophobicContact CG2-CD1 4.02Å; V148-I177 HydrophobicContact CG2-CG1 4.1Å; L150-I177 HydrophobicContact CD2-CD1 3.76Å; L150-I177 HydrophobicContact CD2-CG1 3.77Å; A173-I177 WeakPolarHBondContact O-CG1 3.33Å; A173-I177 PolarHBondContact O-N 3.47Å; Q174-I177 PolarHBondContact O-N 2.79Å; I177-T179 VanDerWaalsContact C-N 3.31Å; I177-T179 PolarHBondContact O-N 2.96Å; I177-L180 HydrophobicContact CD1-CD2 4.23Å; I177-L180 WeakPolarHBondContact O-CB 3.26Å; I177-L180 PolarHBondContact O-N 3.18Å; I177-M181 HydrophobicContact CG2-CE 4.22Å; I177-M181 WeakPolarHBondContact O-CG 3.28Å; I177-M181 PolarHBondContact O-N 2.93Å
178	Y	98.7	Very high	98.5	Very high	51 Å²	51	54.3 Å²	54.3	20%	0.2	26%	0.259	C	S	.	.	H	α-helix	trans	-55.9	-48.2	169.5	174.9	-89.8	0	0	0	111.1	F84 L88 W113 Q174 L180 M181 H182	F84-Y178 AromaticContact CD1-CD2 3.94Å; F84-Y178 HydrophobicContact CD1-CD2 3.94Å; F84-Y178 HydrophobicContact CD1-CE1 4.25Å; F84-Y178 AromaticContact CD1-CE2 3.34Å; F84-Y178 HydrophobicContact CD1-CE2 3.34Å; F84-Y178 AromaticContact CD1-CZ 3.52Å; F84-Y178 AromaticContact CE1-CD2 3.68Å; F84-Y178 HydrophobicContact CE1-CD2 3.68Å; F84-Y178 AromaticContact CE1-CE2 3.58Å; F84-Y178 HydrophobicContact CE1-CE2 3.58Å; F84-Y178 HydrophobicContact CE1-CG 4.31Å; F84-Y178 HydrophobicContact CG-CE2 4.4Å; L88-Y178 HydrophobicContact CD1-CD2 3.74Å; L88-Y178 HydrophobicContact CD1-CE2 3.69Å; W113-Y178 AromaticContact NE1-CD2 3.76Å; Q174-Y178 VanDerWaalsContact O-CB 3.28Å; Q174-Y178 WeakPolarHBondContact O-CB 3.43Å; Q174-Y178 PolarHBondContact O-N 3.47Å; Y178-L180 VanDerWaalsContact C-N 3.34Å; Y178-L180 PolarHBondContact O-N 3.47Å; Y178-M181 PolarHBondContact O-N 3.39Å; Y178-H182 HydrophobicContact CE1-CB 4.39Å; Y178-H182 WeakPolarHBondContact O-CB 3.4Å; Y178-H182 PolarHBondContact O-N 3.09Å
179	T	98.5	Very high	98.5	Very high	42 Å²	42	51.3 Å²	51.3	26%	0.258	24%	0.241	S	C	.	.	H	α-helix	trans	-65.3	-38.9	-179.2	-59.2	0	0	0	0	111.6	L175 Q176 I177 H182 R183	L175-T179 WeakPolarHBondContact O-CB 3.33Å; L175-T179 PolarHBondContact O-N 2.88Å; L175-T179 PolarHBondContact O-OG1 3.25Å; Q176-T179 WeakPolarHBondContact O-CB 3.49Å; Q176-T179 PolarHBondContact O-N 3.21Å; I177-T179 VanDerWaalsContact C-N 3.31Å; I177-T179 PolarHBondContact O-N 2.96Å; T179-H182 PolarHBondContact O-N 3.33Å; T179-R183 HydrophobicContact CG2-CG 4.24Å; T179-R183 WeakPolarHBondContact O-CB 3.36Å; T179-R183 WeakPolarHBondContact O-CG 3.28Å; T179-R183 PolarHBondContact O-N 3.11Å
180	L	98.4	Very high	98.4	Very high	69 Å²	69	52.1 Å²	52.1	36%	0.361	25%	0.245	S	C	.	.	H	α-helix	trans	-58.9	-55.3	175.1	177.5	66.8	0	0	0	110.6	Q176 I177 Y178 H182 R183 D184	Q176-L180 PolarHBondContact O-N 3.43Å; I177-L180 HydrophobicContact CD1-CD2 4.23Å; I177-L180 WeakPolarHBondContact O-CB 3.26Å; I177-L180 PolarHBondContact O-N 3.18Å; Y178-L180 VanDerWaalsContact C-N 3.34Å; Y178-L180 PolarHBondContact O-N 3.47Å; L180-H182 VanDerWaalsContact C-N 3.33Å; L180-H182 PolarHBondContact O-N 3.06Å; L180-R183 PolarHBondContact O-N 3.49Å; L180-D184 WeakPolarHBondContact O-CB 3.2Å; L180-D184 PolarHBondContact O-N 2.68Å
