A0A087X327_POEFO Loading...

Regulator of G protein signaling 4

AlphaFold DB , UniProt , Accession A0A087X327, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 206 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.8	Very low	52.4	Low	236 Å²	236	137.1 Å²	137.1	100%	1.163	83%	0.828	S	S	*	*				0	91.7	0	-60.1	-179.1	-156	0	0	107.7	K3	M1-K3 PolarHBondContact O-N 3.28Å
2	C	43.7	Very low	52.5	Low	142 Å²	142	133.4 Å²	133.4	96%	0.959	81%	0.812	S	S	*	*			trans	-85.4	102	-174.7	-61.5	0	0	0	0	109.8
3	K	51.3	Low	52.5	Low	206 Å²	206	134 Å²	134	90%	0.896	81%	0.806	S	S	*	*			trans	-88.1	131.6	162.8	-66.9	178.6	176.8	178.5	0	107.6	M1	M1-K3 PolarHBondContact O-N 3.28Å
4	G	49.5	Very low	52.6	Low	70 Å²	70	138.9 Å²	138.9	72%	0.722	81%	0.812	S	S	*	*			trans	141.4	77.9	160.1	0	0	0	0	0	115.8
5	L	50.7	Low	52.7	Low	174 Å²	174	136.2 Å²	136.2	91%	0.911	80%	0.803	S	S	*	*			trans	-145.5	69.6	152.6	-83.5	176.4	0	0	0	107.9
6	A	56.7	Low	53	Low	92 Å²	92	133.1 Å²	133.1	76%	0.76	80%	0.797	S	S	*	*			trans	-127.3	73.7	172.4	0	0	0	0	0	108.8
7	T	60.1	Low	53.1	Low	138 Å²	138	137.2 Å²	137.2	85%	0.847	80%	0.802	S	S	*	*			trans	179.1	94.5	150.2	24	0	0	0	0	108.1
8	L	52.5	Low	53.1	Low	146 Å²	146	137 Å²	137	76%	0.764	80%	0.798	S	S	*	*			trans	-121.7	131.3	161.3	-75.4	175.4	0	0	0	108.5
9	P	59.3	Low	53.2	Low	89 Å²	89	135.9 Å²	135.9	58%	0.578	79%	0.787	S	S	*	*			trans	-60.6	144.9	-178.3	-22.6	32.6	0	0	0	113.6	T11 C12	P9-T11 PolarHBondContact O-N 3.19Å; P9-C12 PolarHBondContact O-N 2.89Å
10	A	56.3	Low	53.1	Low	91 Å²	91	138.2 Å²	138.2	75%	0.752	79%	0.787	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	10.5	-177.5	0	0	0	0	0	115.5
11	T	56	Low	53.2	Low	124 Å²	124	139.1 Å²	139.1	76%	0.761	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	-8.8	172.4	52.5	0	0	0	0	113.1	P9	P9-T11 PolarHBondContact O-N 3.19Å
12	C	53.5	Low	53.8	Low	93 Å²	93	136.2 Å²	136.2	63%	0.628	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-87.4	0.2	174.1	-69.8	0	0	0	0	114.3	P9	P9-C12 PolarHBondContact O-N 2.89Å
13	L	52.3	Low	54.4	Low	141 Å²	141	134.6 Å²	134.6	74%	0.738	75%	0.746	S	S	*	*	G	3₁₀ helix	trans	-89.1	6.9	-176.5	-86.4	163.5	0	0	0	115.1
14	K	53.2	Low	54	Low	203 Å²	203	129.2 Å²	129.2	88%	0.883	73%	0.734	S	S	*	*	G	3₁₀ helix	trans	-101.1	8.5	178.3	-88.1	-171.3	177.7	177	0	116.7
15	S	54.9	Low	53.9	Low	98 Å²	98	134.6 Å²	134.6	69%	0.685	74%	0.738	S	S	*	*	S	Bend	trans	-127.2	21.6	174.2	-60.2	0	0	0	0	114.9
16	A	56.8	Low	53.9	Low	86 Å²	86	132.6 Å²	132.6	71%	0.711	73%	0.728	S	S	*	*	S	Bend	trans	-96.5	7.6	179.3	0	0	0	0	0	114.7
17	K	55	Low	53.4	Low	203 Å²	203	135.7 Å²	135.7	88%	0.883	73%	0.73	S	S	*	*	S	Bend	trans	-109.4	-1	178.5	-105.6	-179.8	178.6	177.5	0	115.7
18	D	53.8	Low	52.3	Low	134 Å²	134	136.9 Å²	136.9	72%	0.717	73%	0.727	S	S	*	*	S	Bend	trans	-122.6	27.8	-177.3	-113.4	-41	0	0	0	115.1
19	I	55.2	Low	51.9	Low	117 Å²	117	137.8 Å²	137.8	60%	0.6	72%	0.724	S	S	*	*			trans	-117.9	33.1	173.1	-47.4	174.1	0	0	0	110
20	K	50.3	Low	50.7	Low	180 Å²	180	139.4 Å²	139.4	78%	0.783	74%	0.735	S	S	*	*	S	Bend	trans	-94.1	-17.7	171.6	-158.7	177.2	175.4	-172.5	0	112.9
21	H	55.8	Low	49.5	Very low	159 Å²	159	142.3 Å²	142.3	74%	0.736	73%	0.733	S	S	*	*	S	Bend	trans	-97	-6.3	-177.7	-69.2	99.9	0	0	0	115.2
22	K	54.1	Low	48.7	Very low	175 Å²	175	141.8 Å²	141.8	76%	0.761	73%	0.731	S	S	*	*	S	Bend	trans	-106.5	-3.9	-174.4	-77.9	-175.3	171.8	-86.3	0	116
23	I	54.3	Low	47.6	Very low	108 Å²	108	146.6 Å²	146.6	55%	0.554	75%	0.745	S	S	*	*	S	Bend	trans	-110.4	-10.1	176.7	-52.6	-178.3	0	0	0	112	F25 L26	I23-F25 PolarHBondContact O-N 3.17Å; I23-L26 PolarHBondContact O-N 3.48Å
24	S	44.7	Very low	46.5	Very low	92 Å²	92	144.5 Å²	144.5	64%	0.643	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-15	175.6	-167.2	0	0	0	0	113.9
25	F	47.4	Very low	45.5	Very low	183 Å²	183	139.7 Å²	139.7	80%	0.803	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-17.8	178.2	-169.8	-101	0	0	0	113.2	I23	I23-F25 PolarHBondContact O-N 3.17Å
26	L	48.9	Very low	44.3	Very low	133 Å²	133	142.1 Å²	142.1	70%	0.696	75%	0.751	S	S	*	*	S	Bend	trans	-90.4	0.5	-174.2	-66.1	176.9	0	0	0	114	I23	I23-L26 PolarHBondContact O-N 3.48Å
27	L	47	Very low	43.1	Very low	156 Å²	156	147.1 Å²	147.1	82%	0.817	76%	0.76	S	S	*	*	S	Bend	trans	-135.8	66.3	177.2	-71	172.5	0	0	0	110.8
28	Q	37.8	Very low	41.9	Very low	164 Å²	164	146.3 Å²	146.3	77%	0.766	76%	0.756	S	S	*	*			trans	-135.7	104.9	162.2	-130.3	167.6	-3.7	0	0	110.3
29	K	42.5	Very low	40.8	Very low	165 Å²	165	148.1 Å²	148.1	72%	0.717	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-70.2	131.8	167.6	-178.3	-166.1	-175.9	-162.8	0	108.7	E31	K29-E31 IonicContact NZ-OE2 3.52Å; K29-E31 PolarHBondContact NZ-OE2 3.27Å
30	P	34.5	Very low	39.8	Very low	122 Å²	122	150.3 Å²	150.3	79%	0.792	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-102.2	125.2	160.1	16	2.4	0	0	0	110.4
31	E	30.7	Very low	39.1	Very low	152 Å²	152	148.8 Å²	148.8	71%	0.71	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-90.5	156.9	159.9	-118.4	166.3	110.9	0	0	109.7	K29	K29-E31 IonicContact NZ-OE2 3.52Å; K29-E31 PolarHBondContact NZ-OE2 3.27Å
32	P	39.7	Very low	37.9	Very low	113 Å²	113	150.3 Å²	150.3	73%	0.734	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-97.5	138.9	-151.2	36.1	-33.1	0	0	0	113.4
33	Q	29.8	Very low	37	Very low	195 Å²	195	149.4 Å²	149.4	91%	0.911	77%	0.768	S	S	*	*			trans	-144.9	115.8	161.3	-66.6	-166.7	-65.8	0	0	113.1
34	A	30.4	Very low	35.8	Very low	97 Å²	97	151.1 Å²	151.1	80%	0.802	78%	0.784	S	S	*	*			trans	42.7	115.8	140.5	0	0	0	0	0	122
35	A	31.9	Very low	35.9	Very low	101 Å²	101	150.8 Å²	150.8	84%	0.835	79%	0.787	S	S	*	*			trans	53.2	107.4	131.2	0	0	0	0	0	119.9
36	D	30	Very low	35.3	Very low	150 Å²	150	149 Å²	149	80%	0.802	79%	0.791	S	S	*	*				-165.4	94.5	112.2	-157.9	12.4	0	0	0	109.1
37	Q	30.8	Very low	34.6	Very low	191 Å²	191	146.8 Å²	146.8	89%	0.893	79%	0.792	S	S	*	*			trans	-96.8	99.6	172	-83	-176.6	-4	0	0	108.7	E39	Q37-E39 PolarHBondContact O-N 3.17Å
38	K	30.9	Very low	34.5	Very low	186 Å²	186	145.2 Å²	145.2	81%	0.809	79%	0.789	S	S	*	*			trans	-74.3	102	160	-96.9	179.6	177.1	173.9	0	108.9	I40	K38-I40 PolarHBondContact O-N 3.22Å; K38-I40 VanDerWaalsContact O-N 3.15Å
39	E	29.5	Very low	34.7	Very low	172 Å²	172	141.8 Å²	141.8	80%	0.804	78%	0.779	S	S	*	*			trans	-49.1	111.6	162.1	-77.9	-178.9	112.4	0	0	110.5	Q37	Q37-E39 PolarHBondContact O-N 3.17Å
40	I	35.7	Very low	35.2	Very low	163 Å²	163	143.9 Å²	143.9	84%	0.836	79%	0.788	S	S	*	*			trans	-93.5	104.6	150.3	-62.6	178	0	0	0	105.3	K38 E42	K38-I40 PolarHBondContact O-N 3.22Å; K38-I40 VanDerWaalsContact O-N 3.15Å; I40-E42 PolarHBondContact O-N 3.34Å
41	K	34.1	Very low	36.8	Very low	148 Å²	148	147.1 Å²	147.1	64%	0.643	79%	0.785	S	S	*	*			trans	-51.8	94.5	175.9	-103.7	169.4	171.8	158.2	0	111.1	K43	K41-K43 HydrophobicContact CB-CG 4.29Å; K41-K43 HydrophobicContact CD-CD 4.31Å; K41-K43 HydrophobicContact CD-CG 4.39Å; K41-K43 HydrophobicContact CG-CG 4.21Å; K41-K43 PolarHBondContact O-N 3.22Å
42	E	31.1	Very low	38.8	Very low	191 Å²	191	144.9 Å²	144.9	89%	0.893	78%	0.781	S	S	*	*			trans	-75.7	75.4	154.3	-165.7	174.6	147.2	0	0	107.9	I40 T44	I40-E42 PolarHBondContact O-N 3.34Å; E42-T44 PolarHBondContact O-N 3.4Å
43	K	34.4	Very low	40.6	Very low	156 Å²	156	140.3 Å²	140.3	68%	0.678	75%	0.752	S	S	*	*			trans	-76.1	96.7	165	-79.9	-178.3	169.5	-173.2	0	107.5	K41	K41-K43 HydrophobicContact CB-CG 4.29Å; K41-K43 HydrophobicContact CD-CD 4.31Å; K41-K43 HydrophobicContact CD-CG 4.39Å; K41-K43 HydrophobicContact CG-CG 4.21Å; K41-K43 PolarHBondContact O-N 3.22Å
44	T	30.2	Very low	43	Very low	143 Å²	143	134.3 Å²	134.3	88%	0.877	73%	0.726	S	S	*	*				-178	74.2	120.5	32.6	0	0	0	0	109.7	E42	E42-T44 PolarHBondContact O-N 3.4Å
45	A	46	Very low	45.5	Very low	86 Å²	86	130.2 Å²	130.2	71%	0.711	69%	0.692	S	S	*	*			trans	-104.8	154	146.8	0	0	0	0	0	108.1
46	T	34.4	Very low	48.1	Very low	145 Å²	145	128.4 Å²	128.4	89%	0.89	68%	0.677	S	S	*	*			trans	87	79.1	158.7	-1.5	0	0	0	0	117.6
47	A	35.5	Very low	50.9	Low	87 Å²	87	124 Å²	124	72%	0.719	65%	0.651	S	S	*	*				-168	46.2	126.3	0	0	0	0	0	112.1	T49	A47-T49 PolarHBondContact O-N 3.31Å
48	V	44.3	Very low	53.7	Low	122 Å²	122	114.9 Å²	114.9	74%	0.739	61%	0.609	S	S	*	*			trans	-75.3	79.4	153.3	-172.4	0	0	0	0	105	K50	V48-K50 PolarHBondContact O-N 3.16Å
49	T	41.3	Very low	56.6	Low	92 Å²	92	110.5 Å²	110.5	56%	0.564	59%	0.591	S	S	*	*			trans	-43.3	135.7	156.2	29.6	0	0	0	0	106.1	A47 R51	A47-T49 PolarHBondContact O-N 3.31Å; T49-R51 PolarHBondContact O-N 3.23Å
50	K	53.1	Low	59.6	Low	209 Å²	209	108.4 Å²	108.4	91%	0.909	58%	0.579	S	S	*	*			trans	-62	65.6	167.1	-65.1	178.1	179.8	178.4	0	108.3	V48 V52	V48-K50 PolarHBondContact O-N 3.16Å; K50-V52 PolarHBondContact O-N 2.65Å; K50-V52 VanDerWaalsContact O-N 3.1Å
51	R	68.3	Low	62.4	Low	190 Å²	190	100.9 Å²	100.9	72%	0.717	54%	0.541	S	S	*	.			trans	-67.1	111.3	175.6	-97.8	-171.1	171.1	-173.5	-1.6	104.4	T49 M73	T49-R51 PolarHBondContact O-N 3.23Å; R51-M73 HydrophobicContact CB-CE 3.44Å; R51-M73 VanDerWaalsContact CB-CE 3.44Å; R51-M73 VanDerWaalsContact O-CE 3.23Å; R51-M73 WeakPolarHBondContact O-CE 3.27Å
52	V	72.8	Confident	65.2	Low	105 Å²	105	97.6 Å²	97.6	64%	0.636	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-67.7	129.5	170.5	-177.6	0	0	0	0	105.9	K50 N54	K50-V52 PolarHBondContact O-N 2.65Å; K50-V52 VanDerWaalsContact O-N 3.1Å; V52-N54 PolarHBondContact O-N 3.38Å
53	P	78.9	Confident	68.2	Low	18 Å²	18	95 Å²	95	12%	0.117	51%	0.514	C	S	.	.	P	Polyproline II helix	trans	-55	136.5	171.9	-19.7	29.1	0	0	0	109.7	W61 M73 V77 I179	P53-W61 HydrophobicContact CB-CH2 3.64Å; P53-W61 HydrophobicContact CB-CZ3 4.07Å; P53-W61 HydrophobicContact CG-CH2 3.97Å; P53-W61 HydrophobicContact CG-CZ3 4.43Å; P53-M73 HydrophobicContact CB-CG 4.22Å; P53-M73 HydrophobicContact CG-CG 4.02Å; P53-M73 HydrophobicContact CG-SD 3.95Å; P53-V77 HydrophobicContact CG-CG2 3.49Å; P53-V77 VanDerWaalsContact CG-CG2 3.49Å; P53-I179 HydrophobicContact CB-CD1 4Å; P53-I179 HydrophobicContact CB-CG2 4.35Å; P53-I179 HydrophobicContact CG-CD1 3.92Å; P53-I179 VanDerWaalsContact O-CG2 3.26Å; P53-I179 WeakPolarHBondContact O-CG2 3.42Å
54	N	80.4	Confident	71.2	Confident	69 Å²	69	89.2 Å²	89.2	37%	0.369	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-90.2	162.7	171.4	63.8	56.2	0	0	0	110.6	V52 A56 E57 V58	V52-N54 PolarHBondContact O-N 3.38Å; N54-A56 VanDerWaalsContact C-N 3.28Å; N54-A56 PolarHBondContact O-N 2.85Å; N54-A56 WeakPolarHBondContact OD1-CB 3.48Å; N54-A56 PolarHBondContact OD1-N 3.23Å; N54-E57 PolarHBondContact N-OE2 3.2Å; N54-E57 PolarHBondContact ND2-OE2 3.35Å; N54-E57 PolarHBondContact O-N 3.47Å; N54-E57 WeakPolarHBondContact OD1-CG 3.28Å; N54-E57 PolarHBondContact OD1-N 3Å; N54-V58 PolarHBondContact O-N 3.04Å
55	A	83	Confident	74.3	Confident	11 Å²	11	82.4 Å²	82.4	9%	0.091	45%	0.451	C	S	.	.	H	α-helix	trans	-69	-27.8	-175.8	0	0	0	0	0	112.3	E57 V58 E59 E183	A55-E57 VanDerWaalsContact C-N 3.29Å; A55-E57 PolarHBondContact O-N 3.15Å; A55-V58 CarbonylContact O-C 3.45Å; A55-V58 WeakPolarHBondContact O-CB 3.41Å; A55-V58 PolarHBondContact O-N 3.01Å; A55-V58 VanDerWaalsContact O-N 3.1Å; A55-E59 WeakPolarHBondContact O-CG 3.46Å; A55-E59 PolarHBondContact O-N 3.03Å; A55-E183 HydrophobicContact CB-CB 4.45Å; A55-E183 HydrophobicContact CB-CG 4.01Å; A55-E183 WeakPolarHBondContact CB-OE2 3.18Å; A55-E183 PolarHBondContact N-OE1 2.84Å
56	A	86.3	Confident	76.7	Confident	63 Å²	63	81.2 Å²	81.2	52%	0.521	44%	0.437	S	S	.	.	H	α-helix	trans	-62.8	-36	175.2	0	0	0	0	0	112.3	N54 K60	N54-A56 VanDerWaalsContact C-N 3.28Å; N54-A56 PolarHBondContact O-N 2.85Å; N54-A56 WeakPolarHBondContact OD1-CB 3.48Å; N54-A56 PolarHBondContact OD1-N 3.23Å; A56-K60 PolarHBondContact O-N 3.17Å
57	E	87.6	Confident	79.7	Confident	57 Å²	57	77.9 Å²	77.9	27%	0.266	41%	0.412	S	S	.	.	H	α-helix	trans	-66.9	-41.5	171.1	-71.1	177	117	0	0	111.4	N54 A55 E59 K60 W61	N54-E57 PolarHBondContact N-OE2 3.2Å; N54-E57 PolarHBondContact ND2-OE2 3.35Å; N54-E57 PolarHBondContact O-N 3.47Å; N54-E57 WeakPolarHBondContact OD1-CG 3.28Å; N54-E57 PolarHBondContact OD1-N 3Å; A55-E57 VanDerWaalsContact C-N 3.29Å; A55-E57 PolarHBondContact O-N 3.15Å; E57-E59 VanDerWaalsContact C-N 3.34Å; E57-E59 PolarHBondContact O-N 2.77Å; E57-K60 PolarHBondContact O-N 3.16Å; E57-W61 HydrophobicContact CB-CZ2 4.09Å; E57-W61 VanDerWaalsContact O-CD1 3.27Å; E57-W61 PolarHBondContact O-N 2.71Å
58	V	90.2	Very high	82.6	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-63.5	-37.9	177.4	173.1	0	0	0	0	112.1	N54 A55 K60 W61 K62 I176 I179	N54-V58 PolarHBondContact O-N 3.04Å; A55-V58 CarbonylContact O-C 3.45Å; A55-V58 WeakPolarHBondContact O-CB 3.41Å; A55-V58 PolarHBondContact O-N 3.01Å; A55-V58 VanDerWaalsContact O-N 3.1Å; V58-K60 VanDerWaalsContact C-N 3.35Å; V58-K60 PolarHBondContact O-N 3.12Å; V58-W61 HydrophobicContact CB-CE3 4.38Å; V58-W61 HydrophobicContact CG2-CE3 3.84Å; V58-W61 HydrophobicContact CG2-CZ3 3.82Å; V58-W61 WeakPolarHBondContact O-CB 3.45Å; V58-W61 PolarHBondContact O-N 3.14Å; V58-K62 WeakPolarHBondContact O-CG 3.45Å; V58-K62 PolarHBondContact O-N 3.25Å; V58-I176 HydrophobicContact CG1-CD1 4.14Å; V58-I176 HydrophobicContact CG1-CG2 3.85Å; V58-I176 HydrophobicContact CG2-CD1 4.28Å; V58-I179 HydrophobicContact CG2-CB 4.2Å; V58-I179 HydrophobicContact CG2-CD1 4.34Å; V58-I179 HydrophobicContact CG2-CG2 3.59Å
59	E	91.4	Very high	85.1	Confident	94 Å²	94	68 Å²	68	44%	0.439	34%	0.343	S	S	.	.	H	α-helix	trans	-61.6	-43.5	175.5	-69.7	-48.4	122.9	0	0	111.3	A55 E57 W61 K62 E63	A55-E59 WeakPolarHBondContact O-CG 3.46Å; A55-E59 PolarHBondContact O-N 3.03Å; E57-E59 VanDerWaalsContact C-N 3.34Å; E57-E59 PolarHBondContact O-N 2.77Å; E59-W61 VanDerWaalsContact C-N 3.3Å; E59-W61 PolarHBondContact O-N 3.44Å; E59-K62 WeakPolarHBondContact O-CB 3.28Å; E59-K62 PolarHBondContact O-N 3.03Å; E59-K62 VanDerWaalsContact O-N 3.11Å; E59-K62 IonicContact OE1-NZ 3.12Å; E59-K62 PolarHBondContact OE1-NZ 3.37Å; E59-K62 IonicContact OE2-NZ 2.71Å; E59-E63 PolarHBondContact O-N 2.97Å
60	K	92.8	Very high	87.6	Confident	127 Å²	127	67.7 Å²	67.7	55%	0.552	34%	0.344	S	S	*	.	H	α-helix	trans	-61.4	-40.3	173.4	-66.4	178.9	-179.3	-178.9	0	112	A56 E57 V58 K62 E63 H67	A56-K60 PolarHBondContact O-N 3.17Å; E57-K60 PolarHBondContact O-N 3.16Å; V58-K60 VanDerWaalsContact C-N 3.35Å; V58-K60 PolarHBondContact O-N 3.12Å; K60-K62 PolarHBondContact O-N 2.94Å; K60-E63 WeakPolarHBondContact O-CB 3.4Å; K60-E63 PolarHBondContact O-N 3.43Å; K60-H67 VanDerWaalsContact O-CB 3.31Å; K60-H67 WeakPolarHBondContact O-CB 3.45Å; K60-H67 PolarHBondContact O-ND1 2.92Å
