A0A087XYQ7_POEFO Loading...

Potassium voltage-gated channel interacting protein 3

AlphaFold DB , UniProt , Accession A0A087XYQ7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 257 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	37.4	Very low	35.7	Very low	237 Å²	237	140.5 Å²	140.5	100%	1.167	81%	0.809	S	S	*	*				0	87.4	0	-73.4	163.4	158.3	0	0	105.7
2	Q	35.1	Very low	35.3	Very low	186 Å²	186	141.4 Å²	141.4	87%	0.869	81%	0.807	S	S	*	*				82.8	125.8	93.5	-163.2	156.6	49.4	0	0	109
3	A	37.5	Very low	35.2	Very low	76 Å²	76	143.7 Å²	143.7	63%	0.628	81%	0.814	S	S	*	*			cis	-155.2	140	29.2	0	0	0	0	0	109.2
4	D	36.7	Very low	34.9	Very low	156 Å²	156	138.1 Å²	138.1	83%	0.834	80%	0.804	S	S	*	*				77.2	134.1	101.4	-78.3	-78.1	0	0	0	114.6
5	G	37	Very low	34.7	Very low	68 Å²	68	140.5 Å²	140.5	70%	0.701	81%	0.812	S	S	*	*			cis	-175.9	155.6	5.2	0	0	0	0	0	112.8
6	K	36.7	Very low	35.1	Very low	199 Å²	199	137.3 Å²	137.3	87%	0.865	81%	0.808	S	S	*	*			trans	13.7	127.1	151.6	-98.3	169	163.5	178.2	0	120
7	M	37.7	Very low	34.9	Very low	175 Å²	175	139.2 Å²	139.2	86%	0.862	81%	0.814	S	S	*	*				54.3	129.7	70.7	-74.2	-172.8	-176.9	0	0	113.1
8	V	35.4	Very low	34.6	Very low	125 Å²	125	135.3 Å²	135.3	76%	0.758	81%	0.808	S	S	*	*			cis	-174.7	151.6	31.2	128	0	0	0	0	109.9
9	D	35.5	Very low	34.5	Very low	157 Å²	157	134.7 Å²	134.7	84%	0.84	81%	0.805	S	S	*	*			trans	36.9	146.6	145.5	-154.9	22.1	0	0	0	124.5
10	G	31.8	Very low	34.6	Very low	61 Å²	61	135.5 Å²	135.5	63%	0.629	81%	0.805	S	S	*	*			trans	141.7	86.5	154.7	0	0	0	0	0	118.9
11	S	31.5	Very low	34.6	Very low	106 Å²	106	135 Å²	135	74%	0.741	81%	0.806	S	S	*	*				47.7	137.5	127.5	-67.4	0	0	0	0	125.9
12	L	31	Very low	34.4	Very low	151 Å²	151	128.1 Å²	128.1	79%	0.791	79%	0.787	S	S	*	*			trans	83.6	113.9	141.5	-95.1	96.9	0	0	0	123
13	L	34.2	Very low	34.4	Very low	171 Å²	171	125.7 Å²	125.7	90%	0.895	79%	0.787	S	S	*	*			trans	37.5	127.7	137.4	-64.1	170.4	0	0	0	121.2
14	G	31.2	Very low	34	Very low	66 Å²	66	125.5 Å²	125.5	68%	0.68	79%	0.792	S	S	*	*			trans	173.2	92.5	160.3	0	0	0	0	0	115.3
15	D	32.2	Very low	33.8	Very low	173 Å²	173	129 Å²	129	93%	0.925	79%	0.793	S	S	*	*			trans	72.5	137.8	142.3	-55.6	-33.6	0	0	0	124.2
16	A	39.9	Very low	33.5	Very low	89 Å²	89	132.3 Å²	132.3	74%	0.736	80%	0.8	S	S	*	*			trans	-81	136.3	-178.2	0	0	0	0	0	112.8
17	N	32.4	Very low	33.2	Very low	170 Å²	170	131.5 Å²	131.5	91%	0.909	80%	0.796	S	S	*	*				172	135.1	123.8	-101	-28.4	0	0	0	112.3
18	G	30.2	Very low	32.9	Very low	70 Å²	70	130.5 Å²	130.5	72%	0.722	80%	0.795	S	S	*	*			trans	81.9	138.9	160.6	0	0	0	0	0	114.4
19	V	32.8	Very low	32.5	Very low	123 Å²	123	129.1 Å²	129.1	75%	0.745	79%	0.79	S	S	*	*			cis	-161.8	125.4	9.2	166.8	0	0	0	0	103
20	D	34.9	Very low	32.2	Very low	151 Å²	151	124.6 Å²	124.6	81%	0.807	78%	0.781	S	S	*	*				172.7	137	107.6	-93.3	-49.2	0	0	0	109.1
21	P	34.5	Very low	31.9	Very low	125 Å²	125	130.3 Å²	130.3	81%	0.812	79%	0.788	S	S	*	*			trans	-114.2	142.1	154.8	33.8	-22.3	0	0	0	113
22	A	34.6	Very low	31.7	Very low	93 Å²	93	137.2 Å²	137.2	77%	0.769	80%	0.798	S	S	*	*			trans	-57.7	172.3	175.7	0	0	0	0	0	114.8	G24	A22-G24 PolarHBondContact O-N 3.32Å
23	P	34.1	Very low	31.5	Very low	135 Å²	135	138.6 Å²	138.6	88%	0.877	80%	0.801	S	S	*	*			trans	-82.8	118.6	-157.3	33	-31.8	0	0	0	112.8
24	G	30.4	Very low	31.1	Very low	71 Å²	71	139.3 Å²	139.3	73%	0.732	80%	0.797	S	S	*	*			trans	-103.5	103.7	173.7	0	0	0	0	0	112.8	A22	A22-G24 PolarHBondContact O-N 3.32Å
25	R	31.9	Very low	30.9	Very low	230 Å²	230	140.8 Å²	140.8	87%	0.868	79%	0.794	S	S	*	*			trans	37.2	89.2	139.8	-153.1	177.4	-146.9	-172	5.5	117.5	K27	R25-K27 PolarHBondContact O-N 2.83Å
26	V	31.3	Very low	30.7	Very low	137 Å²	137	144.3 Å²	144.3	83%	0.83	79%	0.794	S	S	*	*			trans	-70.1	108.7	166.1	-179.5	0	0	0	0	109.8	N28	V26-N28 PolarHBondContact O-N 2.89Å
27	K	30.1	Very low	30.1	Very low	182 Å²	182	146.5 Å²	146.5	79%	0.791	79%	0.787	S	S	*	*			trans	-74	105.7	161.4	-78.5	-178.6	176.6	177.8	0	108.1	R25 S29	R25-K27 PolarHBondContact O-N 2.83Å; K27-S29 PolarHBondContact O-N 3.23Å; K27-S29 VanDerWaalsContact O-N 3.08Å
28	N	31	Very low	30	Very low	155 Å²	155	142.3 Å²	142.3	83%	0.829	77%	0.772	S	S	*	*			trans	-70.9	99.6	172.6	-155.8	11.9	0	0	0	109.1	V26	V26-N28 PolarHBondContact O-N 2.89Å
29	S	28	Very low	30.3	Very low	96 Å²	96	148.6 Å²	148.6	67%	0.671	77%	0.774	S	S	*	*			trans	-111.8	84	163.5	55	0	0	0	0	107.1	K27 K31	K27-S29 PolarHBondContact O-N 3.23Å; K27-S29 VanDerWaalsContact O-N 3.08Å; S29-K31 PolarHBondContact O-N 3.11Å
30	G	28.2	Very low	30.1	Very low	62 Å²	62	150.7 Å²	150.7	64%	0.639	77%	0.773	S	S	*	*			trans	-66.6	76.4	175.2	0	0	0	0	0	111	W32	G30-W32 PolarHBondContact O-N 3.17Å
31	K	26.5	Very low	29.9	Very low	181 Å²	181	147.4 Å²	147.4	79%	0.787	77%	0.767	S	S	*	*			trans	-68.4	110.9	160.8	-74.5	-177.9	178.7	178.8	0	106.8	S29 Q33	S29-K31 PolarHBondContact O-N 3.11Å; K31-Q33 PolarHBondContact O-N 3.24Å
32	W	26.5	Very low	29.8	Very low	250 Å²	250	146.2 Å²	146.2	95%	0.947	75%	0.753	S	S	*	*			trans	-51.2	104.2	165.8	-83.1	71.5	0	0	0	109.2	G30	G30-W32 PolarHBondContact O-N 3.17Å
33	Q	25.8	Very low	30	Very low	181 Å²	181	146.8 Å²	146.8	85%	0.846	74%	0.741	S	S	*	*			trans	-86.7	111.6	166.4	-74.5	-153	-38.4	0	0	108	K31 P35	K31-Q33 PolarHBondContact O-N 3.24Å; Q33-P35 WeakPolarHBondContact O-CD 3.36Å
34	K	26.5	Very low	30	Very low	186 Å²	186	146.6 Å²	146.6	81%	0.809	73%	0.726	S	S	*	*			trans	-54.6	120.6	175.2	-69.4	-178.5	177.6	-177.3	0	109.2	R36	K34-R36 PolarHBondContact O-N 3.44Å
35	P	26.4	Very low	30.6	Very low	96 Å²	96	144.3 Å²	144.3	62%	0.623	70%	0.699	S	S	*	*			trans	-65.4	120.4	173.4	24.2	-29.5	0	0	0	109	Q33 F37	Q33-P35 WeakPolarHBondContact O-CD 3.36Å; P35-F37 HydrophobicContact CB-CD2 3.87Å; P35-F37 HydrophobicContact CB-CE2 3.65Å; P35-F37 HydrophobicContact CG-CD2 4.3Å; P35-F37 HydrophobicContact CG-CE2 4.2Å; P35-F37 PolarHBondContact O-N 3.12Å
36	R	27.8	Very low	31.5	Very low	247 Å²	247	135.2 Å²	135.2	93%	0.932	67%	0.67	S	S	*	*			trans	-74.8	77	173.7	-77.6	175.1	62.1	119.7	-3.9	109.2	K34	K34-R36 PolarHBondContact O-N 3.44Å
37	F	28.1	Very low	32.2	Very low	135 Å²	135	129 Å²	129	59%	0.592	63%	0.632	S	S	*	*			trans	-84.4	124.8	156.9	-65.6	-69.9	0	0	0	108	P35 R39	P35-F37 HydrophobicContact CB-CD2 3.87Å; P35-F37 HydrophobicContact CB-CE2 3.65Å; P35-F37 HydrophobicContact CG-CD2 4.3Å; P35-F37 HydrophobicContact CG-CE2 4.2Å; P35-F37 PolarHBondContact O-N 3.12Å; F37-R39 PolarHBondContact O-N 3.42Å
38	S	31	Very low	32.9	Very low	83 Å²	83	121.8 Å²	121.8	58%	0.58	60%	0.604	S	S	*	*			trans	-62	103.4	173.3	172.9	0	0	0	0	107.9	K40 A41	S38-K40 PolarHBondContact O-N 3.42Å; S38-A41 PolarHBondContact O-N 2.77Å
39	R	37	Very low	33.5	Very low	202 Å²	202	119.3 Å²	119.3	76%	0.762	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-42.4	-21.3	173.4	-70.6	172.4	173.5	152.3	-8.1	113.6	F37 A41 M43	F37-R39 PolarHBondContact O-N 3.42Å; R39-A41 VanDerWaalsContact C-N 3.31Å; R39-A41 PolarHBondContact O-N 3.12Å; R39-M43 HydrophobicContact CB-CG 4.41Å; R39-M43 WeakPolarHBondContact O-CB 3.33Å; R39-M43 WeakPolarHBondContact O-CG 3.41Å; R39-M43 PolarHBondContact O-N 2.73Å
40	K	28	Very low	34.4	Very low	166 Å²	166	116 Å²	116	72%	0.722	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	-21.9	175.9	-75.3	-178.7	174.6	177.4	0	115.5	S38	S38-K40 PolarHBondContact O-N 3.42Å
41	A	30.1	Very low	35.3	Very low	83 Å²	83	113.8 Å²	113.8	69%	0.686	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-39.3	-177.1	0	0	0	0	0	112.6	S38 R39	S38-A41 PolarHBondContact O-N 2.77Å; R39-A41 VanDerWaalsContact C-N 3.31Å; R39-A41 PolarHBondContact O-N 3.12Å
42	L	32.6	Very low	36.1	Very low	100 Å²	100	109.6 Å²	109.6	52%	0.524	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-36.7	176.5	-79.9	147.9	0	0	0	112	K44 V256	L42-K44 VanDerWaalsContact C-N 3.26Å; L42-K44 PolarHBondContact O-N 2.97Å; L42-V256 HydrophobicContact CD2-CG2 4.42Å
43	M	38.3	Very low	36.7	Very low	104 Å²	104	100.8 Å²	100.8	51%	0.512	50%	0.497	S	S	.	.	S	Bend	trans	-84.6	35.1	-173.7	-60.1	-131.6	-57.9	0	0	115.9	R39	R39-M43 HydrophobicContact CB-CG 4.41Å; R39-M43 WeakPolarHBondContact O-CB 3.33Å; R39-M43 WeakPolarHBondContact O-CG 3.41Å; R39-M43 PolarHBondContact O-N 2.73Å
44	K	35.4	Very low	37.2	Very low	131 Å²	131	93.7 Å²	93.7	57%	0.57	47%	0.468	S	S	*	.	S	Bend	trans	-133.8	62.7	164.7	-71.9	-172.8	175.7	-173.2	0	107.9	L42 K49	L42-K44 VanDerWaalsContact C-N 3.26Å; L42-K44 PolarHBondContact O-N 2.97Å; K44-K49 HydrophobicContact CB-CD 4.17Å; K44-K49 VanDerWaalsContact CB-CE 3.43Å; K44-K49 HydrophobicContact CB-CG 4.25Å; K44-K49 WeakPolarHBondContact O-CD 3.31Å; K44-K49 WeakPolarHBondContact O-CE 3.07Å; K44-K49 VanDerWaalsContact O-CG 3.29Å; K44-K49 WeakPolarHBondContact O-CG 2.81Å
45	C	43.1	Very low	37.8	Very low	23 Å²	23	86.9 Å²	86.9	16%	0.155	44%	0.441	C	S	.	.			trans	18.8	111	155	-174.7	0	0	0	0	114.4	L47 V48 K49	C45-L47 VanDerWaalsContact C-N 3.3Å; C45-L47 PolarHBondContact O-N 3.2Å; C45-V48 HydrophobicContact CB-CB 3.72Å; C45-V48 HydrophobicContact CB-CG2 4.19Å; C45-V48 PolarHBondContact O-N 3.06Å; C45-V48 WeakPolarHBondContact SG-CB 3.32Å; C45-V48 WeakPolarHBondContact SG-CG2 3.01Å; C45-V48 PolarHBondContact SG-N 3.37Å; C45-K49 WeakPolarHBondContact O-CA 3.49Å; C45-K49 WeakPolarHBondContact O-CB 3.1Å; C45-K49 PolarHBondContact O-N 2.88Å
46	C	49.2	Very low	38.1	Very low	39 Å²	39	89.1 Å²	89.1	26%	0.264	44%	0.444	S	S	.	.	H	α-helix	trans	-62.2	-38	179.9	-71.5	0	0	0	0	111.8	W50 F122	C46-W50 WeakPolarHBondContact O-CB 3.38Å; C46-W50 PolarHBondContact O-N 2.72Å; C46-F122 HydrophobicContact CB-CB 4.01Å; C46-F122 HydrophobicContact CB-CD1 3.57Å; C46-F122 HydrophobicContact CB-CD2 4.2Å; C46-F122 HydrophobicContact CB-CE1 4.12Å; C46-F122 HydrophobicContact CB-CG 3.64Å; C46-F122 WeakPolarHBondContact O-CE1 3.41Å
47	L	46.9	Very low	38.4	Very low	7 Å²	7	82.8 Å²	82.8	4%	0.037	44%	0.435	C	S	.	.	H	α-helix	trans	-70.3	-44	174.4	-78.1	162.7	0	0	0	112.6	C45 W50 I51 Y119 F152	C45-L47 VanDerWaalsContact C-N 3.3Å; C45-L47 PolarHBondContact O-N 3.2Å; L47-W50 PolarHBondContact O-N 3.35Å; L47-I51 WeakPolarHBondContact O-CB 3.3Å; L47-I51 VanDerWaalsContact O-CD1 3.24Å; L47-I51 WeakPolarHBondContact O-CD1 3.36Å; L47-I51 WeakPolarHBondContact O-CG1 3.45Å; L47-I51 PolarHBondContact O-N 2.8Å; L47-Y119 HydrophobicContact CD1-CE2 4.11Å; L47-Y119 HydrophobicContact CG-CE2 4.48Å; L47-F152 HydrophobicContact CD2-CE2 4.43Å; L47-F152 HydrophobicContact CD2-CZ 4.4Å
48	V	44.4	Very low	38.7	Very low	31 Å²	31	84 Å²	84	19%	0.188	44%	0.442	C	S	.	.	H	α-helix	trans	-76.7	-30	178.7	173	0	0	0	0	112.3	C45 I52 L160	C45-V48 HydrophobicContact CB-CB 3.72Å; C45-V48 HydrophobicContact CB-CG2 4.19Å; C45-V48 PolarHBondContact O-N 3.06Å; C45-V48 WeakPolarHBondContact SG-CB 3.32Å; C45-V48 WeakPolarHBondContact SG-CG2 3.01Å; C45-V48 PolarHBondContact SG-N 3.37Å; V48-I52 HydrophobicContact CG1-CD1 3.51Å; V48-I52 HydrophobicContact CG1-CG1 4.03Å; V48-I52 WeakPolarHBondContact O-CB 3.23Å; V48-I52 WeakPolarHBondContact O-CG1 3.35Å; V48-I52 PolarHBondContact O-N 2.59Å; V48-L160 HydrophobicContact CG2-CD1 3.4Å; V48-L160 VanDerWaalsContact CG2-CD1 3.4Å; V48-L160 HydrophobicContact CG2-CD2 3.73Å; V48-L160 HydrophobicContact CG2-CG 4.17Å
49	K	44.2	Very low	38.9	Very low	103 Å²	103	87.6 Å²	87.6	45%	0.448	46%	0.455	S	S	.	.	H	α-helix	trans	-70.2	-36.1	168.8	-97.8	-172.2	-176.6	147.3	0	111.2	K44 C45 I52 A53	K44-K49 HydrophobicContact CB-CD 4.17Å; K44-K49 VanDerWaalsContact CB-CE 3.43Å; K44-K49 HydrophobicContact CB-CG 4.25Å; K44-K49 WeakPolarHBondContact O-CD 3.31Å; K44-K49 WeakPolarHBondContact O-CE 3.07Å; K44-K49 VanDerWaalsContact O-CG 3.29Å; K44-K49 WeakPolarHBondContact O-CG 2.81Å; C45-K49 WeakPolarHBondContact O-CA 3.49Å; C45-K49 WeakPolarHBondContact O-CB 3.1Å; C45-K49 PolarHBondContact O-N 2.88Å; K49-I52 PolarHBondContact O-N 3.28Å; K49-A53 WeakPolarHBondContact O-CA 3.47Å; K49-A53 WeakPolarHBondContact O-CB 3.19Å; K49-A53 PolarHBondContact O-N 2.93Å
50	W	45.4	Very low	38.8	Very low	26 Å²	26	86.1 Å²	86.1	10%	0.098	45%	0.454	C	S	.	.	H	α-helix	trans	-64.5	-47.6	170.6	175.2	82.7	0	0	0	110.6	C46 L47 I52 A53 S54 E104 F122	C46-W50 WeakPolarHBondContact O-CB 3.38Å; C46-W50 PolarHBondContact O-N 2.72Å; L47-W50 PolarHBondContact O-N 3.35Å; W50-I52 VanDerWaalsContact C-N 3.35Å; W50-I52 PolarHBondContact O-N 3.06Å; W50-A53 PolarHBondContact O-N 3.31Å; W50-S54 VanDerWaalsContact O-CB 3.23Å; W50-S54 WeakPolarHBondContact O-CB 3.36Å; W50-S54 PolarHBondContact O-N 3.03Å; W50-S54 PolarHBondContact O-OG 2.92Å; W50-E104 HydrophobicContact CH2-CB 3.91Å; W50-E104 HydrophobicContact CH2-CG 3.89Å; W50-E104 HydrophobicContact CZ2-CB 3.45Å; W50-E104 VanDerWaalsContact CZ2-CB 3.45Å; W50-E104 HydrophobicContact CZ2-CG 3.11Å; W50-E104 VanDerWaalsContact NE1-CD 3.35Å; W50-E104 PolarHBondContact NE1-OE1 2.87Å; W50-F122 HydrophobicContact CB-CE1 3.97Å; W50-F122 HydrophobicContact CB-CZ 3.55Å; W50-F122 AromaticContact CD1-CZ 3.83Å; W50-F122 AromaticContact CG-CZ 3.8Å; W50-F122 HydrophobicContact CG-CZ 3.8Å