181	M	98.6	Very high	98.3	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-60.6	-43.5	178.1	-68.4	-170.5	-69.4	0	0	111.8	F84 F97 L101 N109 L110 W113 I177 Y178 R183 S185 F186	F84-M181 HydrophobicContact CE1-CB 4.12Å; F84-M181 HydrophobicContact CZ-CB 3.72Å; F84-M181 HydrophobicContact CZ-CE 4.28Å; F97-M181 HydrophobicContact CE1-CB 4.46Å; F97-M181 HydrophobicContact CE1-SD 4.01Å; F97-M181 HydrophobicContact CZ-CB 4.45Å; L101-M181 HydrophobicContact CD1-SD 4.06Å; N109-M181 HydrophobicContact CB-CG 3.74Å; N109-M181 HydrophobicContact CB-SD 3.68Å; L110-M181 HydrophobicContact CB-SD 3.94Å; L110-M181 HydrophobicContact CD1-CE 4.46Å; W113-M181 HydrophobicContact CB-CE 4Å; W113-M181 HydrophobicContact CG-CE 4.26Å; I177-M181 HydrophobicContact CG2-CE 4.22Å; I177-M181 WeakPolarHBondContact O-CG 3.28Å; I177-M181 PolarHBondContact O-N 2.93Å; Y178-M181 PolarHBondContact O-N 3.39Å; M181-R183 VanDerWaalsContact C-N 3.32Å; M181-R183 PolarHBondContact O-N 3.29Å; M181-S185 PolarHBondContact O-N 2.9Å; M181-F186 VanDerWaalsContact O-CB 3.26Å; M181-F186 WeakPolarHBondContact O-CB 3.41Å; M181-F186 PolarHBondContact O-N 3.21Å
182	H	98.6	Very high	98.3	Very high	80 Å²	80	53.3 Å²	53.3	37%	0.37	26%	0.256	S	S	.	.	H	α-helix	trans	-64.1	-35.9	-178.2	-177	-144.8	0	0	0	112.9	F84 Y178 T179 L180 F186 P187	F84-H182 HydrophobicContact CD1-CB 3.58Å; F84-H182 AromaticContact CD1-CD2 3.93Å; F84-H182 AromaticContact CD1-CG 3.9Å; F84-H182 HydrophobicContact CE1-CB 3.88Å; F84-H182 HydrophobicContact CG-CB 4.35Å; F84-H182 AromaticContact CG-CD2 3.91Å; Y178-H182 HydrophobicContact CE1-CB 4.39Å; Y178-H182 WeakPolarHBondContact O-CB 3.4Å; Y178-H182 PolarHBondContact O-N 3.09Å; T179-H182 PolarHBondContact O-N 3.33Å; L180-H182 VanDerWaalsContact C-N 3.33Å; L180-H182 PolarHBondContact O-N 3.06Å; H182-F186 AromaticContact CD2-CD1 3.91Å; H182-P187 WeakPolarHBondContact O-CD 3.32Å
183	R	98.1	Very high	98.1	Very high	198 Å²	198	51.1 Å²	51.1	75%	0.747	25%	0.253	S	S	*	.	H	α-helix	trans	-90	-24.3	-176.6	-69.9	-174.8	177.9	-175.2	1.5	113.9	T179 L180 M181	T179-R183 HydrophobicContact CG2-CG 4.24Å; T179-R183 WeakPolarHBondContact O-CB 3.36Å; T179-R183 WeakPolarHBondContact O-CG 3.28Å; T179-R183 PolarHBondContact O-N 3.11Å; L180-R183 PolarHBondContact O-N 3.49Å; M181-R183 VanDerWaalsContact C-N 3.32Å; M181-R183 PolarHBondContact O-N 3.29Å
184	D	98.1	Very high	97.9	Very high	75 Å²	75	53.9 Å²	53.9	40%	0.401	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	-75.8	-178	-177.7	63.3	0	0	0	112.7	L180 F186 P187 R188	L180-D184 WeakPolarHBondContact O-CB 3.2Å; L180-D184 PolarHBondContact O-N 2.68Å; D184-F186 PolarHBondContact O-N 3.47Å; D184-P187 WeakPolarHBondContact O-CD 3.39Å; D184-R188 WeakPolarHBondContact O-CG 3.41Å; D184-R188 PolarHBondContact O-N 3.29Å; D184-R188 IonicContact OD1-NE 3.37Å; D184-R188 PolarHBondContact OD1-NE 3.32Å; D184-R188 IonicContact OD2-CZ 3.33Å; D184-R188 IonicContact OD2-NE 3.62Å; D184-R188 PolarHBondContact OD2-NE 3Å; D184-R188 IonicContact OD2-NH2 2.63Å; D184-R188 PolarHBondContact OD2-NH2 3.32Å