61	W	94.8	Very high	89.5	Confident	5 Å²	5	59.2 Å²	59.2	2%	0.019	31%	0.311	C	S	.	.	H	α-helix	trans	-63.8	-27.6	177	-63.8	-12.3	0	0	0	113.3	P53 E57 V58 E59 E63 V68 M73 G74 V77 Y167 F170 I176	P53-W61 HydrophobicContact CB-CH2 3.64Å; P53-W61 HydrophobicContact CB-CZ3 4.07Å; P53-W61 HydrophobicContact CG-CH2 3.97Å; P53-W61 HydrophobicContact CG-CZ3 4.43Å; E57-W61 HydrophobicContact CB-CZ2 4.09Å; E57-W61 VanDerWaalsContact O-CD1 3.27Å; E57-W61 PolarHBondContact O-N 2.71Å; V58-W61 HydrophobicContact CB-CE3 4.38Å; V58-W61 HydrophobicContact CG2-CE3 3.84Å; V58-W61 HydrophobicContact CG2-CZ3 3.82Å; V58-W61 WeakPolarHBondContact O-CB 3.45Å; V58-W61 PolarHBondContact O-N 3.14Å; E59-W61 VanDerWaalsContact C-N 3.3Å; E59-W61 PolarHBondContact O-N 3.44Å; W61-E63 VanDerWaalsContact C-N 3.35Å; W61-V68 HydrophobicContact CB-CG2 3.68Å; W61-V68 HydrophobicContact CG-CG2 3.92Å; W61-M73 HydrophobicContact CH2-CG 3.84Å; W61-M73 HydrophobicContact CZ2-CB 4.04Å; W61-M73 HydrophobicContact CZ2-CG 3.83Å; W61-G74 VanDerWaalsContact CZ2-CA 3.42Å; W61-V77 HydrophobicContact CH2-CB 4.26Å; W61-V77 HydrophobicContact CH2-CG2 3.86Å; W61-V77 HydrophobicContact CZ3-CB 4.23Å; W61-V77 HydrophobicContact CZ3-CG1 4.23Å; W61-V77 HydrophobicContact CZ3-CG2 4.18Å; W61-Y167 WeakPolarHBondContact O-CE2 3.28Å; W61-Y167 PolarHBondContact O-OH 3.05Å; W61-F170 HydrophobicContact CE3-CE1 4.49Å; W61-F170 HydrophobicContact CE3-CZ 4.27Å; W61-I176 HydrophobicContact CE3-CD1 4.03Å; W61-I176 HydrophobicContact CZ3-CD1 4.25Å
62	K	93.1	Very high	90.7	Very high	80 Å²	80	56.2 Å²	56.2	35%	0.348	31%	0.305	S	S	.	.	H	α-helix	trans	-73.3	-27	175.4	-71.4	167.6	-178.6	169.9	0	112.7	V58 E59 K60 Y167 L171 C180	V58-K62 WeakPolarHBondContact O-CG 3.45Å; V58-K62 PolarHBondContact O-N 3.25Å; E59-K62 WeakPolarHBondContact O-CB 3.28Å; E59-K62 PolarHBondContact O-N 3.03Å; E59-K62 VanDerWaalsContact O-N 3.11Å; E59-K62 IonicContact OE1-NZ 3.12Å; E59-K62 PolarHBondContact OE1-NZ 3.37Å; E59-K62 IonicContact OE2-NZ 2.71Å; K60-K62 PolarHBondContact O-N 2.94Å; K62-Y167 PolarHBondContact O-OH 3.26Å; K62-L171 HydrophobicContact CB-CD2 4.45Å; K62-L171 HydrophobicContact CG-CD2 3.91Å; K62-C180 PolarHBondContact NZ-SG 3.03Å
63	E	94.1	Very high	91.6	Very high	137 Å²	137	53 Å²	53	64%	0.64	28%	0.284	S	S	*	.	H	α-helix	trans	-69.9	-40.1	-178.5	-65.6	171	176.8	0	0	112.5	E59 K60 W61 H67	E59-E63 PolarHBondContact O-N 2.97Å; K60-E63 WeakPolarHBondContact O-CB 3.4Å; K60-E63 PolarHBondContact O-N 3.43Å; W61-E63 VanDerWaalsContact C-N 3.35Å; E63-H67 IonicContact OE2-CE1 3.77Å; E63-H67 PolarHBondContact OE2-CE1 3.3Å; E63-H67 IonicContact OE2-ND1 2.95Å
64	S	95.9	Very high	92.3	Very high	33 Å²	33	52.1 Å²	52.1	23%	0.231	28%	0.278	C	S	.	.			trans	-158.4	149.3	178.3	80.6	0	0	0	0	113.1	C66 H67	S64-C66 PolarHBondContact O-N 3.42Å; S64-C66 PolarHBondContact OG-N 3.33Å; S64-H67 WeakPolarHBondContact O-CB 3.26Å; S64-H67 PolarHBondContact O-N 3.05Å; S64-H67 VanDerWaalsContact O-N 3.12Å; S64-H67 VanDerWaalsContact OG-CG 3.3Å; S64-H67 PolarHBondContact OG-N 2.97Å; S64-H67 VanDerWaalsContact OG-N 3.15Å; S64-H67 PolarHBondContact OG-ND1 3.34Å
65	F	97	Very high	93.1	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.5	-29.1	171.7	-174.7	-127.4	0	0	0	112	H67 V68 M69 F78 Y159 M162 E163 Y167	F65-H67 VanDerWaalsContact C-N 3.27Å; F65-H67 PolarHBondContact O-N 3.38Å; F65-V68 HydrophobicContact CD2-CB 4.18Å; F65-V68 HydrophobicContact CE2-CG1 4.49Å; F65-V68 WeakPolarHBondContact O-CB 3.32Å; F65-V68 PolarHBondContact O-N 2.97Å; F65-V68 VanDerWaalsContact O-N 3.07Å; F65-M69 HydrophobicContact CD1-CG 3.99Å; F65-M69 HydrophobicContact CD2-CG 4.13Å; F65-M69 HydrophobicContact CE1-CG 3.57Å; F65-M69 HydrophobicContact CE1-SD 4.1Å; F65-M69 HydrophobicContact CE2-CG 3.73Å; F65-M69 HydrophobicContact CE2-SD 3.73Å; F65-M69 HydrophobicContact CG-CG 4.26Å; F65-M69 HydrophobicContact CZ-CE 4.44Å; F65-M69 HydrophobicContact CZ-CG 3.43Å; F65-M69 VanDerWaalsContact CZ-CG 3.43Å; F65-M69 HydrophobicContact CZ-SD 3.4Å; F65-M69 WeakPolarHBondContact CZ-SD 3.4Å; F65-M69 WeakPolarHBondContact O-CG 3.49Å; F65-M69 PolarHBondContact O-N 2.96Å; F65-F78 HydrophobicContact CE2-CD1 4.15Å; F65-F78 AromaticContact CE2-CE1 3.62Å; F65-F78 HydrophobicContact CE2-CE1 3.62Å; F65-F78 HydrophobicContact CE2-CE2 4.15Å; F65-F78 AromaticContact CE2-CZ 3.63Å; F65-F78 HydrophobicContact CE2-CZ 3.63Å; F65-F78 AromaticContact CZ-CE1 3.77Å; F65-F78 HydrophobicContact CZ-CE1 3.77Å; F65-F78 HydrophobicContact CZ-CZ 4.02Å; F65-Y159 HydrophobicContact CD1-CD1 4.27Å; F65-Y159 AromaticContact CD1-CD2 3.96Å; F65-Y159 HydrophobicContact CD1-CD2 3.96Å; F65-Y159 AromaticContact CD1-CE1 3.79Å; F65-Y159 HydrophobicContact CD1-CE1 3.79Å; F65-Y159 AromaticContact CD1-CE2 3.48Å; F65-Y159 HydrophobicContact CD1-CE2 3.48Å; F65-Y159 VanDerWaalsContact CD1-CE2 3.48Å; F65-Y159 HydrophobicContact CD1-CG 4.34Å; F65-Y159 AromaticContact CD1-CZ 3.38Å; F65-Y159 HydrophobicContact CE1-CD1 4.45Å; F65-Y159 AromaticContact CE1-CD2 3.67Å; F65-Y159 HydrophobicContact CE1-CD2 3.67Å; F65-Y159 HydrophobicContact CE1-CE1 4.38Å; F65-Y159 AromaticContact CE1-CE2 3.63Å; F65-Y159 HydrophobicContact CE1-CE2 3.63Å; F65-Y159 HydrophobicContact CE1-CG 4.11Å; F65-Y159 AromaticContact CE1-CZ 3.99Å; F65-M162 HydrophobicContact CE1-CB 3.88Å; F65-M162 HydrophobicContact CE1-CE 4.28Å; F65-M162 HydrophobicContact CE2-CB 4.45Å; F65-M162 HydrophobicContact CZ-CB 3.57Å; F65-M162 HydrophobicContact CZ-CE 4.04Å; F65-M162 HydrophobicContact CZ-SD 4.39Å; F65-E163 HydrophobicContact CB-CB 4.26Å; F65-E163 HydrophobicContact CB-CG 3.86Å; F65-E163 HydrophobicContact CD1-CB 3.64Å; F65-E163 HydrophobicContact CD1-CG 4.16Å; F65-E163 HydrophobicContact CE1-CB 4.27Å; F65-E163 HydrophobicContact CG-CB 4.12Å; F65-E163 HydrophobicContact CG-CG 4.28Å; F65-Y167 HydrophobicContact CB-CD1 3.9Å; F65-Y167 HydrophobicContact CB-CD2 4.2Å; F65-Y167 HydrophobicContact CB-CE1 4.04Å; F65-Y167 HydrophobicContact CB-CE2 4.31Å; F65-Y167 HydrophobicContact CB-CG 3.98Å; F65-Y167 HydrophobicContact CD2-CD1 4.43Å; F65-Y167 AromaticContact CD2-CD2 3.55Å; F65-Y167 HydrophobicContact CD2-CD2 3.55Å; F65-Y167 HydrophobicContact CD2-CE2 4.25Å; F65-Y167 AromaticContact CD2-CG 3.65Å; F65-Y167 HydrophobicContact CD2-CG 3.65Å; F65-Y167 HydrophobicContact CE2-CD2 4.4Å; F65-Y167 HydrophobicContact CE2-CG 4.5Å; F65-Y167 HydrophobicContact CG-CD1 4.45Å; F65-Y167 HydrophobicContact CG-CD2 4.29Å; F65-Y167 HydrophobicContact CG-CG 4.09Å
66	C	96.3	Very high	93.6	Very high	62 Å²	62	54.9 Å²	54.9	42%	0.419	29%	0.289	S	S	.	.	H	α-helix	trans	-59.1	-38.1	175	-176	0	0	0	0	111.9	S64 V68 M69 S70 Y159	S64-C66 PolarHBondContact O-N 3.42Å; S64-C66 PolarHBondContact OG-N 3.33Å; C66-V68 VanDerWaalsContact C-N 3.33Å; C66-V68 PolarHBondContact O-N 3.4Å; C66-M69 PolarHBondContact O-N 3.46Å; C66-S70 VanDerWaalsContact O-CB 3.23Å; C66-S70 WeakPolarHBondContact O-CB 3.38Å; C66-S70 PolarHBondContact O-N 3.15Å; C66-S70 PolarHBondContact O-OG 3.41Å; C66-Y159 WeakPolarHBondContact CA-OH 3.41Å; C66-Y159 PolarHBondContact N-OH 3.16Å; C66-Y159 VanDerWaalsContact N-OH 3.11Å
67	H	96.3	Very high	94	Very high	75 Å²	75	52.4 Å²	52.4	35%	0.347	27%	0.268	S	S	.	.	H	α-helix	trans	-65.7	-35.5	175.9	-65.1	149.2	0	0	0	112.6	K60 E63 S64 F65 S71	K60-H67 VanDerWaalsContact O-CB 3.31Å; K60-H67 WeakPolarHBondContact O-CB 3.45Å; K60-H67 PolarHBondContact O-ND1 2.92Å; E63-H67 IonicContact OE2-CE1 3.77Å; E63-H67 PolarHBondContact OE2-CE1 3.3Å; E63-H67 IonicContact OE2-ND1 2.95Å; S64-H67 WeakPolarHBondContact O-CB 3.26Å; S64-H67 PolarHBondContact O-N 3.05Å; S64-H67 VanDerWaalsContact O-N 3.12Å; S64-H67 VanDerWaalsContact OG-CG 3.3Å; S64-H67 PolarHBondContact OG-N 2.97Å; S64-H67 VanDerWaalsContact OG-N 3.15Å; S64-H67 PolarHBondContact OG-ND1 3.34Å; F65-H67 VanDerWaalsContact C-N 3.27Å; F65-H67 PolarHBondContact O-N 3.38Å; H67-S71 WeakPolarHBondContact O-CB 3.4Å; H67-S71 PolarHBondContact O-N 3.24Å
68	V	96.3	Very high	94.4	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-64.2	-51.5	172.7	-179.2	0	0	0	0	109.9	W61 F65 C66 S70 S71 G74 R75 F78 Y167 F170	W61-V68 HydrophobicContact CB-CG2 3.68Å; W61-V68 HydrophobicContact CG-CG2 3.92Å; F65-V68 HydrophobicContact CD2-CB 4.18Å; F65-V68 HydrophobicContact CE2-CG1 4.49Å; F65-V68 WeakPolarHBondContact O-CB 3.32Å; F65-V68 PolarHBondContact O-N 2.97Å; F65-V68 VanDerWaalsContact O-N 3.07Å; C66-V68 VanDerWaalsContact C-N 3.33Å; C66-V68 PolarHBondContact O-N 3.4Å; V68-S70 VanDerWaalsContact C-N 3.34Å; V68-S70 PolarHBondContact O-N 2.9Å; V68-S71 PolarHBondContact O-N 3.33Å; V68-G74 CarbonylContact O-C 3.57Å; V68-G74 WeakPolarHBondContact O-CA 3.37Å; V68-R75 PolarHBondContact O-N 3.49Å; V68-F78 HydrophobicContact CG1-CB 3.74Å; V68-F78 HydrophobicContact CG1-CD2 4.46Å; V68-F78 HydrophobicContact CG1-CG 4.05Å; V68-Y167 HydrophobicContact CG2-CD2 4.26Å; V68-Y167 HydrophobicContact CG2-CE2 3.83Å; V68-F170 HydrophobicContact CG1-CE1 4.46Å; V68-F170 HydrophobicContact CG2-CE1 4.18Å
69	M	96.6	Very high	94.7	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-72.4	-26	-173.3	-64.7	-55.6	-68.7	0	0	113.5	F65 C66 R75 F78 V91 W94 Y159 M162	F65-M69 HydrophobicContact CD1-CG 3.99Å; F65-M69 HydrophobicContact CD2-CG 4.13Å; F65-M69 HydrophobicContact CE1-CG 3.57Å; F65-M69 HydrophobicContact CE1-SD 4.1Å; F65-M69 HydrophobicContact CE2-CG 3.73Å; F65-M69 HydrophobicContact CE2-SD 3.73Å; F65-M69 HydrophobicContact CG-CG 4.26Å; F65-M69 HydrophobicContact CZ-CE 4.44Å; F65-M69 HydrophobicContact CZ-CG 3.43Å; F65-M69 VanDerWaalsContact CZ-CG 3.43Å; F65-M69 HydrophobicContact CZ-SD 3.4Å; F65-M69 WeakPolarHBondContact CZ-SD 3.4Å; F65-M69 WeakPolarHBondContact O-CG 3.49Å; F65-M69 PolarHBondContact O-N 2.96Å; C66-M69 PolarHBondContact O-N 3.46Å; M69-R75 VanDerWaalsContact O-CD 3.29Å; M69-R75 WeakPolarHBondContact O-CD 3.48Å; M69-R75 WeakPolarHBondContact O-CG 3.35Å; M69-R75 PolarHBondContact O-NH1 3.45Å; M69-F78 HydrophobicContact SD-CD1 4.23Å; M69-F78 HydrophobicContact SD-CE1 4.45Å; M69-V91 HydrophobicContact CE-CG2 4.16Å; M69-W94 HydrophobicContact CB-CH2 4.08Å; M69-W94 HydrophobicContact CB-CZ2 4.19Å; M69-W94 HydrophobicContact CE-CB 4.3Å; M69-W94 HydrophobicContact CE-CD2 3.24Å; M69-W94 HydrophobicContact CE-CE3 3.19Å; M69-W94 HydrophobicContact CE-CG 3.75Å; M69-W94 HydrophobicContact CE-CH2 4.06Å; M69-W94 HydrophobicContact CE-CZ2 4.12Å; M69-W94 HydrophobicContact CE-CZ3 3.63Å; M69-Y159 HydrophobicContact CB-CE2 4.23Å; M69-Y159 HydrophobicContact CG-CD2 4.36Å; M69-Y159 HydrophobicContact CG-CE2 3.88Å; M69-M162 HydrophobicContact CE-CE 4.14Å
70	S	94.2	Very high	94.8	Very high	85 Å²	85	48.8 Å²	48.8	59%	0.594	26%	0.258	S	S	*	.	H	α-helix	trans	-79.2	-29.7	176.5	-59.2	0	0	0	0	112.6	C66 V68 R75	C66-S70 VanDerWaalsContact O-CB 3.23Å; C66-S70 WeakPolarHBondContact O-CB 3.38Å; C66-S70 PolarHBondContact O-N 3.15Å; C66-S70 PolarHBondContact O-OG 3.41Å; V68-S70 VanDerWaalsContact C-N 3.34Å; V68-S70 PolarHBondContact O-N 2.9Å; S70-R75 VanDerWaalsContact C-NH1 3.33Å; S70-R75 PolarHBondContact O-NH1 2.95Å
71	S	93.8	Very high	95	Very high	31 Å²	31	43.2 Å²	43.2	22%	0.217	23%	0.234	C	C	.	.			trans	-83.2	131.6	179.2	176.3	0	0	0	0	111.9	H67 V68 M73 G74 R75	H67-S71 WeakPolarHBondContact O-CB 3.4Å; H67-S71 PolarHBondContact O-N 3.24Å; V68-S71 PolarHBondContact O-N 3.33Å; S71-M73 VanDerWaalsContact C-N 3.29Å; S71-M73 PolarHBondContact O-N 3.46Å; S71-M73 PolarHBondContact OG-N 3.45Å; S71-G74 PolarHBondContact O-N 3.46Å; S71-G74 PolarHBondContact OG-N 2.96Å; S71-G74 VanDerWaalsContact OG-N 3.12Å; S71-R75 WeakPolarHBondContact O-CG 3.33Å; S71-R75 PolarHBondContact O-N 3.18Å
72	E	92.4	Very high	95	Very high	127 Å²	127	43 Å²	43	59%	0.593	23%	0.233	S	C	*	.	H	α-helix	trans	-60.6	-41	171.7	-174.8	-178.6	174.8	0	0	111.8	T76	E72-T76 WeakPolarHBondContact O-CB 3.23Å; E72-T76 PolarHBondContact O-N 3.36Å; E72-T76 PolarHBondContact O-OG1 3.02Å
73	M	92.4	Very high	95	Very high	37 Å²	37	44.8 Å²	44.8	18%	0.182	24%	0.241	C	C	.	.	H	α-helix	trans	-64.9	-45	174.6	-171.8	61	67.5	0	0	110.7	R51 P53 W61 S71 R75 T76 V77	R51-M73 HydrophobicContact CB-CE 3.44Å; R51-M73 VanDerWaalsContact CB-CE 3.44Å; R51-M73 VanDerWaalsContact O-CE 3.23Å; R51-M73 WeakPolarHBondContact O-CE 3.27Å; P53-M73 HydrophobicContact CB-CG 4.22Å; P53-M73 HydrophobicContact CG-CG 4.02Å; P53-M73 HydrophobicContact CG-SD 3.95Å; W61-M73 HydrophobicContact CH2-CG 3.84Å; W61-M73 HydrophobicContact CZ2-CB 4.04Å; W61-M73 HydrophobicContact CZ2-CG 3.83Å; S71-M73 VanDerWaalsContact C-N 3.29Å; S71-M73 PolarHBondContact O-N 3.46Å; S71-M73 PolarHBondContact OG-N 3.45Å; M73-R75 PolarHBondContact O-N 2.92Å; M73-T76 WeakPolarHBondContact O-CB 3.46Å; M73-T76 PolarHBondContact O-N 3.4Å; M73-T76 VanDerWaalsContact O-N 3.14Å; M73-V77 HydrophobicContact CG-CG2 4.41Å; M73-V77 VanDerWaalsContact O-CG2 3.32Å; M73-V77 WeakPolarHBondContact O-CG2 3.39Å; M73-V77 PolarHBondContact O-N 3.02Å; M73-V77 HydrophobicContact SD-CG2 4.29Å
74	G	94.1	Very high	95	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-57.2	-50	177.4	0	0	0	0	0	112	W61 V68 S71 T76 V77 F78	W61-G74 VanDerWaalsContact CZ2-CA 3.42Å; V68-G74 CarbonylContact O-C 3.57Å; V68-G74 WeakPolarHBondContact O-CA 3.37Å; S71-G74 PolarHBondContact O-N 3.46Å; S71-G74 PolarHBondContact OG-N 2.96Å; S71-G74 VanDerWaalsContact OG-N 3.12Å; G74-T76 VanDerWaalsContact C-N 3.33Å; G74-T76 PolarHBondContact O-N 3.42Å; G74-V77 PolarHBondContact O-N 3.17Å; G74-F78 WeakPolarHBondContact O-CB 3.15Å; G74-F78 PolarHBondContact O-N 3.48Å
75	R	96	Very high	94.9	Very high	64 Å²	64	43.5 Å²	43.5	24%	0.242	24%	0.24	C	C	.	.	H	α-helix	trans	-58.4	-42.2	174.2	-69.9	-169.5	-59.1	-83.4	-0.5	112.3	V68 M69 S70 S71 M73 T79	V68-R75 PolarHBondContact O-N 3.49Å; M69-R75 VanDerWaalsContact O-CD 3.29Å; M69-R75 WeakPolarHBondContact O-CD 3.48Å; M69-R75 WeakPolarHBondContact O-CG 3.35Å; M69-R75 PolarHBondContact O-NH1 3.45Å; S70-R75 VanDerWaalsContact C-NH1 3.33Å; S70-R75 PolarHBondContact O-NH1 2.95Å; S71-R75 WeakPolarHBondContact O-CG 3.33Å; S71-R75 PolarHBondContact O-N 3.18Å; M73-R75 PolarHBondContact O-N 2.92Å; R75-T79 VanDerWaalsContact O-CB 3.23Å; R75-T79 WeakPolarHBondContact O-CB 3.27Å; R75-T79 PolarHBondContact O-N 3.45Å; R75-T79 PolarHBondContact O-OG1 3.23Å