51	I	47.4	Very low	39	Very low	16 Å²	16	81.5 Å²	81.5	8%	0.082	45%	0.453	C	S	.	.	H	α-helix	trans	-56.1	-47.6	171.9	-70.1	155.7	0	0	0	111	L47 T55 L97 F152 L156	L47-I51 WeakPolarHBondContact O-CB 3.3Å; L47-I51 VanDerWaalsContact O-CD1 3.24Å; L47-I51 WeakPolarHBondContact O-CD1 3.36Å; L47-I51 WeakPolarHBondContact O-CG1 3.45Å; L47-I51 PolarHBondContact O-N 2.8Å; I51-T55 WeakPolarHBondContact O-CG2 3.27Å; I51-T55 PolarHBondContact O-N 2.89Å; I51-T55 VanDerWaalsContact O-N 3.14Å; I51-T55 PolarHBondContact O-OG1 3.08Å; I51-L97 HydrophobicContact CB-CD2 4.28Å; I51-L97 HydrophobicContact CD1-CD2 3.37Å; I51-L97 HydrophobicContact CG1-CD2 3.76Å; I51-L97 HydrophobicContact CG2-CD2 3.52Å; I51-L97 HydrophobicContact CG2-CG 4.31Å; I51-F152 HydrophobicContact CD1-CE1 4.42Å; I51-F152 HydrophobicContact CD1-CZ 4.43Å; I51-L156 HydrophobicContact CD1-CD1 3.78Å
52	I	43.1	Very low	39.1	Very low	93 Å²	93	85.2 Å²	85.2	48%	0.477	46%	0.461	S	S	.	.	H	α-helix	trans	-72.1	-37.5	-177.7	-70.1	170.5	0	0	0	111.6	V48 K49 W50 T55 Q56	V48-I52 HydrophobicContact CG1-CD1 3.51Å; V48-I52 HydrophobicContact CG1-CG1 4.03Å; V48-I52 WeakPolarHBondContact O-CB 3.23Å; V48-I52 WeakPolarHBondContact O-CG1 3.35Å; V48-I52 PolarHBondContact O-N 2.59Å; K49-I52 PolarHBondContact O-N 3.28Å; W50-I52 VanDerWaalsContact C-N 3.35Å; W50-I52 PolarHBondContact O-N 3.06Å; I52-T55 VanDerWaalsContact C-OG1 3.26Å; I52-T55 VanDerWaalsContact CA-OG1 3.23Å; I52-T55 WeakPolarHBondContact CA-OG1 3.46Å; I52-T55 CarbonylContact O-C 3.59Å; I52-T55 WeakPolarHBondContact O-CA 3.18Å; I52-T55 PolarHBondContact O-N 3.13Å; I52-T55 VanDerWaalsContact O-N 3.1Å; I52-T55 PolarHBondContact O-OG1 2.82Å; I52-Q56 PolarHBondContact O-N 2.88Å
53	A	40.6	Very low	39.1	Very low	65 Å²	65	85 Å²	85	54%	0.537	47%	0.468	S	S	.	.	H	α-helix	trans	-68	-39	176.2	0	0	0	0	0	111.2	K49 W50 T55 Q56	K49-A53 WeakPolarHBondContact O-CA 3.47Å; K49-A53 WeakPolarHBondContact O-CB 3.19Å; K49-A53 PolarHBondContact O-N 2.93Å; W50-A53 PolarHBondContact O-N 3.31Å; A53-T55 PolarHBondContact O-N 3.27Å; A53-Q56 PolarHBondContact O-N 2.75Å
54	S	36.5	Very low	39.3	Very low	32 Å²	32	85.8 Å²	85.8	22%	0.224	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-11.2	170.5	-58	0	0	0	0	113.4	W50 R99	W50-S54 VanDerWaalsContact O-CB 3.23Å; W50-S54 WeakPolarHBondContact O-CB 3.36Å; W50-S54 PolarHBondContact O-N 3.03Å; W50-S54 PolarHBondContact O-OG 2.92Å; S54-R99 PolarHBondContact O-NH2 2.95Å
55	T	37.5	Very low	39.4	Very low	42 Å²	42	86.2 Å²	86.2	26%	0.258	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-5.1	173.7	64.7	0	0	0	0	114.6	I51 I52 A53	I51-T55 WeakPolarHBondContact O-CG2 3.27Å; I51-T55 PolarHBondContact O-N 2.89Å; I51-T55 VanDerWaalsContact O-N 3.14Å; I51-T55 PolarHBondContact O-OG1 3.08Å; I52-T55 VanDerWaalsContact C-OG1 3.26Å; I52-T55 VanDerWaalsContact CA-OG1 3.23Å; I52-T55 WeakPolarHBondContact CA-OG1 3.46Å; I52-T55 CarbonylContact O-C 3.59Å; I52-T55 WeakPolarHBondContact O-CA 3.18Å; I52-T55 PolarHBondContact O-N 3.13Å; I52-T55 VanDerWaalsContact O-N 3.1Å; I52-T55 PolarHBondContact O-OG1 2.82Å; A53-T55 PolarHBondContact O-N 3.27Å
56	Q	33.1	Very low	39.1	Very low	144 Å²	144	90.9 Å²	90.9	67%	0.673	53%	0.526	S	S	*	.	S	Bend	trans	-69.5	127.7	170.6	-71.6	-163.6	-7.7	0	0	109.4	I52 A53 Q58	I52-Q56 PolarHBondContact O-N 2.88Å; A53-Q56 PolarHBondContact O-N 2.75Å; Q56-Q58 PolarHBondContact O-N 3.27Å
57	P	34.9	Very low	38.6	Very low	114 Å²	114	96.9 Å²	96.9	74%	0.74	56%	0.555	S	S	*	*			trans	-60	126.3	166.6	-10.9	24.7	0	0	0	107.1	D59	P57-D59 PolarHBondContact O-N 2.97Å
58	Q	34.1	Very low	38.3	Very low	161 Å²	161	103.4 Å²	103.4	75%	0.752	59%	0.589	S	S	*	*			trans	-61.4	110.2	157.8	-79.3	-145.4	-23.5	0	0	106.2	Q56 K60	Q56-Q58 PolarHBondContact O-N 3.27Å; Q58-K60 PolarHBondContact O-N 3.27Å
59	D	35.3	Very low	38	Very low	157 Å²	157	110.2 Å²	110.2	84%	0.84	62%	0.619	S	S	*	*			trans	-65.1	83.9	166.7	-170	28.4	0	0	0	107.5	P57	P57-D59 PolarHBondContact O-N 2.97Å
60	K	33.7	Very low	37.7	Very low	172 Å²	172	114.1 Å²	114.1	75%	0.748	64%	0.644	S	S	*	*			trans	-104.9	108	160.4	-80.7	-169.6	178.7	178.8	0	106	Q58	Q58-K60 PolarHBondContact O-N 3.27Å
61	G	33.8	Very low	37.3	Very low	68 Å²	68	116.7 Å²	116.7	70%	0.701	67%	0.666	S	S	*	*			trans	-58.1	145.6	176.5	0	0	0	0	0	112.7
62	D	30.4	Very low	36.6	Very low	161 Å²	161	122 Å²	122	86%	0.861	70%	0.699	S	S	*	*			trans	104.4	134.5	145	-143.8	9.4	0	0	0	119.3
63	S	32.8	Very low	36.2	Very low	96 Å²	96	123.3 Å²	123.3	67%	0.671	71%	0.711	S	S	*	*			trans	70.6	104.3	167.4	-80.9	0	0	0	0	120.5
64	S	43.2	Very low	36	Very low	120 Å²	120	131 Å²	131	84%	0.839	73%	0.726	S	S	*	*				26.7	119.9	122.5	176.1	0	0	0	0	117
65	D	37.2	Very low	35.9	Very low	141 Å²	141	137.8 Å²	137.8	75%	0.754	75%	0.754	S	S	*	*			trans	98.4	82.7	163.6	-150.7	20.6	0	0	0	115.2
66	S	37.1	Very low	35.9	Very low	121 Å²	121	144 Å²	144	85%	0.846	78%	0.78	S	S	*	*			trans	-155.9	42.6	162.7	-66.9	0	0	0	0	110.7	L68	S66-L68 PolarHBondContact O-N 2.77Å
67	D	38.2	Very low	36.6	Very low	164 Å²	164	140.3 Å²	140.3	88%	0.877	77%	0.769	S	S	*	*	S	Bend	trans	-88.5	20.6	165.4	-154.4	20.2	0	0	0	111.3
68	L	40.4	Very low	37.2	Very low	145 Å²	145	142.6 Å²	142.6	76%	0.759	77%	0.77	S	S	*	*			trans	-149	69	-170.4	-153.5	83.6	0	0	0	111.5	S66	S66-L68 PolarHBondContact O-N 2.77Å
69	E	39.1	Very low	38.5	Very low	173 Å²	173	135.8 Å²	135.8	81%	0.808	74%	0.743	S	S	*	*			trans	-169.3	55.7	145.1	-109.3	179.5	-169.3	0	0	111.8	S71	E69-S71 VanDerWaalsContact C-N 3.31Å
70	L	37.7	Very low	40.1	Very low	185 Å²	185	128.8 Å²	128.8	97%	0.969	71%	0.705	S	S	*	*	S	Bend	trans	-103.5	38	158.5	-165.5	64.5	0	0	0	110.5
71	S	36.5	Very low	41.9	Very low	81 Å²	81	124.8 Å²	124.8	57%	0.566	69%	0.692	S	S	*	*			trans	-151.3	86.8	-179.6	59.2	0	0	0	0	108.9	E69	E69-S71 VanDerWaalsContact C-N 3.31Å
72	T	34.2	Very low	43.9	Very low	128 Å²	128	127 Å²	127	79%	0.785	68%	0.684	S	S	*	*	S	Bend	trans	-175.5	114.4	137.2	27.5	0	0	0	0	111.4
73	V	33.1	Very low	46.1	Very low	120 Å²	120	119.7 Å²	119.7	73%	0.727	65%	0.645	S	S	*	*	S	Bend	trans	91.9	93.1	158.7	-163.4	0	0	0	0	118.4
74	R	37.8	Very low	48.3	Very low	227 Å²	227	118.9 Å²	118.9	86%	0.857	63%	0.63	S	S	*	*	S	Bend	trans	69.7	77.6	133.8	-58.3	177.4	-171	-159.9	2.7	120.2
75	H	33.5	Very low	50.1	Low	174 Å²	174	117.3 Å²	117.3	81%	0.806	63%	0.625	S	S	*	*				176.5	103.9	116.8	-104.1	-72.9	0	0	0	106.2
76	Q	38.5	Very low	52	Low	172 Å²	172	116.5 Å²	116.5	80%	0.804	62%	0.616	S	S	*	*			trans	-55	124.7	160.2	-171.4	174	-0.2	0	0	105.8	E78	Q76-E78 PolarHBondContact O-N 3.32Å
77	P	46.3	Very low	54	Low	67 Å²	67	111.1 Å²	111.1	44%	0.435	58%	0.579	S	S	.	*			trans	-73.5	90.3	-176.9	29.6	-32.2	0	0	0	107	G79 L80	P77-G79 PolarHBondContact O-N 3.44Å; P77-L80 HydrophobicContact CB-CB 4.02Å; P77-L80 HydrophobicContact CB-CD1 4.41Å; P77-L80 HydrophobicContact CG-CB 3.91Å; P77-L80 PolarHBondContact O-N 3.02Å; P77-L80 VanDerWaalsContact O-N 3.1Å
78	E	47.9	Very low	55.9	Low	162 Å²	162	108.1 Å²	108.1	76%	0.757	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56	-9.6	165.3	-78.6	-179.6	128.8	0	0	111.6	Q76 Q82	Q76-E78 PolarHBondContact O-N 3.32Å; E78-Q82 PolarHBondContact O-NE2 3.11Å
79	G	62.7	Low	57.6	Low	18 Å²	18	102 Å²	102	19%	0.186	53%	0.525	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-18.3	173.4	0	0	0	0	0	117	P77 Q82 L83	P77-G79 PolarHBondContact O-N 3.44Å; G79-Q82 PolarHBondContact O-N 3.44Å; G79-L83 VanDerWaalsContact O-CB 3.23Å; G79-L83 WeakPolarHBondContact O-CB 3.32Å; G79-L83 WeakPolarHBondContact O-CG 3.49Å; G79-L83 PolarHBondContact O-N 2.89Å
80	L	69	Low	59.6	Low	9 Å²	9	97.3 Å²	97.3	5%	0.047	51%	0.508	C	S	.	.	H	α-helix	trans	-72.8	-38.5	-170.2	-136.6	81.7	0	0	0	113	P77 Q84 R91 L94 Q95 F149	P77-L80 HydrophobicContact CB-CB 4.02Å; P77-L80 HydrophobicContact CB-CD1 4.41Å; P77-L80 HydrophobicContact CG-CB 3.91Å; P77-L80 PolarHBondContact O-N 3.02Å; P77-L80 VanDerWaalsContact O-N 3.1Å; L80-Q84 WeakPolarHBondContact O-CB 3.21Å; L80-Q84 PolarHBondContact O-N 3.23Å; L80-R91 HydrophobicContact CD2-CG 3.98Å; L80-L94 HydrophobicContact CD1-CB 4.26Å; L80-L94 HydrophobicContact CD2-CB 4.28Å; L80-L94 HydrophobicContact CG-CB 4.11Å; L80-L94 HydrophobicContact CG-CD1 4.42Å; L80-Q95 HydrophobicContact CD2-CG 3.73Å; L80-F149 HydrophobicContact CD1-CE1 4.43Å
81	D	69.9	Low	61.6	Low	88 Å²	88	93.5 Å²	93.5	47%	0.471	48%	0.481	S	S	.	.	H	α-helix	trans	-72.3	-34.2	176.6	-73.4	-47.6	0	0	0	111.6	Q84 A85 R91	D81-Q84 PolarHBondContact O-N 2.55Å; D81-A85 PolarHBondContact O-N 3.48Å; D81-A85 VanDerWaalsContact O-N 3.09Å; D81-R91 IonicContact OD1-CZ 3.55Å; D81-R91 IonicContact OD1-NH1 2.67Å; D81-R91 PolarHBondContact OD1-NH1 3.16Å; D81-R91 IonicContact OD2-CZ 3.62Å; D81-R91 IonicContact OD2-NH1 3.55Å; D81-R91 PolarHBondContact OD2-NH1 2.84Å; D81-R91 IonicContact OD2-NH2 2.84Å
82	Q	75.5	Confident	63.5	Low	116 Å²	116	97.6 Å²	97.6	54%	0.542	49%	0.489	S	S	.	.	H	α-helix	trans	-68.2	-44	171.8	-64.7	-176	14.5	0	0	111.6	E78 G79 Q84 A85 Q86	E78-Q82 PolarHBondContact O-NE2 3.11Å; G79-Q82 PolarHBondContact O-N 3.44Å; Q82-Q84 VanDerWaalsContact C-N 3.29Å; Q82-Q84 PolarHBondContact O-N 3.49Å; Q82-A85 WeakPolarHBondContact O-CB 3.35Å; Q82-A85 PolarHBondContact O-N 2.82Å; Q82-A85 VanDerWaalsContact O-N 3.07Å; Q82-Q86 WeakPolarHBondContact O-CB 3.41Å; Q82-Q86 VanDerWaalsContact O-CG 3.32Å; Q82-Q86 WeakPolarHBondContact O-CG 3.44Å; Q82-Q86 PolarHBondContact O-N 2.93Å
83	L	76.5	Confident	65.5	Low	6 Å²	6	94.3 Å²	94.3	3%	0.031	46%	0.464	C	S	.	.	H	α-helix	trans	-63.5	-36.3	174.5	-73.6	171.7	0	0	0	111.3	G79 A85 Q86 T87 L94 F149 E150 I154	G79-L83 VanDerWaalsContact O-CB 3.23Å; G79-L83 WeakPolarHBondContact O-CB 3.32Å; G79-L83 WeakPolarHBondContact O-CG 3.49Å; G79-L83 PolarHBondContact O-N 2.89Å; L83-A85 VanDerWaalsContact C-N 3.28Å; L83-A85 PolarHBondContact O-N 3.11Å; L83-Q86 PolarHBondContact O-N 3.2Å; L83-T87 WeakPolarHBondContact O-CA 3.5Å; L83-T87 WeakPolarHBondContact O-CB 3.19Å; L83-T87 VanDerWaalsContact O-CG2 3.23Å; L83-T87 WeakPolarHBondContact O-CG2 3.46Å; L83-T87 PolarHBondContact O-N 3.3Å; L83-T87 PolarHBondContact O-OG1 3.35Å; L83-L94 HydrophobicContact CB-CD1 4.13Å; L83-F149 HydrophobicContact CD1-CD1 3.92Å; L83-F149 HydrophobicContact CD1-CE1 3.83Å; L83-E150 HydrophobicContact CD1-CG 4.08Å; L83-E150 HydrophobicContact CD2-CB 4Å; L83-E150 HydrophobicContact CD2-CG 4.04Å; L83-E150 HydrophobicContact CG-CG 4.35Å; L83-I154 HydrophobicContact CD2-CD1 4.48Å; L83-I154 HydrophobicContact CD2-CG1 4.34Å
84	Q	80.4	Confident	67.6	Low	79 Å²	79	88.6 Å²	88.6	37%	0.369	43%	0.43	S	S	.	.	H	α-helix	trans	-64.9	-32.9	173.1	-172.3	178.3	-37.5	0	0	112.3	L80 D81 Q82 R91 L94	L80-Q84 WeakPolarHBondContact O-CB 3.21Å; L80-Q84 PolarHBondContact O-N 3.23Å; D81-Q84 PolarHBondContact O-N 2.55Å; Q82-Q84 VanDerWaalsContact C-N 3.29Å; Q82-Q84 PolarHBondContact O-N 3.49Å; Q84-R91 VanDerWaalsContact OE1-CB 3.29Å; Q84-L94 HydrophobicContact CB-CD1 3.86Å
85	A	79.9	Confident	69.4	Low	87 Å²	87	82.8 Å²	82.8	72%	0.719	41%	0.412	S	S	*	.	H	α-helix	trans	-76.6	-32.9	175.4	0	0	0	0	0	112.9	D81 Q82 L83	D81-A85 PolarHBondContact O-N 3.48Å; D81-A85 VanDerWaalsContact O-N 3.09Å; Q82-A85 WeakPolarHBondContact O-CB 3.35Å; Q82-A85 PolarHBondContact O-N 2.82Å; Q82-A85 VanDerWaalsContact O-N 3.07Å; L83-A85 VanDerWaalsContact C-N 3.28Å; L83-A85 PolarHBondContact O-N 3.11Å
86	Q	76.9	Confident	71.3	Confident	124 Å²	124	76.5 Å²	76.5	58%	0.579	39%	0.388	S	S	*	.	H	α-helix	trans	-88.6	-16.7	-177.9	-67.5	176.9	32.7	0	0	113.4	Q82 L83	Q82-Q86 WeakPolarHBondContact O-CB 3.41Å; Q82-Q86 VanDerWaalsContact O-CG 3.32Å; Q82-Q86 WeakPolarHBondContact O-CG 3.44Å; Q82-Q86 PolarHBondContact O-N 2.93Å; L83-Q86 PolarHBondContact O-N 3.2Å
87	T	79.8	Confident	73	Confident	9 Å²	9	68.7 Å²	68.7	6%	0.055	35%	0.352	C	S	.	.	S	Bend	trans	-123.1	158.9	-175.3	74.5	0	0	0	0	111.1	L83 F89 V153 I154 S157	L83-T87 WeakPolarHBondContact O-CA 3.5Å; L83-T87 WeakPolarHBondContact O-CB 3.19Å; L83-T87 VanDerWaalsContact O-CG2 3.23Å; L83-T87 WeakPolarHBondContact O-CG2 3.46Å; L83-T87 PolarHBondContact O-N 3.3Å; L83-T87 PolarHBondContact O-OG1 3.35Å; T87-F89 PolarHBondContact O-N 3.3Å; T87-V153 HydrophobicContact CG2-CG1 3.9Å; T87-I154 HydrophobicContact CG2-CG1 4.07Å; T87-S157 WeakPolarHBondContact CA-OG 3.45Å