185	S	98.2	Very high	97.8	Very high	4 Å²	4	53.8 Å²	53.8	3%	0.028	27%	0.269	C	S	.	.	H	α-helix	trans	-65.7	-35.8	-170.3	-47.7	0	0	0	0	113.3	F100 M181 R188 F189	F100-S185 WeakPolarHBondContact CE1-O 3.44Å; M181-S185 PolarHBondContact O-N 2.9Å; S185-R188 PolarHBondContact O-N 3.45Å; S185-F189 WeakPolarHBondContact O-CB 3.45Å; S185-F189 PolarHBondContact O-N 3.31Å
186	F	98.4	Very high	97.5	Very high	10 Å²	10	54.9 Å²	54.9	4%	0.044	27%	0.265	C	S	.	.	H	α-helix	trans	-68.7	-46.3	-175.2	-179.6	-113.8	0	0	0	113.6	W80 F84 M87 F97 M181 H182 D184 R188 F189 L190	W80-F186 WeakPolarHBondContact O-CZ 3.43Å; F84-F186 HydrophobicContact CB-CD1 3.86Å; F84-F186 HydrophobicContact CB-CE1 3.71Å; F84-F186 HydrophobicContact CB-CG 4.34Å; F84-F186 HydrophobicContact CB-CZ 4.08Å; F84-F186 HydrophobicContact CD2-CB 3.92Å; F84-F186 AromaticContact CD2-CD1 3.84Å; F84-F186 HydrophobicContact CD2-CD1 3.84Å; F84-F186 AromaticContact CD2-CD2 3.33Å; F84-F186 HydrophobicContact CD2-CD2 3.33Å; F84-F186 HydrophobicContact CD2-CE1 4.13Å; F84-F186 AromaticContact CD2-CE2 3.67Å; F84-F186 HydrophobicContact CD2-CE2 3.67Å; F84-F186 AromaticContact CD2-CG 3.4Å; F84-F186 HydrophobicContact CD2-CG 3.4Å; F84-F186 VanDerWaalsContact CD2-CG 3.4Å; F84-F186 HydrophobicContact CD2-CZ 4.04Å; F84-F186 HydrophobicContact CE2-CB 3.94Å; F84-F186 AromaticContact CE2-CD2 3.75Å; F84-F186 HydrophobicContact CE2-CD2 3.75Å; F84-F186 HydrophobicContact CE2-CE2 4.41Å; F84-F186 AromaticContact CE2-CG 3.89Å; F84-F186 HydrophobicContact CE2-CG 3.89Å; F84-F186 HydrophobicContact CG-CD1 4.06Å; F84-F186 HydrophobicContact CG-CD2 4.33Å; F84-F186 HydrophobicContact CG-CE1 4.3Å; F84-F186 HydrophobicContact CG-CG 4.05Å; M87-F186 HydrophobicContact CB-CE2 4.35Å; M87-F186 HydrophobicContact CE-CD2 4.12Å; M87-F186 HydrophobicContact CE-CE2 4.12Å; M87-F186 HydrophobicContact CG-CE2 4.36Å; F97-F186 HydrophobicContact CE2-CB 4.36Å; F97-F186 HydrophobicContact CE2-CD2 4.3Å; F97-F186 HydrophobicContact CZ-CB 4.22Å; M181-F186 VanDerWaalsContact O-CB 3.26Å; M181-F186 WeakPolarHBondContact O-CB 3.41Å; M181-F186 PolarHBondContact O-N 3.21Å; H182-F186 AromaticContact CD2-CD1 3.91Å; D184-F186 PolarHBondContact O-N 3.47Å; F186-R188 PolarHBondContact O-N 3.21Å; F186-F189 HydrophobicContact CD2-CD1 4.02Å; F186-F189 HydrophobicContact CE2-CD1 4.05Å; F186-F189 HydrophobicContact CE2-CE1 4.5Å; F186-F189 WeakPolarHBondContact O-CB 3.43Å; F186-F189 PolarHBondContact O-N 2.96Å; F186-L190 HydrophobicContact CD1-CD1 4.3Å; F186-L190 HydrophobicContact CE1-CD1 3.72Å; F186-L190 HydrophobicContact CE1-CG 4.32Å; F186-L190 HydrophobicContact CE2-CD1 4.35Å; F186-L190 HydrophobicContact CE2-CD2 4.04Å; F186-L190 HydrophobicContact CE2-CG 4.1Å; F186-L190 HydrophobicContact CZ-CD1 3.75Å; F186-L190 HydrophobicContact CZ-CD2 4.03Å; F186-L190 HydrophobicContact CZ-CG 4Å; F186-L190 WeakPolarHBondContact O-CG 3.34Å; F186-L190 PolarHBondContact O-N 3.1Å