76	T	94.2	Very high	94.5	Very high	73 Å²	73	51.9 Å²	51.9	45%	0.448	28%	0.277	S	S	.	.	H	α-helix	trans	-63.2	-47.3	-179.4	-60.9	0	0	0	0	112.1	E72 M73 G74 S80	E72-T76 WeakPolarHBondContact O-CB 3.23Å; E72-T76 PolarHBondContact O-N 3.36Å; E72-T76 PolarHBondContact O-OG1 3.02Å; M73-T76 WeakPolarHBondContact O-CB 3.46Å; M73-T76 PolarHBondContact O-N 3.4Å; M73-T76 VanDerWaalsContact O-N 3.14Å; G74-T76 VanDerWaalsContact C-N 3.33Å; G74-T76 PolarHBondContact O-N 3.42Å; T76-S80 PolarHBondContact O-N 2.68Å; T76-S80 VanDerWaalsContact O-N 3.08Å; T76-S80 PolarHBondContact O-OG 3.27Å
77	V	94.1	Very high	94.4	Very high	12 Å²	12	49.7 Å²	49.7	7%	0.073	26%	0.262	C	S	.	.	H	α-helix	trans	-68.4	-44.3	179.7	-178.2	0	0	0	0	110.1	P53 W61 M73 G74 T79 S80 F81 F170 M175	P53-V77 HydrophobicContact CG-CG2 3.49Å; P53-V77 VanDerWaalsContact CG-CG2 3.49Å; W61-V77 HydrophobicContact CH2-CB 4.26Å; W61-V77 HydrophobicContact CH2-CG2 3.86Å; W61-V77 HydrophobicContact CZ3-CB 4.23Å; W61-V77 HydrophobicContact CZ3-CG1 4.23Å; W61-V77 HydrophobicContact CZ3-CG2 4.18Å; M73-V77 HydrophobicContact CG-CG2 4.41Å; M73-V77 VanDerWaalsContact O-CG2 3.32Å; M73-V77 WeakPolarHBondContact O-CG2 3.39Å; M73-V77 PolarHBondContact O-N 3.02Å; M73-V77 HydrophobicContact SD-CG2 4.29Å; G74-V77 PolarHBondContact O-N 3.17Å; V77-T79 PolarHBondContact O-N 2.69Å; V77-S80 WeakPolarHBondContact O-CB 3.22Å; V77-S80 PolarHBondContact O-N 3.49Å; V77-S80 VanDerWaalsContact O-N 3.16Å; V77-F81 PolarHBondContact O-N 3.24Å; V77-F170 HydrophobicContact CG1-CE2 3.86Å; V77-F170 HydrophobicContact CG1-CZ 4.04Å; V77-M175 HydrophobicContact CG1-CG 4.08Å; V77-M175 HydrophobicContact CG1-SD 3.4Å; V77-M175 WeakPolarHBondContact CG1-SD 3.14Å
78	F	96.2	Very high	94.3	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63.1	-40.5	177.3	-172	-115.9	0	0	0	112.5	F65 V68 M69 G74 S80 F81 L82 V91 M162 F170	F65-F78 HydrophobicContact CE2-CD1 4.15Å; F65-F78 AromaticContact CE2-CE1 3.62Å; F65-F78 HydrophobicContact CE2-CE1 3.62Å; F65-F78 HydrophobicContact CE2-CE2 4.15Å; F65-F78 AromaticContact CE2-CZ 3.63Å; F65-F78 HydrophobicContact CE2-CZ 3.63Å; F65-F78 AromaticContact CZ-CE1 3.77Å; F65-F78 HydrophobicContact CZ-CE1 3.77Å; F65-F78 HydrophobicContact CZ-CZ 4.02Å; V68-F78 HydrophobicContact CG1-CB 3.74Å; V68-F78 HydrophobicContact CG1-CD2 4.46Å; V68-F78 HydrophobicContact CG1-CG 4.05Å; M69-F78 HydrophobicContact SD-CD1 4.23Å; M69-F78 HydrophobicContact SD-CE1 4.45Å; G74-F78 WeakPolarHBondContact O-CB 3.15Å; G74-F78 PolarHBondContact O-N 3.48Å; F78-S80 VanDerWaalsContact C-N 3.3Å; F78-S80 PolarHBondContact O-N 2.78Å; F78-F81 HydrophobicContact CD2-CD1 4.22Å; F78-F81 HydrophobicContact CE2-CD1 4.12Å; F78-F81 WeakPolarHBondContact O-CB 3.31Å; F78-F81 PolarHBondContact O-N 3.07Å; F78-F81 VanDerWaalsContact O-N 3.15Å; F78-L82 HydrophobicContact CD1-CD1 3.97Å; F78-L82 HydrophobicContact CD1-CG 4.34Å; F78-L82 HydrophobicContact CE1-CD1 3.55Å; F78-L82 HydrophobicContact CE1-CD2 4.35Å; F78-L82 HydrophobicContact CE1-CG 4.04Å; F78-L82 HydrophobicContact CE2-CD2 4.33Å; F78-L82 HydrophobicContact CE2-CG 4.46Å; F78-L82 HydrophobicContact CZ-CD1 4.02Å; F78-L82 HydrophobicContact CZ-CD2 3.96Å; F78-L82 HydrophobicContact CZ-CG 4.1Å; F78-L82 WeakPolarHBondContact O-CG 3.35Å; F78-L82 PolarHBondContact O-N 3.4Å; F78-V91 HydrophobicContact CD1-CG2 4.25Å; F78-M162 HydrophobicContact CE1-CB 4.33Å; F78-M162 HydrophobicContact CE1-CG 4.43Å; F78-M162 HydrophobicContact CE1-SD 3.81Å; F78-M162 HydrophobicContact CZ-CB 4.19Å; F78-M162 HydrophobicContact CZ-SD 4.49Å; F78-F170 HydrophobicContact CB-CE2 4.35Å; F78-F170 HydrophobicContact CB-CZ 4.43Å; F78-F170 HydrophobicContact CD2-CB 3.97Å; F78-F170 HydrophobicContact CD2-CD1 4.01Å; F78-F170 AromaticContact CD2-CD2 3.77Å; F78-F170 HydrophobicContact CD2-CD2 3.77Å; F78-F170 HydrophobicContact CD2-CE1 4.41Å; F78-F170 HydrophobicContact CD2-CE2 4.17Å; F78-F170 AromaticContact CD2-CG 3.65Å; F78-F170 HydrophobicContact CD2-CG 3.65Å; F78-F170 HydrophobicContact CD2-CZ 4.46Å; F78-F170 HydrophobicContact CE2-CB 3.88Å; F78-F170 HydrophobicContact CE2-CD2 4.5Å; F78-F170 HydrophobicContact CE2-CG 4.07Å
79	T	96.3	Very high	94.1	Very high	18 Å²	18	49.7 Å²	49.7	11%	0.11	26%	0.263	C	S	.	.	H	α-helix	trans	-60.7	-41.4	173.4	-57.8	0	0	0	0	111.3	R75 V77 F81 L82 K83 V91	R75-T79 VanDerWaalsContact O-CB 3.23Å; R75-T79 WeakPolarHBondContact O-CB 3.27Å; R75-T79 PolarHBondContact O-N 3.45Å; R75-T79 PolarHBondContact O-OG1 3.23Å; V77-T79 PolarHBondContact O-N 2.69Å; T79-F81 VanDerWaalsContact C-N 3.3Å; T79-F81 PolarHBondContact O-N 3.26Å; T79-L82 PolarHBondContact O-N 3.07Å; T79-K83 HydrophobicContact CG2-CD 4.36Å; T79-K83 WeakPolarHBondContact O-CB 3.23Å; T79-K83 VanDerWaalsContact O-CG 3.32Å; T79-K83 WeakPolarHBondContact O-CG 3.49Å; T79-K83 PolarHBondContact O-N 2.69Å; T79-V91 HydrophobicContact CG2-CG1 4.05Å
80	S	94.9	Very high	94	Very high	56 Å²	56	49.9 Å²	49.9	39%	0.392	26%	0.264	S	S	.	.	H	α-helix	trans	-64.2	-37.6	176.3	-57.1	0	0	0	0	111.8	T76 V77 F78 S84	T76-S80 PolarHBondContact O-N 2.68Å; T76-S80 VanDerWaalsContact O-N 3.08Å; T76-S80 PolarHBondContact O-OG 3.27Å; V77-S80 WeakPolarHBondContact O-CB 3.22Å; V77-S80 PolarHBondContact O-N 3.49Å; V77-S80 VanDerWaalsContact O-N 3.16Å; F78-S80 VanDerWaalsContact C-N 3.3Å; F78-S80 PolarHBondContact O-N 2.78Å; S80-S84 PolarHBondContact O-N 2.61Å
81	F	95.5	Very high	94.1	Very high	11 Å²	11	45.9 Å²	45.9	5%	0.048	24%	0.235	C	C	.	.	H	α-helix	trans	-63.4	-52.2	173.4	167.6	-100	0	0	0	111.6	V77 F78 T79 K83 S84 E85 S166 R169 F170	V77-F81 PolarHBondContact O-N 3.24Å; F78-F81 HydrophobicContact CD2-CD1 4.22Å; F78-F81 HydrophobicContact CE2-CD1 4.12Å; F78-F81 WeakPolarHBondContact O-CB 3.31Å; F78-F81 PolarHBondContact O-N 3.07Å; F78-F81 VanDerWaalsContact O-N 3.15Å; T79-F81 VanDerWaalsContact C-N 3.3Å; T79-F81 PolarHBondContact O-N 3.26Å; F81-K83 VanDerWaalsContact C-N 3.29Å; F81-K83 PolarHBondContact O-N 3.27Å; F81-S84 WeakPolarHBondContact O-CB 3.4Å; F81-S84 PolarHBondContact O-N 3.1Å; F81-S84 PolarHBondContact O-OG 2.92Å; F81-E85 WeakPolarHBondContact CE1-OE2 3.23Å; F81-E85 HydrophobicContact CE2-CG 4.33Å; F81-E85 HydrophobicContact CZ-CG 4.19Å; F81-E85 WeakPolarHBondContact CZ-OE1 3.21Å; F81-E85 WeakPolarHBondContact CZ-OE2 3.23Å; F81-E85 PolarHBondContact O-N 3.08Å; F81-S166 VanDerWaalsContact CE1-O 3.27Å; F81-S166 WeakPolarHBondContact CE1-O 3.5Å; F81-R169 HydrophobicContact CE1-CB 4.45Å; F81-R169 HydrophobicContact CZ-CB 3.69Å; F81-F170 HydrophobicContact CB-CD2 3.71Å; F81-F170 HydrophobicContact CB-CE2 4.18Å; F81-F170 HydrophobicContact CD1-CB 3.79Å; F81-F170 AromaticContact CD1-CD2 3.93Å; F81-F170 HydrophobicContact CD1-CD2 3.93Å; F81-F170 HydrophobicContact CD1-CG 4.33Å; F81-F170 HydrophobicContact CD2-CD2 4.27Å; F81-F170 HydrophobicContact CE1-CB 3.79Å; F81-F170 HydrophobicContact CG-CB 4.22Å; F81-F170 AromaticContact CG-CD2 3.69Å; F81-F170 HydrophobicContact CG-CD2 3.69Å; F81-F170 HydrophobicContact CG-CG 4.46Å; F81-F170 HydrophobicContact CZ-CB 4.21Å
82	L	95.2	Very high	94.1	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.4	-35.2	179.9	-66.4	-178.4	0	0	0	113	F78 T79 S84 E85 F86 S87 Q88 V91 M162 S166	F78-L82 HydrophobicContact CD1-CD1 3.97Å; F78-L82 HydrophobicContact CD1-CG 4.34Å; F78-L82 HydrophobicContact CE1-CD1 3.55Å; F78-L82 HydrophobicContact CE1-CD2 4.35Å; F78-L82 HydrophobicContact CE1-CG 4.04Å; F78-L82 HydrophobicContact CE2-CD2 4.33Å; F78-L82 HydrophobicContact CE2-CG 4.46Å; F78-L82 HydrophobicContact CZ-CD1 4.02Å; F78-L82 HydrophobicContact CZ-CD2 3.96Å; F78-L82 HydrophobicContact CZ-CG 4.1Å; F78-L82 WeakPolarHBondContact O-CG 3.35Å; F78-L82 PolarHBondContact O-N 3.4Å; T79-L82 PolarHBondContact O-N 3.07Å; L82-S84 VanDerWaalsContact C-N 3.26Å; L82-S84 PolarHBondContact O-N 3.28Å; L82-E85 CarbonylContact O-C 3.43Å; L82-E85 VanDerWaalsContact O-C 3.3Å; L82-E85 WeakPolarHBondContact O-CA 3.42Å; L82-E85 PolarHBondContact O-N 3.03Å; L82-F86 PolarHBondContact O-N 2.93Å; L82-S87 WeakPolarHBondContact CD2-OG 3.19Å; L82-S87 PolarHBondContact O-N 3.17Å; L82-S87 PolarHBondContact O-OG 3.38Å; L82-Q88 HydrophobicContact CB-CB 4.23Å; L82-V91 HydrophobicContact CD1-CB 3.66Å; L82-V91 HydrophobicContact CD1-CG1 3.63Å; L82-M162 HydrophobicContact CD1-SD 4.17Å; L82-S166 VanDerWaalsContact CD2-CB 3.46Å
83	K	94.3	Very high	94.2	Very high	118 Å²	118	40.6 Å²	40.6	51%	0.513	21%	0.209	S	C	.	.	H	α-helix	trans	-60.8	-35	172.7	-77.9	177.1	179.1	176.8	0	112.7	T79 F81 E85 F86 Q88	T79-K83 HydrophobicContact CG2-CD 4.36Å; T79-K83 WeakPolarHBondContact O-CB 3.23Å; T79-K83 VanDerWaalsContact O-CG 3.32Å; T79-K83 WeakPolarHBondContact O-CG 3.49Å; T79-K83 PolarHBondContact O-N 2.69Å; F81-K83 VanDerWaalsContact C-N 3.29Å; F81-K83 PolarHBondContact O-N 3.27Å; K83-E85 PolarHBondContact O-N 3.2Å; K83-F86 PolarHBondContact O-N 3.11Å; K83-Q88 HydrophobicContact CG-CB 3.65Å; K83-Q88 HydrophobicContact CG-CG 3.86Å
84	S	93.3	Very high	94.4	Very high	84 Å²	84	40.4 Å²	40.4	59%	0.587	21%	0.206	S	C	*	.	H	α-helix	trans	-72.7	-19.2	176.5	74.4	0	0	0	0	112.7	S80 F81 L82	S80-S84 PolarHBondContact O-N 2.61Å; F81-S84 WeakPolarHBondContact O-CB 3.4Å; F81-S84 PolarHBondContact O-N 3.1Å; F81-S84 PolarHBondContact O-OG 2.92Å; L82-S84 VanDerWaalsContact C-N 3.26Å; L82-S84 PolarHBondContact O-N 3.28Å
85	E	93.4	Very high	94.4	Very high	58 Å²	58	42.7 Å²	42.7	27%	0.271	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	11.4	175.1	-59.3	-166.9	140	0	0	113.3	F81 L82 K83 S87 R169	F81-E85 WeakPolarHBondContact CE1-OE2 3.23Å; F81-E85 HydrophobicContact CE2-CG 4.33Å; F81-E85 HydrophobicContact CZ-CG 4.19Å; F81-E85 WeakPolarHBondContact CZ-OE1 3.21Å; F81-E85 WeakPolarHBondContact CZ-OE2 3.23Å; F81-E85 PolarHBondContact O-N 3.08Å; L82-E85 CarbonylContact O-C 3.43Å; L82-E85 VanDerWaalsContact O-C 3.3Å; L82-E85 WeakPolarHBondContact O-CA 3.42Å; L82-E85 PolarHBondContact O-N 3.03Å; K83-E85 PolarHBondContact O-N 3.2Å; E85-S87 VanDerWaalsContact C-N 3.27Å; E85-S87 PolarHBondContact O-N 3.38Å; E85-R169 IonicContact OE1-CZ 3.21Å; E85-R169 IonicContact OE1-NE 3.58Å; E85-R169 IonicContact OE1-NH1 3.79Å; E85-R169 PolarHBondContact OE1-NH1 3.41Å; E85-R169 IonicContact OE2-CZ 3.04Å; E85-R169 IonicContact OE2-NE 3.62Å; E85-R169 IonicContact OE2-NH1 3.47Å; E85-R169 PolarHBondContact OE2-NH1 3.32Å; E85-R169 IonicContact OE2-NH2 3.68Å; E85-R169 PolarHBondContact OE2-NH2 3.07Å
86	F	89.6	Confident	94.4	Very high	177 Å²	177	40.4 Å²	40.4	78%	0.776	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.6	42.6	-178.9	-54.1	-87.2	0	0	0	113.8	L82 K83	L82-F86 PolarHBondContact O-N 2.93Å; K83-F86 PolarHBondContact O-N 3.11Å
87	S	93.1	Very high	94.4	Very high	15 Å²	15	37 Å²	37	11%	0.105	19%	0.192	C	C	.	.			trans	-134.2	22.7	-177	56.1	0	0	0	0	113.4	L82 E85 E89 N90	L82-S87 WeakPolarHBondContact CD2-OG 3.19Å; L82-S87 PolarHBondContact O-N 3.17Å; L82-S87 PolarHBondContact O-OG 3.38Å; E85-S87 VanDerWaalsContact C-N 3.27Å; E85-S87 PolarHBondContact O-N 3.38Å; S87-E89 VanDerWaalsContact C-N 3.28Å; S87-E89 WeakPolarHBondContact CA-OE1 3.45Å; S87-E89 WeakPolarHBondContact CA-OE2 3.26Å; S87-E89 PolarHBondContact O-N 3.41Å; S87-N90 PolarHBondContact O-ND2 2.82Å
88	Q	94.1	Very high	94.5	Very high	58 Å²	58	39 Å²	39	27%	0.271	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-21.7	-175.3	71.9	-81	2.2	0	0	114.1	L82 K83 N90 V91 D92	L82-Q88 HydrophobicContact CB-CB 4.23Å; K83-Q88 HydrophobicContact CG-CB 3.65Å; K83-Q88 HydrophobicContact CG-CG 3.86Å; Q88-N90 PolarHBondContact O-N 3Å; Q88-N90 VanDerWaalsContact O-N 3.09Å; Q88-V91 VanDerWaalsContact O-CG1 3.23Å; Q88-V91 WeakPolarHBondContact O-CG1 3.32Å; Q88-V91 PolarHBondContact O-N 3.09Å; Q88-V91 VanDerWaalsContact O-N 3.09Å; Q88-D92 PolarHBondContact O-N 3.09Å
89	E	93.5	Very high	94.4	Very high	18 Å²	18	42.5 Å²	42.5	8%	0.084	22%	0.219	C	C	.	.	H	α-helix	trans	-55.1	-30.7	177.7	68.8	-65	149.8	0	0	112.3	S87 F93 N126 V129	S87-E89 VanDerWaalsContact C-N 3.28Å; S87-E89 WeakPolarHBondContact CA-OE1 3.45Å; S87-E89 WeakPolarHBondContact CA-OE2 3.26Å; S87-E89 PolarHBondContact O-N 3.41Å; E89-F93 VanDerWaalsContact O-CB 3.28Å; E89-F93 WeakPolarHBondContact O-CB 3.22Å; E89-F93 PolarHBondContact O-N 3.16Å; E89-N126 HydrophobicContact CB-CB 4.17Å; E89-V129 HydrophobicContact CG-CG2 4.23Å; E89-V129 WeakPolarHBondContact OE1-CG2 3.47Å
90	N	93.9	Very high	94.3	Very high	6 Å²	6	41.8 Å²	41.8	3%	0.032	22%	0.215	C	C	.	.	H	α-helix	trans	-63.9	-47	177	-61.5	-64.7	0	0	0	112.6	S87 Q88 W94 V128 I158 M162	S87-N90 PolarHBondContact O-ND2 2.82Å; Q88-N90 PolarHBondContact O-N 3Å; Q88-N90 VanDerWaalsContact O-N 3.09Å; N90-W94 PolarHBondContact O-N 3.25Å; N90-W94 VanDerWaalsContact O-N 3.16Å; N90-V128 WeakPolarHBondContact OD1-CG1 3.01Å; N90-I158 HydrophobicContact CB-CG2 3.78Å; N90-I158 VanDerWaalsContact O-CG2 3.25Å; N90-I158 WeakPolarHBondContact O-CG2 3.49Å; N90-M162 HydrophobicContact CB-CG 3.8Å; N90-M162 HydrophobicContact CB-SD 3.67Å
91	V	95.5	Very high	94.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-75.4	-36	179.4	69.3	0	0	0	0	111	M69 F78 T79 L82 Q88 F93 W94 I95 M162	M69-V91 HydrophobicContact CE-CG2 4.16Å; F78-V91 HydrophobicContact CD1-CG2 4.25Å; T79-V91 HydrophobicContact CG2-CG1 4.05Å; L82-V91 HydrophobicContact CD1-CB 3.66Å; L82-V91 HydrophobicContact CD1-CG1 3.63Å; Q88-V91 VanDerWaalsContact O-CG1 3.23Å; Q88-V91 WeakPolarHBondContact O-CG1 3.32Å; Q88-V91 PolarHBondContact O-N 3.09Å; Q88-V91 VanDerWaalsContact O-N 3.09Å; V91-F93 PolarHBondContact O-N 3.41Å; V91-W94 PolarHBondContact O-N 3.46Å; V91-I95 HydrophobicContact CG2-CD1 3.98Å; V91-I95 HydrophobicContact CG2-CG1 4.39Å; V91-I95 VanDerWaalsContact O-CG1 3.28Å; V91-I95 WeakPolarHBondContact O-CG1 3.12Å; V91-I95 PolarHBondContact O-N 2.88Å; V91-M162 HydrophobicContact CB-SD 4.02Å
92	D	94.8	Very high	94.1	Very high	48 Å²	48	49.8 Å²	49.8	26%	0.257	24%	0.242	S	C	.	.	H	α-helix	trans	-62.7	-43.8	177.5	-70.4	-17.4	0	0	0	110.8	Q88 I95 A96 Y119	Q88-D92 PolarHBondContact O-N 3.09Å; D92-I95 PolarHBondContact O-N 3.26Å; D92-A96 WeakPolarHBondContact O-CB 3.26Å; D92-A96 PolarHBondContact O-N 2.85Å; D92-Y119 HydrophobicContact CB-CE1 4.16Å