88	K	77.6	Confident	74.3	Confident	101 Å²	101	70.4 Å²	70.4	44%	0.439	35%	0.35	S	S	.	.	S	Bend	trans	-88	28	178.4	-59.3	174.5	-168.5	172.1	0	111.3	S157 R161 E166	K88-S157 PolarHBondContact N-OG 3.31Å; K88-R161 HydrophobicContact CB-CB 3.83Å; K88-R161 HydrophobicContact CB-CG 4.5Å; K88-R161 HydrophobicContact CD-CB 3.89Å; K88-R161 WeakPolarHBondContact CD-O 3.47Å; K88-R161 HydrophobicContact CG-CB 4.47Å; K88-R161 PolarHBondContact NZ-O 3Å; K88-R161 WeakPolarHBondContact O-CD 3.16Å; K88-R161 PolarHBondContact O-NH1 2.98Å; K88-E166 IonicContact NZ-OE1 3.73Å; K88-E166 IonicContact NZ-OE2 3.68Å; K88-E166 PolarHBondContact NZ-OE2 3.05Å
89	F	77.2	Confident	75.4	Confident	15 Å²	15	68.7 Å²	68.7	7%	0.066	34%	0.337	C	S	.	.			trans	-103.9	147.3	179.3	-68.9	-71.9	0	0	0	112.4	T87 E93 L94 L97 V153 L156 L160	T87-F89 PolarHBondContact O-N 3.3Å; F89-E93 HydrophobicContact CB-CB 4.34Å; F89-E93 HydrophobicContact CD1-CB 4.12Å; F89-L94 HydrophobicContact CB-CD2 3.72Å; F89-L94 HydrophobicContact CB-CG 3.84Å; F89-L94 HydrophobicContact CD2-CD2 4.22Å; F89-L94 HydrophobicContact CG-CD2 4.25Å; F89-L97 HydrophobicContact CD1-CD1 4.22Å; F89-L97 HydrophobicContact CD2-CD1 4.34Å; F89-L97 HydrophobicContact CE1-CD1 4.28Å; F89-L97 HydrophobicContact CE2-CD1 4.33Å; F89-L97 HydrophobicContact CG-CD1 4.31Å; F89-L97 HydrophobicContact CZ-CD1 4.33Å; F89-V153 HydrophobicContact CD2-CG1 3.72Å; F89-V153 HydrophobicContact CE2-CG1 4.01Å; F89-L156 HydrophobicContact CE2-CB 4.17Å; F89-L156 HydrophobicContact CZ-CB 4.14Å; F89-L160 HydrophobicContact CE1-CD1 4.32Å; F89-L160 HydrophobicContact CZ-CD1 4.02Å
90	T	81.4	Confident	75.8	Confident	75 Å²	75	67.9 Å²	67.9	46%	0.46	33%	0.329	S	S	.	.			trans	-78.9	157.3	170.8	66.1	0	0	0	0	111.1	K92 E93 L94	T90-K92 PolarHBondContact O-N 2.75Å; T90-K92 VanDerWaalsContact O-N 3.15Å; T90-E93 PolarHBondContact N-OE2 3.32Å; T90-E93 WeakPolarHBondContact O-CB 3.24Å; T90-E93 PolarHBondContact O-N 3.31Å; T90-E93 VanDerWaalsContact OG1-CG 3.26Å; T90-E93 WeakPolarHBondContact OG1-CG 3.2Å; T90-E93 PolarHBondContact OG1-N 3.12Å; T90-E93 PolarHBondContact OG1-OE2 3.37Å; T90-E93 VanDerWaalsContact OG1-OE2 3.09Å; T90-L94 WeakPolarHBondContact O-CG 3.42Å; T90-L94 PolarHBondContact O-N 3.08Å
91	R	78.4	Confident	75.9	Confident	106 Å²	106	67.7 Å²	67.7	40%	0.4	33%	0.328	S	S	.	.	H	α-helix	trans	-50.7	-41.1	176	-158.6	173.6	175	122.1	-1	113.4	L80 D81 Q84 L94 Q95	L80-R91 HydrophobicContact CD2-CG 3.98Å; D81-R91 IonicContact OD1-CZ 3.55Å; D81-R91 IonicContact OD1-NH1 2.67Å; D81-R91 PolarHBondContact OD1-NH1 3.16Å; D81-R91 IonicContact OD2-CZ 3.62Å; D81-R91 IonicContact OD2-NH1 3.55Å; D81-R91 PolarHBondContact OD2-NH1 2.84Å; D81-R91 IonicContact OD2-NH2 2.84Å; Q84-R91 VanDerWaalsContact OE1-CB 3.29Å; R91-L94 PolarHBondContact O-N 3.41Å; R91-Q95 WeakPolarHBondContact O-CG 3.23Å; R91-Q95 PolarHBondContact O-N 3.42Å
92	K	77.5	Confident	76	Confident	167 Å²	167	66.9 Å²	66.9	73%	0.726	32%	0.32	S	S	*	.	H	α-helix	trans	-66.4	-40.5	179.6	-69.3	-173.5	177.7	-177	0	111.9	T90 Q95 S96	T90-K92 PolarHBondContact O-N 2.75Å; T90-K92 VanDerWaalsContact O-N 3.15Å; K92-Q95 PolarHBondContact O-N 3.11Å; K92-S96 PolarHBondContact O-N 2.92Å; K92-S96 VanDerWaalsContact O-N 3.08Å; K92-S96 PolarHBondContact O-OG 3.44Å
93	E	76.8	Confident	75.8	Confident	59 Å²	59	66.5 Å²	66.5	28%	0.276	32%	0.322	S	S	.	.	H	α-helix	trans	-66.5	-42.1	175.6	-69	170	139.4	0	0	111.2	F89 T90 Q95 S96 L97 R161	F89-E93 HydrophobicContact CB-CB 4.34Å; F89-E93 HydrophobicContact CD1-CB 4.12Å; T90-E93 PolarHBondContact N-OE2 3.32Å; T90-E93 WeakPolarHBondContact O-CB 3.24Å; T90-E93 PolarHBondContact O-N 3.31Å; T90-E93 VanDerWaalsContact OG1-CG 3.26Å; T90-E93 WeakPolarHBondContact OG1-CG 3.2Å; T90-E93 PolarHBondContact OG1-N 3.12Å; T90-E93 PolarHBondContact OG1-OE2 3.37Å; T90-E93 VanDerWaalsContact OG1-OE2 3.09Å; E93-Q95 PolarHBondContact O-N 3.29Å; E93-S96 WeakPolarHBondContact O-CB 3.37Å; E93-S96 PolarHBondContact O-N 3.11Å; E93-L97 WeakPolarHBondContact O-CB 3.49Å; E93-L97 VanDerWaalsContact O-CG 3.27Å; E93-L97 WeakPolarHBondContact O-CG 3.49Å; E93-L97 PolarHBondContact O-N 3.19Å; E93-R161 IonicContact OE1-CZ 3.12Å; E93-R161 IonicContact OE1-NH1 3.44Å; E93-R161 PolarHBondContact OE1-NH1 3.17Å; E93-R161 IonicContact OE1-NH2 3.74Å; E93-R161 PolarHBondContact OE1-NH2 3.5Å; E93-R161 IonicContact OE2-CZ 3.52Å; E93-R161 IonicContact OE2-NH1 3.44Å; E93-R161 PolarHBondContact OE2-NH1 2.78Å; E93-R161 IonicContact OE2-NH2 2.69Å
94	L	75.8	Confident	75.2	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-61.6	-41.7	175.8	-67.7	176.4	0	0	0	112.4	L80 L83 Q84 F89 T90 R91 L97 Y98 V153	L80-L94 HydrophobicContact CD1-CB 4.26Å; L80-L94 HydrophobicContact CD2-CB 4.28Å; L80-L94 HydrophobicContact CG-CB 4.11Å; L80-L94 HydrophobicContact CG-CD1 4.42Å; L83-L94 HydrophobicContact CB-CD1 4.13Å; Q84-L94 HydrophobicContact CB-CD1 3.86Å; F89-L94 HydrophobicContact CB-CD2 3.72Å; F89-L94 HydrophobicContact CB-CG 3.84Å; F89-L94 HydrophobicContact CD2-CD2 4.22Å; F89-L94 HydrophobicContact CG-CD2 4.25Å; T90-L94 WeakPolarHBondContact O-CG 3.42Å; T90-L94 PolarHBondContact O-N 3.08Å; R91-L94 PolarHBondContact O-N 3.41Å; L94-L97 HydrophobicContact CD2-CD1 4.39Å; L94-L97 PolarHBondContact O-N 2.94Å; L94-Y98 VanDerWaalsContact O-CB 3.32Å; L94-Y98 WeakPolarHBondContact O-CB 3.39Å; L94-Y98 PolarHBondContact O-N 2.83Å; L94-V153 HydrophobicContact CD2-CB 4.48Å; L94-V153 HydrophobicContact CD2-CG1 3.29Å; L94-V153 HydrophobicContact CD2-CG2 4.43Å
95	Q	75.8	Confident	74.6	Confident	104 Å²	104	66.1 Å²	66.1	49%	0.486	32%	0.32	S	S	.	.	H	α-helix	trans	-62.4	-43.4	174.4	-75.7	177.1	-24.8	0	0	112	L80 R91 K92 E93 Y98 R99	L80-Q95 HydrophobicContact CD2-CG 3.73Å; R91-Q95 WeakPolarHBondContact O-CG 3.23Å; R91-Q95 PolarHBondContact O-N 3.42Å; K92-Q95 PolarHBondContact O-N 3.11Å; E93-Q95 PolarHBondContact O-N 3.29Å; Q95-Y98 PolarHBondContact O-N 2.56Å; Q95-R99 PolarHBondContact O-N 2.81Å
96	S	73.2	Confident	74	Confident	43 Å²	43	66.8 Å²	66.8	30%	0.301	32%	0.317	S	S	.	.	H	α-helix	trans	-62.1	-45.8	175.7	-76.4	0	0	0	0	112.4	K92 E93 R99 G100	K92-S96 PolarHBondContact O-N 2.92Å; K92-S96 VanDerWaalsContact O-N 3.08Å; K92-S96 PolarHBondContact O-OG 3.44Å; E93-S96 WeakPolarHBondContact O-CB 3.37Å; E93-S96 PolarHBondContact O-N 3.11Å; S96-R99 PolarHBondContact O-N 2.87Å; S96-G100 PolarHBondContact O-N 2.99Å
97	L	75	Confident	73.7	Confident	8 Å²	8	65 Å²	65	4%	0.042	32%	0.319	C	S	.	.	H	α-helix	trans	-59.7	-46.1	175	-74.5	165.7	0	0	0	111.1	I51 F89 E93 L94 R99 G100 F101 F149 V153 L156	I51-L97 HydrophobicContact CB-CD2 4.28Å; I51-L97 HydrophobicContact CD1-CD2 3.37Å; I51-L97 HydrophobicContact CG1-CD2 3.76Å; I51-L97 HydrophobicContact CG2-CD2 3.52Å; I51-L97 HydrophobicContact CG2-CG 4.31Å; F89-L97 HydrophobicContact CD1-CD1 4.22Å; F89-L97 HydrophobicContact CD2-CD1 4.34Å; F89-L97 HydrophobicContact CE1-CD1 4.28Å; F89-L97 HydrophobicContact CE2-CD1 4.33Å; F89-L97 HydrophobicContact CG-CD1 4.31Å; F89-L97 HydrophobicContact CZ-CD1 4.33Å; E93-L97 WeakPolarHBondContact O-CB 3.49Å; E93-L97 VanDerWaalsContact O-CG 3.27Å; E93-L97 WeakPolarHBondContact O-CG 3.49Å; E93-L97 PolarHBondContact O-N 3.19Å; L94-L97 HydrophobicContact CD2-CD1 4.39Å; L94-L97 PolarHBondContact O-N 2.94Å; L97-R99 VanDerWaalsContact C-N 3.34Å; L97-R99 PolarHBondContact O-N 3.43Å; L97-G100 PolarHBondContact O-N 2.92Å; L97-F101 WeakPolarHBondContact O-CB 3.41Å; L97-F101 PolarHBondContact O-N 3.03Å; L97-F149 HydrophobicContact CB-CE2 3.98Å; L97-F149 HydrophobicContact CB-CZ 4.04Å; L97-V153 HydrophobicContact CD1-CG1 4.43Å; L97-V153 HydrophobicContact CD1-CG2 4.43Å; L97-L156 HydrophobicContact CD2-CD1 4.02Å
98	Y	73.4	Confident	73.3	Confident	103 Å²	103	65.4 Å²	65.4	40%	0.404	32%	0.324	S	S	.	.	H	α-helix	trans	-62.5	-41.7	179.5	-174.9	-108	0	0	0	112	L94 Q95 F101 K102 F149	L94-Y98 VanDerWaalsContact O-CB 3.32Å; L94-Y98 WeakPolarHBondContact O-CB 3.39Å; L94-Y98 PolarHBondContact O-N 2.83Å; Q95-Y98 PolarHBondContact O-N 2.56Å; Y98-F101 PolarHBondContact O-N 3.34Å; Y98-K102 HydrophobicContact CD1-CG 4.47Å; Y98-K102 HydrophobicContact CE1-CG 3.96Å; Y98-K102 HydrophobicContact CE2-CG 4.14Å; Y98-K102 WeakPolarHBondContact O-CB 3.4Å; Y98-K102 PolarHBondContact O-N 2.94Å; Y98-K102 WeakPolarHBondContact OH-CE 3.32Å; Y98-F149 VanDerWaalsContact CA-CZ 3.49Å; Y98-F149 HydrophobicContact CD2-CB 4.47Å; Y98-F149 AromaticContact CD2-CD1 3.65Å; Y98-F149 HydrophobicContact CD2-CD1 3.65Å; Y98-F149 AromaticContact CD2-CD2 3.99Å; Y98-F149 HydrophobicContact CD2-CD2 3.99Å; Y98-F149 AromaticContact CD2-CE1 3.76Å; Y98-F149 HydrophobicContact CD2-CE1 3.76Å; Y98-F149 HydrophobicContact CD2-CE2 4.11Å; Y98-F149 AromaticContact CD2-CG 3.75Å; Y98-F149 HydrophobicContact CD2-CG 3.75Å; Y98-F149 AromaticContact CD2-CZ 3.99Å; Y98-F149 HydrophobicContact CD2-CZ 3.99Å; Y98-F149 HydrophobicContact CE2-CD1 4.35Å; Y98-F149 HydrophobicContact CE2-CG 4.38Å; Y98-F149 HydrophobicContact CG-CE1 4.3Å; Y98-F149 HydrophobicContact CG-CZ 4.25Å
99	R	71.2	Confident	73.3	Confident	125 Å²	125	64.2 Å²	64.2	47%	0.472	32%	0.322	S	S	.	.	H	α-helix	trans	-63.6	-44.2	176.5	-166.5	179.9	76.2	-170.8	5.9	111.7	S54 Q95 S96 L97 K102 N103	S54-R99 PolarHBondContact O-NH2 2.95Å; Q95-R99 PolarHBondContact O-N 2.81Å; S96-R99 PolarHBondContact O-N 2.87Å; L97-R99 VanDerWaalsContact C-N 3.34Å; L97-R99 PolarHBondContact O-N 3.43Å; R99-K102 PolarHBondContact O-N 3.12Å; R99-N103 WeakPolarHBondContact O-CB 3.44Å; R99-N103 VanDerWaalsContact O-CG 3.26Å; R99-N103 PolarHBondContact O-N 3.38Å
100	G	71.3	Confident	73.4	Confident	2 Å²	2	63.9 Å²	63.9	2%	0.021	32%	0.321	C	S	.	.	H	α-helix	trans	-60	-47.9	175	0	0	0	0	0	111.7	S96 L97 K102 N103 E104	S96-G100 PolarHBondContact O-N 2.99Å; L97-G100 PolarHBondContact O-N 2.92Å; G100-K102 PolarHBondContact O-N 3.44Å; G100-N103 PolarHBondContact O-N 3.26Å; G100-E104 WeakPolarHBondContact O-CG 3.26Å; G100-E104 PolarHBondContact O-N 2.8Å
101	F	70.9	Confident	73.5	Confident	5 Å²	5	63.6 Å²	63.6	2%	0.022	32%	0.317	C	S	.	.	H	α-helix	trans	-60.3	-43.8	178	-171.5	-85.9	0	0	0	112.6	L97 Y98 E104 C105 G108 V110 F149 F152	L97-F101 WeakPolarHBondContact O-CB 3.41Å; L97-F101 PolarHBondContact O-N 3.03Å; Y98-F101 PolarHBondContact O-N 3.34Å; F101-E104 PolarHBondContact O-N 3.43Å; F101-C105 PolarHBondContact O-N 3.34Å; F101-G108 WeakPolarHBondContact CE1-O 3.39Å; F101-V110 HydrophobicContact CD2-CG2 4.18Å; F101-V110 HydrophobicContact CE1-CG2 4.29Å; F101-V110 HydrophobicContact CE2-CG2 3.23Å; F101-V110 HydrophobicContact CZ-CG2 3.31Å; F101-F149 HydrophobicContact CB-CD2 3.87Å; F101-F149 HydrophobicContact CB-CE2 4.2Å; F101-F149 HydrophobicContact CD1-CB 4.23Å; F101-F149 HydrophobicContact CD1-CD2 4.13Å; F101-F149 HydrophobicContact CD2-CD2 4.07Å; F101-F149 HydrophobicContact CE1-CB 4.07Å; F101-F149 AromaticContact CG-CD2 3.77Å; F101-F149 HydrophobicContact CG-CD2 3.77Å; F101-F149 HydrophobicContact CZ-CB 4.27Å; F101-F152 AromaticContact CD2-CD1 3.95Å; F101-F152 HydrophobicContact CD2-CD1 3.95Å; F101-F152 HydrophobicContact CD2-CE1 4.36Å; F101-F152 HydrophobicContact CD2-CG 4.27Å; F101-F152 HydrophobicContact CE2-CB 4.15Å; F101-F152 HydrophobicContact CE2-CD1 4.35Å; F101-F152 HydrophobicContact CE2-CG 4.21Å
102	K	71.4	Confident	73.8	Confident	70 Å²	70	61.3 Å²	61.3	30%	0.304	31%	0.311	S	S	.	.	H	α-helix	trans	-70.9	-32.3	179.2	-90.4	-71.1	-176.4	-176.2	0	114.2	Y98 R99 G100 E104 C105 P106	Y98-K102 HydrophobicContact CD1-CG 4.47Å; Y98-K102 HydrophobicContact CE1-CG 3.96Å; Y98-K102 HydrophobicContact CE2-CG 4.14Å; Y98-K102 WeakPolarHBondContact O-CB 3.4Å; Y98-K102 PolarHBondContact O-N 2.94Å; Y98-K102 WeakPolarHBondContact OH-CE 3.32Å; R99-K102 PolarHBondContact O-N 3.12Å; G100-K102 PolarHBondContact O-N 3.44Å; K102-E104 PolarHBondContact O-N 3Å; K102-C105 CarbonylContact O-C 3.45Å; K102-P106 PolarHBondContact NZ-O 3.43Å; K102-P106 WeakPolarHBondContact O-CA 3.28Å
103	N	70.4	Confident	74.2	Confident	109 Å²	109	61 Å²	61	58%	0.583	31%	0.312	S	S	*	.	H	α-helix	trans	-63.9	-33	175.6	-79.5	-6.6	0	0	0	111.8	R99 G100	R99-N103 WeakPolarHBondContact O-CB 3.44Å; R99-N103 VanDerWaalsContact O-CG 3.26Å; R99-N103 PolarHBondContact O-N 3.38Å; G100-N103 PolarHBondContact O-N 3.26Å
104	E	65.2	Low	74.4	Confident	72 Å²	72	60.3 Å²	60.3	34%	0.336	31%	0.312	S	S	.	.	H	α-helix	trans	-100.6	-27	-170.6	-66.2	-99.9	-171.2	0	0	111.2	W50 G100 F101 K102	W50-E104 HydrophobicContact CH2-CB 3.91Å; W50-E104 HydrophobicContact CH2-CG 3.89Å; W50-E104 HydrophobicContact CZ2-CB 3.45Å; W50-E104 VanDerWaalsContact CZ2-CB 3.45Å; W50-E104 HydrophobicContact CZ2-CG 3.11Å; W50-E104 VanDerWaalsContact NE1-CD 3.35Å; W50-E104 PolarHBondContact NE1-OE1 2.87Å; G100-E104 WeakPolarHBondContact O-CG 3.26Å; G100-E104 PolarHBondContact O-N 2.8Å; F101-E104 PolarHBondContact O-N 3.43Å; K102-E104 PolarHBondContact O-N 3Å