187	P	98.2	Very high	97.3	Very high	52 Å²	52	57.5 Å²	57.5	34%	0.338	28%	0.281	S	S	.	.	H	α-helix	trans	-56.9	-37.3	169.6	-28	33.6	0	0	0	113.1	H182 D184 N191	H182-P187 WeakPolarHBondContact O-CD 3.32Å; D184-P187 WeakPolarHBondContact O-CD 3.39Å; P187-N191 PolarHBondContact O-N 3.25Å; P187-N191 PolarHBondContact O-ND2 3.4Å
188	R	98.3	Very high	97	Very high	94 Å²	94	59.4 Å²	59.4	36%	0.355	29%	0.291	S	S	.	.	H	α-helix	trans	-69.2	-40.1	177.3	-64.1	-171.6	-63.5	105.2	5.9	111.3	F100 E104 D184 S185 F186 N191 S192	F100-R188 HydrophobicContact CZ-CB 3.96Å; E104-R188 IonicContact OE1-CZ 2.64Å; E104-R188 IonicContact OE1-NH1 3.42Å; E104-R188 PolarHBondContact OE1-NH1 3.19Å; E104-R188 IonicContact OE2-CZ 3.35Å; E104-R188 IonicContact OE2-NH1 3.37Å; E104-R188 PolarHBondContact OE2-NH1 2.69Å; E104-R188 IonicContact OE2-NH2 3.42Å; E104-R188 PolarHBondContact OE2-NH2 3.45Å; D184-R188 WeakPolarHBondContact O-CG 3.41Å; D184-R188 PolarHBondContact O-N 3.29Å; D184-R188 IonicContact OD1-NE 3.37Å; D184-R188 PolarHBondContact OD1-NE 3.32Å; D184-R188 IonicContact OD2-CZ 3.33Å; D184-R188 IonicContact OD2-NE 3.62Å; D184-R188 PolarHBondContact OD2-NE 3Å; D184-R188 IonicContact OD2-NH2 2.63Å; D184-R188 PolarHBondContact OD2-NH2 3.32Å; S185-R188 PolarHBondContact O-N 3.45Å; F186-R188 PolarHBondContact O-N 3.21Å; R188-N191 CarbonylContact O-C 3.25Å; R188-N191 PolarHBondContact O-N 3.46Å; R188-S192 PolarHBondContact O-N 3.12Å
189	F	98.3	Very high	96.7	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-56.7	-50.9	172.2	168.3	-110.9	0	0	0	112.1	I96 F97 F100 S185 F186 N191 S192 V194 Y195	I96-F189 HydrophobicContact CG2-CE2 3.73Å; I96-F189 HydrophobicContact CG2-CZ 3.78Å; F97-F189 HydrophobicContact CD2-CB 3.85Å; F97-F189 AromaticContact CD2-CD1 3.94Å; F97-F189 HydrophobicContact CD2-CD1 3.94Å; F97-F189 HydrophobicContact CD2-CD2 4.05Å; F97-F189 AromaticContact CD2-CG 3.66Å; F97-F189 HydrophobicContact CD2-CG 3.66Å; F97-F189 HydrophobicContact CE2-CB 3.74Å; F97-F189 HydrophobicContact CE2-CD1 4.43Å; F97-F189 HydrophobicContact CE2-CG 4.08Å; F100-F189 HydrophobicContact CB-CD2 3.73Å; F100-F189 HydrophobicContact CB-CE2 4.3Å; F100-F189 HydrophobicContact CD1-CB 3.66Å; F100-F189 HydrophobicContact CD1-CD2 4.07Å; F100-F189 HydrophobicContact CD1-CG 4.29Å; F100-F189 HydrophobicContact CD2-CB 4.42Å; F100-F189 HydrophobicContact CD2-CD2 4.09Å; F100-F189 HydrophobicContact CE1-CB 3.68Å; F100-F189 HydrophobicContact CE2-CB 4.43Å; F100-F189 HydrophobicContact CG-CB 4.05Å; F100-F189 AromaticContact CG-CD2 3.67Å; F100-F189 HydrophobicContact CG-CD2 3.67Å; F100-F189 HydrophobicContact CG-CG 4.33Å; F100-F189 HydrophobicContact CZ-CB 4.08Å; S185-F189 WeakPolarHBondContact O-CB 3.45Å; S185-F189 PolarHBondContact O-N 3.31Å; F186-F189 HydrophobicContact CD2-CD1 4.02Å; F186-F189 HydrophobicContact CE2-CD1 4.05Å; F186-F189 HydrophobicContact CE2-CE1 4.5Å; F186-F189 WeakPolarHBondContact O-CB 3.43Å; F186-F189 PolarHBondContact O-N 2.96Å; F189-N191 PolarHBondContact O-N 3.46Å; F189-N191 VanDerWaalsContact O-N 3.17Å; F189-S192 VanDerWaalsContact O-CB 3.28Å; F189-S192 WeakPolarHBondContact O-CB 3.33Å; F189-S192 PolarHBondContact O-N 3.38Å; F189-S192 PolarHBondContact O-OG 2.64Å; F189-V194 HydrophobicContact CE2-CG1 4.34Å; F189-Y195 AromaticContact CE1-CD2 3.81Å; F189-Y195 HydrophobicContact CE1-CD2 3.81Å; F189-Y195 HydrophobicContact CE1-CE2 4.47Å; F189-Y195 HydrophobicContact CE1-CG 4.31Å; F189-Y195 AromaticContact CZ-CD2 3.77Å; F189-Y195 HydrophobicContact CZ-CD2 3.77Å; F189-Y195 HydrophobicContact CZ-CG 4.31Å; F189-Y195 VanDerWaalsContact O-CB 3.3Å; F189-Y195 WeakPolarHBondContact O-CB 3.26Å