93	F	94.8	Very high	94	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-61.6	-46.1	173.1	176.2	-109.8	0	0	0	112	E89 V91 I95 A96 C97 M115 Y119 V120 V128 F151 A154 I158	E89-F93 VanDerWaalsContact O-CB 3.28Å; E89-F93 WeakPolarHBondContact O-CB 3.22Å; E89-F93 PolarHBondContact O-N 3.16Å; V91-F93 PolarHBondContact O-N 3.41Å; F93-I95 VanDerWaalsContact C-N 3.32Å; F93-I95 PolarHBondContact O-N 2.76Å; F93-A96 WeakPolarHBondContact O-CB 3.42Å; F93-A96 PolarHBondContact O-N 3.27Å; F93-C97 VanDerWaalsContact CZ-SG 3.5Å; F93-C97 PolarHBondContact O-N 2.95Å; F93-C97 PolarHBondContact O-SG 2.97Å; F93-M115 HydrophobicContact CE2-CE 4.47Å; F93-Y119 HydrophobicContact CB-CD1 3.84Å; F93-Y119 HydrophobicContact CB-CE1 4.16Å; F93-Y119 HydrophobicContact CB-CG 4.1Å; F93-Y119 HydrophobicContact CD2-CD1 4.27Å; F93-Y119 AromaticContact CD2-CD2 3.9Å; F93-Y119 HydrophobicContact CD2-CD2 3.9Å; F93-Y119 AromaticContact CD2-CG 3.65Å; F93-Y119 HydrophobicContact CD2-CG 3.65Å; F93-Y119 HydrophobicContact CG-CG 4.31Å; F93-V120 HydrophobicContact CE2-CG2 4.02Å; F93-V120 HydrophobicContact CZ-CG2 4.4Å; F93-V128 HydrophobicContact CB-CG2 3.73Å; F93-V128 HydrophobicContact CD1-CG2 4.31Å; F93-V128 HydrophobicContact CD2-CG2 4.32Å; F93-V128 HydrophobicContact CG-CG2 3.86Å; F93-F151 HydrophobicContact CE2-CD1 4.1Å; F93-F151 HydrophobicContact CZ-CB 4.4Å; F93-F151 HydrophobicContact CZ-CD1 4.11Å; F93-A154 HydrophobicContact CE1-CB 3.94Å; F93-A154 HydrophobicContact CZ-CB 3.79Å; F93-I158 HydrophobicContact CD1-CB 4.25Å; F93-I158 HydrophobicContact CD1-CG1 3.85Å; F93-I158 HydrophobicContact CD1-CG2 4.39Å; F93-I158 HydrophobicContact CE1-CG1 4.05Å
94	W	95.4	Very high	93.9	Very high	32 Å²	32	48.4 Å²	48.4	12%	0.121	25%	0.245	C	C	.	.	H	α-helix	trans	-60.1	-42.3	179.1	-174.6	96.5	0	0	0	112.1	M69 N90 V91 C97 E98 Q155 Y159 M162	M69-W94 HydrophobicContact CB-CH2 4.08Å; M69-W94 HydrophobicContact CB-CZ2 4.19Å; M69-W94 HydrophobicContact CE-CB 4.3Å; M69-W94 HydrophobicContact CE-CD2 3.24Å; M69-W94 HydrophobicContact CE-CE3 3.19Å; M69-W94 HydrophobicContact CE-CG 3.75Å; M69-W94 HydrophobicContact CE-CH2 4.06Å; M69-W94 HydrophobicContact CE-CZ2 4.12Å; M69-W94 HydrophobicContact CE-CZ3 3.63Å; N90-W94 PolarHBondContact O-N 3.25Å; N90-W94 VanDerWaalsContact O-N 3.16Å; V91-W94 PolarHBondContact O-N 3.46Å; W94-C97 WeakPolarHBondContact O-CB 3.4Å; W94-C97 PolarHBondContact O-N 3.46Å; W94-E98 HydrophobicContact CD2-CG 4.27Å; W94-E98 HydrophobicContact CE3-CG 3.93Å; W94-E98 HydrophobicContact CH2-CG 3.59Å; W94-E98 HydrophobicContact CZ2-CG 3.93Å; W94-E98 HydrophobicContact CZ3-CG 3.57Å; W94-E98 PolarHBondContact O-N 3.26Å; W94-E98 VanDerWaalsContact O-N 3.17Å; W94-Q155 VanDerWaalsContact CD1-CG 3.43Å; W94-Q155 HydrophobicContact CG-CG 4.15Å; W94-Q155 PolarHBondContact O-NE2 3.36Å; W94-Y159 AromaticContact NE1-CD2 3.58Å; W94-M162 HydrophobicContact CB-CE 4.04Å; W94-M162 HydrophobicContact CG-CE 4.29Å
95	I	95.4	Very high	93.8	Very high	48 Å²	48	49.9 Å²	49.9	25%	0.246	25%	0.253	C	S	.	.	H	α-helix	trans	-64.8	-44.2	176.4	-68.1	167.2	0	0	0	110.2	V91 D92 F93 C97 E98 D99	V91-I95 HydrophobicContact CG2-CD1 3.98Å; V91-I95 HydrophobicContact CG2-CG1 4.39Å; V91-I95 VanDerWaalsContact O-CG1 3.28Å; V91-I95 WeakPolarHBondContact O-CG1 3.12Å; V91-I95 PolarHBondContact O-N 2.88Å; D92-I95 PolarHBondContact O-N 3.26Å; F93-I95 VanDerWaalsContact C-N 3.32Å; F93-I95 PolarHBondContact O-N 2.76Å; I95-C97 PolarHBondContact O-N 2.84Å; I95-E98 PolarHBondContact O-N 3.3Å; I95-E98 VanDerWaalsContact O-N 3.11Å; I95-D99 PolarHBondContact O-N 3.42Å
96	A	94.9	Very high	93.7	Very high	17 Å²	17	52.2 Å²	52.2	14%	0.14	28%	0.275	C	S	.	.	H	α-helix	trans	-59.2	-37.2	177.5	0	0	0	0	0	112	D92 F93 D99 Y100 M115 Y119	D92-A96 WeakPolarHBondContact O-CB 3.26Å; D92-A96 PolarHBondContact O-N 2.85Å; F93-A96 WeakPolarHBondContact O-CB 3.42Å; F93-A96 PolarHBondContact O-N 3.27Å; A96-D99 PolarHBondContact O-N 3.49Å; A96-Y100 WeakPolarHBondContact O-CB 3.25Å; A96-Y100 PolarHBondContact O-N 3.39Å; A96-M115 VanDerWaalsContact C-CE 3.47Å; A96-M115 HydrophobicContact CB-CE 3.69Å; A96-M115 HydrophobicContact CB-SD 4.29Å; A96-Y119 HydrophobicContact CB-CE2 4.19Å
97	C	94.6	Very high	93.8	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.007	27%	0.266	C	S	.	.	H	α-helix	trans	-64.3	-43.5	173.5	-68.8	0	0	0	0	112.7	F93 W94 I95 D99 Y100 K101 F151 Q155	F93-C97 VanDerWaalsContact CZ-SG 3.5Å; F93-C97 PolarHBondContact O-N 2.95Å; F93-C97 PolarHBondContact O-SG 2.97Å; W94-C97 WeakPolarHBondContact O-CB 3.4Å; W94-C97 PolarHBondContact O-N 3.46Å; I95-C97 PolarHBondContact O-N 2.84Å; C97-D99 VanDerWaalsContact C-N 3.28Å; C97-D99 PolarHBondContact O-N 3.01Å; C97-Y100 WeakPolarHBondContact O-CB 3.37Å; C97-Y100 PolarHBondContact O-N 3.42Å; C97-K101 WeakPolarHBondContact O-CG 3.42Å; C97-K101 PolarHBondContact O-N 3.18Å; C97-K101 VanDerWaalsContact O-N 3.12Å; C97-F151 HydrophobicContact CB-CB 4.48Å; C97-F151 VanDerWaalsContact SG-CB 3.52Å; C97-Q155 HydrophobicContact CB-CB 4.12Å; C97-Q155 VanDerWaalsContact CB-CD 3.41Å; C97-Q155 HydrophobicContact CB-CG 3.8Å
98	E	95.1	Very high	93.7	Very high	55 Å²	55	50.2 Å²	50.2	26%	0.257	27%	0.265	S	S	.	.	H	α-helix	trans	-63.2	-35.5	175.3	-70.8	-58.2	104	0	0	112.4	W94 I95 K101 K102 Q155	W94-E98 HydrophobicContact CD2-CG 4.27Å; W94-E98 HydrophobicContact CE3-CG 3.93Å; W94-E98 HydrophobicContact CH2-CG 3.59Å; W94-E98 HydrophobicContact CZ2-CG 3.93Å; W94-E98 HydrophobicContact CZ3-CG 3.57Å; W94-E98 PolarHBondContact O-N 3.26Å; W94-E98 VanDerWaalsContact O-N 3.17Å; I95-E98 PolarHBondContact O-N 3.3Å; I95-E98 VanDerWaalsContact O-N 3.11Å; E98-K101 IonicContact OE1-NZ 3.86Å; E98-K101 PolarHBondContact OE1-NZ 2.75Å; E98-K102 WeakPolarHBondContact O-CE 3.45Å; E98-K102 WeakPolarHBondContact O-CG 3.45Å; E98-Q155 PolarHBondContact OE1-NE2 3.46Å
99	D	94.4	Very high	93.5	Very high	73 Å²	73	49.9 Å²	49.9	39%	0.39	27%	0.272	S	S	.	.	H	α-helix	trans	-76.4	-28.7	175.1	-71.2	-16.8	0	0	0	112.6	I95 A96 C97 K102 T103 K111	I95-D99 PolarHBondContact O-N 3.42Å; A96-D99 PolarHBondContact O-N 3.49Å; C97-D99 VanDerWaalsContact C-N 3.28Å; C97-D99 PolarHBondContact O-N 3.01Å; D99-K102 PolarHBondContact O-N 3.1Å; D99-K102 IonicContact OD1-NZ 2.83Å; D99-T103 PolarHBondContact O-N 3.17Å; D99-T103 PolarHBondContact O-OG1 3.16Å; D99-K111 PolarHBondContact O-NZ 2.91Å
100	Y	93.9	Very high	93.4	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.008	29%	0.293	C	S	.	.	H	α-helix	trans	-64.3	-44.3	174.5	178	-100.4	0	0	0	111.2	A96 C97 K102 T103 M108 K111 A112 M115 G147 C150 F151	A96-Y100 WeakPolarHBondContact O-CB 3.25Å; A96-Y100 PolarHBondContact O-N 3.39Å; C97-Y100 WeakPolarHBondContact O-CB 3.37Å; C97-Y100 PolarHBondContact O-N 3.42Å; Y100-K102 PolarHBondContact O-N 3.08Å; Y100-K102 VanDerWaalsContact O-N 3.11Å; Y100-T103 WeakPolarHBondContact O-CB 3.25Å; Y100-T103 PolarHBondContact O-N 3.5Å; Y100-T103 PolarHBondContact O-OG1 3.47Å; Y100-M108 HydrophobicContact CE1-CE 3.88Å; Y100-M108 HydrophobicContact CE2-CB 4.2Å; Y100-M108 HydrophobicContact CE2-CE 4.49Å; Y100-M108 HydrophobicContact CE2-CG 4.44Å; Y100-M108 WeakPolarHBondContact CE2-O 3.48Å; Y100-K111 HydrophobicContact CD2-CB 4.24Å; Y100-K111 HydrophobicContact CD2-CD 4.07Å; Y100-K111 HydrophobicContact CD2-CG 4.04Å; Y100-K111 HydrophobicContact CE2-CB 4.44Å; Y100-A112 HydrophobicContact CE2-CB 3.75Å; Y100-M115 HydrophobicContact CD2-SD 3.99Å; Y100-M115 HydrophobicContact CG-SD 4.12Å; Y100-G147 VanDerWaalsContact CE1-O 3.24Å; Y100-G147 WeakPolarHBondContact CE1-O 3.43Å; Y100-G147 PolarHBondContact OH-O 3.33Å; Y100-C150 HydrophobicContact CE1-CB 4.43Å; Y100-F151 AromaticContact CD1-CD2 3.71Å; Y100-F151 HydrophobicContact CD1-CD2 3.71Å; Y100-F151 HydrophobicContact CD1-CE2 4.04Å; Y100-F151 HydrophobicContact CD2-CE2 4.08Å; Y100-F151 AromaticContact CE1-CD2 3.9Å; Y100-F151 HydrophobicContact CE1-CD2 3.9Å; Y100-F151 HydrophobicContact CE1-CE2 4.01Å; Y100-F151 HydrophobicContact CE2-CE2 4.08Å; Y100-F151 HydrophobicContact CG-CD2 4.04Å; Y100-F151 HydrophobicContact CG-CE2 4.07Å
101	K	93.6	Very high	93.4	Very high	85 Å²	85	55.4 Å²	55.4	37%	0.37	30%	0.303	S	S	.	.	H	α-helix	trans	-59.4	-25	177	-67.7	172.4	-170.8	168.8	0	113.7	C97 E98 D152 Q155	C97-K101 WeakPolarHBondContact O-CG 3.42Å; C97-K101 PolarHBondContact O-N 3.18Å; C97-K101 VanDerWaalsContact O-N 3.12Å; E98-K101 IonicContact OE1-NZ 3.86Å; E98-K101 PolarHBondContact OE1-NZ 2.75Å; K101-D152 VanDerWaalsContact CE-OD1 3.28Å; K101-D152 WeakPolarHBondContact CE-OD1 3.45Å; K101-D152 IonicContact NZ-OD1 3.98Å; K101-Q155 VanDerWaalsContact CE-OE1 3.31Å
102	K	93.4	Very high	93.2	Very high	150 Å²	150	55.4 Å²	55.4	65%	0.652	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-1.4	177.1	-59	167.7	-164.4	159.6	0	113.2	E98 D99 Y100	E98-K102 WeakPolarHBondContact O-CE 3.45Å; E98-K102 WeakPolarHBondContact O-CG 3.45Å; D99-K102 PolarHBondContact O-N 3.1Å; D99-K102 IonicContact OD1-NZ 2.83Å; Y100-K102 PolarHBondContact O-N 3.08Å; Y100-K102 VanDerWaalsContact O-N 3.11Å
103	T	92.7	Very high	93	Very high	20 Å²	20	59.3 Å²	59.3	12%	0.123	32%	0.318	C	S	.	.	S	Bend	trans	-78.1	136.6	-174	-61.6	0	0	0	0	110.6	D99 Y100 K107 M108 K111	D99-T103 PolarHBondContact O-N 3.17Å; D99-T103 PolarHBondContact O-OG1 3.16Å; Y100-T103 WeakPolarHBondContact O-CB 3.25Å; Y100-T103 PolarHBondContact O-N 3.5Å; Y100-T103 PolarHBondContact O-OG1 3.47Å; T103-K107 HydrophobicContact CG2-CB 3.78Å; T103-M108 HydrophobicContact CG2-CG 4Å; T103-M108 WeakPolarHBondContact O-CG 3.24Å; T103-K111 HydrophobicContact CG2-CD 3.99Å; T103-K111 VanDerWaalsContact OG1-CD 3.27Å; T103-K111 WeakPolarHBondContact OG1-CD 3.1Å; T103-K111 PolarHBondContact OG1-NZ 3.5Å; T103-K111 VanDerWaalsContact OG1-NZ 3.11Å
104	P	92.3	Very high	92.9	Very high	70 Å²	70	64.7 Å²	64.7	46%	0.455	34%	0.343	S	S	.	.			trans	-60.4	142.3	175.7	-23.6	33.3	0	0	0	111.9	S106 K107 M108	P104-S106 PolarHBondContact O-N 3.01Å; P104-K107 PolarHBondContact O-N 2.87Å; P104-M108 WeakPolarHBondContact O-CG 3.32Å; P104-M108 PolarHBondContact O-N 3.39Å
105	P	90.4	Very high	92.7	Very high	114 Å²	114	63.5 Å²	63.5	74%	0.74	34%	0.339	S	S	*	.	H	α-helix	trans	-50.1	-35.8	-178.1	-30.8	35.9	0	0	0	114.8	K107 M108	P105-K107 PolarHBondContact O-N 3.36Å; P105-M108 HydrophobicContact CB-SD 4.46Å; P105-M108 HydrophobicContact CG-SD 4.48Å; P105-M108 PolarHBondContact O-N 2.8Å
106	S	91.5	Very high	92.4	Very high	107 Å²	107	62.7 Å²	62.7	75%	0.748	33%	0.333	S	S	*	.	H	α-helix	trans	-63.1	-21.6	178.2	58.1	0	0	0	0	114.7	P104	P104-S106 PolarHBondContact O-N 3.01Å
107	K	91.6	Very high	92.1	Very high	135 Å²	135	67 Å²	67	59%	0.587	35%	0.35	S	S	*	.	H	α-helix	trans	-109.4	-10	-179.8	-64.5	-175.8	179.7	-179	0	113.2	T103 P104 P105 T110 K111	T103-K107 HydrophobicContact CG2-CB 3.78Å; P104-K107 PolarHBondContact O-N 2.87Å; P105-K107 PolarHBondContact O-N 3.36Å; K107-T110 PolarHBondContact O-N 3.31Å; K107-K111 WeakPolarHBondContact O-CB 3.48Å; K107-K111 PolarHBondContact O-N 2.87Å
108	M	91.3	Very high	91.8	Very high	15 Å²	15	70.6 Å²	70.6	7%	0.074	37%	0.367	C	S	.	.	H	α-helix	trans	-61.5	-50.5	-173.2	-75.8	177.5	74.1	0	0	112.2	Y100 T103 P104 P105 T110 K111 A112 G147 P148	Y100-M108 HydrophobicContact CE1-CE 3.88Å; Y100-M108 HydrophobicContact CE2-CB 4.2Å; Y100-M108 HydrophobicContact CE2-CE 4.49Å; Y100-M108 HydrophobicContact CE2-CG 4.44Å; Y100-M108 WeakPolarHBondContact CE2-O 3.48Å; T103-M108 HydrophobicContact CG2-CG 4Å; T103-M108 WeakPolarHBondContact O-CG 3.24Å; P104-M108 WeakPolarHBondContact O-CG 3.32Å; P104-M108 PolarHBondContact O-N 3.39Å; P105-M108 HydrophobicContact CB-SD 4.46Å; P105-M108 HydrophobicContact CG-SD 4.48Å; P105-M108 PolarHBondContact O-N 2.8Å; M108-T110 VanDerWaalsContact C-N 3.3Å; M108-T110 PolarHBondContact O-N 3.45Å; M108-K111 PolarHBondContact O-N 2.99Å; M108-K111 VanDerWaalsContact O-N 3.14Å; M108-A112 WeakPolarHBondContact O-CB 3.29Å; M108-A112 PolarHBondContact O-N 2.92Å; M108-G147 VanDerWaalsContact CE-C 3.47Å; M108-G147 WeakPolarHBondContact CE-O 3.44Å; M108-P148 HydrophobicContact CE-CB 3.81Å; M108-P148 VanDerWaalsContact CE-N 3.34Å
109	A	90.8	Very high	91.5	Very high	51 Å²	51	68.8 Å²	68.8	42%	0.421	36%	0.358	S	S	.	.	H	α-helix	trans	-57.2	-41.7	-179.1	0	0	0	0	0	113	K113	A109-K113 WeakPolarHBondContact O-CG 3.48Å; A109-K113 PolarHBondContact O-N 2.99Å
110	T	91.7	Very high	91.1	Very high	87 Å²	87	65.4 Å²	65.4	53%	0.534	34%	0.339	S	S	.	.	H	α-helix	trans	-66.7	-45.9	177.1	-55.2	0	0	0	0	111.5	K107 M108 A112 K113 Q114	K107-T110 PolarHBondContact O-N 3.31Å; M108-T110 VanDerWaalsContact C-N 3.3Å; M108-T110 PolarHBondContact O-N 3.45Å; T110-A112 PolarHBondContact O-N 3.23Å; T110-K113 PolarHBondContact O-N 3.09Å; T110-Q114 WeakPolarHBondContact O-CG 3.28Å; T110-Q114 PolarHBondContact O-N 3.14Å; T110-Q114 VanDerWaalsContact O-N 3.12Å
111	K	92.8	Very high	90.6	Very high	54 Å²	54	69.2 Å²	69.2	24%	0.235	36%	0.357	C	S	.	.	H	α-helix	trans	-65.3	-38.7	178.7	-171.7	174.5	177.6	173.1	0	112	D99 Y100 T103 K107 M108 K113 Q114 M115	D99-K111 PolarHBondContact O-NZ 2.91Å; Y100-K111 HydrophobicContact CD2-CB 4.24Å; Y100-K111 HydrophobicContact CD2-CD 4.07Å; Y100-K111 HydrophobicContact CD2-CG 4.04Å; Y100-K111 HydrophobicContact CE2-CB 4.44Å; T103-K111 HydrophobicContact CG2-CD 3.99Å; T103-K111 VanDerWaalsContact OG1-CD 3.27Å; T103-K111 WeakPolarHBondContact OG1-CD 3.1Å; T103-K111 PolarHBondContact OG1-NZ 3.5Å; T103-K111 VanDerWaalsContact OG1-NZ 3.11Å; K107-K111 WeakPolarHBondContact O-CB 3.48Å; K107-K111 PolarHBondContact O-N 2.87Å; M108-K111 PolarHBondContact O-N 2.99Å; M108-K111 VanDerWaalsContact O-N 3.14Å; K111-K113 PolarHBondContact O-N 3.48Å; K111-Q114 PolarHBondContact O-N 2.89Å; K111-M115 HydrophobicContact CG-CG 4.43Å; K111-M115 HydrophobicContact CG-SD 4.13Å; K111-M115 WeakPolarHBondContact O-CG 3.31Å; K111-M115 PolarHBondContact O-N 3.24Å
112	A	92.1	Very high	89.8	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-59.3	-46.1	176.4	0	0	0	0	0	111.3	Y100 M108 T110 M115 Y116 I143 F151	Y100-A112 HydrophobicContact CE2-CB 3.75Å; M108-A112 WeakPolarHBondContact O-CB 3.29Å; M108-A112 PolarHBondContact O-N 2.92Å; T110-A112 PolarHBondContact O-N 3.23Å; A112-M115 PolarHBondContact O-N 3.26Å; A112-Y116 WeakPolarHBondContact O-CB 3.28Å; A112-Y116 PolarHBondContact O-N 3.23Å; A112-I143 HydrophobicContact CB-CB 4.3Å; A112-I143 HydrophobicContact CB-CG2 4.04Å; A112-F151 HydrophobicContact CB-CE2 4.15Å; A112-F151 HydrophobicContact CB-CZ 4.22Å