105	C	67.2	Low	74.7	Confident	4 Å²	4	60.7 Å²	60.7	3%	0.027	31%	0.314	C	S	.	.			trans	-128.3	85.2	172.8	-54.5	0	0	0	0	109.5	F101 K102 S107 G108 V110	F101-C105 PolarHBondContact O-N 3.34Å; K102-C105 CarbonylContact O-C 3.45Å; C105-S107 PolarHBondContact O-N 2.94Å; C105-G108 PolarHBondContact O-N 2.92Å; C105-V110 HydrophobicContact CB-CG2 4.39Å
106	P	68.6	Low	75	Confident	102 Å²	102	58.7 Å²	58.7	66%	0.662	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-32.4	-179.5	-24.7	33.8	0	0	0	112.9	K102 G108	K102-P106 PolarHBondContact NZ-O 3.43Å; K102-P106 WeakPolarHBondContact O-CA 3.28Å; P106-G108 PolarHBondContact O-N 3.47Å
107	S	70.3	Confident	75.2	Confident	87 Å²	87	59.8 Å²	59.8	61%	0.608	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-25.5	174	57.3	0	0	0	0	113.3	C105 L109	C105-S107 PolarHBondContact O-N 2.94Å; S107-L109 VanDerWaalsContact C-N 3.26Å; S107-L109 PolarHBondContact OG-N 3.44Å; S107-L109 PolarHBondContact OG-O 3.15Å
108	G	70.5	Confident	75.2	Confident	17 Å²	17	60.1 Å²	60.1	18%	0.175	31%	0.313	C	S	.	.	S	Bend	trans	77.3	10.3	-171.6	0	0	0	0	0	114.2	F101 C105 P106	F101-G108 WeakPolarHBondContact CE1-O 3.39Å; C105-G108 PolarHBondContact O-N 2.92Å; P106-G108 PolarHBondContact O-N 3.47Å
109	L	76.8	Confident	75.1	Confident	76 Å²	76	55.3 Å²	55.3	40%	0.398	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	138.8	174.7	-62.6	172.8	0	0	0	108.5	S107 R148	S107-L109 VanDerWaalsContact C-N 3.26Å; S107-L109 PolarHBondContact OG-N 3.44Å; S107-L109 PolarHBondContact OG-O 3.15Å; L109-R148 HydrophobicContact CD2-CG 3.81Å
110	V	80.4	Confident	75.2	Confident	7 Å²	7	51.7 Å²	51.7	4%	0.042	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	116	170.7	-161.9	0	0	0	0	108.1	F101 C105 T114 F115 F136 S146 I147	F101-V110 HydrophobicContact CD2-CG2 4.18Å; F101-V110 HydrophobicContact CE1-CG2 4.29Å; F101-V110 HydrophobicContact CE2-CG2 3.23Å; F101-V110 HydrophobicContact CZ-CG2 3.31Å; C105-V110 HydrophobicContact CB-CG2 4.39Å; V110-T114 HydrophobicContact CG1-CG2 4.15Å; V110-F115 HydrophobicContact CG1-CB 3.98Å; V110-F115 HydrophobicContact CG1-CD2 4.21Å; V110-F136 WeakPolarHBondContact O-CE2 3.28Å; V110-S146 CarbonylContact O-C 3.57Å; V110-S146 WeakPolarHBondContact O-CA 3.28Å; V110-I147 HydrophobicContact CB-CB 4.35Å; V110-I147 PolarHBondContact N-O 2.78Å; V110-I147 PolarHBondContact O-N 2.9Å
111	D	84.3	Confident	75.1	Confident	70 Å²	70	57.3 Å²	57.3	37%	0.374	31%	0.313	S	S	.	.			trans	-85.4	168.7	167.5	59.8	30.7	0	0	0	110.8	E113 T114 F115 F136	D111-E113 VanDerWaalsContact C-N 3.29Å; D111-E113 PolarHBondContact O-N 3.19Å; D111-E113 PolarHBondContact OD1-N 2.98Å; D111-T114 PolarHBondContact O-N 3.23Å; D111-T114 WeakPolarHBondContact OD1-CB 3.31Å; D111-T114 PolarHBondContact OD1-N 2.63Å; D111-T114 PolarHBondContact OD1-OG1 2.88Å; D111-F115 WeakPolarHBondContact O-CB 3.48Å; D111-F115 PolarHBondContact O-N 3.47Å; D111-F136 VanDerWaalsContact C-CE2 3.49Å
112	E	84.7	Confident	74.8	Confident	57 Å²	57	59.7 Å²	59.7	27%	0.266	32%	0.324	S	S	.	.	H	α-helix	trans	-61.6	-37.6	-175.6	-167.6	-169.5	148	0	0	112.6	F115 K116 H133 F136	E112-F115 PolarHBondContact O-N 2.9Å; E112-K116 HydrophobicContact CG-CD 4.48Å; E112-K116 WeakPolarHBondContact O-CB 3.15Å; E112-K116 WeakPolarHBondContact O-CG 3.29Å; E112-K116 PolarHBondContact O-N 2.82Å; E112-K116 WeakPolarHBondContact OE1-CE 3.35Å; E112-K116 IonicContact OE1-NZ 2.55Å; E112-K116 PolarHBondContact OE1-NZ 3.4Å; E112-H133 IonicContact OE1-CE1 3.38Å; E112-H133 IonicContact OE1-CG 3.75Å; E112-H133 IonicContact OE1-ND1 3.19Å; E112-H133 PolarHBondContact OE1-ND1 2.97Å; E112-H133 IonicContact OE2-CE1 2.63Å; E112-H133 IonicContact OE2-ND1 2.82Å; E112-F136 HydrophobicContact CB-CD1 4.02Å; E112-F136 HydrophobicContact CB-CD2 4.29Å; E112-F136 HydrophobicContact CB-CE1 3.96Å; E112-F136 HydrophobicContact CB-CE2 4.22Å; E112-F136 HydrophobicContact CB-CG 4.19Å; E112-F136 HydrophobicContact CB-CZ 4.06Å; E112-F136 HydrophobicContact CG-CB 4.37Å; E112-F136 HydrophobicContact CG-CD1 3.93Å; E112-F136 HydrophobicContact CG-CD2 4.47Å; E112-F136 HydrophobicContact CG-CE1 4.37Å; E112-F136 HydrophobicContact CG-CG 4Å
113	E	84.5	Confident	74.5	Confident	160 Å²	160	58.2 Å²	58.2	75%	0.748	32%	0.317	S	S	*	.	H	α-helix	trans	-68.3	-44.1	-179.2	-172.1	171.5	-168	0	0	111.4	D111 F115 K116 S117	D111-E113 VanDerWaalsContact C-N 3.29Å; D111-E113 PolarHBondContact O-N 3.19Å; D111-E113 PolarHBondContact OD1-N 2.98Å; E113-F115 VanDerWaalsContact C-N 3.33Å; E113-F115 PolarHBondContact O-N 3.4Å; E113-K116 PolarHBondContact O-N 2.67Å; E113-S117 WeakPolarHBondContact O-CB 3.32Å; E113-S117 PolarHBondContact O-N 3.3Å
114	T	81.3	Confident	74.2	Confident	45 Å²	45	58.2 Å²	58.2	28%	0.276	32%	0.324	S	S	.	.	H	α-helix	trans	-61.4	-43.5	173.2	-56.5	0	0	0	0	110.4	V110 D111 K116 S117 I118	V110-T114 HydrophobicContact CG1-CG2 4.15Å; D111-T114 PolarHBondContact O-N 3.23Å; D111-T114 WeakPolarHBondContact OD1-CB 3.31Å; D111-T114 PolarHBondContact OD1-N 2.63Å; D111-T114 PolarHBondContact OD1-OG1 2.88Å; T114-K116 PolarHBondContact O-N 3.02Å; T114-S117 PolarHBondContact O-N 2.67Å; T114-I118 HydrophobicContact CG2-CD1 3.95Å; T114-I118 VanDerWaalsContact O-CG1 3.3Å; T114-I118 WeakPolarHBondContact O-CG1 3.02Å; T114-I118 PolarHBondContact O-N 3.49Å
115	F	81.6	Confident	74.1	Confident	9 Å²	9	61.7 Å²	61.7	4%	0.039	34%	0.34	C	S	.	.	H	α-helix	trans	-61.2	-45.8	177.6	-166.4	-93.1	0	0	0	112	V110 D111 E112 E113 S117 I118 Y119 A132 L135 F136 F139 I147	V110-F115 HydrophobicContact CG1-CB 3.98Å; V110-F115 HydrophobicContact CG1-CD2 4.21Å; D111-F115 WeakPolarHBondContact O-CB 3.48Å; D111-F115 PolarHBondContact O-N 3.47Å; E112-F115 PolarHBondContact O-N 2.9Å; E113-F115 VanDerWaalsContact C-N 3.33Å; E113-F115 PolarHBondContact O-N 3.4Å; F115-S117 PolarHBondContact O-N 3.34Å; F115-I118 PolarHBondContact O-N 2.98Å; F115-Y119 AromaticContact CE1-CD2 4Å; F115-Y119 HydrophobicContact CE1-CD2 4Å; F115-Y119 HydrophobicContact CE1-CE2 4.39Å; F115-Y119 HydrophobicContact CZ-CD2 4.24Å; F115-Y119 HydrophobicContact CZ-CE2 4.37Å; F115-Y119 PolarHBondContact O-N 3.12Å; F115-A132 HydrophobicContact CD1-CB 4.21Å; F115-A132 WeakPolarHBondContact CD1-O 3.29Å; F115-A132 HydrophobicContact CE1-CB 4.39Å; F115-A132 WeakPolarHBondContact CE1-O 3.43Å; F115-L135 HydrophobicContact CE1-CB 3.85Å; F115-L135 HydrophobicContact CZ-CB 4.2Å; F115-F136 HydrophobicContact CB-CD2 3.75Å; F115-F136 HydrophobicContact CB-CE2 4.41Å; F115-F136 HydrophobicContact CD1-CB 3.97Å; F115-F136 HydrophobicContact CD1-CD2 4.36Å; F115-F136 HydrophobicContact CD2-CD2 4.34Å; F115-F136 HydrophobicContact CE1-CB 4.37Å; F115-F136 HydrophobicContact CG-CB 4.37Å; F115-F136 AromaticContact CG-CD2 3.91Å; F115-F136 HydrophobicContact CG-CD2 3.91Å; F115-F139 HydrophobicContact CZ-CD2 4.33Å; F115-I147 HydrophobicContact CD2-CD1 4.21Å; F115-I147 HydrophobicContact CE2-CD1 4.36Å
116	K	82.1	Confident	74.2	Confident	61 Å²	61	62.8 Å²	62.8	27%	0.265	35%	0.352	S	S	.	.	H	α-helix	trans	-61.2	-42.1	175.1	-76.4	175.6	-179.7	173.6	0	112.5	E112 E113 T114 Y119 S120 S129 A132	E112-K116 HydrophobicContact CG-CD 4.48Å; E112-K116 WeakPolarHBondContact O-CB 3.15Å; E112-K116 WeakPolarHBondContact O-CG 3.29Å; E112-K116 PolarHBondContact O-N 2.82Å; E112-K116 WeakPolarHBondContact OE1-CE 3.35Å; E112-K116 IonicContact OE1-NZ 2.55Å; E112-K116 PolarHBondContact OE1-NZ 3.4Å; E113-K116 PolarHBondContact O-N 2.67Å; T114-K116 PolarHBondContact O-N 3.02Å; K116-Y119 PolarHBondContact O-N 2.95Å; K116-S120 WeakPolarHBondContact O-CB 3.32Å; K116-S120 PolarHBondContact O-N 3.4Å; K116-S120 PolarHBondContact O-OG 2.85Å; K116-S129 WeakPolarHBondContact CE-O 3.4Å; K116-A132 HydrophobicContact CB-CB 4.49Å; K116-A132 HydrophobicContact CG-CB 3.89Å
117	S	78	Confident	74.5	Confident	67 Å²	67	61.9 Å²	61.9	47%	0.469	34%	0.341	S	S	.	.	H	α-helix	trans	-61.3	-47.7	177.7	-178.1	0	0	0	0	111.3	E113 T114 F115 Y119 S120 Q121	E113-S117 WeakPolarHBondContact O-CB 3.32Å; E113-S117 PolarHBondContact O-N 3.3Å; T114-S117 PolarHBondContact O-N 2.67Å; F115-S117 PolarHBondContact O-N 3.34Å; S117-Y119 PolarHBondContact O-N 3.01Å; S117-S120 PolarHBondContact O-N 3.4Å; S117-Q121 WeakPolarHBondContact O-CG 3.4Å; S117-Q121 PolarHBondContact O-N 3.47Å
118	I	75.2	Confident	74.9	Confident	14 Å²	14	57.8 Å²	57.8	7%	0.072	31%	0.313	C	S	.	.	H	α-helix	trans	-58.8	-48	175.6	-67.2	165.5	0	0	0	110	T114 F115 S120 Q121 F122	T114-I118 HydrophobicContact CG2-CD1 3.95Å; T114-I118 VanDerWaalsContact O-CG1 3.3Å; T114-I118 WeakPolarHBondContact O-CG1 3.02Å; T114-I118 PolarHBondContact O-N 3.49Å; F115-I118 PolarHBondContact O-N 2.98Å; I118-S120 PolarHBondContact O-N 3.24Å; I118-Q121 PolarHBondContact O-N 2.93Å; I118-F122 HydrophobicContact CG2-CE2 3.89Å; I118-F122 WeakPolarHBondContact O-CD2 3.3Å; I118-F122 WeakPolarHBondContact O-CE2 3.43Å
119	Y	71.2	Confident	75.5	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.008	32%	0.316	C	S	.	.	H	α-helix	trans	-64	-39.2	-178.6	-129.1	-96.6	0	0	0	112.9	L47 F115 K116 S117 Q121 F122 F123 A128 Y131 A132 L135 M198	L47-Y119 HydrophobicContact CD1-CE2 4.11Å; L47-Y119 HydrophobicContact CG-CE2 4.48Å; F115-Y119 AromaticContact CE1-CD2 4Å; F115-Y119 HydrophobicContact CE1-CD2 4Å; F115-Y119 HydrophobicContact CE1-CE2 4.39Å; F115-Y119 HydrophobicContact CZ-CD2 4.24Å; F115-Y119 HydrophobicContact CZ-CE2 4.37Å; F115-Y119 PolarHBondContact O-N 3.12Å; K116-Y119 PolarHBondContact O-N 2.95Å; S117-Y119 PolarHBondContact O-N 3.01Å; Y119-Q121 VanDerWaalsContact C-N 3.26Å; Y119-Q121 PolarHBondContact O-N 3Å; Y119-F122 PolarHBondContact O-N 3.2Å; Y119-F122 VanDerWaalsContact O-N 3.14Å; Y119-F123 HydrophobicContact CD1-CD2 4.13Å; Y119-F123 AromaticContact CD1-CE2 3.99Å; Y119-F123 HydrophobicContact CD1-CE2 3.99Å; Y119-F123 HydrophobicContact CE1-CD2 4.33Å; Y119-F123 AromaticContact CE1-CE2 3.73Å; Y119-F123 HydrophobicContact CE1-CE2 3.73Å; Y119-A128 HydrophobicContact CD1-CB 4.18Å; Y119-Y131 HydrophobicContact CE1-CD1 4.05Å; Y119-Y131 HydrophobicContact CE1-CE1 4.34Å; Y119-A132 HydrophobicContact CD1-CB 4.35Å; Y119-A132 HydrophobicContact CG-CB 4.05Å; Y119-L135 HydrophobicContact CE1-CD1 3.85Å; Y119-L135 HydrophobicContact CE2-CD1 3.67Å; Y119-L135 WeakPolarHBondContact OH-CD1 3.41Å; Y119-M198 HydrophobicContact CE1-SD 4.09Å
120	S	73.3	Confident	75.9	Confident	49 Å²	49	57.7 Å²	57.7	34%	0.343	31%	0.313	S	S	.	.	H	α-helix	trans	-64.8	-28.6	-179.2	-59.1	0	0	0	0	112.9	K116 S117 I118 F122 F123	K116-S120 WeakPolarHBondContact O-CB 3.32Å; K116-S120 PolarHBondContact O-N 3.4Å; K116-S120 PolarHBondContact O-OG 2.85Å; S117-S120 PolarHBondContact O-N 3.4Å; I118-S120 PolarHBondContact O-N 3.24Å; S120-F122 PolarHBondContact O-N 3Å; S120-F123 CarbonylContact O-C 3.37Å; S120-F123 PolarHBondContact O-N 2.92Å
121	Q	68.4	Low	76.1	Confident	120 Å²	120	57.4 Å²	57.4	56%	0.561	31%	0.312	S	S	*	.	H	α-helix	trans	-63.6	-27.2	175.7	-67.3	175.5	33.5	0	0	112.9	S117 I118 Y119	S117-Q121 WeakPolarHBondContact O-CG 3.4Å; S117-Q121 PolarHBondContact O-N 3.47Å; I118-Q121 PolarHBondContact O-N 2.93Å; Y119-Q121 VanDerWaalsContact C-N 3.26Å; Y119-Q121 PolarHBondContact O-N 3Å
122	F	64.6	Low	76.1	Confident	55 Å²	55	54.1 Å²	54.1	24%	0.241	29%	0.294	C	S	.	.	H	α-helix	trans	-83.7	-19.8	178.4	-60.1	-74	0	0	0	113.5	C46 W50 I118 Y119 S120 P124	C46-F122 HydrophobicContact CB-CB 4.01Å; C46-F122 HydrophobicContact CB-CD1 3.57Å; C46-F122 HydrophobicContact CB-CD2 4.2Å; C46-F122 HydrophobicContact CB-CE1 4.12Å; C46-F122 HydrophobicContact CB-CG 3.64Å; C46-F122 WeakPolarHBondContact O-CE1 3.41Å; W50-F122 HydrophobicContact CB-CE1 3.97Å; W50-F122 HydrophobicContact CB-CZ 3.55Å; W50-F122 AromaticContact CD1-CZ 3.83Å; W50-F122 AromaticContact CG-CZ 3.8Å; W50-F122 HydrophobicContact CG-CZ 3.8Å; I118-F122 HydrophobicContact CG2-CE2 3.89Å; I118-F122 WeakPolarHBondContact O-CD2 3.3Å; I118-F122 WeakPolarHBondContact O-CE2 3.43Å; Y119-F122 PolarHBondContact O-N 3.2Å; Y119-F122 VanDerWaalsContact O-N 3.14Å; S120-F122 PolarHBondContact O-N 3Å; F122-P124 WeakPolarHBondContact O-CD 3.23Å