190	L	97.3	Very high	96.3	Very high	38 Å²	38	59 Å²	59	20%	0.199	29%	0.29	C	S	.	.	H	α-helix	trans	-62.7	-24.5	179.8	-65.6	-179.9	0	0	0	113.2	A81 F186 Y195	A81-L190 HydrophobicContact CB-CD1 4.41Å; A81-L190 HydrophobicContact CB-CD2 4.2Å; F186-L190 HydrophobicContact CD1-CD1 4.3Å; F186-L190 HydrophobicContact CE1-CD1 3.72Å; F186-L190 HydrophobicContact CE1-CG 4.32Å; F186-L190 HydrophobicContact CE2-CD1 4.35Å; F186-L190 HydrophobicContact CE2-CD2 4.04Å; F186-L190 HydrophobicContact CE2-CG 4.1Å; F186-L190 HydrophobicContact CZ-CD1 3.75Å; F186-L190 HydrophobicContact CZ-CD2 4.03Å; F186-L190 HydrophobicContact CZ-CG 4Å; F186-L190 WeakPolarHBondContact O-CG 3.34Å; F186-L190 PolarHBondContact O-N 3.1Å; L190-Y195 HydrophobicContact CB-CD1 4.42Å; L190-Y195 HydrophobicContact CD2-CD1 3.99Å; L190-Y195 HydrophobicContact CD2-CD2 4.31Å; L190-Y195 HydrophobicContact CD2-CE1 3.74Å; L190-Y195 HydrophobicContact CD2-CE2 4.11Å; L190-Y195 HydrophobicContact CD2-CG 4.26Å; L190-Y195 WeakPolarHBondContact O-CD1 3.42Å
191	N	96.9	Very high	95.9	Very high	117 Å²	117	58 Å²	58	63%	0.626	29%	0.289	S	S	*	.	H	α-helix	trans	-95.4	-3.4	176.9	-71	-57.4	0	0	0	113.8	P187 R188 F189 R196	P187-N191 PolarHBondContact O-N 3.25Å; P187-N191 PolarHBondContact O-ND2 3.4Å; R188-N191 CarbonylContact O-C 3.25Å; R188-N191 PolarHBondContact O-N 3.46Å; F189-N191 PolarHBondContact O-N 3.46Å; F189-N191 VanDerWaalsContact O-N 3.17Å; N191-R196 PolarHBondContact O-NH1 3.49Å
192	S	97.1	Very high	95.4	Very high	17 Å²	17	59.5 Å²	59.5	12%	0.119	30%	0.295	C	S	.	.	S	Bend	trans	-74.4	161.8	-178.3	74.3	0	0	0	0	112.1	R188 F189 V194 Y195 R196	R188-S192 PolarHBondContact O-N 3.12Å; F189-S192 VanDerWaalsContact O-CB 3.28Å; F189-S192 WeakPolarHBondContact O-CB 3.33Å; F189-S192 PolarHBondContact O-N 3.38Å; F189-S192 PolarHBondContact O-OG 2.64Å; S192-V194 VanDerWaalsContact C-N 3.25Å; S192-V194 PolarHBondContact O-N 2.8Å; S192-V194 PolarHBondContact OG-N 3.28Å; S192-Y195 PolarHBondContact OG-N 3Å; S192-R196 WeakPolarHBondContact O-CG 3.49Å; S192-R196 PolarHBondContact O-N 2.93Å
193	S	95.7	Very high	94.9	Very high	62 Å²	62	61.7 Å²	61.7	43%	0.434	30%	0.3	S	S	.	.	H	α-helix	trans	-62.2	-35.9	168.7	50.6	0	0	0	0	111.6	Y195 R196 D197	S193-Y195 VanDerWaalsContact C-N 3.35Å; S193-Y195 PolarHBondContact O-N 3.42Å; S193-R196 PolarHBondContact O-N 2.79Å; S193-D197 VanDerWaalsContact O-CB 3.29Å; S193-D197 WeakPolarHBondContact O-CB 3.33Å; S193-D197 PolarHBondContact O-N 3.3Å