113	K	91.2	Very high	89	Confident	129 Å²	129	68.2 Å²	68.2	56%	0.561	37%	0.372	S	S	*	.	H	α-helix	trans	-61.7	-44.8	176.1	-71.7	177	-179	-176.5	0	112.3	A109 T110 K111 Y116 Q117	A109-K113 WeakPolarHBondContact O-CG 3.48Å; A109-K113 PolarHBondContact O-N 2.99Å; T110-K113 PolarHBondContact O-N 3.09Å; K111-K113 PolarHBondContact O-N 3.48Å; K113-Y116 PolarHBondContact O-N 2.64Å; K113-Q117 WeakPolarHBondContact O-CG 3.41Å; K113-Q117 PolarHBondContact O-N 3.4Å
114	Q	91.6	Very high	88.3	Confident	113 Å²	113	67.7 Å²	67.7	53%	0.528	37%	0.37	S	S	.	.	H	α-helix	trans	-60.7	-46.4	177.1	-72.1	174.3	-23.8	0	0	111.9	T110 K111 Y116 Q117 Q118	T110-Q114 WeakPolarHBondContact O-CG 3.28Å; T110-Q114 PolarHBondContact O-N 3.14Å; T110-Q114 VanDerWaalsContact O-N 3.12Å; K111-Q114 PolarHBondContact O-N 2.89Å; Q114-Y116 VanDerWaalsContact C-N 3.34Å; Q114-Y116 PolarHBondContact O-N 3.26Å; Q114-Q117 PolarHBondContact O-N 3.46Å; Q114-Q118 VanDerWaalsContact O-CB 3.29Å; Q114-Q118 WeakPolarHBondContact O-CB 3.47Å; Q114-Q118 PolarHBondContact O-N 3.12Å
115	M	92.1	Very high	87.2	Confident	7 Å²	7	69.6 Å²	69.6	3%	0.034	38%	0.382	C	S	.	.	H	α-helix	trans	-64.3	-39.4	178	-72.8	177.6	60.9	0	0	112.2	F93 A96 Y100 K111 A112 Q118 Y119 F151	F93-M115 HydrophobicContact CE2-CE 4.47Å; A96-M115 VanDerWaalsContact C-CE 3.47Å; A96-M115 HydrophobicContact CB-CE 3.69Å; A96-M115 HydrophobicContact CB-SD 4.29Å; Y100-M115 HydrophobicContact CD2-SD 3.99Å; Y100-M115 HydrophobicContact CG-SD 4.12Å; K111-M115 HydrophobicContact CG-CG 4.43Å; K111-M115 HydrophobicContact CG-SD 4.13Å; K111-M115 WeakPolarHBondContact O-CG 3.31Å; K111-M115 PolarHBondContact O-N 3.24Å; A112-M115 PolarHBondContact O-N 3.26Å; M115-Q118 PolarHBondContact O-N 3.43Å; M115-Y119 WeakPolarHBondContact O-CB 3.24Å; M115-Y119 PolarHBondContact O-N 3.47Å; M115-F151 HydrophobicContact CB-CE1 4.24Å; M115-F151 HydrophobicContact CB-CE2 4.36Å; M115-F151 HydrophobicContact CB-CZ 3.79Å; M115-F151 HydrophobicContact CE-CD2 4.04Å; M115-F151 HydrophobicContact CE-CE2 4.04Å; M115-F151 HydrophobicContact CE-CG 4.34Å; M115-F151 HydrophobicContact CE-CZ 4.32Å; M115-F151 HydrophobicContact SD-CE2 4.11Å; M115-F151 HydrophobicContact SD-CZ 4.47Å
116	Y	89.1	Confident	86.3	Confident	31 Å²	31	67.1 Å²	67.1	12%	0.122	36%	0.363	C	S	.	.	I	π-helix	trans	-59.7	-50.6	175.8	-177.2	-94.3	0	0	0	111.3	A112 K113 Q114 Q118 Y119 V120 E121 T139 R140 I143	A112-Y116 WeakPolarHBondContact O-CB 3.28Å; A112-Y116 PolarHBondContact O-N 3.23Å; K113-Y116 PolarHBondContact O-N 2.64Å; Q114-Y116 VanDerWaalsContact C-N 3.34Å; Q114-Y116 PolarHBondContact O-N 3.26Å; Y116-Q118 VanDerWaalsContact C-N 3.26Å; Y116-Q118 PolarHBondContact O-N 2.91Å; Y116-Y119 PolarHBondContact O-N 3.07Å; Y116-V120 HydrophobicContact CD2-CB 3.66Å; Y116-V120 HydrophobicContact CD2-CG1 3.68Å; Y116-V120 HydrophobicContact CD2-CG2 4.44Å; Y116-V120 HydrophobicContact CE2-CB 3.99Å; Y116-V120 HydrophobicContact CE2-CG1 3.57Å; Y116-V120 HydrophobicContact CG-CB 4.27Å; Y116-V120 CarbonylContact O-C 3.51Å; Y116-V120 WeakPolarHBondContact O-CA 3.46Å; Y116-V120 PolarHBondContact O-N 3Å; Y116-E121 HydrophobicContact CD1-CB 4.1Å; Y116-E121 HydrophobicContact CE1-CB 3.86Å; Y116-E121 HydrophobicContact CE1-CG 4.15Å; Y116-E121 PolarHBondContact O-N 3Å; Y116-T139 HydrophobicContact CD2-CG2 4.21Å; Y116-R140 HydrophobicContact CE2-CB 3.84Å; Y116-R140 HydrophobicContact CE2-CG 4.23Å; Y116-I143 HydrophobicContact CD1-CD1 3.99Å; Y116-I143 HydrophobicContact CD2-CD1 3.5Å; Y116-I143 HydrophobicContact CE2-CD1 4.07Å; Y116-I143 HydrophobicContact CG-CD1 3.45Å; Y116-I143 VanDerWaalsContact CG-CD1 3.45Å
117	Q	88.6	Confident	85.4	Confident	109 Å²	109	65.5 Å²	65.5	51%	0.509	34%	0.343	S	S	.	.	I	π-helix	trans	-63.9	-31	178.6	-70	175.6	-31	0	0	113.1	K113 Q114 A124 P125	K113-Q117 WeakPolarHBondContact O-CG 3.41Å; K113-Q117 PolarHBondContact O-N 3.4Å; Q114-Q117 PolarHBondContact O-N 3.46Å; Q117-A124 VanDerWaalsContact O-CB 3.31Å; Q117-A124 WeakPolarHBondContact O-CB 3.25Å; Q117-P125 WeakPolarHBondContact O-CD 3.36Å
118	Q	87.8	Confident	84.4	Confident	76 Å²	76	59.2 Å²	59.2	36%	0.355	32%	0.316	S	S	.	.	I	π-helix	trans	-81	-34.6	-177.4	-174.6	173.8	-4.7	0	0	113.2	Q114 M115 Y116 N126	Q114-Q118 VanDerWaalsContact O-CB 3.29Å; Q114-Q118 WeakPolarHBondContact O-CB 3.47Å; Q114-Q118 PolarHBondContact O-N 3.12Å; M115-Q118 PolarHBondContact O-N 3.43Å; Y116-Q118 VanDerWaalsContact C-N 3.26Å; Y116-Q118 PolarHBondContact O-N 2.91Å; Q118-N126 PolarHBondContact NE2-ND2 3.21Å; Q118-N126 CarbonylContact O-C 3.57Å; Q118-N126 WeakPolarHBondContact O-CA 3.49Å; Q118-N126 WeakPolarHBondContact O-CB 3.33Å; Q118-N126 PolarHBondContact O-N 2.88Å; Q118-N126 VanDerWaalsContact O-N 3.17Å
119	Y	88.5	Confident	83.1	Confident	17 Å²	17	63.6 Å²	63.6	7%	0.067	34%	0.343	C	S	.	.	I	π-helix	trans	-127.7	-24.6	-166.2	-65.4	-72.4	0	0	0	115.4	D92 F93 A96 M115 Y116 N126 V128	D92-Y119 HydrophobicContact CB-CE1 4.16Å; F93-Y119 HydrophobicContact CB-CD1 3.84Å; F93-Y119 HydrophobicContact CB-CE1 4.16Å; F93-Y119 HydrophobicContact CB-CG 4.1Å; F93-Y119 HydrophobicContact CD2-CD1 4.27Å; F93-Y119 AromaticContact CD2-CD2 3.9Å; F93-Y119 HydrophobicContact CD2-CD2 3.9Å; F93-Y119 AromaticContact CD2-CG 3.65Å; F93-Y119 HydrophobicContact CD2-CG 3.65Å; F93-Y119 HydrophobicContact CG-CG 4.31Å; A96-Y119 HydrophobicContact CB-CE2 4.19Å; M115-Y119 WeakPolarHBondContact O-CB 3.24Å; M115-Y119 PolarHBondContact O-N 3.47Å; Y116-Y119 PolarHBondContact O-N 3.07Å; Y119-N126 HydrophobicContact CD1-CB 3.92Å; Y119-N126 HydrophobicContact CE1-CB 3.93Å; Y119-V128 HydrophobicContact CD1-CG2 3.97Å; Y119-V128 HydrophobicContact CG-CG2 4.32Å; Y119-V128 WeakPolarHBondContact O-CG2 3.4Å; Y119-V128 PolarHBondContact O-N 2.88Å
120	V	85.4	Confident	82	Confident	1 Å²	1	65.8 Å²	65.8	1%	0.006	35%	0.348	C	S	.	.	I	π-helix	trans	-117.4	-32.8	-165.9	-174.1	0	0	0	0	113	F93 Y116 L131 R136 T139 F151	F93-V120 HydrophobicContact CE2-CG2 4.02Å; F93-V120 HydrophobicContact CZ-CG2 4.4Å; Y116-V120 HydrophobicContact CD2-CB 3.66Å; Y116-V120 HydrophobicContact CD2-CG1 3.68Å; Y116-V120 HydrophobicContact CD2-CG2 4.44Å; Y116-V120 HydrophobicContact CE2-CB 3.99Å; Y116-V120 HydrophobicContact CE2-CG1 3.57Å; Y116-V120 HydrophobicContact CG-CB 4.27Å; Y116-V120 CarbonylContact O-C 3.51Å; Y116-V120 WeakPolarHBondContact O-CA 3.46Å; Y116-V120 PolarHBondContact O-N 3Å; V120-L131 HydrophobicContact CG1-CD1 4.27Å; V120-L131 HydrophobicContact CG2-CD1 4.18Å; V120-R136 HydrophobicContact CG1-CB 4.3Å; V120-R136 HydrophobicContact CG1-CG 4.04Å; V120-R136 VanDerWaalsContact O-CD 3.24Å; V120-R136 WeakPolarHBondContact O-CD 3.39Å; V120-T139 HydrophobicContact CG1-CG2 4.13Å; V120-T139 HydrophobicContact CG2-CG2 4.45Å; V120-F151 HydrophobicContact CG2-CE1 4.49Å
121	E	83.3	Confident	81.3	Confident	82 Å²	82	62 Å²	62	38%	0.383	33%	0.325	S	S	.	.	S	Bend	trans	-58.8	144.7	176.5	-169.4	163.5	-114.5	0	0	110.4	Y116 D123 A124	Y116-E121 HydrophobicContact CD1-CB 4.1Å; Y116-E121 HydrophobicContact CE1-CB 3.86Å; Y116-E121 HydrophobicContact CE1-CG 4.15Å; Y116-E121 PolarHBondContact O-N 3Å; E121-D123 PolarHBondContact O-N 3.38Å; E121-A124 HydrophobicContact CB-CB 4.35Å; E121-A124 WeakPolarHBondContact O-CB 3.4Å; E121-A124 PolarHBondContact O-N 3.26Å
122	A	77.3	Confident	80.8	Confident	62 Å²	62	63 Å²	63	51%	0.512	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	136	174.3	0	0	0	0	0	109.2	A124	A122-A124 PolarHBondContact O-N 3.41Å
123	D	77.3	Confident	80.4	Confident	152 Å²	152	66 Å²	66	81%	0.813	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.2	21.5	-174.9	-50	-57.8	0	0	0	114	E121 E127	E121-D123 PolarHBondContact O-N 3.38Å; D123-E127 PolarHBondContact N-OE2 3.31Å
124	A	78	Confident	80.1	Confident	10 Å²	10	63.3 Å²	63.3	8%	0.083	36%	0.359	C	S	.	.			trans	-57.9	145.7	173.8	0	0	0	0	0	111.3	Q117 E121 A122 N126 E127	Q117-A124 VanDerWaalsContact O-CB 3.31Å; Q117-A124 WeakPolarHBondContact O-CB 3.25Å; E121-A124 HydrophobicContact CB-CB 4.35Å; E121-A124 WeakPolarHBondContact O-CB 3.4Å; E121-A124 PolarHBondContact O-N 3.26Å; A122-A124 PolarHBondContact O-N 3.41Å; A124-N126 PolarHBondContact O-N 3.28Å; A124-N126 VanDerWaalsContact O-N 3.11Å; A124-E127 HydrophobicContact CB-CB 4.1Å; A124-E127 WeakPolarHBondContact O-CB 3.46Å; A124-E127 PolarHBondContact O-N 2.98Å
125	P	69	Low	79.7	Confident	110 Å²	110	58 Å²	58	71%	0.714	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-28.6	-175.8	23.9	-34.3	0	0	0	113.3	Q117	Q117-P125 WeakPolarHBondContact O-CD 3.36Å
126	N	71.8	Confident	79.5	Confident	61 Å²	61	61.1 Å²	61.1	33%	0.326	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.6	43.7	171.5	-59.6	-18.6	0	0	0	109.8	E89 Q118 Y119 A124 V128	E89-N126 HydrophobicContact CB-CB 4.17Å; Q118-N126 PolarHBondContact NE2-ND2 3.21Å; Q118-N126 CarbonylContact O-C 3.57Å; Q118-N126 WeakPolarHBondContact O-CA 3.49Å; Q118-N126 WeakPolarHBondContact O-CB 3.33Å; Q118-N126 PolarHBondContact O-N 2.88Å; Q118-N126 VanDerWaalsContact O-N 3.17Å; Y119-N126 HydrophobicContact CD1-CB 3.92Å; Y119-N126 HydrophobicContact CE1-CB 3.93Å; A124-N126 PolarHBondContact O-N 3.28Å; A124-N126 VanDerWaalsContact O-N 3.11Å; N126-V128 PolarHBondContact O-N 3.02Å; N126-V128 VanDerWaalsContact O-N 3.09Å
127	E	72.3	Confident	79.3	Confident	73 Å²	73	62.4 Å²	62.4	34%	0.341	35%	0.353	S	S	.	.			trans	-48.2	121	178.9	-177	177.4	179.9	0	0	110	D123 A124 V129	D123-E127 PolarHBondContact N-OE2 3.31Å; A124-E127 HydrophobicContact CB-CB 4.1Å; A124-E127 WeakPolarHBondContact O-CB 3.46Å; A124-E127 PolarHBondContact O-N 2.98Å; E127-V129 PolarHBondContact O-N 3.38Å
128	V	70.3	Confident	79.2	Confident	3 Å²	3	61.4 Å²	61.4	2%	0.018	35%	0.347	C	S	.	.			trans	-72.5	123.5	-178.2	-172.9	0	0	0	0	108.6	N90 F93 Y119 N126 N130 L131 I158	N90-V128 WeakPolarHBondContact OD1-CG1 3.01Å; F93-V128 HydrophobicContact CB-CG2 3.73Å; F93-V128 HydrophobicContact CD1-CG2 4.31Å; F93-V128 HydrophobicContact CD2-CG2 4.32Å; F93-V128 HydrophobicContact CG-CG2 3.86Å; Y119-V128 HydrophobicContact CD1-CG2 3.97Å; Y119-V128 HydrophobicContact CG-CG2 4.32Å; Y119-V128 WeakPolarHBondContact O-CG2 3.4Å; Y119-V128 PolarHBondContact O-N 2.88Å; N126-V128 PolarHBondContact O-N 3.02Å; N126-V128 VanDerWaalsContact O-N 3.09Å; V128-N130 PolarHBondContact O-N 3.44Å; V128-L131 HydrophobicContact CB-CD1 4.37Å; V128-I158 HydrophobicContact CB-CD1 4.34Å; V128-I158 HydrophobicContact CG1-CD1 3.19Å; V128-I158 HydrophobicContact CG1-CG1 3.7Å; V128-I158 HydrophobicContact CG1-CG2 4.35Å
129	V	63.8	Low	79.2	Confident	107 Å²	107	57.9 Å²	57.9	65%	0.648	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-11	-158.3	175.2	0	0	0	0	115.2	E89 E127	E89-V129 HydrophobicContact CG-CG2 4.23Å; E89-V129 WeakPolarHBondContact OE1-CG2 3.47Å; E127-V129 PolarHBondContact O-N 3.38Å
130	N	67.6	Low	79.1	Confident	97 Å²	97	61.1 Å²	61.1	52%	0.519	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-149.9	40.4	-175.1	-158.2	14.8	0	0	0	115.4	V128 L161	V128-N130 PolarHBondContact O-N 3.44Å; N130-L161 HydrophobicContact CB-CD1 4.33Å; N130-L161 HydrophobicContact CB-CD2 3.79Å
131	L	78.4	Confident	79.2	Confident	8 Å²	8	68.4 Å²	68.4	4%	0.042	37%	0.37	C	S	.	.			trans	-84.8	121.7	163.7	-70.5	174.9	0	0	0	109.4	V120 V128 T135 R136 A154 M157 I158	V120-L131 HydrophobicContact CG1-CD1 4.27Å; V120-L131 HydrophobicContact CG2-CD1 4.18Å; V128-L131 HydrophobicContact CB-CD1 4.37Å; L131-T135 HydrophobicContact CD2-CG2 4Å; L131-R136 HydrophobicContact CB-CG 3.91Å; L131-R136 PolarHBondContact O-NH1 3.18Å; L131-A154 HydrophobicContact CD1-CB 4.24Å; L131-A154 HydrophobicContact CD2-CB 3.81Å; L131-M157 HydrophobicContact CD2-CB 4.4Å; L131-M157 HydrophobicContact CD2-SD 4.48Å; L131-I158 HydrophobicContact CD2-CD1 4.05Å; L131-I158 HydrophobicContact CD2-CG1 4.22Å; L131-I158 HydrophobicContact CG-CD1 4.19Å
132	D	82.1	Confident	79.3	Confident	75 Å²	75	66.7 Å²	66.7	40%	0.401	36%	0.362	S	S	.	.			trans	-68.3	159.9	174.9	73.8	43	0	0	0	111.3	A134 T135 R136	D132-A134 PolarHBondContact O-N 3.46Å; D132-A134 WeakPolarHBondContact OD1-CA 3.47Å; D132-A134 WeakPolarHBondContact OD1-CB 3.34Å; D132-A134 PolarHBondContact OD1-N 2.88Å; D132-T135 PolarHBondContact O-N 3.23Å; D132-T135 PolarHBondContact OD1-N 3.41Å; D132-T135 PolarHBondContact OD1-OG1 3Å; D132-R136 WeakPolarHBondContact O-CG 3.43Å; D132-R136 PolarHBondContact O-N 3.02Å
133	A	82.7	Confident	79.7	Confident	64 Å²	64	64.6 Å²	64.6	53%	0.529	34%	0.342	S	S	.	.	H	α-helix	trans	-60.8	-29.7	-177	0	0	0	0	0	112.8	E137	A133-E137 WeakPolarHBondContact O-CB 3.34Å; A133-E137 PolarHBondContact O-N 3.41Å
134	A	85	Confident	79.8	Confident	72 Å²	72	64 Å²	64	60%	0.595	34%	0.335	S	S	*	.	H	α-helix	trans	-71.8	-44	-179.7	0	0	0	0	0	110.9	D132 E137 K138	D132-A134 PolarHBondContact O-N 3.46Å; D132-A134 WeakPolarHBondContact OD1-CA 3.47Å; D132-A134 WeakPolarHBondContact OD1-CB 3.34Å; D132-A134 PolarHBondContact OD1-N 2.88Å; A134-E137 PolarHBondContact O-N 3.35Å; A134-K138 WeakPolarHBondContact O-CB 3.39Å; A134-K138 PolarHBondContact O-N 2.76Å
135	T	84.3	Confident	79.6	Confident	2 Å²	2	68 Å²	68	1%	0.012	36%	0.362	C	S	.	.	H	α-helix	trans	-65.7	-41.4	175.4	-55.6	0	0	0	0	111.2	L131 D132 E137 K138 T139 E153 A154 M157	L131-T135 HydrophobicContact CD2-CG2 4Å; D132-T135 PolarHBondContact O-N 3.23Å; D132-T135 PolarHBondContact OD1-N 3.41Å; D132-T135 PolarHBondContact OD1-OG1 3Å; T135-E137 PolarHBondContact O-N 3.11Å; T135-K138 PolarHBondContact O-N 2.88Å; T135-T139 WeakPolarHBondContact O-CB 3.45Å; T135-T139 PolarHBondContact O-N 3.32Å; T135-T139 PolarHBondContact O-OG1 2.72Å; T135-E153 HydrophobicContact CG2-CG 4.2Å; T135-A154 HydrophobicContact CG2-CB 4.07Å; T135-M157 HydrophobicContact CG2-SD 3.73Å; T135-M157 PolarHBondContact OG1-SD 3.12Å
136	R	86	Confident	79.8	Confident	71 Å²	71	63.7 Å²	63.7	27%	0.268	34%	0.337	S	S	.	.	H	α-helix	trans	-59.2	-46.6	174.7	-71.1	-169	-57.2	-113.2	8	112.2	V120 L131 D132 K138 T139 R140	V120-R136 HydrophobicContact CG1-CB 4.3Å; V120-R136 HydrophobicContact CG1-CG 4.04Å; V120-R136 VanDerWaalsContact O-CD 3.24Å; V120-R136 WeakPolarHBondContact O-CD 3.39Å; L131-R136 HydrophobicContact CB-CG 3.91Å; L131-R136 PolarHBondContact O-NH1 3.18Å; D132-R136 WeakPolarHBondContact O-CG 3.43Å; D132-R136 PolarHBondContact O-N 3.02Å; R136-K138 VanDerWaalsContact C-N 3.34Å; R136-T139 PolarHBondContact O-N 3.28Å; R136-R140 WeakPolarHBondContact O-CB 3.5Å; R136-R140 PolarHBondContact O-N 3.33Å