123	F	65.5	Low	76.2	Confident	39 Å²	39	54 Å²	54	17%	0.171	29%	0.293	C	S	.	.			trans	-125.3	60	-178	-60.8	-84	0	0	0	111	Y119 S120 Q125 G126 A128 M198 V256	Y119-F123 HydrophobicContact CD1-CD2 4.13Å; Y119-F123 AromaticContact CD1-CE2 3.99Å; Y119-F123 HydrophobicContact CD1-CE2 3.99Å; Y119-F123 HydrophobicContact CE1-CD2 4.33Å; Y119-F123 AromaticContact CE1-CE2 3.73Å; Y119-F123 HydrophobicContact CE1-CE2 3.73Å; S120-F123 CarbonylContact O-C 3.37Å; S120-F123 PolarHBondContact O-N 2.92Å; F123-Q125 PolarHBondContact O-N 3.28Å; F123-G126 PolarHBondContact O-N 2.98Å; F123-G126 VanDerWaalsContact O-N 3.16Å; F123-A128 HydrophobicContact CB-CB 4.17Å; F123-A128 HydrophobicContact CD2-CB 4.19Å; F123-A128 HydrophobicContact CG-CB 4.46Å; F123-M198 HydrophobicContact CB-CG 4.36Å; F123-M198 HydrophobicContact CD1-CG 3.8Å; F123-M198 HydrophobicContact CD1-SD 4.37Å; F123-M198 HydrophobicContact CD2-CG 4.07Å; F123-M198 HydrophobicContact CD2-SD 4.07Å; F123-M198 HydrophobicContact CE1-CG 4.05Å; F123-M198 HydrophobicContact CE1-SD 4.1Å; F123-M198 HydrophobicContact CE2-CG 4.31Å; F123-M198 HydrophobicContact CE2-SD 3.78Å; F123-M198 HydrophobicContact CG-CG 3.81Å; F123-M198 HydrophobicContact CG-SD 4.36Å; F123-M198 HydrophobicContact CZ-CE 4.42Å; F123-M198 HydrophobicContact CZ-CG 4.3Å; F123-M198 HydrophobicContact CZ-SD 3.79Å; F123-V256 HydrophobicContact CZ-CG1 4.43Å
124	P	64.5	Low	76.2	Confident	110 Å²	110	47.5 Å²	47.5	71%	0.714	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-6.1	-173	27.8	-36.3	0	0	0	114.5	F122	F122-P124 WeakPolarHBondContact O-CD 3.23Å
125	Q	62.6	Low	76.3	Confident	144 Å²	144	45.3 Å²	45.3	67%	0.673	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.5	-1.4	-177.8	-58.7	-168.8	37.6	0	0	113.8	F123 Y202	F123-Q125 PolarHBondContact O-N 3.28Å; Q125-Y202 VanDerWaalsContact OE1-CE2 3.24Å; Q125-Y202 PolarHBondContact OE1-OH 3.14Å
126	G	69	Low	76.5	Confident	27 Å²	27	45 Å²	45	28%	0.278	25%	0.248	S	C	.	.	S	Bend	trans	-127.8	172.9	178.4	0	0	0	0	0	111.5	F123	F123-G126 PolarHBondContact O-N 2.98Å; F123-G126 VanDerWaalsContact O-N 3.16Å
127	D	76.8	Confident	76.6	Confident	83 Å²	83	44.7 Å²	44.7	44%	0.444	25%	0.249	S	C	.	.			trans	-99	97.7	172.2	-175.3	3.4	0	0	0	109.6	S129 D197 M198	D127-S129 VanDerWaalsContact C-N 3.32Å; D127-S129 WeakPolarHBondContact OD1-CB 3.46Å; D127-S129 PolarHBondContact OD1-N 3.38Å; D127-S129 PolarHBondContact OD1-OG 3.39Å; D127-S129 PolarHBondContact OD2-OG 2.83Å; D127-D197 PolarHBondContact N-O 3Å; D127-D197 CarbonylContact O-C 3.5Å; D127-M198 WeakPolarHBondContact O-CA 3.47Å; D127-M198 PolarHBondContact O-N 2.91Å
128	A	77.3	Confident	76.8	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.008	23%	0.228	C	C	.	.			trans	-86.2	-1.9	178	0	0	0	0	0	113.1	Y119 F123 T130 Y131 A132 M198	Y119-A128 HydrophobicContact CD1-CB 4.18Å; F123-A128 HydrophobicContact CB-CB 4.17Å; F123-A128 HydrophobicContact CD2-CB 4.19Å; F123-A128 HydrophobicContact CG-CB 4.46Å; A128-T130 PolarHBondContact O-N 3.13Å; A128-Y131 PolarHBondContact O-N 3.32Å; A128-A132 WeakPolarHBondContact O-CB 3.3Å; A128-A132 PolarHBondContact O-N 3.03Å; A128-M198 HydrophobicContact CB-CB 4.46Å; A128-M198 HydrophobicContact CB-CG 3.9Å; A128-M198 HydrophobicContact CB-SD 4.42Å
129	S	83.5	Confident	77	Confident	36 Å²	36	41 Å²	41	25%	0.252	23%	0.225	S	C	.	.	H	α-helix	trans	-63.3	-44.3	-168.5	66.3	0	0	0	0	112.9	K116 D127 H133	K116-S129 WeakPolarHBondContact CE-O 3.4Å; D127-S129 VanDerWaalsContact C-N 3.32Å; D127-S129 WeakPolarHBondContact OD1-CB 3.46Å; D127-S129 PolarHBondContact OD1-N 3.38Å; D127-S129 PolarHBondContact OD1-OG 3.39Å; D127-S129 PolarHBondContact OD2-OG 2.83Å; S129-H133 PolarHBondContact O-N 2.94Å
130	T	85.1	Confident	77.6	Confident	55 Å²	55	41.2 Å²	41.2	34%	0.337	23%	0.226	S	C	.	.	H	α-helix	trans	-67	-42.9	178.9	-53	0	0	0	0	111.4	A128 H133 F134	A128-T130 PolarHBondContact O-N 3.13Å; T130-H133 WeakPolarHBondContact O-CB 3.2Å; T130-H133 PolarHBondContact O-N 2.96Å; T130-F134 HydrophobicContact CG2-CD2 4.37Å; T130-F134 HydrophobicContact CG2-CE2 3.65Å; T130-F134 HydrophobicContact CG2-CZ 3.92Å; T130-F134 VanDerWaalsContact O-CD2 3.3Å; T130-F134 WeakPolarHBondContact O-CD2 3.46Å; T130-F134 PolarHBondContact O-N 3.35Å
131	Y	84.1	Confident	77.5	Confident	2 Å²	2	44 Å²	44	1%	0.008	24%	0.236	C	C	.	.	H	α-helix	trans	-68.7	-39.6	178.2	-172.4	-112.3	0	0	0	111.9	Y119 A128 H133 F134 L135 L174 S194 I195 M198 I257	Y119-Y131 HydrophobicContact CE1-CD1 4.05Å; Y119-Y131 HydrophobicContact CE1-CE1 4.34Å; A128-Y131 PolarHBondContact O-N 3.32Å; Y131-H133 VanDerWaalsContact C-N 3.27Å; Y131-H133 PolarHBondContact O-N 2.97Å; Y131-F134 PolarHBondContact O-N 3.49Å; Y131-L135 HydrophobicContact CD1-CD1 3.62Å; Y131-L135 HydrophobicContact CD1-CG 4.23Å; Y131-L135 HydrophobicContact CE1-CD1 3.35Å; Y131-L135 HydrophobicContact CE1-CD2 4.48Å; Y131-L135 HydrophobicContact CE1-CG 3.92Å; Y131-L135 PolarHBondContact O-N 3.38Å; Y131-L174 HydrophobicContact CE2-CD2 4.41Å; Y131-S194 WeakPolarHBondContact CD2-OG 3.37Å; Y131-I195 HydrophobicContact CD2-CG1 3.79Å; Y131-I195 HydrophobicContact CE2-CD1 4.09Å; Y131-I195 HydrophobicContact CE2-CG1 3.62Å; Y131-M198 HydrophobicContact CD1-CE 3.85Å; Y131-M198 HydrophobicContact CD1-SD 3.47Å; Y131-M198 WeakPolarHBondContact CD1-SD 3.25Å; Y131-M198 HydrophobicContact CE1-CE 4Å; Y131-M198 HydrophobicContact CE1-SD 4.06Å; Y131-M198 HydrophobicContact CG-CE 4.37Å; Y131-M198 HydrophobicContact CG-SD 4.15Å; Y131-I257 HydrophobicContact CE1-CG1 4.49Å; Y131-I257 WeakPolarHBondContact OH-CD1 3.5Å; Y131-I257 WeakPolarHBondContact OH-CG1 3.17Å
132	A	83.9	Confident	77.9	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.4	-33.9	174.4	0	0	0	0	0	112.1	F115 K116 Y119 A128 F136	F115-A132 HydrophobicContact CD1-CB 4.21Å; F115-A132 WeakPolarHBondContact CD1-O 3.29Å; F115-A132 HydrophobicContact CE1-CB 4.39Å; F115-A132 WeakPolarHBondContact CE1-O 3.43Å; K116-A132 HydrophobicContact CB-CB 4.49Å; K116-A132 HydrophobicContact CG-CB 3.89Å; Y119-A132 HydrophobicContact CD1-CB 4.35Å; Y119-A132 HydrophobicContact CG-CB 4.05Å; A128-A132 WeakPolarHBondContact O-CB 3.3Å; A128-A132 PolarHBondContact O-N 3.03Å; A132-F136 VanDerWaalsContact O-CB 3.25Å; A132-F136 WeakPolarHBondContact O-CB 3.49Å; A132-F136 PolarHBondContact O-N 2.78Å
133	H	87.4	Confident	78.5	Confident	55 Å²	55	47.6 Å²	47.6	26%	0.255	25%	0.249	S	C	.	.	H	α-helix	trans	-62.4	-48.1	171.6	176.8	70.7	0	0	0	112	E112 S129 T130 Y131 L135 F136 N137	E112-H133 IonicContact OE1-CE1 3.38Å; E112-H133 IonicContact OE1-CG 3.75Å; E112-H133 IonicContact OE1-ND1 3.19Å; E112-H133 PolarHBondContact OE1-ND1 2.97Å; E112-H133 IonicContact OE2-CE1 2.63Å; E112-H133 IonicContact OE2-ND1 2.82Å; S129-H133 PolarHBondContact O-N 2.94Å; T130-H133 WeakPolarHBondContact O-CB 3.2Å; T130-H133 PolarHBondContact O-N 2.96Å; Y131-H133 VanDerWaalsContact C-N 3.27Å; Y131-H133 PolarHBondContact O-N 2.97Å; H133-L135 PolarHBondContact O-N 3.3Å; H133-F136 WeakPolarHBondContact O-CB 3.49Å; H133-F136 PolarHBondContact O-N 2.78Å; H133-N137 PolarHBondContact NE2-ND2 3.05Å; H133-N137 PolarHBondContact O-N 3.05Å
134	F	85.6	Confident	79.2	Confident	23 Å²	23	49.5 Å²	49.5	10%	0.101	26%	0.261	C	S	.	.	H	α-helix	trans	-63.6	-41.5	178.4	-60.6	-41.9	0	0	0	112.3	T130 Y131 N137 A138 L174 I177 A190 I191	T130-F134 HydrophobicContact CG2-CD2 4.37Å; T130-F134 HydrophobicContact CG2-CE2 3.65Å; T130-F134 HydrophobicContact CG2-CZ 3.92Å; T130-F134 VanDerWaalsContact O-CD2 3.3Å; T130-F134 WeakPolarHBondContact O-CD2 3.46Å; T130-F134 PolarHBondContact O-N 3.35Å; Y131-F134 PolarHBondContact O-N 3.49Å; F134-N137 PolarHBondContact O-N 3.09Å; F134-A138 PolarHBondContact O-N 2.82Å; F134-L174 HydrophobicContact CB-CD1 4.19Å; F134-I177 HydrophobicContact CD1-CD1 4.02Å; F134-I177 HydrophobicContact CD1-CG1 4.07Å; F134-I177 HydrophobicContact CD1-CG2 4.25Å; F134-I177 HydrophobicContact CE1-CD1 3.56Å; F134-I177 HydrophobicContact CE1-CG1 4.08Å; F134-I177 HydrophobicContact CE1-CG2 4.06Å; F134-I177 HydrophobicContact CE2-CD1 4.44Å; F134-I177 HydrophobicContact CZ-CD1 3.79Å; F134-A190 HydrophobicContact CE2-CB 4.46Å; F134-A190 HydrophobicContact CZ-CB 4.13Å; F134-I191 HydrophobicContact CB-CD1 3.78Å; F134-I191 HydrophobicContact CD1-CD1 4.38Å; F134-I191 HydrophobicContact CD2-CD1 3.49Å; F134-I191 VanDerWaalsContact CD2-CD1 3.49Å; F134-I191 HydrophobicContact CE2-CD1 4.09Å; F134-I191 HydrophobicContact CG-CD1 3.64Å
135	L	83.7	Confident	80	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.4	-45.5	173	-79.5	173.3	0	0	0	111.9	F115 Y119 Y131 H133 N137 A138 F139 W170 L174 I257	F115-L135 HydrophobicContact CE1-CB 3.85Å; F115-L135 HydrophobicContact CZ-CB 4.2Å; Y119-L135 HydrophobicContact CE1-CD1 3.85Å; Y119-L135 HydrophobicContact CE2-CD1 3.67Å; Y119-L135 WeakPolarHBondContact OH-CD1 3.41Å; Y131-L135 HydrophobicContact CD1-CD1 3.62Å; Y131-L135 HydrophobicContact CD1-CG 4.23Å; Y131-L135 HydrophobicContact CE1-CD1 3.35Å; Y131-L135 HydrophobicContact CE1-CD2 4.48Å; Y131-L135 HydrophobicContact CE1-CG 3.92Å; Y131-L135 PolarHBondContact O-N 3.38Å; H133-L135 PolarHBondContact O-N 3.3Å; L135-N137 VanDerWaalsContact C-N 3.32Å; L135-N137 PolarHBondContact O-N 3.41Å; L135-A138 WeakPolarHBondContact O-CA 3.43Å; L135-A138 WeakPolarHBondContact O-CB 3.37Å; L135-A138 PolarHBondContact O-N 2.93Å; L135-F139 VanDerWaalsContact O-CD2 3.28Å; L135-F139 WeakPolarHBondContact O-CD2 3.28Å; L135-F139 PolarHBondContact O-N 3.42Å; L135-W170 HydrophobicContact CD2-CH2 3.63Å; L135-W170 HydrophobicContact CD2-CZ2 4.43Å; L135-L174 HydrophobicContact CD2-CD1 3.87Å; L135-L174 HydrophobicContact CD2-CD2 4.12Å; L135-L174 HydrophobicContact CG-CD1 4.22Å; L135-I257 HydrophobicContact CD2-CD1 4.06Å; L135-I257 HydrophobicContact CD2-CG1 4.34Å; L135-I257 HydrophobicContact CD2-CG2 4.15Å
136	F	84.8	Confident	81	Confident	3 Å²	3	40.7 Å²	40.7	1%	0.013	22%	0.224	C	C	.	.	H	α-helix	trans	-55.7	-48.8	177.4	-179.7	-91.3	0	0	0	111.1	V110 D111 E112 F115 A132 H133 A138 F139 D140 I147	V110-F136 WeakPolarHBondContact O-CE2 3.28Å; D111-F136 VanDerWaalsContact C-CE2 3.49Å; E112-F136 HydrophobicContact CB-CD1 4.02Å; E112-F136 HydrophobicContact CB-CD2 4.29Å; E112-F136 HydrophobicContact CB-CE1 3.96Å; E112-F136 HydrophobicContact CB-CE2 4.22Å; E112-F136 HydrophobicContact CB-CG 4.19Å; E112-F136 HydrophobicContact CB-CZ 4.06Å; E112-F136 HydrophobicContact CG-CB 4.37Å; E112-F136 HydrophobicContact CG-CD1 3.93Å; E112-F136 HydrophobicContact CG-CD2 4.47Å; E112-F136 HydrophobicContact CG-CE1 4.37Å; E112-F136 HydrophobicContact CG-CG 4Å; F115-F136 HydrophobicContact CB-CD2 3.75Å; F115-F136 HydrophobicContact CB-CE2 4.41Å; F115-F136 HydrophobicContact CD1-CB 3.97Å; F115-F136 HydrophobicContact CD1-CD2 4.36Å; F115-F136 HydrophobicContact CD2-CD2 4.34Å; F115-F136 HydrophobicContact CE1-CB 4.37Å; F115-F136 HydrophobicContact CG-CB 4.37Å; F115-F136 AromaticContact CG-CD2 3.91Å; F115-F136 HydrophobicContact CG-CD2 3.91Å; A132-F136 VanDerWaalsContact O-CB 3.25Å; A132-F136 WeakPolarHBondContact O-CB 3.49Å; A132-F136 PolarHBondContact O-N 2.78Å; H133-F136 WeakPolarHBondContact O-CB 3.49Å; H133-F136 PolarHBondContact O-N 2.78Å; F136-A138 VanDerWaalsContact C-N 3.26Å; F136-A138 PolarHBondContact O-N 3.34Å; F136-F139 PolarHBondContact O-N 3.34Å; F136-F139 VanDerWaalsContact O-N 3.13Å; F136-D140 HydrophobicContact CE1-CB 4.32Å; F136-D140 WeakPolarHBondContact O-CB 3.34Å; F136-D140 PolarHBondContact O-N 3.01Å; F136-I147 HydrophobicContact CD2-CD1 3.31Å; F136-I147 HydrophobicContact CD2-CG1 4.01Å; F136-I147 HydrophobicContact CE2-CD1 3.5Å; F136-I147 HydrophobicContact CE2-CG1 3.68Å; F136-I147 HydrophobicContact CG-CD1 4.07Å; F136-I147 HydrophobicContact CZ-CD1 4.37Å; F136-I147 HydrophobicContact CZ-CG1 4.17Å
137	N	84.7	Confident	81.6	Confident	53 Å²	53	39.4 Å²	39.4	28%	0.283	21%	0.21	S	C	.	.	H	α-helix	trans	-63.7	-29.5	176	-78.7	0.5	0	0	0	113.4	H133 F134 L135	H133-N137 PolarHBondContact NE2-ND2 3.05Å; H133-N137 PolarHBondContact O-N 3.05Å; F134-N137 PolarHBondContact O-N 3.09Å; L135-N137 VanDerWaalsContact C-N 3.32Å; L135-N137 PolarHBondContact O-N 3.41Å
138	A	82.4	Confident	81.9	Confident	2 Å²	2	39 Å²	39	2%	0.017	20%	0.203	C	C	.	.	H	α-helix	trans	-73.5	-30.7	175.2	0	0	0	0	0	112.6	F134 L135 F136 W170 N173 L174	F134-A138 PolarHBondContact O-N 2.82Å; L135-A138 WeakPolarHBondContact O-CA 3.43Å; L135-A138 WeakPolarHBondContact O-CB 3.37Å; L135-A138 PolarHBondContact O-N 2.93Å; F136-A138 VanDerWaalsContact C-N 3.26Å; F136-A138 PolarHBondContact O-N 3.34Å; A138-W170 HydrophobicContact CB-CZ2 4.45Å; A138-N173 PolarHBondContact O-ND2 2.9Å; A138-L174 HydrophobicContact CB-CB 4.4Å; A138-L174 HydrophobicContact CB-CD1 3.88Å