194	V	94.5	Very high	94.2	Very high	58 Å²	58	60.2 Å²	60.2	35%	0.352	29%	0.294	S	S	.	.	H	α-helix	trans	-51.3	-53.5	179.5	-179.4	0	0	0	0	111.1	I96 F189 S192 L198	I96-V194 HydrophobicContact CG2-CG1 4.12Å; F189-V194 HydrophobicContact CE2-CG1 4.34Å; S192-V194 VanDerWaalsContact C-N 3.25Å; S192-V194 PolarHBondContact O-N 2.8Å; S192-V194 PolarHBondContact OG-N 3.28Å; V194-L198 HydrophobicContact CG1-CD1 4.36Å; V194-L198 WeakPolarHBondContact O-CD1 3.18Å; V194-L198 VanDerWaalsContact O-CG 3.28Å; V194-L198 WeakPolarHBondContact O-CG 3.33Å; V194-L198 PolarHBondContact O-N 3.16Å
195	Y	94.9	Very high	93.3	Very high	9 Å²	9	60.5 Å²	60.5	4%	0.035	30%	0.299	C	S	.	.	H	α-helix	trans	-72.6	-36.6	-178.7	-176.2	-107.4	0	0	0	113.1	L77 W80 A81 F189 L190 S192 S193 L198 L199	L77-Y195 HydrophobicContact CD2-CE2 4.43Å; L77-Y195 PolarHBondContact O-OH 3.32Å; W80-Y195 HydrophobicContact CE3-CE2 4.1Å; A81-Y195 WeakPolarHBondContact CB-OH 3.49Å; F189-Y195 AromaticContact CE1-CD2 3.81Å; F189-Y195 HydrophobicContact CE1-CD2 3.81Å; F189-Y195 HydrophobicContact CE1-CE2 4.47Å; F189-Y195 HydrophobicContact CE1-CG 4.31Å; F189-Y195 AromaticContact CZ-CD2 3.77Å; F189-Y195 HydrophobicContact CZ-CD2 3.77Å; F189-Y195 HydrophobicContact CZ-CG 4.31Å; F189-Y195 VanDerWaalsContact O-CB 3.3Å; F189-Y195 WeakPolarHBondContact O-CB 3.26Å; L190-Y195 HydrophobicContact CB-CD1 4.42Å; L190-Y195 HydrophobicContact CD2-CD1 3.99Å; L190-Y195 HydrophobicContact CD2-CD2 4.31Å; L190-Y195 HydrophobicContact CD2-CE1 3.74Å; L190-Y195 HydrophobicContact CD2-CE2 4.11Å; L190-Y195 HydrophobicContact CD2-CG 4.26Å; L190-Y195 WeakPolarHBondContact O-CD1 3.42Å; S192-Y195 PolarHBondContact OG-N 3Å; S193-Y195 VanDerWaalsContact C-N 3.35Å; S193-Y195 PolarHBondContact O-N 3.42Å; Y195-L198 PolarHBondContact O-N 3.37Å; Y195-L199 HydrophobicContact CD1-CD1 3.95Å; Y195-L199 HydrophobicContact CE1-CD1 3.42Å; Y195-L199 VanDerWaalsContact CE1-CD1 3.42Å; Y195-L199 HydrophobicContact CE1-CG 4.12Å; Y195-L199 PolarHBondContact O-N 3.29Å; Y195-L199 VanDerWaalsContact O-N 3.11Å
196	R	94.3	Very high	91.8	Very high	132 Å²	132	63.5 Å²	63.5	50%	0.498	32%	0.319	S	S	.	.	H	α-helix	trans	-64.8	-44.4	176.5	-72	-168.4	-59.3	-111.4	-5.2	112.5	N191 S192 S193 L198 L199 D200	N191-R196 PolarHBondContact O-NH1 3.49Å; S192-R196 WeakPolarHBondContact O-CG 3.49Å; S192-R196 PolarHBondContact O-N 2.93Å; S193-R196 PolarHBondContact O-N 2.79Å; R196-L198 VanDerWaalsContact C-N 3.29Å; R196-L198 PolarHBondContact O-N 3.4Å; R196-L199 PolarHBondContact O-N 3.41Å; R196-D200 PolarHBondContact O-N 2.93Å
197	D	93.6	Very high	90.3	Very high	100 Å²	100	69.9 Å²	69.9	54%	0.535	35%	0.353	S	S	.	.	H	α-helix	trans	-65.6	-36	-179.2	-64.6	-20.1	0	0	0	110.7	S193 D200 S201	S193-D197 VanDerWaalsContact O-CB 3.29Å; S193-D197 WeakPolarHBondContact O-CB 3.33Å; S193-D197 PolarHBondContact O-N 3.3Å; D197-D200 PolarHBondContact O-N 2.75Å; D197-S201 VanDerWaalsContact O-CB 3.28Å; D197-S201 WeakPolarHBondContact O-CB 3.37Å; D197-S201 PolarHBondContact O-N 3.03Å