137	E	86.2	Confident	80.5	Confident	59 Å²	59	61.6 Å²	61.6	28%	0.276	33%	0.33	S	S	.	.	H	α-helix	trans	-65.8	-38	178.1	174.3	56.1	-162.2	0	0	111.7	A133 A134 T135 R140 R141	A133-E137 WeakPolarHBondContact O-CB 3.34Å; A133-E137 PolarHBondContact O-N 3.41Å; A134-E137 PolarHBondContact O-N 3.35Å; T135-E137 PolarHBondContact O-N 3.11Å; E137-R140 WeakPolarHBondContact O-CB 3.35Å; E137-R140 PolarHBondContact O-N 2.91Å; E137-R140 IonicContact OE1-CZ 3.4Å; E137-R140 IonicContact OE1-NE 3.36Å; E137-R140 IonicContact OE1-NH2 3.32Å; E137-R140 PolarHBondContact OE1-NH2 3.48Å; E137-R140 IonicContact OE2-CZ 2.69Å; E137-R140 IonicContact OE2-NE 3.23Å; E137-R140 PolarHBondContact OE2-NE 2.97Å; E137-R140 IonicContact OE2-NH2 2.85Å; E137-R140 PolarHBondContact OE2-NH2 3.19Å; E137-R141 WeakPolarHBondContact O-CG 3.45Å; E137-R141 PolarHBondContact O-N 3.39Å; E137-R141 VanDerWaalsContact O-N 3.13Å; E137-R141 IonicContact OE1-CZ 3.34Å; E137-R141 IonicContact OE1-NE 2.69Å; E137-R141 PolarHBondContact OE1-NE 3.32Å; E137-R141 IonicContact OE1-NH2 2.95Å; E137-R141 PolarHBondContact OE1-NH2 2.86Å
138	K	86.3	Confident	81.1	Confident	87 Å²	87	62 Å²	62	38%	0.378	34%	0.339	S	S	.	.	H	α-helix	trans	-63.7	-50.3	174.6	-174.1	179.9	172.4	178.7	0	111.3	A134 T135 R136 R140 R141 E142 E153	A134-K138 WeakPolarHBondContact O-CB 3.39Å; A134-K138 PolarHBondContact O-N 2.76Å; T135-K138 PolarHBondContact O-N 2.88Å; R136-K138 VanDerWaalsContact C-N 3.34Å; K138-R140 PolarHBondContact O-N 3.4Å; K138-R141 PolarHBondContact O-N 2.83Å; K138-E142 WeakPolarHBondContact CE-OE1 3.41Å; K138-E142 IonicContact NZ-OE1 3.87Å; K138-E142 WeakPolarHBondContact O-CG 3.38Å; K138-E142 PolarHBondContact O-N 2.92Å; K138-E153 WeakPolarHBondContact CD-OE2 3.3Å; K138-E153 VanDerWaalsContact CE-OE2 3.29Å; K138-E153 WeakPolarHBondContact CE-OE2 3.35Å; K138-E153 IonicContact NZ-OE2 2.61Å; K138-E153 PolarHBondContact NZ-OE2 2.96Å
139	T	87.2	Confident	82	Confident	2 Å²	2	64.8 Å²	64.8	1%	0.012	36%	0.359	C	S	.	.	H	α-helix	trans	-57.2	-40.6	175.4	-63.8	0	0	0	0	110.8	Y116 V120 T135 R136 R141 E142 I143 F151	Y116-T139 HydrophobicContact CD2-CG2 4.21Å; V120-T139 HydrophobicContact CG1-CG2 4.13Å; V120-T139 HydrophobicContact CG2-CG2 4.45Å; T135-T139 WeakPolarHBondContact O-CB 3.45Å; T135-T139 PolarHBondContact O-N 3.32Å; T135-T139 PolarHBondContact O-OG1 2.72Å; R136-T139 PolarHBondContact O-N 3.28Å; T139-R141 VanDerWaalsContact C-N 3.31Å; T139-R141 PolarHBondContact O-N 3.33Å; T139-E142 PolarHBondContact O-N 2.93Å; T139-I143 HydrophobicContact CG2-CG2 4.26Å; T139-I143 WeakPolarHBondContact O-CG1 3.43Å; T139-I143 WeakPolarHBondContact O-CG2 3.44Å; T139-I143 PolarHBondContact O-N 3.05Å; T139-F151 HydrophobicContact CG2-CD1 3.77Å; T139-F151 HydrophobicContact CG2-CE1 3.76Å
140	R	87.5	Confident	83.3	Confident	85 Å²	85	59.7 Å²	59.7	32%	0.321	33%	0.328	S	S	.	.	H	α-helix	trans	-57.2	-40.4	175.3	-167.6	-172.2	68.5	73.4	3.4	112.7	Y116 R136 E137 K138 I143 E144	Y116-R140 HydrophobicContact CE2-CB 3.84Å; Y116-R140 HydrophobicContact CE2-CG 4.23Å; R136-R140 WeakPolarHBondContact O-CB 3.5Å; R136-R140 PolarHBondContact O-N 3.33Å; E137-R140 WeakPolarHBondContact O-CB 3.35Å; E137-R140 PolarHBondContact O-N 2.91Å; E137-R140 IonicContact OE1-CZ 3.4Å; E137-R140 IonicContact OE1-NE 3.36Å; E137-R140 IonicContact OE1-NH2 3.32Å; E137-R140 PolarHBondContact OE1-NH2 3.48Å; E137-R140 IonicContact OE2-CZ 2.69Å; E137-R140 IonicContact OE2-NE 3.23Å; E137-R140 PolarHBondContact OE2-NE 2.97Å; E137-R140 IonicContact OE2-NH2 2.85Å; E137-R140 PolarHBondContact OE2-NH2 3.19Å; K138-R140 PolarHBondContact O-N 3.4Å; R140-I143 WeakPolarHBondContact O-CG1 3.13Å; R140-E144 IonicContact NH1-OE1 2.75Å; R140-E144 PolarHBondContact NH1-OE1 2.92Å
141	R	87.2	Confident	84.4	Confident	154 Å²	154	55.2 Å²	55.2	58%	0.581	30%	0.304	S	S	*	.	H	α-helix	trans	-73.3	-38.7	176.1	-65	177	-163.9	-167.8	4.4	112	E137 K138 T139 E144	E137-R141 WeakPolarHBondContact O-CG 3.45Å; E137-R141 PolarHBondContact O-N 3.39Å; E137-R141 VanDerWaalsContact O-N 3.13Å; E137-R141 IonicContact OE1-CZ 3.34Å; E137-R141 IonicContact OE1-NE 2.69Å; E137-R141 PolarHBondContact OE1-NE 3.32Å; E137-R141 IonicContact OE1-NH2 2.95Å; E137-R141 PolarHBondContact OE1-NH2 2.86Å; K138-R141 PolarHBondContact O-N 2.83Å; T139-R141 VanDerWaalsContact C-N 3.31Å; T139-R141 PolarHBondContact O-N 3.33Å; R141-E144 WeakPolarHBondContact O-CB 3.23Å; R141-E144 PolarHBondContact O-N 2.95Å
142	E	85.8	Confident	85.1	Confident	47 Å²	47	58.2 Å²	58.2	22%	0.22	32%	0.32	C	S	.	.	H	α-helix	trans	-69.1	-36.5	-178.7	-69.7	-176.7	172.4	0	0	112.1	K138 T139 E144 S145 G146 C150	K138-E142 WeakPolarHBondContact CE-OE1 3.41Å; K138-E142 IonicContact NZ-OE1 3.87Å; K138-E142 WeakPolarHBondContact O-CG 3.38Å; K138-E142 PolarHBondContact O-N 2.92Å; T139-E142 PolarHBondContact O-N 2.93Å; E142-E144 PolarHBondContact O-N 3.2Å; E142-S145 WeakPolarHBondContact O-CA 3.29Å; E142-S145 WeakPolarHBondContact O-CB 3.42Å; E142-S145 PolarHBondContact O-N 2.99Å; E142-S145 PolarHBondContact O-OG 3.11Å; E142-G146 PolarHBondContact O-N 3.38Å; E142-C150 VanDerWaalsContact C-SG 3.52Å; E142-C150 HydrophobicContact CB-CB 4.15Å; E142-C150 PolarHBondContact O-SG 3.27Å; E142-C150 WeakPolarHBondContact OE2-CA 3.31Å
143	I	85.9	Confident	85.5	Confident	18 Å²	18	58.1 Å²	58.1	9%	0.092	32%	0.317	C	S	.	.	H	α-helix	trans	-64.5	-24.6	175.3	59.9	174.5	0	0	0	113.1	A112 Y116 T139 R140 S145 G146 C150 F151	A112-I143 HydrophobicContact CB-CB 4.3Å; A112-I143 HydrophobicContact CB-CG2 4.04Å; Y116-I143 HydrophobicContact CD1-CD1 3.99Å; Y116-I143 HydrophobicContact CD2-CD1 3.5Å; Y116-I143 HydrophobicContact CE2-CD1 4.07Å; Y116-I143 HydrophobicContact CG-CD1 3.45Å; Y116-I143 VanDerWaalsContact CG-CD1 3.45Å; T139-I143 HydrophobicContact CG2-CG2 4.26Å; T139-I143 WeakPolarHBondContact O-CG1 3.43Å; T139-I143 WeakPolarHBondContact O-CG2 3.44Å; T139-I143 PolarHBondContact O-N 3.05Å; R140-I143 WeakPolarHBondContact O-CG1 3.13Å; I143-S145 PolarHBondContact O-N 3.3Å; I143-G146 PolarHBondContact O-N 3.34Å; I143-C150 HydrophobicContact CG2-CB 4.18Å; I143-F151 HydrophobicContact CG2-CE1 4.13Å; I143-F151 HydrophobicContact CG2-CZ 3.82Å
144	E	78.3	Confident	85.9	Confident	140 Å²	140	55.1 Å²	55.1	65%	0.654	29%	0.292	S	S	*	.	H	α-helix	trans	-65.7	-30	172.5	-65.8	170.8	-174.1	0	0	111.1	R140 R141 E142	R140-E144 IonicContact NH1-OE1 2.75Å; R140-E144 PolarHBondContact NH1-OE1 2.92Å; R141-E144 WeakPolarHBondContact O-CB 3.23Å; R141-E144 PolarHBondContact O-N 2.95Å; E142-E144 PolarHBondContact O-N 3.2Å
145	S	75	Confident	86.3	Confident	94 Å²	94	52.1 Å²	52.1	66%	0.657	27%	0.266	S	S	*	.	H	α-helix	trans	-84.4	-19.3	175.6	77.6	0	0	0	0	114	E142 I143 G147	E142-S145 WeakPolarHBondContact O-CA 3.29Å; E142-S145 WeakPolarHBondContact O-CB 3.42Å; E142-S145 PolarHBondContact O-N 2.99Å; E142-S145 PolarHBondContact O-OG 3.11Å; I143-S145 PolarHBondContact O-N 3.3Å; S145-G147 VanDerWaalsContact C-N 3.27Å; S145-G147 PolarHBondContact O-N 3.42Å
146	G	73.3	Confident	86.7	Confident	18 Å²	18	58.8 Å²	58.8	19%	0.186	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	22.3	172.5	0	0	0	0	0	115.7	E142 I143	E142-G146 PolarHBondContact O-N 3.38Å; I143-G146 PolarHBondContact O-N 3.34Å
147	G	84.9	Confident	87	Confident	18 Å²	18	58 Å²	58	19%	0.186	29%	0.294	C	S	.	.			trans	-74.8	169.4	-179.3	0	0	0	0	0	114.7	Y100 M108 S145 S149 C150	Y100-G147 VanDerWaalsContact CE1-O 3.24Å; Y100-G147 WeakPolarHBondContact CE1-O 3.43Å; Y100-G147 PolarHBondContact OH-O 3.33Å; M108-G147 VanDerWaalsContact CE-C 3.47Å; M108-G147 WeakPolarHBondContact CE-O 3.44Å; S145-G147 VanDerWaalsContact C-N 3.27Å; S145-G147 PolarHBondContact O-N 3.42Å; G147-S149 VanDerWaalsContact C-N 3.26Å; G147-S149 PolarHBondContact O-N 3.17Å; G147-C150 PolarHBondContact N-SG 3.16Å; G147-C150 PolarHBondContact O-SG 3.27Å
148	P	86	Confident	87.3	Confident	82 Å²	82	55.1 Å²	55.1	53%	0.532	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-21.7	177.4	26.5	-33.1	0	0	0	113.7	M108	M108-P148 HydrophobicContact CE-CB 3.81Å; M108-P148 VanDerWaalsContact CE-N 3.34Å
149	S	89.1	Confident	87.8	Confident	60 Å²	60	53.1 Å²	53.1	42%	0.42	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	4.9	-175.6	58.3	0	0	0	0	114.6	G147 F151 D152	G147-S149 VanDerWaalsContact C-N 3.26Å; G147-S149 PolarHBondContact O-N 3.17Å; S149-F151 PolarHBondContact O-N 3.06Å; S149-D152 WeakPolarHBondContact CA-OD2 3.46Å; S149-D152 WeakPolarHBondContact CB-OD2 3.44Å; S149-D152 WeakPolarHBondContact O-CB 3.36Å; S149-D152 PolarHBondContact O-N 2.79Å
150	C	89.9	Confident	88.1	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.007	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-24	-172.8	-65.5	0	0	0	0	115.3	Y100 E142 I143 G147	Y100-C150 HydrophobicContact CE1-CB 4.43Å; E142-C150 VanDerWaalsContact C-SG 3.52Å; E142-C150 HydrophobicContact CB-CB 4.15Å; E142-C150 PolarHBondContact O-SG 3.27Å; E142-C150 WeakPolarHBondContact OE2-CA 3.31Å; I143-C150 HydrophobicContact CG2-CB 4.18Å; G147-C150 PolarHBondContact N-SG 3.16Å; G147-C150 PolarHBondContact O-SG 3.27Å
151	F	91.8	Very high	88.4	Confident	3 Å²	3	53.8 Å²	53.8	1%	0.013	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.2	5.4	-177	-57.9	-76	0	0	0	112.7	F93 C97 Y100 A112 M115 V120 T139 I143 S149 E153 A154 Q155	F93-F151 HydrophobicContact CE2-CD1 4.1Å; F93-F151 HydrophobicContact CZ-CB 4.4Å; F93-F151 HydrophobicContact CZ-CD1 4.11Å; C97-F151 HydrophobicContact CB-CB 4.48Å; C97-F151 VanDerWaalsContact SG-CB 3.52Å; Y100-F151 AromaticContact CD1-CD2 3.71Å; Y100-F151 HydrophobicContact CD1-CD2 3.71Å; Y100-F151 HydrophobicContact CD1-CE2 4.04Å; Y100-F151 HydrophobicContact CD2-CE2 4.08Å; Y100-F151 AromaticContact CE1-CD2 3.9Å; Y100-F151 HydrophobicContact CE1-CD2 3.9Å; Y100-F151 HydrophobicContact CE1-CE2 4.01Å; Y100-F151 HydrophobicContact CE2-CE2 4.08Å; Y100-F151 HydrophobicContact CG-CD2 4.04Å; Y100-F151 HydrophobicContact CG-CE2 4.07Å; A112-F151 HydrophobicContact CB-CE2 4.15Å; A112-F151 HydrophobicContact CB-CZ 4.22Å; M115-F151 HydrophobicContact CB-CE1 4.24Å; M115-F151 HydrophobicContact CB-CE2 4.36Å; M115-F151 HydrophobicContact CB-CZ 3.79Å; M115-F151 HydrophobicContact CE-CD2 4.04Å; M115-F151 HydrophobicContact CE-CE2 4.04Å; M115-F151 HydrophobicContact CE-CG 4.34Å; M115-F151 HydrophobicContact CE-CZ 4.32Å; M115-F151 HydrophobicContact SD-CE2 4.11Å; M115-F151 HydrophobicContact SD-CZ 4.47Å; V120-F151 HydrophobicContact CG2-CE1 4.49Å; T139-F151 HydrophobicContact CG2-CD1 3.77Å; T139-F151 HydrophobicContact CG2-CE1 3.76Å; I143-F151 HydrophobicContact CG2-CE1 4.13Å; I143-F151 HydrophobicContact CG2-CZ 3.82Å; S149-F151 PolarHBondContact O-N 3.06Å; F151-E153 PolarHBondContact O-N 2.75Å; F151-A154 PolarHBondContact O-N 3.35Å; F151-Q155 WeakPolarHBondContact O-CB 3.33Å; F151-Q155 PolarHBondContact O-N 3.37Å
152	D	92.2	Very high	88.8	Confident	70 Å²	70	46.5 Å²	46.5	37%	0.374	25%	0.253	S	S	.	.	H	α-helix	trans	-62.1	-41.9	-171.3	-77.4	-10.1	0	0	0	112.3	K101 S149 K156	K101-D152 VanDerWaalsContact CE-OD1 3.28Å; K101-D152 WeakPolarHBondContact CE-OD1 3.45Å; K101-D152 IonicContact NZ-OD1 3.98Å; S149-D152 WeakPolarHBondContact CA-OD2 3.46Å; S149-D152 WeakPolarHBondContact CB-OD2 3.44Å; S149-D152 WeakPolarHBondContact O-CB 3.36Å; S149-D152 PolarHBondContact O-N 2.79Å; D152-K156 VanDerWaalsContact O-CB 3.3Å; D152-K156 WeakPolarHBondContact O-CB 3.43Å; D152-K156 PolarHBondContact O-N 3.44Å
153	E	90.6	Very high	89.3	Confident	74 Å²	74	47.4 Å²	47.4	35%	0.346	26%	0.258	S	S	.	.	H	α-helix	trans	-68.4	-49.6	178	-175.2	169.8	151.7	0	0	111.8	T135 K138 F151 Q155 K156 M157	T135-E153 HydrophobicContact CG2-CG 4.2Å; K138-E153 WeakPolarHBondContact CD-OE2 3.3Å; K138-E153 VanDerWaalsContact CE-OE2 3.29Å; K138-E153 WeakPolarHBondContact CE-OE2 3.35Å; K138-E153 IonicContact NZ-OE2 2.61Å; K138-E153 PolarHBondContact NZ-OE2 2.96Å; F151-E153 PolarHBondContact O-N 2.75Å; E153-Q155 VanDerWaalsContact C-N 3.34Å; E153-Q155 PolarHBondContact O-N 3.41Å; E153-K156 PolarHBondContact O-N 2.85Å; E153-M157 WeakPolarHBondContact O-CG 3.48Å; E153-M157 PolarHBondContact O-N 3.33Å
154	A	91.3	Very high	89.7	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-58	-47.8	177.1	0	0	0	0	0	110.7	F93 L131 T135 F151 K156 M157 I158	F93-A154 HydrophobicContact CE1-CB 3.94Å; F93-A154 HydrophobicContact CZ-CB 3.79Å; L131-A154 HydrophobicContact CD1-CB 4.24Å; L131-A154 HydrophobicContact CD2-CB 3.81Å; T135-A154 HydrophobicContact CG2-CB 4.07Å; F151-A154 PolarHBondContact O-N 3.35Å; A154-K156 VanDerWaalsContact C-N 3.32Å; A154-K156 PolarHBondContact O-N 3.32Å; A154-M157 PolarHBondContact O-N 3.06Å; A154-M157 VanDerWaalsContact O-N 3.16Å; A154-I158 WeakPolarHBondContact O-CG1 3.27Å; A154-I158 PolarHBondContact O-N 2.83Å
155	Q	94	Very high	90.4	Very high	10 Å²	10	50.3 Å²	50.3	5%	0.047	27%	0.271	C	S	.	.	H	α-helix	trans	-59.7	-41.6	178.1	-171.1	-172.5	23.9	0	0	111.7	W94 C97 E98 K101 F151 E153 I158 Y159	W94-Q155 VanDerWaalsContact CD1-CG 3.43Å; W94-Q155 HydrophobicContact CG-CG 4.15Å; W94-Q155 PolarHBondContact O-NE2 3.36Å; C97-Q155 HydrophobicContact CB-CB 4.12Å; C97-Q155 VanDerWaalsContact CB-CD 3.41Å; C97-Q155 HydrophobicContact CB-CG 3.8Å; E98-Q155 PolarHBondContact OE1-NE2 3.46Å; K101-Q155 VanDerWaalsContact CE-OE1 3.31Å; F151-Q155 WeakPolarHBondContact O-CB 3.33Å; F151-Q155 PolarHBondContact O-N 3.37Å; E153-Q155 VanDerWaalsContact C-N 3.34Å; E153-Q155 PolarHBondContact O-N 3.41Å; Q155-I158 PolarHBondContact O-N 3.26Å; Q155-Y159 WeakPolarHBondContact O-CB 3.41Å; Q155-Y159 PolarHBondContact O-N 3.43Å
156	K	93.1	Very high	91.4	Very high	142 Å²	142	46.1 Å²	46.1	62%	0.617	24%	0.242	S	C	*	.	H	α-helix	trans	-64	-40.8	176.3	-177.7	178.6	179.9	-179.9	0	112	D152 E153 A154 N160	D152-K156 VanDerWaalsContact O-CB 3.3Å; D152-K156 WeakPolarHBondContact O-CB 3.43Å; D152-K156 PolarHBondContact O-N 3.44Å; E153-K156 PolarHBondContact O-N 2.85Å; A154-K156 VanDerWaalsContact C-N 3.32Å; A154-K156 PolarHBondContact O-N 3.32Å; K156-N160 WeakPolarHBondContact O-CB 3.36Å; K156-N160 PolarHBondContact O-N 3.36Å; K156-N160 PolarHBondContact O-ND2 3.14Å