139	F	79.4	Confident	82.1	Confident	3 Å²	3	39.9 Å²	39.9	1%	0.013	21%	0.206	C	C	.	.	H	α-helix	trans	-83.9	-30.5	174.5	-82.2	-80	0	0	0	113.3	F115 L135 F136 I141 I147 L159 W170	F115-F139 HydrophobicContact CZ-CD2 4.33Å; L135-F139 VanDerWaalsContact O-CD2 3.28Å; L135-F139 WeakPolarHBondContact O-CD2 3.28Å; L135-F139 PolarHBondContact O-N 3.42Å; F136-F139 PolarHBondContact O-N 3.34Å; F136-F139 VanDerWaalsContact O-N 3.13Å; F139-I141 VanDerWaalsContact C-N 3.26Å; F139-I141 PolarHBondContact O-N 3.37Å; F139-I147 HydrophobicContact CB-CD1 3.53Å; F139-I147 HydrophobicContact CB-CG1 4.12Å; F139-L159 HydrophobicContact CE1-CD1 4.39Å; F139-L159 HydrophobicContact CZ-CD1 3.68Å; F139-W170 HydrophobicContact CD2-CZ2 4.22Å; F139-W170 HydrophobicContact CE2-CH2 4.33Å; F139-W170 AromaticContact CE2-CZ2 3.71Å; F139-W170 HydrophobicContact CE2-CZ2 3.71Å; F139-W170 AromaticContact CZ-CZ2 3.88Å; F139-W170 HydrophobicContact CZ-CZ2 3.88Å
140	D	82.3	Confident	82	Confident	6 Å²	6	42.4 Å²	42.4	3%	0.032	21%	0.214	C	C	.	.			trans	-78.4	72	176.7	-173.8	10.9	0	0	0	111.8	F136 N142 R143 N144 G145 I147	F136-D140 HydrophobicContact CE1-CB 4.32Å; F136-D140 WeakPolarHBondContact O-CB 3.34Å; F136-D140 PolarHBondContact O-N 3.01Å; D140-N142 PolarHBondContact O-N 3.31Å; D140-N142 PolarHBondContact OD1-N 2.96Å; D140-R143 PolarHBondContact O-N 2.94Å; D140-R143 VanDerWaalsContact O-N 3.11Å; D140-R143 WeakPolarHBondContact OD1-CA 2.95Å; D140-R143 PolarHBondContact OD1-N 3.47Å; D140-R143 WeakPolarHBondContact OD2-CA 3.44Å; D140-N144 PolarHBondContact OD1-N 3.29Å; D140-N144 PolarHBondContact OD1-OD1 2.95Å; D140-N144 VanDerWaalsContact OD1-OD1 3.08Å; D140-N144 PolarHBondContact OD2-N 3.42Å; D140-N144 VanDerWaalsContact OD2-N 3.11Å; D140-G145 WeakPolarHBondContact OD2-CA 3.26Å; D140-G145 PolarHBondContact OD2-N 3.22Å; D140-I147 HydrophobicContact CB-CG1 4.2Å
141	I	72.9	Confident	81.9	Confident	107 Å²	107	40.2 Å²	40.2	55%	0.549	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-34.1	178.6	-60.7	169.4	0	0	0	111.3	F139	F139-I141 VanDerWaalsContact C-N 3.26Å; F139-I141 PolarHBondContact O-N 3.37Å
142	N	75.3	Confident	81.6	Confident	84 Å²	84	40.7 Å²	40.7	45%	0.449	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-6	-175.3	-59.8	-60.6	0	0	0	113.2	D140 N144 R148 D151	D140-N142 PolarHBondContact O-N 3.31Å; D140-N142 PolarHBondContact OD1-N 2.96Å; N142-N144 PolarHBondContact O-N 3.15Å; N142-N144 VanDerWaalsContact O-N 3.11Å; N142-R148 PolarHBondContact ND2-NH1 2.94Å; N142-R148 PolarHBondContact ND2-NH2 2.88Å; N142-D151 PolarHBondContact ND2-OD1 3.34Å; N142-D151 VanDerWaalsContact ND2-OD1 3.12Å; N142-D151 PolarHBondContact ND2-OD2 3.16Å
143	R	77.3	Confident	81.4	Confident	166 Å²	166	40.7 Å²	40.7	63%	0.626	20%	0.202	S	C	*	.			trans	46	37.1	-175.6	-55.9	-163.3	-155.6	-179.4	19.3	113.6	D140 G145 K179	D140-R143 PolarHBondContact O-N 2.94Å; D140-R143 VanDerWaalsContact O-N 3.11Å; D140-R143 WeakPolarHBondContact OD1-CA 2.95Å; D140-R143 PolarHBondContact OD1-N 3.47Å; D140-R143 WeakPolarHBondContact OD2-CA 3.44Å; R143-G145 VanDerWaalsContact C-N 3.29Å; R143-K179 VanDerWaalsContact NH2-CG 3.34Å
144	N	80.4	Confident	81.2	Confident	80 Å²	80	40.4 Å²	40.4	43%	0.428	20%	0.203	S	C	.	.	S	Bend	trans	-90.9	2.4	179.5	67.1	-3.5	0	0	0	111.8	D140 N142 S146 R148	D140-N144 PolarHBondContact OD1-N 3.29Å; D140-N144 PolarHBondContact OD1-OD1 2.95Å; D140-N144 VanDerWaalsContact OD1-OD1 3.08Å; D140-N144 PolarHBondContact OD2-N 3.42Å; D140-N144 VanDerWaalsContact OD2-N 3.11Å; N142-N144 PolarHBondContact O-N 3.15Å; N142-N144 VanDerWaalsContact O-N 3.11Å; N144-S146 VanDerWaalsContact C-N 3.27Å; N144-S146 PolarHBondContact ND2-O 2.6Å; N144-S146 PolarHBondContact O-N 3.25Å; N144-S146 PolarHBondContact OD1-N 2.61Å; N144-S146 PolarHBondContact OD1-O 2.83Å; N144-R148 PolarHBondContact ND2-NH1 3.42Å
145	G	82.3	Confident	80.8	Confident	38 Å²	38	39.7 Å²	39.7	39%	0.392	20%	0.201	S	C	.	.	S	Bend	trans	74	16.7	-178.1	0	0	0	0	0	113	D140 R143	D140-G145 WeakPolarHBondContact OD2-CA 3.26Å; D140-G145 PolarHBondContact OD2-N 3.22Å; R143-G145 VanDerWaalsContact C-N 3.29Å
146	S	83.1	Confident	80.6	Confident	30 Å²	30	39.8 Å²	39.8	21%	0.21	20%	0.202	C	C	.	.			trans	-155.2	116.7	-177.8	-68.7	0	0	0	0	112.4	V110 N144 R148	V110-S146 CarbonylContact O-C 3.57Å; V110-S146 WeakPolarHBondContact O-CA 3.28Å; N144-S146 VanDerWaalsContact C-N 3.27Å; N144-S146 PolarHBondContact ND2-O 2.6Å; N144-S146 PolarHBondContact O-N 3.25Å; N144-S146 PolarHBondContact OD1-N 2.61Å; N144-S146 PolarHBondContact OD1-O 2.83Å; S146-R148 PolarHBondContact O-N 2.8Å
147	I	82	Confident	80.4	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	120.8	177.9	-60.4	165.6	0	0	0	109.1	V110 F115 F136 F139 D140 D151 F152	V110-I147 HydrophobicContact CB-CB 4.35Å; V110-I147 PolarHBondContact N-O 2.78Å; V110-I147 PolarHBondContact O-N 2.9Å; F115-I147 HydrophobicContact CD2-CD1 4.21Å; F115-I147 HydrophobicContact CE2-CD1 4.36Å; F136-I147 HydrophobicContact CD2-CD1 3.31Å; F136-I147 HydrophobicContact CD2-CG1 4.01Å; F136-I147 HydrophobicContact CE2-CD1 3.5Å; F136-I147 HydrophobicContact CE2-CG1 3.68Å; F136-I147 HydrophobicContact CG-CD1 4.07Å; F136-I147 HydrophobicContact CZ-CD1 4.37Å; F136-I147 HydrophobicContact CZ-CG1 4.17Å; F139-I147 HydrophobicContact CB-CD1 3.53Å; F139-I147 HydrophobicContact CB-CG1 4.12Å; D140-I147 HydrophobicContact CB-CG1 4.2Å; I147-D151 HydrophobicContact CG2-CB 4.18Å; I147-F152 HydrophobicContact CG2-CB 3.97Å
148	R	83.5	Confident	80.2	Confident	76 Å²	76	39 Å²	39	29%	0.287	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	161.3	170.6	-59.9	-169.9	-61	-79	-4.5	110.3	L109 N142 N144 S146 E150 D151 F152	L109-R148 HydrophobicContact CD2-CG 3.81Å; N142-R148 PolarHBondContact ND2-NH1 2.94Å; N142-R148 PolarHBondContact ND2-NH2 2.88Å; N144-R148 PolarHBondContact ND2-NH1 3.42Å; S146-R148 PolarHBondContact O-N 2.8Å; R148-E150 PolarHBondContact O-N 3.36Å; R148-D151 IonicContact CZ-OD2 3.03Å; R148-D151 PolarHBondContact N-OD2 3.49Å; R148-D151 IonicContact NE-OD2 3.91Å; R148-D151 IonicContact NH1-OD2 3.87Å; R148-D151 IonicContact NH2-OD1 3.6Å; R148-D151 IonicContact NH2-OD2 2.63Å; R148-D151 PolarHBondContact NH2-OD2 3.49Å; R148-D151 PolarHBondContact O-N 3.48Å; R148-F152 PolarHBondContact O-N 3.36Å
149	F	80.5	Confident	79.9	Confident	18 Å²	18	40 Å²	40	8%	0.079	20%	0.204	C	C	.	.	H	α-helix	trans	-54.7	-38.8	174.5	179	-110.9	0	0	0	112.6	L80 L83 L97 Y98 F101 F152 V153	L80-F149 HydrophobicContact CD1-CE1 4.43Å; L83-F149 HydrophobicContact CD1-CD1 3.92Å; L83-F149 HydrophobicContact CD1-CE1 3.83Å; L97-F149 HydrophobicContact CB-CE2 3.98Å; L97-F149 HydrophobicContact CB-CZ 4.04Å; Y98-F149 VanDerWaalsContact CA-CZ 3.49Å; Y98-F149 HydrophobicContact CD2-CB 4.47Å; Y98-F149 AromaticContact CD2-CD1 3.65Å; Y98-F149 HydrophobicContact CD2-CD1 3.65Å; Y98-F149 AromaticContact CD2-CD2 3.99Å; Y98-F149 HydrophobicContact CD2-CD2 3.99Å; Y98-F149 AromaticContact CD2-CE1 3.76Å; Y98-F149 HydrophobicContact CD2-CE1 3.76Å; Y98-F149 HydrophobicContact CD2-CE2 4.11Å; Y98-F149 AromaticContact CD2-CG 3.75Å; Y98-F149 HydrophobicContact CD2-CG 3.75Å; Y98-F149 AromaticContact CD2-CZ 3.99Å; Y98-F149 HydrophobicContact CD2-CZ 3.99Å; Y98-F149 HydrophobicContact CE2-CD1 4.35Å; Y98-F149 HydrophobicContact CE2-CG 4.38Å; Y98-F149 HydrophobicContact CG-CE1 4.3Å; Y98-F149 HydrophobicContact CG-CZ 4.25Å; F101-F149 HydrophobicContact CB-CD2 3.87Å; F101-F149 HydrophobicContact CB-CE2 4.2Å; F101-F149 HydrophobicContact CD1-CB 4.23Å; F101-F149 HydrophobicContact CD1-CD2 4.13Å; F101-F149 HydrophobicContact CD2-CD2 4.07Å; F101-F149 HydrophobicContact CE1-CB 4.07Å; F101-F149 AromaticContact CG-CD2 3.77Å; F101-F149 HydrophobicContact CG-CD2 3.77Å; F101-F149 HydrophobicContact CZ-CB 4.27Å; F149-F152 PolarHBondContact O-N 3.39Å; F149-V153 HydrophobicContact CD1-CG2 4.21Å; F149-V153 HydrophobicContact CD2-CG2 3.94Å; F149-V153 HydrophobicContact CE1-CG2 3.74Å; F149-V153 HydrophobicContact CE2-CG2 3.4Å; F149-V153 VanDerWaalsContact CE2-CG2 3.4Å; F149-V153 HydrophobicContact CG-CG2 4.31Å; F149-V153 HydrophobicContact CZ-CG2 3.3Å; F149-V153 VanDerWaalsContact O-CG2 3.29Å; F149-V153 WeakPolarHBondContact O-CG2 3.04Å; F149-V153 PolarHBondContact O-N 2.92Å
150	E	82.2	Confident	79.6	Confident	89 Å²	89	43.3 Å²	43.3	42%	0.416	22%	0.222	S	C	.	.	H	α-helix	trans	-60.1	-51.7	178.2	-63.9	163.5	-156.7	0	0	111.8	L83 R148 F152 V153 I154	L83-E150 HydrophobicContact CD1-CG 4.08Å; L83-E150 HydrophobicContact CD2-CB 4Å; L83-E150 HydrophobicContact CD2-CG 4.04Å; L83-E150 HydrophobicContact CG-CG 4.35Å; R148-E150 PolarHBondContact O-N 3.36Å; E150-F152 VanDerWaalsContact C-N 3.28Å; E150-F152 PolarHBondContact O-N 3.02Å; E150-V153 PolarHBondContact O-N 3.35Å; E150-I154 WeakPolarHBondContact O-CB 3.27Å; E150-I154 WeakPolarHBondContact O-CD1 3.44Å; E150-I154 VanDerWaalsContact O-CG1 3.22Å; E150-I154 WeakPolarHBondContact O-CG1 3.49Å; E150-I154 PolarHBondContact O-N 3.35Å
151	D	81.3	Confident	79.3	Confident	10 Å²	10	47.6 Å²	47.6	5%	0.053	24%	0.237	C	C	.	.	H	α-helix	trans	-60.2	-40.9	179.3	-58.6	-48.3	0	0	0	110.7	N142 I147 R148 G155	N142-D151 PolarHBondContact ND2-OD1 3.34Å; N142-D151 VanDerWaalsContact ND2-OD1 3.12Å; N142-D151 PolarHBondContact ND2-OD2 3.16Å; I147-D151 HydrophobicContact CG2-CB 4.18Å; R148-D151 IonicContact CZ-OD2 3.03Å; R148-D151 PolarHBondContact N-OD2 3.49Å; R148-D151 IonicContact NE-OD2 3.91Å; R148-D151 IonicContact NH1-OD2 3.87Å; R148-D151 IonicContact NH2-OD1 3.6Å; R148-D151 IonicContact NH2-OD2 2.63Å; R148-D151 PolarHBondContact NH2-OD2 3.49Å; R148-D151 PolarHBondContact O-N 3.48Å; D151-G155 PolarHBondContact O-N 2.89Å
152	F	79.1	Confident	79.4	Confident	11 Å²	11	43 Å²	43	5%	0.048	22%	0.217	C	C	.	.	H	α-helix	trans	-62.1	-48.6	177.2	-176.9	-109.1	0	0	0	112.7	L47 I51 F101 I147 R148 F149 E150 G155 L156	L47-F152 HydrophobicContact CD2-CE2 4.43Å; L47-F152 HydrophobicContact CD2-CZ 4.4Å; I51-F152 HydrophobicContact CD1-CE1 4.42Å; I51-F152 HydrophobicContact CD1-CZ 4.43Å; F101-F152 AromaticContact CD2-CD1 3.95Å; F101-F152 HydrophobicContact CD2-CD1 3.95Å; F101-F152 HydrophobicContact CD2-CE1 4.36Å; F101-F152 HydrophobicContact CD2-CG 4.27Å; F101-F152 HydrophobicContact CE2-CB 4.15Å; F101-F152 HydrophobicContact CE2-CD1 4.35Å; F101-F152 HydrophobicContact CE2-CG 4.21Å; I147-F152 HydrophobicContact CG2-CB 3.97Å; R148-F152 PolarHBondContact O-N 3.36Å; F149-F152 PolarHBondContact O-N 3.39Å; E150-F152 VanDerWaalsContact C-N 3.28Å; E150-F152 PolarHBondContact O-N 3.02Å; F152-G155 PolarHBondContact O-N 3.39Å; F152-L156 HydrophobicContact CD1-CD1 3.84Å; F152-L156 HydrophobicContact CE1-CD1 3.35Å; F152-L156 HydrophobicContact CE1-CG 4.35Å; F152-L156 HydrophobicContact CE2-CD1 4.27Å; F152-L156 HydrophobicContact CG-CD1 4.49Å; F152-L156 HydrophobicContact CZ-CD1 3.6Å; F152-L156 HydrophobicContact CZ-CG 4.3Å; F152-L156 WeakPolarHBondContact O-CG 3.49Å; F152-L156 PolarHBondContact O-N 2.84Å
153	V	79.6	Confident	79.8	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-69.8	-37.6	-179.1	178.8	0	0	0	0	111.4	T87 F89 L94 L97 F149 E150 L156 S157	T87-V153 HydrophobicContact CG2-CG1 3.9Å; F89-V153 HydrophobicContact CD2-CG1 3.72Å; F89-V153 HydrophobicContact CE2-CG1 4.01Å; L94-V153 HydrophobicContact CD2-CB 4.48Å; L94-V153 HydrophobicContact CD2-CG1 3.29Å; L94-V153 HydrophobicContact CD2-CG2 4.43Å; L97-V153 HydrophobicContact CD1-CG1 4.43Å; L97-V153 HydrophobicContact CD1-CG2 4.43Å; F149-V153 HydrophobicContact CD1-CG2 4.21Å; F149-V153 HydrophobicContact CD2-CG2 3.94Å; F149-V153 HydrophobicContact CE1-CG2 3.74Å; F149-V153 HydrophobicContact CE2-CG2 3.4Å; F149-V153 VanDerWaalsContact CE2-CG2 3.4Å; F149-V153 HydrophobicContact CG-CG2 4.31Å; F149-V153 HydrophobicContact CZ-CG2 3.3Å; F149-V153 VanDerWaalsContact O-CG2 3.29Å; F149-V153 WeakPolarHBondContact O-CG2 3.04Å; F149-V153 PolarHBondContact O-N 2.92Å; E150-V153 PolarHBondContact O-N 3.35Å; V153-L156 PolarHBondContact O-N 3.26Å; V153-S157 WeakPolarHBondContact O-CB 3.23Å; V153-S157 PolarHBondContact O-N 3.43Å
154	I	82.1	Confident	80	Confident	50 Å²	50	37.6 Å²	37.6	26%	0.256	21%	0.208	S	C	.	.	H	α-helix	trans	-60.9	-48.1	175.8	-69.6	165.9	0	0	0	110	L83 T87 E150 L156 S157 V158	L83-I154 HydrophobicContact CD2-CD1 4.48Å; L83-I154 HydrophobicContact CD2-CG1 4.34Å; T87-I154 HydrophobicContact CG2-CG1 4.07Å; E150-I154 WeakPolarHBondContact O-CB 3.27Å; E150-I154 WeakPolarHBondContact O-CD1 3.44Å; E150-I154 VanDerWaalsContact O-CG1 3.22Å; E150-I154 WeakPolarHBondContact O-CG1 3.49Å; E150-I154 PolarHBondContact O-N 3.35Å; I154-L156 PolarHBondContact O-N 3.22Å; I154-S157 WeakPolarHBondContact O-CB 3.28Å; I154-S157 PolarHBondContact O-N 3.02Å; I154-V158 PolarHBondContact O-N 2.95Å