198	L	91.8	Very high	88.3	Confident	39 Å²	39	74.1 Å²	74.1	20%	0.204	37%	0.373	C	S	.	.	H	α-helix	trans	-61.3	-48.4	171.6	-75.8	165.2	0	0	0	112.1	L77 I96 V194 Y195 R196 D200 S201 R202	L77-L198 HydrophobicContact CD1-CB 4.26Å; I96-L198 HydrophobicContact CD1-CD1 3.84Å; I96-L198 HydrophobicContact CD1-CD2 4.25Å; I96-L198 HydrophobicContact CG1-CD1 4.37Å; I96-L198 HydrophobicContact CG2-CD1 3.53Å; V194-L198 HydrophobicContact CG1-CD1 4.36Å; V194-L198 WeakPolarHBondContact O-CD1 3.18Å; V194-L198 VanDerWaalsContact O-CG 3.28Å; V194-L198 WeakPolarHBondContact O-CG 3.33Å; V194-L198 PolarHBondContact O-N 3.16Å; Y195-L198 PolarHBondContact O-N 3.37Å; R196-L198 VanDerWaalsContact C-N 3.29Å; R196-L198 PolarHBondContact O-N 3.4Å; L198-D200 PolarHBondContact O-N 3.29Å; L198-S201 PolarHBondContact O-N 3.36Å; L198-R202 WeakPolarHBondContact O-CG 3.33Å; L198-R202 PolarHBondContact O-N 3.06Å; L198-R202 VanDerWaalsContact O-N 3.09Å
199	L	92.4	Very high	86	Confident	22 Å²	22	77.9 Å²	77.9	12%	0.115	41%	0.406	C	S	.	.	H	α-helix	trans	-60.7	-45.1	177.1	-77.9	173	0	0	0	112	L74 L77 L78 Y195 R196 R202 R203	L74-L199 HydrophobicContact CD1-CD2 3.98Å; L77-L199 HydrophobicContact CB-CD2 3.69Å; L77-L199 HydrophobicContact CD1-CD2 3.97Å; L77-L199 HydrophobicContact CD1-CG 4.41Å; L77-L199 HydrophobicContact CG-CD2 4.49Å; L78-L199 HydrophobicContact CD2-CD2 4.28Å; Y195-L199 HydrophobicContact CD1-CD1 3.95Å; Y195-L199 HydrophobicContact CE1-CD1 3.42Å; Y195-L199 VanDerWaalsContact CE1-CD1 3.42Å; Y195-L199 HydrophobicContact CE1-CG 4.12Å; Y195-L199 PolarHBondContact O-N 3.29Å; Y195-L199 VanDerWaalsContact O-N 3.11Å; R196-L199 PolarHBondContact O-N 3.41Å; L199-R202 PolarHBondContact O-N 3.11Å; L199-R203 WeakPolarHBondContact O-CG 3.46Å; L199-R203 PolarHBondContact O-N 3.11Å
200	D	91.5	Very high	85.4	Confident	62 Å²	62	81.8 Å²	81.8	33%	0.332	43%	0.427	S	S	.	.	H	α-helix	trans	-69	-39.7	-178.6	-77	-12.4	0	0	0	112	R196 D197 L198 R202 R203 R204	R196-D200 PolarHBondContact O-N 2.93Å; D197-D200 PolarHBondContact O-N 2.75Å; L198-D200 PolarHBondContact O-N 3.29Å; D200-R202 VanDerWaalsContact C-N 3.27Å; D200-R202 PolarHBondContact O-N 3.26Å; D200-R203 PolarHBondContact O-N 3.02Å; D200-R203 IonicContact OD1-NH1 3.71Å; D200-R204 WeakPolarHBondContact O-CG 3.25Å; D200-R204 PolarHBondContact O-N 3.02Å; D200-R204 VanDerWaalsContact O-N 3.16Å
201	S	89.8	Confident	84.8	Confident	49 Å²	49	84.1 Å²	84.1	34%	0.343	44%	0.439	S	S	.	.	H	α-helix	trans	-57.7	-42.7	172.6	-176.4	0	0	0	0	111	D197 L198 T205	D197-S201 VanDerWaalsContact O-CB 3.28Å; D197-S201 WeakPolarHBondContact O-CB 3.37Å; D197-S201 PolarHBondContact O-N 3.03Å; L198-S201 PolarHBondContact O-N 3.36Å; S201-T205 PolarHBondContact O-N 3.43Å; S201-T205 PolarHBondContact O-OG1 3.49Å; S201-T205 VanDerWaalsContact O-OG1 3.06Å
202	R	87.9	Confident	84.1	Confident	32 Å²	32	82.2 Å²	82.2	12%	0.121	43%	0.428	C	S	.	.	