157	M	91.6	Very high	92.5	Very high	53 Å²	53	46.2 Å²	46.2	26%	0.261	24%	0.237	S	C	.	.	H	α-helix	trans	-62.7	-45.9	176.3	-71.5	-179.1	71.5	0	0	111.6	L131 T135 E153 A154 N160 L161	L131-M157 HydrophobicContact CD2-CB 4.4Å; L131-M157 HydrophobicContact CD2-SD 4.48Å; T135-M157 HydrophobicContact CG2-SD 3.73Å; T135-M157 PolarHBondContact OG1-SD 3.12Å; E153-M157 WeakPolarHBondContact O-CG 3.48Å; E153-M157 PolarHBondContact O-N 3.33Å; A154-M157 PolarHBondContact O-N 3.06Å; A154-M157 VanDerWaalsContact O-N 3.16Å; M157-N160 PolarHBondContact O-N 2.97Å; M157-L161 WeakPolarHBondContact O-CB 3.34Å; M157-L161 PolarHBondContact O-N 3.22Å
158	I	93.1	Very high	93	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-67.5	-38.7	179.5	-60.7	-48	0	0	0	111.9	N90 F93 V128 L131 A154 Q155 N160 L161 M162	N90-I158 HydrophobicContact CB-CG2 3.78Å; N90-I158 VanDerWaalsContact O-CG2 3.25Å; N90-I158 WeakPolarHBondContact O-CG2 3.49Å; F93-I158 HydrophobicContact CD1-CB 4.25Å; F93-I158 HydrophobicContact CD1-CG1 3.85Å; F93-I158 HydrophobicContact CD1-CG2 4.39Å; F93-I158 HydrophobicContact CE1-CG1 4.05Å; V128-I158 HydrophobicContact CB-CD1 4.34Å; V128-I158 HydrophobicContact CG1-CD1 3.19Å; V128-I158 HydrophobicContact CG1-CG1 3.7Å; V128-I158 HydrophobicContact CG1-CG2 4.35Å; L131-I158 HydrophobicContact CD2-CD1 4.05Å; L131-I158 HydrophobicContact CD2-CG1 4.22Å; L131-I158 HydrophobicContact CG-CD1 4.19Å; A154-I158 WeakPolarHBondContact O-CG1 3.27Å; A154-I158 PolarHBondContact O-N 2.83Å; Q155-I158 PolarHBondContact O-N 3.26Å; I158-N160 PolarHBondContact O-N 3.19Å; I158-L161 HydrophobicContact CD1-CD2 4.28Å; I158-L161 WeakPolarHBondContact O-CB 3.43Å; I158-L161 PolarHBondContact O-N 2.99Å; I158-M162 HydrophobicContact CG2-CE 4.05Å; I158-M162 HydrophobicContact CG2-SD 4.49Å; I158-M162 WeakPolarHBondContact O-CG 3.45Å; I158-M162 PolarHBondContact O-N 3.15Å
159	Y	95.2	Very high	93.5	Very high	45 Å²	45	54.5 Å²	54.5	18%	0.176	25%	0.252	C	S	.	.	H	α-helix	trans	-57.1	-49	171.1	-177.6	-84.5	0	0	0	111.4	F65 C66 M69 W94 Q155 L161 M162 E163	F65-Y159 HydrophobicContact CD1-CD1 4.27Å; F65-Y159 AromaticContact CD1-CD2 3.96Å; F65-Y159 HydrophobicContact CD1-CD2 3.96Å; F65-Y159 AromaticContact CD1-CE1 3.79Å; F65-Y159 HydrophobicContact CD1-CE1 3.79Å; F65-Y159 AromaticContact CD1-CE2 3.48Å; F65-Y159 HydrophobicContact CD1-CE2 3.48Å; F65-Y159 VanDerWaalsContact CD1-CE2 3.48Å; F65-Y159 HydrophobicContact CD1-CG 4.34Å; F65-Y159 AromaticContact CD1-CZ 3.38Å; F65-Y159 HydrophobicContact CE1-CD1 4.45Å; F65-Y159 AromaticContact CE1-CD2 3.67Å; F65-Y159 HydrophobicContact CE1-CD2 3.67Å; F65-Y159 HydrophobicContact CE1-CE1 4.38Å; F65-Y159 AromaticContact CE1-CE2 3.63Å; F65-Y159 HydrophobicContact CE1-CE2 3.63Å; F65-Y159 HydrophobicContact CE1-CG 4.11Å; F65-Y159 AromaticContact CE1-CZ 3.99Å; C66-Y159 WeakPolarHBondContact CA-OH 3.41Å; C66-Y159 PolarHBondContact N-OH 3.16Å; C66-Y159 VanDerWaalsContact N-OH 3.11Å; M69-Y159 HydrophobicContact CB-CE2 4.23Å; M69-Y159 HydrophobicContact CG-CD2 4.36Å; M69-Y159 HydrophobicContact CG-CE2 3.88Å; W94-Y159 AromaticContact NE1-CD2 3.58Å; Q155-Y159 WeakPolarHBondContact O-CB 3.41Å; Q155-Y159 PolarHBondContact O-N 3.43Å; Y159-L161 VanDerWaalsContact C-N 3.33Å; Y159-L161 PolarHBondContact O-N 3.11Å; Y159-M162 PolarHBondContact O-N 3.09Å; Y159-E163 WeakPolarHBondContact O-CB 3.02Å; Y159-E163 PolarHBondContact O-N 3.15Å
160	N	94.5	Very high	93.8	Very high	55 Å²	55	51.7 Å²	51.7	29%	0.294	23%	0.232	S	C	.	.	H	α-helix	trans	-65.6	-34.9	179.3	-70.1	-25.5	0	0	0	112.9	K156 M157 I158 K164	K156-N160 WeakPolarHBondContact O-CB 3.36Å; K156-N160 PolarHBondContact O-N 3.36Å; K156-N160 PolarHBondContact O-ND2 3.14Å; M157-N160 PolarHBondContact O-N 2.97Å; I158-N160 PolarHBondContact O-N 3.19Å; N160-K164 WeakPolarHBondContact O-CB 3.38Å; N160-K164 VanDerWaalsContact O-CG 3.25Å; N160-K164 WeakPolarHBondContact O-CG 3.42Å; N160-K164 PolarHBondContact O-N 2.89Å
161	L	93.5	Very high	94	Very high	46 Å²	46	53.8 Å²	53.8	24%	0.241	24%	0.243	C	C	.	.	H	α-helix	trans	-61.2	-54.2	174.7	176.4	67.8	0	0	0	110.3	N130 M157 I158 Y159 E163 K164 D165	N130-L161 HydrophobicContact CB-CD1 4.33Å; N130-L161 HydrophobicContact CB-CD2 3.79Å; M157-L161 WeakPolarHBondContact O-CB 3.34Å; M157-L161 PolarHBondContact O-N 3.22Å; I158-L161 HydrophobicContact CD1-CD2 4.28Å; I158-L161 WeakPolarHBondContact O-CB 3.43Å; I158-L161 PolarHBondContact O-N 2.99Å; Y159-L161 VanDerWaalsContact C-N 3.33Å; Y159-L161 PolarHBondContact O-N 3.11Å; L161-E163 VanDerWaalsContact C-N 3.32Å; L161-E163 PolarHBondContact O-N 3.43Å; L161-K164 PolarHBondContact O-N 3.21Å; L161-D165 PolarHBondContact O-N 3.22Å; L161-D165 VanDerWaalsContact O-N 3.08Å
162	M	95.3	Very high	94.1	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-60.5	-42	178.3	-69	-173.4	-63.2	0	0	111.2	F65 M69 F78 L82 N90 V91 W94 I158 Y159 K164 S166 Y167	F65-M162 HydrophobicContact CE1-CB 3.88Å; F65-M162 HydrophobicContact CE1-CE 4.28Å; F65-M162 HydrophobicContact CE2-CB 4.45Å; F65-M162 HydrophobicContact CZ-CB 3.57Å; F65-M162 HydrophobicContact CZ-CE 4.04Å; F65-M162 HydrophobicContact CZ-SD 4.39Å; M69-M162 HydrophobicContact CE-CE 4.14Å; F78-M162 HydrophobicContact CE1-CB 4.33Å; F78-M162 HydrophobicContact CE1-CG 4.43Å; F78-M162 HydrophobicContact CE1-SD 3.81Å; F78-M162 HydrophobicContact CZ-CB 4.19Å; F78-M162 HydrophobicContact CZ-SD 4.49Å; L82-M162 HydrophobicContact CD1-SD 4.17Å; N90-M162 HydrophobicContact CB-CG 3.8Å; N90-M162 HydrophobicContact CB-SD 3.67Å; V91-M162 HydrophobicContact CB-SD 4.02Å; W94-M162 HydrophobicContact CB-CE 4.04Å; W94-M162 HydrophobicContact CG-CE 4.29Å; I158-M162 HydrophobicContact CG2-CE 4.05Å; I158-M162 HydrophobicContact CG2-SD 4.49Å; I158-M162 WeakPolarHBondContact O-CG 3.45Å; I158-M162 PolarHBondContact O-N 3.15Å; Y159-M162 PolarHBondContact O-N 3.09Å; M162-K164 PolarHBondContact O-N 3.21Å; M162-S166 PolarHBondContact O-N 2.78Å; M162-S166 VanDerWaalsContact O-N 3.17Å; M162-Y167 VanDerWaalsContact O-CB 3.25Å; M162-Y167 WeakPolarHBondContact O-CB 3.49Å; M162-Y167 PolarHBondContact O-N 3.37Å
163	E	96.4	Very high	94.1	Very high	67 Å²	67	58.8 Å²	58.8	31%	0.313	26%	0.263	S	S	.	.	H	α-helix	trans	-63.3	-42	179.2	-175.6	170.6	-136.1	0	0	112.8	F65 Y159 L161	F65-E163 HydrophobicContact CB-CB 4.26Å; F65-E163 HydrophobicContact CB-CG 3.86Å; F65-E163 HydrophobicContact CD1-CB 3.64Å; F65-E163 HydrophobicContact CD1-CG 4.16Å; F65-E163 HydrophobicContact CE1-CB 4.27Å; F65-E163 HydrophobicContact CG-CB 4.12Å; F65-E163 HydrophobicContact CG-CG 4.28Å; Y159-E163 WeakPolarHBondContact O-CB 3.02Å; Y159-E163 PolarHBondContact O-N 3.15Å; L161-E163 VanDerWaalsContact C-N 3.32Å; L161-E163 PolarHBondContact O-N 3.43Å
164	K	94.4	Very high	94	Very high	143 Å²	143	62.9 Å²	62.9	62%	0.622	28%	0.28	S	S	*	.	H	α-helix	trans	-78.7	-30.5	-175.2	-73.3	176.4	-178.7	179.5	0	113.3	N160 L161 M162 R168	N160-K164 WeakPolarHBondContact O-CB 3.38Å; N160-K164 VanDerWaalsContact O-CG 3.25Å; N160-K164 WeakPolarHBondContact O-CG 3.42Å; N160-K164 PolarHBondContact O-N 2.89Å; L161-K164 PolarHBondContact O-N 3.21Å; M162-K164 PolarHBondContact O-N 3.21Å; K164-R168 VanDerWaalsContact O-CD 3.24Å; K164-R168 WeakPolarHBondContact O-CD 3.41Å; K164-R168 PolarHBondContact O-NE 3Å
165	D	94	Very high	93.7	Very high	76 Å²	76	66 Å²	66	41%	0.406	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	-75.5	-175.6	-174.1	70.1	0	0	0	112.3	L161 Y167 R168 R169	L161-D165 PolarHBondContact O-N 3.22Å; L161-D165 VanDerWaalsContact O-N 3.08Å; D165-Y167 VanDerWaalsContact C-N 3.32Å; D165-Y167 PolarHBondContact O-N 3.21Å; D165-R168 WeakPolarHBondContact O-CB 3.44Å; D165-R168 PolarHBondContact O-N 3.29Å; D165-R169 PolarHBondContact O-N 3.12Å; D165-R169 IonicContact OD1-NE 2.77Å; D165-R169 IonicContact OD2-CZ 2.76Å; D165-R169 IonicContact OD2-NE 3.82Å; D165-R169 PolarHBondContact OD2-NE 3.5Å; D165-R169 IonicContact OD2-NH2 3.93Å; D165-R169 PolarHBondContact OD2-NH2 2.82Å
166	S	95.5	Very high	93.5	Very high	5 Å²	5	65.7 Å²	65.7	4%	0.035	29%	0.294	C	S	.	.	H	α-helix	trans	-59.7	-38.6	-171	-46.3	0	0	0	0	113.3	F81 L82 M162 R168 R169 F170	F81-S166 VanDerWaalsContact CE1-O 3.27Å; F81-S166 WeakPolarHBondContact CE1-O 3.5Å; L82-S166 VanDerWaalsContact CD2-CB 3.46Å; M162-S166 PolarHBondContact O-N 2.78Å; M162-S166 VanDerWaalsContact O-N 3.17Å; S166-R168 PolarHBondContact O-N 3.47Å; S166-R169 PolarHBondContact O-N 3.14Å; S166-F170 VanDerWaalsContact O-CB 3.26Å; S166-F170 WeakPolarHBondContact O-CB 3.47Å; S166-F170 PolarHBondContact O-N 3.03Å
167	Y	96.9	Very high	93.2	Very high	21 Å²	21	63.5 Å²	63.5	8%	0.082	29%	0.286	C	S	.	.	H	α-helix	trans	-64.4	-39.8	177.8	172.7	-118.3	0	0	0	111.9	W61 K62 F65 V68 M162 D165 R169 F170 L171	W61-Y167 WeakPolarHBondContact O-CE2 3.28Å; W61-Y167 PolarHBondContact O-OH 3.05Å; K62-Y167 PolarHBondContact O-OH 3.26Å; F65-Y167 HydrophobicContact CB-CD1 3.9Å; F65-Y167 HydrophobicContact CB-CD2 4.2Å; F65-Y167 HydrophobicContact CB-CE1 4.04Å; F65-Y167 HydrophobicContact CB-CE2 4.31Å; F65-Y167 HydrophobicContact CB-CG 3.98Å; F65-Y167 HydrophobicContact CD2-CD1 4.43Å; F65-Y167 AromaticContact CD2-CD2 3.55Å; F65-Y167 HydrophobicContact CD2-CD2 3.55Å; F65-Y167 HydrophobicContact CD2-CE2 4.25Å; F65-Y167 AromaticContact CD2-CG 3.65Å; F65-Y167 HydrophobicContact CD2-CG 3.65Å; F65-Y167 HydrophobicContact CE2-CD2 4.4Å; F65-Y167 HydrophobicContact CE2-CG 4.5Å; F65-Y167 HydrophobicContact CG-CD1 4.45Å; F65-Y167 HydrophobicContact CG-CD2 4.29Å; F65-Y167 HydrophobicContact CG-CG 4.09Å; V68-Y167 HydrophobicContact CG2-CD2 4.26Å; V68-Y167 HydrophobicContact CG2-CE2 3.83Å; M162-Y167 VanDerWaalsContact O-CB 3.25Å; M162-Y167 WeakPolarHBondContact O-CB 3.49Å; M162-Y167 PolarHBondContact O-N 3.37Å; D165-Y167 VanDerWaalsContact C-N 3.32Å; D165-Y167 PolarHBondContact O-N 3.21Å; Y167-R169 VanDerWaalsContact C-N 3.28Å; Y167-R169 PolarHBondContact O-N 3.11Å; Y167-F170 HydrophobicContact CD2-CD1 4.15Å; Y167-F170 WeakPolarHBondContact O-CB 3.48Å; Y167-F170 PolarHBondContact O-N 3.39Å; Y167-L171 HydrophobicContact CD2-CD2 4.41Å; Y167-L171 HydrophobicContact CD2-CG 4.24Å; Y167-L171 HydrophobicContact CE1-CD1 4.03Å; Y167-L171 HydrophobicContact CE2-CD1 4Å; Y167-L171 HydrophobicContact CE2-CD2 3.72Å; Y167-L171 HydrophobicContact CE2-CG 3.83Å; Y167-L171 WeakPolarHBondContact O-CG 3.45Å; Y167-L171 PolarHBondContact O-N 3.12Å
168	R	95.3	Very high	92.9	Very high	170 Å²	170	65.4 Å²	65.4	64%	0.642	29%	0.294	S	S	*	.	H	α-helix	trans	-64.7	-35.2	176.5	-64.8	-170.3	176.3	-172.1	-3.4	112.1	K164 D165 S166	K164-R168 VanDerWaalsContact O-CD 3.24Å; K164-R168 WeakPolarHBondContact O-CD 3.41Å; K164-R168 PolarHBondContact O-NE 3Å; D165-R168 WeakPolarHBondContact O-CB 3.44Å; D165-R168 PolarHBondContact O-N 3.29Å; S166-R168 PolarHBondContact O-N 3.47Å
169	R	96	Very high	92.4	Very high	104 Å²	104	66 Å²	66	39%	0.392	30%	0.298	S	S	.	.	H	α-helix	trans	-74.7	-40.3	174.6	-66.6	-169.1	-77.6	153.5	-7	111.7	F81 E85 D165 S166 Y167 L171 K172 S173	F81-R169 HydrophobicContact CE1-CB 4.45Å; F81-R169 HydrophobicContact CZ-CB 3.69Å; E85-R169 IonicContact OE1-CZ 3.21Å; E85-R169 IonicContact OE1-NE 3.58Å; E85-R169 IonicContact OE1-NH1 3.79Å; E85-R169 PolarHBondContact OE1-NH1 3.41Å; E85-R169 IonicContact OE2-CZ 3.04Å; E85-R169 IonicContact OE2-NE 3.62Å; E85-R169 IonicContact OE2-NH1 3.47Å; E85-R169 PolarHBondContact OE2-NH1 3.32Å; E85-R169 IonicContact OE2-NH2 3.68Å; E85-R169 PolarHBondContact OE2-NH2 3.07Å; D165-R169 PolarHBondContact O-N 3.12Å; D165-R169 IonicContact OD1-NE 2.77Å; D165-R169 IonicContact OD2-CZ 2.76Å; D165-R169 IonicContact OD2-NE 3.82Å; D165-R169 PolarHBondContact OD2-NE 3.5Å; D165-R169 IonicContact OD2-NH2 3.93Å; D165-R169 PolarHBondContact OD2-NH2 2.82Å; S166-R169 PolarHBondContact O-N 3.14Å; Y167-R169 VanDerWaalsContact C-N 3.28Å; Y167-R169 PolarHBondContact O-N 3.11Å; R169-L171 PolarHBondContact O-N 3.04Å; R169-K172 CarbonylContact O-C 3.3Å; R169-K172 PolarHBondContact O-N 3.18Å; R169-S173 PolarHBondContact O-N 2.76Å
170	F	95.6	Very high	91.6	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-54.1	-49.1	175.9	171.2	-110.9	0	0	0	112.2	W61 V68 V77 F78 F81 S166 Y167 K172 S173 I176	W61-F170 HydrophobicContact CE3-CE1 4.49Å; W61-F170 HydrophobicContact CE3-CZ 4.27Å; V68-F170 HydrophobicContact CG1-CE1 4.46Å; V68-F170 HydrophobicContact CG2-CE1 4.18Å; V77-F170 HydrophobicContact CG1-CE2 3.86Å; V77-F170 HydrophobicContact CG1-CZ 4.04Å; F78-F170 HydrophobicContact CB-CE2 4.35Å; F78-F170 HydrophobicContact CB-CZ 4.43Å; F78-F170 HydrophobicContact CD2-CB 3.97Å; F78-F170 HydrophobicContact CD2-CD1 4.01Å; F78-F170 AromaticContact CD2-CD2 3.77Å; F78-F170 HydrophobicContact CD2-CD2 3.77Å; F78-F170 HydrophobicContact CD2-CE1 4.41Å; F78-F170 HydrophobicContact CD2-CE2 4.17Å; F78-F170 AromaticContact CD2-CG 3.65Å; F78-F170 HydrophobicContact CD2-CG 3.65Å; F78-F170 HydrophobicContact CD2-CZ 4.46Å; F78-F170 HydrophobicContact CE2-CB 3.88Å; F78-F170 HydrophobicContact CE2-CD2 4.5Å; F78-F170 HydrophobicContact CE2-CG 4.07Å; F81-F170 HydrophobicContact CB-CD2 3.71Å; F81-F170 HydrophobicContact CB-CE2 4.18Å; F81-F170 HydrophobicContact CD1-CB 3.79Å; F81-F170 AromaticContact CD1-CD2 3.93Å; F81-F170 HydrophobicContact CD1-CD2 3.93Å; F81-F170 HydrophobicContact CD1-CG 4.33Å; F81-F170 HydrophobicContact CD2-CD2 4.27Å; F81-F170 HydrophobicContact CE1-CB 3.79Å; F81-F170 HydrophobicContact CG-CB 4.22Å; F81-F170 AromaticContact CG-CD2 3.69Å; F81-F170 HydrophobicContact CG-CD2 3.69Å; F81-F170 HydrophobicContact CG-CG 4.46Å; F81-F170 HydrophobicContact CZ-CB 4.21Å; S166-F170 VanDerWaalsContact O-CB 3.26Å; S166-F170 WeakPolarHBondContact O-CB 3.47Å; S166-F170 PolarHBondContact O-N 3.03Å; Y167-F170 HydrophobicContact CD2-CD1 4.15Å; Y167-F170 WeakPolarHBondContact O-CB 3.48Å; Y167-F170 PolarHBondContact O-N 3.39Å; F170-K172 PolarHBondContact O-N 3.38Å; F170-K172 VanDerWaalsContact O-N 3.17Å; F170-S173 VanDerWaalsContact O-CB 3.22Å; F170-S173 WeakPolarHBondContact O-CB 3.36Å; F170-S173 PolarHBondContact O-N 3.35Å; F170-S173 PolarHBondContact O-OG 3.32Å; F170-I176 HydrophobicContact CD1-CG1 4.49Å; F170-I176 HydrophobicContact CD2-CG1 4.36Å; F170-I176 HydrophobicContact CE1-CD1 3.91Å; F170-I176 HydrophobicContact CE1-CG1 4.2Å; F170-I176 HydrophobicContact CE2-CD1 4.07Å; F170-I176 HydrophobicContact CE2-CG1 4.07Å; F170-I176 HydrophobicContact CZ-CD1 3.59Å; F170-I176 HydrophobicContact CZ-CG1 4Å; F170-I176 VanDerWaalsContact O-CG1 3.31Å; F170-I176 WeakPolarHBondContact O-CG1 3.47Å