155	G	78.6	Confident	80.2	Confident	7 Å²	7	36.8 Å²	36.8	7%	0.072	21%	0.206	C	C	.	.	H	α-helix	trans	-59.6	-45.2	175.5	0	0	0	0	0	112.7	D151 F152 S157 V158 L159	D151-G155 PolarHBondContact O-N 2.89Å; F152-G155 PolarHBondContact O-N 3.39Å; G155-S157 VanDerWaalsContact C-N 3.31Å; G155-S157 PolarHBondContact O-N 2.88Å; G155-V158 PolarHBondContact O-N 3.03Å; G155-L159 WeakPolarHBondContact O-CG 3.48Å; G155-L159 PolarHBondContact O-N 3.1Å
156	L	78.8	Confident	80.3	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-63.4	-34.8	176.2	-75.3	179.3	0	0	0	113.3	I51 F89 L97 F152 V153 I154 V158 L159 L160	I51-L156 HydrophobicContact CD1-CD1 3.78Å; F89-L156 HydrophobicContact CE2-CB 4.17Å; F89-L156 HydrophobicContact CZ-CB 4.14Å; L97-L156 HydrophobicContact CD2-CD1 4.02Å; F152-L156 HydrophobicContact CD1-CD1 3.84Å; F152-L156 HydrophobicContact CE1-CD1 3.35Å; F152-L156 HydrophobicContact CE1-CG 4.35Å; F152-L156 HydrophobicContact CE2-CD1 4.27Å; F152-L156 HydrophobicContact CG-CD1 4.49Å; F152-L156 HydrophobicContact CZ-CD1 3.6Å; F152-L156 HydrophobicContact CZ-CG 4.3Å; F152-L156 WeakPolarHBondContact O-CG 3.49Å; F152-L156 PolarHBondContact O-N 2.84Å; V153-L156 PolarHBondContact O-N 3.26Å; I154-L156 PolarHBondContact O-N 3.22Å; L156-V158 VanDerWaalsContact C-N 3.3Å; L156-V158 PolarHBondContact O-N 3.01Å; L156-L159 PolarHBondContact O-N 3.13Å; L156-L160 WeakPolarHBondContact O-CB 3.39Å; L156-L160 WeakPolarHBondContact O-CG 3.49Å; L156-L160 PolarHBondContact O-N 3.08Å
157	S	80.9	Confident	80.3	Confident	8 Å²	8	39.6 Å²	39.6	6%	0.056	20%	0.204	C	C	.	.	H	α-helix	trans	-62.3	-41.7	177.6	178.4	0	0	0	0	110.8	T87 K88 V153 I154 G155 R161 G162	T87-S157 WeakPolarHBondContact CA-OG 3.45Å; K88-S157 PolarHBondContact N-OG 3.31Å; V153-S157 WeakPolarHBondContact O-CB 3.23Å; V153-S157 PolarHBondContact O-N 3.43Å; I154-S157 WeakPolarHBondContact O-CB 3.28Å; I154-S157 PolarHBondContact O-N 3.02Å; G155-S157 VanDerWaalsContact C-N 3.31Å; G155-S157 PolarHBondContact O-N 2.88Å; S157-R161 CarbonylContact O-C 3.58Å; S157-R161 WeakPolarHBondContact O-CA 3.37Å; S157-R161 WeakPolarHBondContact O-CB 3.01Å; S157-R161 PolarHBondContact O-N 3.44Å; S157-G162 PolarHBondContact O-N 3.17Å; S157-G162 VanDerWaalsContact O-N 3.08Å
158	V	80.3	Confident	80.4	Confident	31 Å²	31	40 Å²	40	19%	0.188	21%	0.206	C	C	.	.	H	α-helix	trans	-67.1	-48.8	175	172.6	0	0	0	0	111	I154 G155 L156 L160 G162 E166 W170	I154-V158 PolarHBondContact O-N 2.95Å; G155-V158 PolarHBondContact O-N 3.03Å; L156-V158 VanDerWaalsContact C-N 3.3Å; L156-V158 PolarHBondContact O-N 3.01Å; V158-L160 PolarHBondContact O-N 2.87Å; V158-G162 WeakPolarHBondContact O-CA 3.32Å; V158-G162 PolarHBondContact O-N 3.47Å; V158-E166 HydrophobicContact CG1-CB 3.98Å; V158-E166 WeakPolarHBondContact CG1-O 3.07Å; V158-W170 HydrophobicContact CG1-CB 3.91Å; V158-W170 HydrophobicContact CG1-CG 4.29Å
159	L	76.6	Confident	80.5	Confident	24 Å²	24	39.3 Å²	39.3	13%	0.126	21%	0.209	C	C	.	.	H	α-helix	trans	-61.9	-45.3	-178.3	-73.5	173.8	0	0	0	113.2	F139 G155 L156 K167 W170 I257	F139-L159 HydrophobicContact CE1-CD1 4.39Å; F139-L159 HydrophobicContact CZ-CD1 3.68Å; G155-L159 WeakPolarHBondContact O-CG 3.48Å; G155-L159 PolarHBondContact O-N 3.1Å; L156-L159 PolarHBondContact O-N 3.13Å; L159-K167 WeakPolarHBondContact O-CE 3.28Å; L159-K167 PolarHBondContact O-NZ 3.25Å; L159-W170 HydrophobicContact CD1-CH2 4.03Å; L159-W170 HydrophobicContact CD1-CZ2 3.79Å; L159-W170 HydrophobicContact CD2-CD2 3.61Å; L159-W170 HydrophobicContact CD2-CE3 3.44Å; L159-W170 VanDerWaalsContact CD2-CE3 3.44Å; L159-W170 HydrophobicContact CD2-CG 4.31Å; L159-W170 HydrophobicContact CD2-CH2 3.95Å; L159-W170 HydrophobicContact CD2-CZ2 4.12Å; L159-W170 HydrophobicContact CD2-CZ3 3.63Å; L159-W170 HydrophobicContact CG-CD2 4.16Å; L159-W170 HydrophobicContact CG-CE3 4.41Å; L159-W170 HydrophobicContact CG-CH2 4.47Å; L159-W170 HydrophobicContact CG-CZ2 4.23Å; L159-I257 HydrophobicContact CD1-CG2 4.14Å
160	L	72.6	Confident	80.7	Confident	72 Å²	72	39.5 Å²	39.5	38%	0.377	21%	0.209	S	C	.	.	H	α-helix	trans	-87.8	-37.3	-173	-59.2	179.7	0	0	0	113	V48 F89 L156 V158	V48-L160 HydrophobicContact CG2-CD1 3.4Å; V48-L160 VanDerWaalsContact CG2-CD1 3.4Å; V48-L160 HydrophobicContact CG2-CD2 3.73Å; V48-L160 HydrophobicContact CG2-CG 4.17Å; F89-L160 HydrophobicContact CE1-CD1 4.32Å; F89-L160 HydrophobicContact CZ-CD1 4.02Å; L156-L160 WeakPolarHBondContact O-CB 3.39Å; L156-L160 WeakPolarHBondContact O-CG 3.49Å; L156-L160 PolarHBondContact O-N 3.08Å; V158-L160 PolarHBondContact O-N 2.87Å
161	R	75.9	Confident	80.9	Confident	96 Å²	96	35.5 Å²	35.5	36%	0.362	19%	0.191	S	C	.	.	H	α-helix	trans	-128.7	5	-170	-63.5	-178.9	177.5	151	7.9	113.3	K88 E93 S157	K88-R161 HydrophobicContact CB-CB 3.83Å; K88-R161 HydrophobicContact CB-CG 4.5Å; K88-R161 HydrophobicContact CD-CB 3.89Å; K88-R161 WeakPolarHBondContact CD-O 3.47Å; K88-R161 HydrophobicContact CG-CB 4.47Å; K88-R161 PolarHBondContact NZ-O 3Å; K88-R161 WeakPolarHBondContact O-CD 3.16Å; K88-R161 PolarHBondContact O-NH1 2.98Å; E93-R161 IonicContact OE1-CZ 3.12Å; E93-R161 IonicContact OE1-NH1 3.44Å; E93-R161 PolarHBondContact OE1-NH1 3.17Å; E93-R161 IonicContact OE1-NH2 3.74Å; E93-R161 PolarHBondContact OE1-NH2 3.5Å; E93-R161 IonicContact OE2-CZ 3.52Å; E93-R161 IonicContact OE2-NH1 3.44Å; E93-R161 PolarHBondContact OE2-NH1 2.78Å; E93-R161 IonicContact OE2-NH2 2.69Å; S157-R161 CarbonylContact O-C 3.58Å; S157-R161 WeakPolarHBondContact O-CA 3.37Å; S157-R161 WeakPolarHBondContact O-CB 3.01Å; S157-R161 PolarHBondContact O-N 3.44Å
162	G	74.9	Confident	81.2	Confident	12 Å²	12	35.6 Å²	35.6	12%	0.124	19%	0.191	C	C	.	.			trans	-65.1	151.8	171.5	0	0	0	0	0	111.9	S157 V158 E166 K167	S157-G162 PolarHBondContact O-N 3.17Å; S157-G162 VanDerWaalsContact O-N 3.08Å; V158-G162 WeakPolarHBondContact O-CA 3.32Å; V158-G162 PolarHBondContact O-N 3.47Å; G162-E166 VanDerWaalsContact CA-OE2 3.28Å; G162-E166 WeakPolarHBondContact CA-OE2 3.33Å; G162-K167 WeakPolarHBondContact O-CE 3.4Å
163	S	84.6	Confident	81.5	Confident	57 Å²	57	37.3 Å²	37.3	40%	0.399	20%	0.2	S	C	.	.			trans	-62.8	163.7	162.5	62	0	0	0	0	110.5	T165 E166 K167	S163-T165 PolarHBondContact O-N 3.22Å; S163-E166 WeakPolarHBondContact CB-OE2 3.47Å; S163-E166 PolarHBondContact N-OE2 3.22Å; S163-E166 PolarHBondContact O-N 2.98Å; S163-E166 VanDerWaalsContact O-N 3.15Å; S163-E166 VanDerWaalsContact OG-CG 3.28Å; S163-E166 WeakPolarHBondContact OG-CG 3.43Å; S163-E166 PolarHBondContact OG-N 3.38Å; S163-E166 PolarHBondContact OG-OE2 3.28Å; S163-K167 WeakPolarHBondContact O-CG 3.44Å; S163-K167 PolarHBondContact O-N 2.98Å
164	V	81.5	Confident	81.9	Confident	79 Å²	79	37.7 Å²	37.7	48%	0.479	20%	0.202	S	C	.	.	H	α-helix	trans	-54.8	-41.3	176.9	179	0	0	0	0	110.9	K167 L168	V164-K167 PolarHBondContact O-N 3.45Å; V164-L168 HydrophobicContact CG1-CD1 3.99Å; V164-L168 HydrophobicContact CG1-CG 4.3Å; V164-L168 WeakPolarHBondContact O-CB 3.18Å; V164-L168 VanDerWaalsContact O-CG 3.28Å; V164-L168 WeakPolarHBondContact O-CG 3.25Å; V164-L168 PolarHBondContact O-N 3.02Å
165	T	84	Confident	82.1	Confident	63 Å²	63	35.9 Å²	35.9	39%	0.387	19%	0.193	S	C	.	.	H	α-helix	trans	-65.2	-43.4	178	-47.7	0	0	0	0	112.7	S163 K167 L168 N169	S163-T165 PolarHBondContact O-N 3.22Å; T165-K167 VanDerWaalsContact C-N 3.29Å; T165-K167 PolarHBondContact O-N 3.37Å; T165-L168 PolarHBondContact O-N 2.95Å; T165-N169 PolarHBondContact O-N 3.47Å; T165-N169 PolarHBondContact O-ND2 3Å
166	E	84.1	Confident	82.6	Confident	71 Å²	71	35.9 Å²	35.9	33%	0.332	19%	0.191	S	C	.	.	H	α-helix	trans	-61.8	-39.5	176.5	-70.9	167.7	126.7	0	0	111.2	K88 V158 G162 S163 W170	K88-E166 IonicContact NZ-OE1 3.73Å; K88-E166 IonicContact NZ-OE2 3.68Å; K88-E166 PolarHBondContact NZ-OE2 3.05Å; V158-E166 HydrophobicContact CG1-CB 3.98Å; V158-E166 WeakPolarHBondContact CG1-O 3.07Å; G162-E166 VanDerWaalsContact CA-OE2 3.28Å; G162-E166 WeakPolarHBondContact CA-OE2 3.33Å; S163-E166 WeakPolarHBondContact CB-OE2 3.47Å; S163-E166 PolarHBondContact N-OE2 3.22Å; S163-E166 PolarHBondContact O-N 2.98Å; S163-E166 VanDerWaalsContact O-N 3.15Å; S163-E166 VanDerWaalsContact OG-CG 3.28Å; S163-E166 WeakPolarHBondContact OG-CG 3.43Å; S163-E166 PolarHBondContact OG-N 3.38Å; S163-E166 PolarHBondContact OG-OE2 3.28Å; E166-W170 WeakPolarHBondContact O-CB 3.3Å; E166-W170 PolarHBondContact O-N 2.91Å
167	K	82.6	Confident	83	Confident	56 Å²	56	37.8 Å²	37.8	24%	0.243	20%	0.201	C	C	.	.	H	α-helix	trans	-67.2	-44.6	175.9	-65.4	-177.2	-170.7	-146.4	0	112.2	L159 G162 S163 V164 T165 N169 W170 A171	L159-K167 WeakPolarHBondContact O-CE 3.28Å; L159-K167 PolarHBondContact O-NZ 3.25Å; G162-K167 WeakPolarHBondContact O-CE 3.4Å; S163-K167 WeakPolarHBondContact O-CG 3.44Å; S163-K167 PolarHBondContact O-N 2.98Å; V164-K167 PolarHBondContact O-N 3.45Å; T165-K167 VanDerWaalsContact C-N 3.29Å; T165-K167 PolarHBondContact O-N 3.37Å; K167-N169 VanDerWaalsContact C-N 3.33Å; K167-N169 PolarHBondContact O-N 3.36Å; K167-W170 CarbonylContact O-C 3.46Å; K167-W170 WeakPolarHBondContact O-CB 3.4Å; K167-W170 PolarHBondContact O-N 3.33Å; K167-W170 VanDerWaalsContact O-N 3.09Å; K167-A171 WeakPolarHBondContact O-CB 3.48Å; K167-A171 PolarHBondContact O-N 2.81Å
168	L	84.6	Confident	83.3	Confident	7 Å²	7	41.2 Å²	41.2	4%	0.037	22%	0.218	C	C	.	.	H	α-helix	trans	-61.7	-39.3	176	-71.5	174.4	0	0	0	112.2	V164 T165 W170 A171 F172 F236 I237 C240	V164-L168 HydrophobicContact CG1-CD1 3.99Å; V164-L168 HydrophobicContact CG1-CG 4.3Å; V164-L168 WeakPolarHBondContact O-CB 3.18Å; V164-L168 VanDerWaalsContact O-CG 3.28Å; V164-L168 WeakPolarHBondContact O-CG 3.25Å; V164-L168 PolarHBondContact O-N 3.02Å; T165-L168 PolarHBondContact O-N 2.95Å; L168-W170 VanDerWaalsContact C-N 3.32Å; L168-A171 PolarHBondContact O-N 3.39Å; L168-F172 WeakPolarHBondContact O-CB 3.15Å; L168-F172 PolarHBondContact O-N 3.39Å; L168-F236 HydrophobicContact CB-CE1 4.42Å; L168-F236 HydrophobicContact CD2-CE1 4.12Å; L168-F236 WeakPolarHBondContact O-CE1 3.4Å; L168-I237 HydrophobicContact CB-CG1 4.31Å; L168-I237 HydrophobicContact CD1-CG2 4.37Å; L168-C240 HydrophobicContact CD1-CB 4.04Å; L168-C240 HydrophobicContact CD2-CB 3.72Å
169	N	86.9	Confident	83.6	Confident	63 Å²	63	41.7 Å²	41.7	34%	0.337	22%	0.218	S	C	.	.	H	α-helix	trans	-62.8	-41.3	173.2	-76.4	-24.5	0	0	0	111.7	T165 K167 F172 N173 I233 I237	T165-N169 PolarHBondContact O-N 3.47Å; T165-N169 PolarHBondContact O-ND2 3Å; K167-N169 VanDerWaalsContact C-N 3.33Å; K167-N169 PolarHBondContact O-N 3.36Å; N169-F172 PolarHBondContact O-N 3.38Å; N169-N173 PolarHBondContact O-N 3.25Å; N169-I233 WeakPolarHBondContact OD1-CD1 3.47Å; N169-I237 WeakPolarHBondContact OD1-CD1 3.13Å
170	W	84.6	Confident	84.2	Confident	22 Å²	22	44.4 Å²	44.4	8%	0.083	23%	0.232	C	C	.	.	H	α-helix	trans	-66.9	-41.5	177	-169.6	93.6	0	0	0	111.6	L135 A138 F139 V158 L159 E166 K167 L168 N173 L174 I257	L135-W170 HydrophobicContact CD2-CH2 3.63Å; L135-W170 HydrophobicContact CD2-CZ2 4.43Å; A138-W170 HydrophobicContact CB-CZ2 4.45Å; F139-W170 HydrophobicContact CD2-CZ2 4.22Å; F139-W170 HydrophobicContact CE2-CH2 4.33Å; F139-W170 AromaticContact CE2-CZ2 3.71Å; F139-W170 HydrophobicContact CE2-CZ2 3.71Å; F139-W170 AromaticContact CZ-CZ2 3.88Å; F139-W170 HydrophobicContact CZ-CZ2 3.88Å; V158-W170 HydrophobicContact CG1-CB 3.91Å; V158-W170 HydrophobicContact CG1-CG 4.29Å; L159-W170 HydrophobicContact CD1-CH2 4.03Å; L159-W170 HydrophobicContact CD1-CZ2 3.79Å; L159-W170 HydrophobicContact CD2-CD2 3.61Å; L159-W170 HydrophobicContact CD2-CE3 3.44Å; L159-W170 VanDerWaalsContact CD2-CE3 3.44Å; L159-W170 HydrophobicContact CD2-CG 4.31Å; L159-W170 HydrophobicContact CD2-CH2 3.95Å; L159-W170 HydrophobicContact CD2-CZ2 4.12Å; L159-W170 HydrophobicContact CD2-CZ3 3.63Å; L159-W170 HydrophobicContact CG-CD2 4.16Å; L159-W170 HydrophobicContact CG-CE3 4.41Å; L159-W170 HydrophobicContact CG-CH2 4.47Å; L159-W170 HydrophobicContact CG-CZ2 4.23Å; E166-W170 WeakPolarHBondContact O-CB 3.3Å; E166-W170 PolarHBondContact O-N 2.91Å; K167-W170 CarbonylContact O-C 3.46Å; K167-W170 WeakPolarHBondContact O-CB 3.4Å; K167-W170 PolarHBondContact O-N 3.33Å; K167-W170 VanDerWaalsContact O-N 3.09Å; L168-W170 VanDerWaalsContact C-N 3.32Å; W170-N173 WeakPolarHBondContact O-CB 3.46Å; W170-N173 PolarHBondContact O-N 2.83Å; W170-L174 HydrophobicContact CH2-CD2 4.4Å; W170-L174 HydrophobicContact CZ3-CB 4.29Å; W170-L174 HydrophobicContact CZ3-CD2 3.99Å; W170-L174 PolarHBondContact O-N 3.24Å; W170-I257 HydrophobicContact CH2-CD1 3.81Å; W170-I257 HydrophobicContact CH2-CG2 4.24Å; W170-I257 HydrophobicContact CZ3-CD1 3.46Å; W170-I257 VanDerWaalsContact CZ3-CD1 3.46Å