H	α-helix	trans	-71.4	-40.4	179.5	-70.4	-58.1	-179.8	-139.8	-23.3	114	R71 P72 L74 L77 L198 L199 D200 R204 T205 C206	R71-R202 VanDerWaalsContact C-NH2 3.25Å; R71-R202 VanDerWaalsContact CA-NH2 3.31Å; R71-R202 VanDerWaalsContact CB-CZ 3.49Å; P72-R202 WeakPolarHBondContact O-CD 3.49Å; P72-R202 PolarHBondContact O-NE 3.05Å; L74-R202 HydrophobicContact CB-CB 4.24Å; L74-R202 HydrophobicContact CD1-CB 4.09Å; L77-R202 HydrophobicContact CD1-CB 4.19Å; L77-R202 HydrophobicContact CD1-CG 3.58Å; L198-R202 WeakPolarHBondContact O-CG 3.33Å; L198-R202 PolarHBondContact O-N 3.06Å; L198-R202 VanDerWaalsContact O-N 3.09Å; L199-R202 PolarHBondContact O-N 3.11Å; D200-R202 VanDerWaalsContact C-N 3.27Å; D200-R202 PolarHBondContact O-N 3.26Å; R202-R204 VanDerWaalsContact C-N 3.26Å; R202-R204 PolarHBondContact O-N 3.24Å; R202-T205 PolarHBondContact O-N 3.04Å; R202-C206 PolarHBondContact O-N 3.25Å
203	R	87.4	Confident	83.3	Confident	126 Å²	126	86.1 Å²	86.1	48%	0.475	45%	0.446	S	S	.	.	H	α-helix	trans	-58.4	-40.7	176.6	-77.1	170.9	171.4	173.2	-3.6	111.8	L74 L199 D200 C206 L207	L74-R203 HydrophobicContact CD1-CG 4.12Å; L74-R203 HydrophobicContact CD2-CG 4.18Å; L199-R203 WeakPolarHBondContact O-CG 3.46Å; L199-R203 PolarHBondContact O-N 3.11Å; D200-R203 PolarHBondContact O-N 3.02Å; D200-R203 IonicContact OD1-NH1 3.71Å; R203-C206 PolarHBondContact O-N 3.1Å; R203-L207 WeakPolarHBondContact O-CG 3.31Å; R203-L207 PolarHBondContact O-N 3.33Å
204	R	84.3	Confident	82.6	Confident	166 Å²	166	87.6 Å²	87.6	63%	0.626	45%	0.447	S	S	*	.	H	α-helix	trans	-63.8	-48	176.8	-67.6	173.9	-163.4	167.8	8	111.3	D200 R202 C206 L207 D208	D200-R204 WeakPolarHBondContact O-CG 3.25Å; D200-R204 PolarHBondContact O-N 3.02Å; D200-R204 VanDerWaalsContact O-N 3.16Å; R202-R204 VanDerWaalsContact C-N 3.26Å; R202-R204 PolarHBondContact O-N 3.24Å; R204-C206 VanDerWaalsContact C-N 3.25Å; R204-C206 PolarHBondContact O-N 3.49Å; R204-L207 PolarHBondContact O-N 2.62Å; R204-D208 PolarHBondContact O-N 3Å
205	T	78.3	Confident	81.8	Confident	81 Å²	81	89.5 Å²	89.5	50%	0.497	45%	0.454	S	S	.	.	H	α-helix	trans	-60.5	-32.6	178.2	-48.6	0	0	0	0	113.1	S201 R202 T209	S201-T205 PolarHBondContact O-N 3.43Å; S201-T205 PolarHBondContact O-OG1 3.49Å; S201-T205 VanDerWaalsContact O-OG1 3.06Å; R202-T205 PolarHBondContact O-N 3.04Å; T205-T209 PolarHBondContact O-OG1 3.46Å
206	C	67.6	Low	80.8	Confident	68 Å²	68	95.3 Å²	95.3	46%	0.459	48%	0.484	S	S	.	.	H	α-helix	trans	-75.7	-19.6	175.3	-70.4	0	0	0	0	114.6	R202 R203 R204 T209	R202-C206 PolarHBondContact O-N 3.25Å; R203-C206 PolarHBondContact O-N 3.1Å; R204-C206 VanDerWaalsContact C-N 3.25Å; R204-C206 PolarHBondContact O-N 3.49Å; C206-T209 PolarHBondContact O-OG1 2.9Å
207	L	65.5	Low	79.8	Confident	143 Å²	143	92.5 Å²	92.5	75%	0.749	48%	0.482	S	S	*	.	H	α-helix	trans	-88.5	-17.8	179	-69.3	170	0	0	0	112.7	R203 R204	R203-L207 WeakPolarHBondContact O-CG 3.31Å; R203-L207 PolarHBondContact O-N 3.33Å; R204-L207 PolarHBondContact O-N 2.62Å
208	D	57.1	Low	78.6	Confident	141 Å²	141	91.8 Å²	91.8	75%	0.754	48%	0.478	S	S	*	.			trans	-93	6	-178.4	-66	-30.7	0	0	0	113.4	R204	R204-D208 PolarHBondContact O-N 3Å
209	T	50.1	Low	77.4	Confident	173 Å²	173	96.6 Å²	96.6	100%	1.061	50%	0.503	S	S	*	.			trans	-120.3	0	174.9	36.9	0	0	0	0	111.2	T205 C206	T205-T209 PolarHBondContact O-OG1 3.46Å; C206-T209 PolarHBondContact O-OG1 2.9Å

Retrieved 209 of 209 residues in 56.1 ms (Link to these results)

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