171	L	94.4	Very high	90.6	Very high	45 Å²	45	68.2 Å²	68.2	24%	0.236	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-24.1	178.7	-65.6	-174.5	0	0	0	113.7	K62 Y167 R169	K62-L171 HydrophobicContact CB-CD2 4.45Å; K62-L171 HydrophobicContact CG-CD2 3.91Å; Y167-L171 HydrophobicContact CD2-CD2 4.41Å; Y167-L171 HydrophobicContact CD2-CG 4.24Å; Y167-L171 HydrophobicContact CE1-CD1 4.03Å; Y167-L171 HydrophobicContact CE2-CD1 4Å; Y167-L171 HydrophobicContact CE2-CD2 3.72Å; Y167-L171 HydrophobicContact CE2-CG 3.83Å; Y167-L171 WeakPolarHBondContact O-CG 3.45Å; Y167-L171 PolarHBondContact O-N 3.12Å; R169-L171 PolarHBondContact O-N 3.04Å
172	K	92.8	Very high	89.3	Confident	160 Å²	160	72.2 Å²	72.2	70%	0.696	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-5.6	177.8	-63.5	179.5	-176.9	-179.1	0	112.9	R169 F170 Q177	R169-K172 CarbonylContact O-C 3.3Å; R169-K172 PolarHBondContact O-N 3.18Å; F170-K172 PolarHBondContact O-N 3.38Å; F170-K172 VanDerWaalsContact O-N 3.17Å; K172-Q177 PolarHBondContact O-NE2 3.35Å
173	S	92.8	Very high	87.7	Confident	18 Å²	18	76.4 Å²	76.4	13%	0.126	35%	0.346	C	S	.	.	S	Bend	trans	-66.2	151.9	-174.9	72.1	0	0	0	0	111.9	R169 F170 M175 I176 Q177	R169-S173 PolarHBondContact O-N 2.76Å; F170-S173 VanDerWaalsContact O-CB 3.22Å; F170-S173 WeakPolarHBondContact O-CB 3.36Å; F170-S173 PolarHBondContact O-N 3.35Å; F170-S173 PolarHBondContact O-OG 3.32Å; S173-M175 PolarHBondContact O-N 3.17Å; S173-I176 PolarHBondContact O-N 3.07Å; S173-I176 VanDerWaalsContact O-N 3.17Å; S173-I176 PolarHBondContact OG-N 2.76Å; S173-Q177 WeakPolarHBondContact O-CG 3.5Å; S173-Q177 PolarHBondContact O-N 3.13Å; S173-Q177 VanDerWaalsContact O-N 3.16Å
174	K	88.3	Confident	85.8	Confident	160 Å²	160	76.6 Å²	76.6	70%	0.696	35%	0.354	S	S	*	.	H	α-helix	trans	-55.6	-35.8	173.5	-67.2	-175.5	178.8	-179.1	0	111.8	I176 Q177 E178	K174-I176 VanDerWaalsContact C-N 3.35Å; K174-I176 PolarHBondContact O-N 3.36Å; K174-Q177 PolarHBondContact O-N 2.89Å; K174-E178 WeakPolarHBondContact O-CB 3.29Å; K174-E178 VanDerWaalsContact O-CG 3.28Å; K174-E178 WeakPolarHBondContact O-CG 3.18Å; K174-E178 PolarHBondContact O-N 2.92Å
175	M	85.6	Confident	83.8	Confident	67 Å²	67	73.4 Å²	73.4	33%	0.33	35%	0.349	S	S	.	.	H	α-helix	trans	-55.4	-47	177.6	-175.6	178.2	-73	0	0	112.2	V77 S173 I179	V77-M175 HydrophobicContact CG1-CG 4.08Å; V77-M175 HydrophobicContact CG1-SD 3.4Å; V77-M175 WeakPolarHBondContact CG1-SD 3.14Å; S173-M175 PolarHBondContact O-N 3.17Å; M175-I179 WeakPolarHBondContact O-CD1 3.44Å; M175-I179 WeakPolarHBondContact O-CG1 3.32Å; M175-I179 PolarHBondContact O-N 3.35Å
176	I	89.1	Confident	82	Confident	3 Å²	3	72.4 Å²	72.4	2%	0.015	35%	0.351	C	S	.	.	H	α-helix	trans	-71	-40.5	177.4	-70.8	-65	0	0	0	111.6	V58 W61 F170 S173 K174 E178 I179 C180	V58-I176 HydrophobicContact CG1-CD1 4.14Å; V58-I176 HydrophobicContact CG1-CG2 3.85Å; V58-I176 HydrophobicContact CG2-CD1 4.28Å; W61-I176 HydrophobicContact CE3-CD1 4.03Å; W61-I176 HydrophobicContact CZ3-CD1 4.25Å; F170-I176 HydrophobicContact CD1-CG1 4.49Å; F170-I176 HydrophobicContact CD2-CG1 4.36Å; F170-I176 HydrophobicContact CE1-CD1 3.91Å; F170-I176 HydrophobicContact CE1-CG1 4.2Å; F170-I176 HydrophobicContact CE2-CD1 4.07Å; F170-I176 HydrophobicContact CE2-CG1 4.07Å; F170-I176 HydrophobicContact CZ-CD1 3.59Å; F170-I176 HydrophobicContact CZ-CG1 4Å; F170-I176 VanDerWaalsContact O-CG1 3.31Å; F170-I176 WeakPolarHBondContact O-CG1 3.47Å; S173-I176 PolarHBondContact O-N 3.07Å; S173-I176 VanDerWaalsContact O-N 3.17Å; S173-I176 PolarHBondContact OG-N 2.76Å; K174-I176 VanDerWaalsContact C-N 3.35Å; K174-I176 PolarHBondContact O-N 3.36Å; I176-E178 PolarHBondContact O-N 2.96Å; I176-I179 PolarHBondContact O-N 2.85Å; I176-C180 PolarHBondContact O-N 2.75Å
177	Q	86.6	Confident	80.1	Confident	95 Å²	95	74.8 Å²	74.8	44%	0.444	37%	0.372	S	S	.	.	H	α-helix	trans	-62	-42.9	178.5	-65.5	177	18.8	0	0	112.2	K172 S173 K174 I179 C180 Q181	K172-Q177 PolarHBondContact O-NE2 3.35Å; S173-Q177 WeakPolarHBondContact O-CG 3.5Å; S173-Q177 PolarHBondContact O-N 3.13Å; S173-Q177 VanDerWaalsContact O-N 3.16Å; K174-Q177 PolarHBondContact O-N 2.89Å; Q177-I179 VanDerWaalsContact C-N 3.35Å; Q177-I179 PolarHBondContact O-N 2.83Å; Q177-C180 PolarHBondContact O-N 2.95Å; Q177-Q181 WeakPolarHBondContact O-CB 3.45Å; Q177-Q181 VanDerWaalsContact O-CG 3.26Å; Q177-Q181 WeakPolarHBondContact O-CG 3.24Å; Q177-Q181 PolarHBondContact O-N 2.61Å
178	E	85.4	Confident	77.8	Confident	93 Å²	93	80.4 Å²	80.4	44%	0.435	40%	0.399	S	S	.	.	H	α-helix	trans	-64.8	-36.1	179.5	-75	172.5	-158.5	0	0	112.6	K174 I176 Q181 K182	K174-E178 WeakPolarHBondContact O-CB 3.29Å; K174-E178 VanDerWaalsContact O-CG 3.28Å; K174-E178 WeakPolarHBondContact O-CG 3.18Å; K174-E178 PolarHBondContact O-N 2.92Å; I176-E178 PolarHBondContact O-N 2.96Å; E178-Q181 PolarHBondContact O-N 2.79Å; E178-K182 WeakPolarHBondContact O-CB 3.41Å; E178-K182 VanDerWaalsContact O-CG 3.27Å; E178-K182 WeakPolarHBondContact O-CG 3.39Å; E178-K182 PolarHBondContact O-N 3.26Å
179	I	82.1	Confident	75.8	Confident	14 Å²	14	79.3 Å²	79.3	7%	0.072	40%	0.401	C	S	.	.	H	α-helix	trans	-65.9	-45.3	176.5	-65.3	159.9	0	0	0	110.2	P53 V58 M175 I176 Q177 Q181	P53-I179 HydrophobicContact CB-CD1 4Å; P53-I179 HydrophobicContact CB-CG2 4.35Å; P53-I179 HydrophobicContact CG-CD1 3.92Å; P53-I179 VanDerWaalsContact O-CG2 3.26Å; P53-I179 WeakPolarHBondContact O-CG2 3.42Å; V58-I179 HydrophobicContact CG2-CB 4.2Å; V58-I179 HydrophobicContact CG2-CD1 4.34Å; V58-I179 HydrophobicContact CG2-CG2 3.59Å; M175-I179 WeakPolarHBondContact O-CD1 3.44Å; M175-I179 WeakPolarHBondContact O-CG1 3.32Å; M175-I179 PolarHBondContact O-N 3.35Å; I176-I179 PolarHBondContact O-N 2.85Å; Q177-I179 VanDerWaalsContact C-N 3.35Å; Q177-I179 PolarHBondContact O-N 2.83Å; I179-Q181 VanDerWaalsContact C-N 3.35Å; I179-Q181 PolarHBondContact O-N 3.2Å
180	C	79.3	Confident	73.7	Confident	29 Å²	29	82.3 Å²	82.3	20%	0.196	42%	0.416	C	S	.	.	H	α-helix	trans	-65.4	-35.2	176.7	-65.6	0	0	0	0	113	K62 I176 Q177 S184	K62-C180 PolarHBondContact NZ-SG 3.03Å; I176-C180 PolarHBondContact O-N 2.75Å; Q177-C180 PolarHBondContact O-N 2.95Å; C180-S184 PolarHBondContact O-OG 2.87Å
181	Q	73.7	Confident	71.4	Confident	117 Å²	117	90.1 Å²	90.1	55%	0.547	45%	0.45	S	S	.	.	H	α-helix	trans	-74.8	-37	-179.1	-74.8	173.7	7.2	0	0	113.1	Q177 E178 I179 E183 S184 C185	Q177-Q181 WeakPolarHBondContact O-CB 3.45Å; Q177-Q181 VanDerWaalsContact O-CG 3.26Å; Q177-Q181 WeakPolarHBondContact O-CG 3.24Å; Q177-Q181 PolarHBondContact O-N 2.61Å; E178-Q181 PolarHBondContact O-N 2.79Å; I179-Q181 VanDerWaalsContact C-N 3.35Å; I179-Q181 PolarHBondContact O-N 3.2Å; Q181-E183 PolarHBondContact O-N 3.25Å; Q181-S184 WeakPolarHBondContact O-CB 3.5Å; Q181-S184 PolarHBondContact O-N 3.41Å; Q181-C185 PolarHBondContact O-N 3.3Å; Q181-C185 VanDerWaalsContact O-N 3.15Å
182	K	66.8	Low	69	Low	130 Å²	130	89.8 Å²	89.8	57%	0.565	46%	0.458	S	S	*	.	H	α-helix	trans	-58.6	-32.5	178.6	-79.9	170.7	-176.5	168.7	0	112.8	E178 A186	E178-K182 WeakPolarHBondContact O-CB 3.41Å; E178-K182 VanDerWaalsContact O-CG 3.27Å; E178-K182 WeakPolarHBondContact O-CG 3.39Å; E178-K182 PolarHBondContact O-N 3.26Å; K182-A186 WeakPolarHBondContact O-CB 3.49Å; K182-A186 PolarHBondContact O-N 3.28Å
183	E	60.2	Low	67	Low	88 Å²	88	86.6 Å²	86.6	41%	0.411	46%	0.455	S	S	.	.	H	α-helix	trans	-75.1	-31.9	174.1	-68.6	-161.7	176.6	0	0	113.5	A55 Q181 A186 A187	A55-E183 HydrophobicContact CB-CB 4.45Å; A55-E183 HydrophobicContact CB-CG 4.01Å; A55-E183 WeakPolarHBondContact CB-OE2 3.18Å; A55-E183 PolarHBondContact N-OE1 2.84Å; Q181-E183 PolarHBondContact O-N 3.25Å; E183-A186 PolarHBondContact O-N 2.76Å; E183-A187 VanDerWaalsContact O-CB 3.23Å; E183-A187 WeakPolarHBondContact O-CB 2.97Å; E183-A187 PolarHBondContact O-N 3.22Å
184	S	57.6	Low	64.9	Low	70 Å²	70	91.1 Å²	91.1	49%	0.49	48%	0.478	S	S	.	.	H	α-helix	trans	-67.1	-41.2	177.2	-61.3	0	0	0	0	111.6	C180 Q181 Q188	C180-S184 PolarHBondContact O-OG 2.87Å; Q181-S184 WeakPolarHBondContact O-CB 3.5Å; Q181-S184 PolarHBondContact O-N 3.41Å; S184-Q188 VanDerWaalsContact O-CG 3.28Å; S184-Q188 WeakPolarHBondContact O-CG 3.45Å; S184-Q188 PolarHBondContact O-N 3.42Å; S184-Q188 VanDerWaalsContact O-N 3.14Å
185	C	53.2	Low	63	Low	77 Å²	77	92.5 Å²	92.5	52%	0.52	48%	0.479	S	S	.	.	H	α-helix	trans	-68.8	-43.8	173.7	-80.8	0	0	0	0	112.5	Q181 A187 Q188 E189	Q181-C185 PolarHBondContact O-N 3.3Å; Q181-C185 VanDerWaalsContact O-N 3.15Å; C185-A187 VanDerWaalsContact C-N 3.28Å; C185-A187 PolarHBondContact O-N 2.9Å; C185-Q188 PolarHBondContact O-N 3.39Å; C185-Q188 VanDerWaalsContact O-N 3.12Å; C185-E189 PolarHBondContact O-N 3.43Å
186	A	55.8	Low	61.4	Low	54 Å²	54	95.4 Å²	95.4	45%	0.446	50%	0.495	S	S	.	.	H	α-helix	trans	-64.1	-32.3	177.9	0	0	0	0	0	112.9	K182 E183	K182-A186 WeakPolarHBondContact O-CB 3.49Å; K182-A186 PolarHBondContact O-N 3.28Å; E183-A186 PolarHBondContact O-N 2.76Å
187	A	54.5	Low	59.6	Low	56 Å²	56	100.5 Å²	100.5	46%	0.463	52%	0.522	S	S	.	.	H	α-helix	trans	-73.6	-30.8	173.8	0	0	0	0	0	112.9	E183 C185 K191	E183-A187 VanDerWaalsContact O-CB 3.23Å; E183-A187 WeakPolarHBondContact O-CB 2.97Å; E183-A187 PolarHBondContact O-N 3.22Å; C185-A187 VanDerWaalsContact C-N 3.28Å; C185-A187 PolarHBondContact O-N 2.9Å; A187-K191 PolarHBondContact O-N 3.11Å
188	Q	50.2	Low	58	Low	139 Å²	139	99.8 Å²	99.8	65%	0.65	53%	0.528	S	S	*	.	H	α-helix	trans	-75.4	-36.3	176.9	-76.2	-177.5	-49.3	0	0	112.7	S184 C185 K190 K191 G192	S184-Q188 VanDerWaalsContact O-CG 3.28Å; S184-Q188 WeakPolarHBondContact O-CG 3.45Å; S184-Q188 PolarHBondContact O-N 3.42Å; S184-Q188 VanDerWaalsContact O-N 3.14Å; C185-Q188 PolarHBondContact O-N 3.39Å; C185-Q188 VanDerWaalsContact O-N 3.12Å; Q188-K190 VanDerWaalsContact C-N 3.33Å; Q188-K190 PolarHBondContact O-N 3.09Å; Q188-K191 PolarHBondContact O-N 3Å; Q188-G192 PolarHBondContact O-N 3.29Å
189	E	51.6	Low	56.3	Low	146 Å²	146	104.5 Å²	104.5	68%	0.682	54%	0.541	S	S	*	.	H	α-helix	trans	-62.8	-38	174.4	-74.1	177.9	164.7	0	0	112.2	C185 K191 G192 C193	C185-E189 PolarHBondContact O-N 3.43Å; E189-K191 PolarHBondContact O-N 3.29Å; E189-G192 PolarHBondContact O-N 2.96Å; E189-C193 PolarHBondContact O-N 3.29Å; E189-C193 VanDerWaalsContact O-N 3.17Å
190	K	51.8	Low	54.9	Low	167 Å²	167	111.5 Å²	111.5	73%	0.726	57%	0.574	S	S	*	*	H	α-helix	trans	-66	-35.7	175.1	-72.5	-163.6	177.2	-173.1	0	113.4	Q188 D194	Q188-K190 VanDerWaalsContact C-N 3.33Å; Q188-K190 PolarHBondContact O-N 3.09Å; K190-D194 PolarHBondContact O-N 3.01Å
191	K	48.3	Very low	53.7	Low	164 Å²	164	115.8 Å²	115.8	71%	0.713	60%	0.599	S	S	*	*	H	α-helix	trans	-74.1	-26.3	175.1	-71.7	-171.2	177.1	-176.3	0	112.9	A187 Q188 E189	A187-K191 PolarHBondContact O-N 3.11Å; Q188-K191 PolarHBondContact O-N 3Å; E189-K191 PolarHBondContact O-N 3.29Å
192	G	44.1	Very low	52.8	Low	39 Å²	39	117.8 Å²	117.8	40%	0.402	61%	0.613	S	S	.	*	H	α-helix	trans	-72.2	-39.2	175.4	0	0	0	0	0	113.6	Q188 E189	Q188-G192 PolarHBondContact O-N 3.29Å; E189-G192 PolarHBondContact O-N 2.96Å
193	C	50.8	Low	52	Low	93 Å²	93	116.2 Å²	116.2	63%	0.628	62%	0.623	S	S	*	*	H	α-helix	trans	-70.2	-36.6	175.8	-78.6	0	0	0	0	113	E189 W195 L196 D197	E189-C193 PolarHBondContact O-N 3.29Å; E189-C193 VanDerWaalsContact O-N 3.17Å; C193-W195 VanDerWaalsContact C-N 3.27Å; C193-W195 PolarHBondContact O-N 2.64Å; C193-L196 PolarHBondContact O-N 3.41Å; C193-D197 PolarHBondContact O-N 3.2Å; C193-D197 VanDerWaalsContact O-N 3.17Å
194	D	48.1	Very low	51.4	Low	113 Å²	113	115.8 Å²	115.8	60%	0.604	64%	0.643	S	S	*	*	H	α-helix	trans	-65.7	-30	-178	-146.8	34.9	0	0	0	112.7	K190 S198	K190-D194 PolarHBondContact O-N 3.01Å; D194-S198 PolarHBondContact O-N 2.86Å; D194-S198 PolarHBondContact O-OG 3.19Å
195	W	49.4	Very low	50.7	Low	189 Å²	189	116.5 Å²	116.5	72%	0.716	66%	0.661	S	S	*	*	H	α-helix	trans	-75.5	-32.3	176.5	-128.8	90.1	0	0	0	113.2	C193	C193-W195 VanDerWaalsContact C-N 3.27Å; C193-W195 PolarHBondContact O-N 2.64Å
196	L	50.8	Low	50.1	Low	128 Å²	128	121.2 Å²	121.2	67%	0.67	71%	0.706	S	S	*	*	H	α-helix	trans	-77.4	-33.2	179.2	-76.1	163.6	0	0	0	111.7	C193	C193-L196 PolarHBondContact O-N 3.41Å
197	D	52.1	Low	49.8	Very low	109 Å²	109	124.6 Å²	124.6	58%	0.583	72%	0.719	S	S	*	*	H	α-helix	trans	-71.5	-40.9	176.2	-162.6	28.5	0	0	0	111.9	C193 R199 Q200	C193-D197 PolarHBondContact O-N 3.2Å; C193-D197 VanDerWaalsContact O-N 3.17Å; D197-R199 PolarHBondContact O-N 3.01Å; D197-R199 VanDerWaalsContact O-N 3.16Å; D197-Q200 PolarHBondContact O-N 3.26Å
198	S	51.7	Low	49.6	Very low	80 Å²	80	128.2 Å²	128.2	56%	0.559	73%	0.732	S	S	*	*	H	α-helix	trans	-65.1	-20.3	177.7	-65.4	0	0	0	0	114.2	D194	D194-S198 PolarHBondContact O-N 2.86Å; D194-S198 PolarHBondContact O-OG 3.19Å
199	R	51.2	Low	49.6	Very low	192 Å²	192	127.6 Å²	127.6	73%	0.725	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-10.9	-178.8	-146.5	174.5	179.9	-146.1	-1.4	113.3	D197	D197-R199 PolarHBondContact O-N 3.01Å; D197-R199 VanDerWaalsContact O-N 3.16Å
200	Q	52.5	Low	49.5	Very low	162 Å²	162	126.5 Å²	126.5	76%	0.757	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	-11	-178.9	-149	145.9	32	0	0	113.2	D197	D197-Q200 PolarHBondContact O-N 3.26Å
201	V	54.2	Low	49.3	Very low	118 Å²	118	124 Å²	124	72%	0.715	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-11.8	-179.2	-177.5	0	0	0	0	113.6
202	L	53.5	Low	49.4	Very low	160 Å²	160	121.3 Å²	121.3	84%	0.838	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	7.4	-176.6	-67.3	176.2	0	0	0	115.6
203	A	50.5	Low	49.7	Very low	96 Å²	96	127.2 Å²	127.2	79%	0.793	77%	0.767	S	S	*	*	S	Bend	trans	-112.2	19.7	-175	0	0	0	0	0	115
204	G	46.7	Very low	49.7	Very low	79 Å²	79	129.8 Å²	129.8	81%	0.814	78%	0.778	S	S	*	*			trans	-134.5	30.3	-167.8	0	0	0	0	0	117.4
205	G	43.8	Very low	49.8	Very low	85 Å²	85	131.3 Å²	131.3	88%	0.876	79%	0.792	S	S	*	*			trans	-136.7	87.5	176.7	0	0	0	0	0	112.1
206	A	41.3	Very low	49.8	Very low	177 Å²	177	126 Å²	126	100%	1.463	80%	0.799	S	S	*	*			trans	-113.7	0	163.6	0	0	0	0	0	108.6

Retrieved 206 of 206 residues in 72.6 ms (Link to these results)

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