171	A	84.8	Confident	85	Confident	5 Å²	5	42.5 Å²	42.5	4%	0.041	23%	0.231	C	C	.	.	H	α-helix	trans	-62.8	-43.8	173.9	0	0	0	0	0	111.3	K167 L168 N173 L174 Y175 F236	K167-A171 WeakPolarHBondContact O-CB 3.48Å; K167-A171 PolarHBondContact O-N 2.81Å; L168-A171 PolarHBondContact O-N 3.39Å; A171-N173 VanDerWaalsContact C-N 3.29Å; A171-N173 PolarHBondContact O-N 3.48Å; A171-L174 WeakPolarHBondContact O-CA 3.47Å; A171-L174 WeakPolarHBondContact O-CB 3.45Å; A171-L174 PolarHBondContact O-N 2.97Å; A171-Y175 VanDerWaalsContact O-CD2 3.26Å; A171-Y175 WeakPolarHBondContact O-CD2 3.2Å; A171-Y175 PolarHBondContact O-N 2.88Å; A171-F236 HydrophobicContact CB-CE1 4.46Å; A171-F236 HydrophobicContact CB-CZ 4.39Å
172	F	87.7	Confident	85.8	Confident	11 Å²	11	43.2 Å²	43.2	5%	0.048	23%	0.234	C	C	.	.	H	α-helix	trans	-55.1	-48.1	173.5	-177.8	-86.8	0	0	0	110.8	L168 N169 L174 Y175 D176 G181 I183 I233 F236	L168-F172 WeakPolarHBondContact O-CB 3.15Å; L168-F172 PolarHBondContact O-N 3.39Å; N169-F172 PolarHBondContact O-N 3.38Å; F172-L174 VanDerWaalsContact C-N 3.25Å; F172-L174 PolarHBondContact O-N 3.41Å; F172-Y175 PolarHBondContact O-N 3.49Å; F172-D176 HydrophobicContact CD1-CB 4.42Å; F172-D176 HydrophobicContact CE1-CB 4.07Å; F172-D176 WeakPolarHBondContact O-CB 3.47Å; F172-D176 PolarHBondContact O-N 3.38Å; F172-G181 WeakPolarHBondContact CZ-O 3.29Å; F172-I183 HydrophobicContact CD2-CD1 3.32Å; F172-I183 HydrophobicContact CD2-CG1 4.08Å; F172-I183 HydrophobicContact CE2-CD1 3.33Å; F172-I183 HydrophobicContact CE2-CG1 3.62Å; F172-I183 HydrophobicContact CG-CD1 4.09Å; F172-I183 HydrophobicContact CZ-CD1 4.1Å; F172-I183 HydrophobicContact CZ-CG1 3.93Å; F172-I233 HydrophobicContact CB-CG1 4.41Å; F172-I233 HydrophobicContact CD1-CB 4.27Å; F172-I233 HydrophobicContact CD1-CD1 4.16Å; F172-I233 HydrophobicContact CD1-CG1 4.16Å; F172-I233 HydrophobicContact CD2-CB 4.09Å; F172-I233 HydrophobicContact CD2-CG1 4.14Å; F172-I233 HydrophobicContact CE1-CB 4.18Å; F172-I233 VanDerWaalsContact CE2-CA 3.48Å; F172-I233 HydrophobicContact CE2-CB 3.98Å; F172-I233 HydrophobicContact CG-CB 4.25Å; F172-I233 HydrophobicContact CG-CD1 4.33Å; F172-I233 HydrophobicContact CG-CG1 3.95Å; F172-I233 HydrophobicContact CZ-CB 4.04Å; F172-F236 HydrophobicContact CB-CD1 4.07Å; F172-F236 HydrophobicContact CB-CE1 4.21Å; F172-F236 HydrophobicContact CD2-CB 3.79Å; F172-F236 HydrophobicContact CD2-CD1 4.09Å; F172-F236 HydrophobicContact CD2-CD2 4.39Å; F172-F236 AromaticContact CD2-CG 3.84Å; F172-F236 HydrophobicContact CD2-CG 3.84Å; F172-F236 HydrophobicContact CE2-CB 4.26Å
173	N	87.1	Confident	86.6	Confident	47 Å²	47	42.7 Å²	42.7	25%	0.251	23%	0.228	S	C	.	.	H	α-helix	trans	-60.1	-34.8	175	-174	36.9	0	0	0	111.8	A138 N169 W170 A171 D176 K179	A138-N173 PolarHBondContact O-ND2 2.9Å; N169-N173 PolarHBondContact O-N 3.25Å; W170-N173 WeakPolarHBondContact O-CB 3.46Å; W170-N173 PolarHBondContact O-N 2.83Å; A171-N173 VanDerWaalsContact C-N 3.29Å; A171-N173 PolarHBondContact O-N 3.48Å; N173-D176 VanDerWaalsContact O-O 3.12Å; N173-K179 PolarHBondContact O-NZ 3.23Å; N173-K179 WeakPolarHBondContact OD1-CD 3.18Å; N173-K179 VanDerWaalsContact OD1-CE 3.24Å; N173-K179 WeakPolarHBondContact OD1-CE 3.44Å; N173-K179 PolarHBondContact OD1-NZ 3.47Å
174	L	86.5	Confident	87	Confident	8 Å²	8	41.4 Å²	41.4	4%	0.042	22%	0.218	C	C	.	.	H	α-helix	trans	-66.6	-38.3	174	-179	63.5	0	0	0	112.5	Y131 F134 L135 A138 W170 A171 F172 I191 I257	Y131-L174 HydrophobicContact CE2-CD2 4.41Å; F134-L174 HydrophobicContact CB-CD1 4.19Å; L135-L174 HydrophobicContact CD2-CD1 3.87Å; L135-L174 HydrophobicContact CD2-CD2 4.12Å; L135-L174 HydrophobicContact CG-CD1 4.22Å; A138-L174 HydrophobicContact CB-CB 4.4Å; A138-L174 HydrophobicContact CB-CD1 3.88Å; W170-L174 HydrophobicContact CH2-CD2 4.4Å; W170-L174 HydrophobicContact CZ3-CB 4.29Å; W170-L174 HydrophobicContact CZ3-CD2 3.99Å; W170-L174 PolarHBondContact O-N 3.24Å; A171-L174 WeakPolarHBondContact O-CA 3.47Å; A171-L174 WeakPolarHBondContact O-CB 3.45Å; A171-L174 PolarHBondContact O-N 2.97Å; F172-L174 VanDerWaalsContact C-N 3.25Å; F172-L174 PolarHBondContact O-N 3.41Å; L174-I191 VanDerWaalsContact O-CD1 3.3Å; L174-I191 WeakPolarHBondContact O-CD1 3.3Å; L174-I257 HydrophobicContact CD2-CD1 3.81Å
175	Y	87.2	Confident	87.4	Confident	13 Å²	13	41.7 Å²	41.7	5%	0.051	21%	0.213	C	C	.	.	H	α-helix	trans	-75.4	-34.2	-179.9	-83.2	-82.3	0	0	0	113.7	A171 F172 I177 I183 M188 I191 M250	A171-Y175 VanDerWaalsContact O-CD2 3.26Å; A171-Y175 WeakPolarHBondContact O-CD2 3.2Å; A171-Y175 PolarHBondContact O-N 2.88Å; F172-Y175 PolarHBondContact O-N 3.49Å; Y175-I177 PolarHBondContact O-N 2.77Å; Y175-I183 HydrophobicContact CG-CD1 4.45Å; Y175-M188 HydrophobicContact CD1-CG 4.32Å; Y175-M188 HydrophobicContact CE1-CG 4.28Å; Y175-I191 HydrophobicContact CD1-CB 3.99Å; Y175-I191 HydrophobicContact CD1-CG1 4.02Å; Y175-I191 HydrophobicContact CD1-CG2 3.96Å; Y175-I191 HydrophobicContact CE1-CB 3.84Å; Y175-I191 HydrophobicContact CE1-CG1 4.37Å; Y175-I191 HydrophobicContact CE1-CG2 3.47Å; Y175-I191 VanDerWaalsContact CE1-CG2 3.47Å; Y175-M250 HydrophobicContact CD2-CE 4.49Å; Y175-M250 HydrophobicContact CE1-CE 4.25Å; Y175-M250 HydrophobicContact CE2-CE 3.42Å; Y175-M250 VanDerWaalsContact CE2-CE 3.42Å; Y175-M250 HydrophobicContact CE2-SD 4.01Å; Y175-M250 WeakPolarHBondContact OH-CE 3.48Å
176	D	89.5	Confident	87.7	Confident	7 Å²	7	45.2 Å²	45.2	4%	0.037	23%	0.225	C	C	.	.			trans	-77.5	94.1	174.2	179.1	2.7	0	0	0	109.4	F172 N173 N178 K179 D180 G181 I183	F172-D176 HydrophobicContact CD1-CB 4.42Å; F172-D176 HydrophobicContact CE1-CB 4.07Å; F172-D176 WeakPolarHBondContact O-CB 3.47Å; F172-D176 PolarHBondContact O-N 3.38Å; N173-D176 VanDerWaalsContact O-O 3.12Å; D176-N178 PolarHBondContact OD1-OD1 2.97Å; D176-K179 VanDerWaalsContact CG-CA 3.46Å; D176-K179 WeakPolarHBondContact O-CD 2.91Å; D176-K179 WeakPolarHBondContact O-CE 3.48Å; D176-K179 PolarHBondContact O-NZ 2.96Å; D176-K179 WeakPolarHBondContact OD1-CA 3.49Å; D176-K179 PolarHBondContact OD1-N 2.85Å; D176-K179 VanDerWaalsContact OD2-CA 3.31Å; D176-K179 WeakPolarHBondContact OD2-CA 3.35Å; D176-D180 PolarHBondContact OD1-N 3.08Å; D176-G181 WeakPolarHBondContact OD2-CA 3.44Å; D176-G181 PolarHBondContact OD2-N 3.1Å; D176-I183 HydrophobicContact CB-CG1 4.21Å
177	I	87.2	Confident	88	Confident	42 Å²	42	42.5 Å²	42.5	22%	0.215	21%	0.212	C	C	.	.	S	Bend	trans	-76.8	-44.4	-173.1	-64.9	170.6	0	0	0	109.7	F134 Y175 K179 E187 A190 I191	F134-I177 HydrophobicContact CD1-CD1 4.02Å; F134-I177 HydrophobicContact CD1-CG1 4.07Å; F134-I177 HydrophobicContact CD1-CG2 4.25Å; F134-I177 HydrophobicContact CE1-CD1 3.56Å; F134-I177 HydrophobicContact CE1-CG1 4.08Å; F134-I177 HydrophobicContact CE1-CG2 4.06Å; F134-I177 HydrophobicContact CE2-CD1 4.44Å; F134-I177 HydrophobicContact CZ-CD1 3.79Å; Y175-I177 PolarHBondContact O-N 2.77Å; I177-K179 VanDerWaalsContact C-N 3.31Å; I177-E187 HydrophobicContact CB-CG 4.15Å; I177-E187 HydrophobicContact CD1-CB 4.09Å; I177-E187 HydrophobicContact CD1-CG 4.15Å; I177-E187 HydrophobicContact CG1-CB 4.36Å; I177-E187 HydrophobicContact CG1-CG 4.32Å; I177-E187 PolarHBondContact N-OE1 3.34Å; I177-A190 HydrophobicContact CD1-CB 3.92Å; I177-I191 HydrophobicContact CD1-CD1 4.22Å; I177-I191 HydrophobicContact CD1-CG1 4.17Å; I177-I191 HydrophobicContact CG1-CD1 4.19Å; I177-I191 HydrophobicContact CG1-CG1 4.4Å
178	N	87	Confident	88.2	Confident	79 Å²	79	40.3 Å²	40.3	42%	0.422	20%	0.203	S	C	.	.	S	Bend	trans	-80.6	-13.4	-177.1	74.1	6.3	0	0	0	113.1	D176 D180 E187	D176-N178 PolarHBondContact OD1-OD1 2.97Å; N178-D180 VanDerWaalsContact ND2-CG 3.33Å; N178-D180 PolarHBondContact ND2-OD2 2.79Å; N178-D180 WeakPolarHBondContact OD1-CB 3.26Å; N178-D180 PolarHBondContact OD1-N 3.21Å; N178-D180 PolarHBondContact OD1-OD1 3.39Å; N178-D180 PolarHBondContact OD1-OD2 2.85Å; N178-E187 VanDerWaalsContact CG-OE1 3.25Å; N178-E187 PolarHBondContact N-OE1 3.42Å; N178-E187 PolarHBondContact OD1-OE1 2.61Å
179	K	86.8	Confident	88.3	Confident	42 Å²	42	41.9 Å²	41.9	18%	0.183	21%	0.211	C	C	.	.			trans	64.5	35.8	179.5	-50.7	-67.7	178.4	-146.9	0	113.3	R143 N173 D176 I177 G181	R143-K179 VanDerWaalsContact NH2-CG 3.34Å; N173-K179 PolarHBondContact O-NZ 3.23Å; N173-K179 WeakPolarHBondContact OD1-CD 3.18Å; N173-K179 VanDerWaalsContact OD1-CE 3.24Å; N173-K179 WeakPolarHBondContact OD1-CE 3.44Å; N173-K179 PolarHBondContact OD1-NZ 3.47Å; D176-K179 VanDerWaalsContact CG-CA 3.46Å; D176-K179 WeakPolarHBondContact O-CD 2.91Å; D176-K179 WeakPolarHBondContact O-CE 3.48Å; D176-K179 PolarHBondContact O-NZ 2.96Å; D176-K179 WeakPolarHBondContact OD1-CA 3.49Å; D176-K179 PolarHBondContact OD1-N 2.85Å; D176-K179 VanDerWaalsContact OD2-CA 3.31Å; D176-K179 WeakPolarHBondContact OD2-CA 3.35Å; I177-K179 VanDerWaalsContact C-N 3.31Å; K179-G181 VanDerWaalsContact C-N 3.29Å
180	D	88.6	Confident	88.4	Confident	80 Å²	80	40.5 Å²	40.5	43%	0.428	21%	0.209	S	C	.	.	S	Bend	trans	-86.1	-3.8	177	70.8	12.8	0	0	0	112.9	D176 N178 Y182	D176-D180 PolarHBondContact OD1-N 3.08Å; N178-D180 VanDerWaalsContact ND2-CG 3.33Å; N178-D180 PolarHBondContact ND2-OD2 2.79Å; N178-D180 WeakPolarHBondContact OD1-CB 3.26Å; N178-D180 PolarHBondContact OD1-N 3.21Å; N178-D180 PolarHBondContact OD1-OD1 3.39Å; N178-D180 PolarHBondContact OD1-OD2 2.85Å; D180-Y182 WeakPolarHBondContact O-CD2 3.35Å; D180-Y182 WeakPolarHBondContact OD1-CA 3.42Å; D180-Y182 WeakPolarHBondContact OD1-CB 3.38Å; D180-Y182 PolarHBondContact OD1-N 3.44Å; D180-Y182 VanDerWaalsContact OD1-O 3.06Å
181	G	89.4	Confident	88.4	Confident	33 Å²	33	39.5 Å²	39.5	34%	0.34	21%	0.205	S	C	.	.	S	Bend	trans	88.1	7.4	-178.9	0	0	0	0	0	113.7	F172 D176 K179	F172-G181 WeakPolarHBondContact CZ-O 3.29Å; D176-G181 WeakPolarHBondContact OD2-CA 3.44Å; D176-G181 PolarHBondContact OD2-N 3.1Å; K179-G181 VanDerWaalsContact C-N 3.29Å
182	Y	92.9	Very high	88.3	Confident	111 Å²	111	39.6 Å²	39.6	44%	0.435	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	143.7	179.2	-57.4	-86.2	0	0	0	109.9	D180 V230 T232	D180-Y182 WeakPolarHBondContact O-CD2 3.35Å; D180-Y182 WeakPolarHBondContact OD1-CA 3.42Å; D180-Y182 WeakPolarHBondContact OD1-CB 3.38Å; D180-Y182 PolarHBondContact OD1-N 3.44Å; D180-Y182 VanDerWaalsContact OD1-O 3.06Å; Y182-V230 HydrophobicContact CD1-CB 4.23Å; Y182-V230 HydrophobicContact CD1-CG2 3.8Å; Y182-V230 HydrophobicContact CE1-CG2 4.47Å; Y182-V230 HydrophobicContact CG-CG2 4.47Å; Y182-T232 HydrophobicContact CD1-CG2 3.85Å; Y182-T232 HydrophobicContact CE1-CG2 3.74Å
183	I	91.4	Very high	88.1	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	116	172.4	-61.1	164.3	0	0	0	108.3	F172 Y175 D176 M188 V231 F236	F172-I183 HydrophobicContact CD2-CD1 3.32Å; F172-I183 HydrophobicContact CD2-CG1 4.08Å; F172-I183 HydrophobicContact CE2-CD1 3.33Å; F172-I183 HydrophobicContact CE2-CG1 3.62Å; F172-I183 HydrophobicContact CG-CD1 4.09Å; F172-I183 HydrophobicContact CZ-CD1 4.1Å; F172-I183 HydrophobicContact CZ-CG1 3.93Å; Y175-I183 HydrophobicContact CG-CD1 4.45Å; D176-I183 HydrophobicContact CB-CG1 4.21Å; I183-M188 HydrophobicContact CG2-CB 4.22Å; I183-M188 HydrophobicContact CG2-CE 4.13Å; I183-V231 HydrophobicContact CB-CB 4.24Å; I183-V231 PolarHBondContact N-O 2.76Å; I183-V231 PolarHBondContact O-N 3.05Å; I183-F236 HydrophobicContact CD1-CD2 4.16Å; I183-F236 HydrophobicContact CD1-CE2 4.48Å
184	T	92.1	Very high	87.9	Confident	31 Å²	31	42 Å²	42	19%	0.19	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	161.3	172	62.8	0	0	0	0	111.4	E186 E187 M188 V230	T184-E186 PolarHBondContact O-N 2.89Å; T184-E187 WeakPolarHBondContact CB-OE2 3.42Å; T184-E187 PolarHBondContact N-OE2 2.96Å; T184-E187 PolarHBondContact O-N 3.07Å; T184-E187 VanDerWaalsContact OG1-CD 3.29Å; T184-E187 WeakPolarHBondContact OG1-CG 3.47Å; T184-E187 PolarHBondContact OG1-N 3.43Å; T184-E187 PolarHBondContact OG1-OE2 2.72Å; T184-M188 PolarHBondContact O-N 3.09Å; T184-V230 HydrophobicContact CG2-CG1 4.33Å
185	K	89.9	Confident	87.4	Confident	85 Å²	85	41.8 Å²	41.8	37%	0.37	21%	0.212	S	C	.	.	H	α-helix	trans	-62.4	-36.3	176.7	-173.8	-178.6	177.7	177.2	0	111.4	L189 V216 D217 F220	K185-L189 WeakPolarHBondContact O-CB 3.4Å; K185-L189 PolarHBondContact O-N 2.97Å; K185-V216 HydrophobicContact CG-CG1 3.94Å; K185-D217 WeakPolarHBondContact CE-OD1 3.22Å; K185-D217 IonicContact NZ-OD1 2.59Å; K185-D217 PolarHBondContact NZ-OD1 3.43Å; K185-F220 HydrophobicContact CB-CD2 3.97Å; K185-F220 HydrophobicContact CB-CE2 3.88Å; K185-F220 HydrophobicContact CB-CG 4.37Å; K185-F220 HydrophobicContact CB-CZ 4.19Å; K185-F220 HydrophobicContact CG-CD2 4.32Å; K185-F220 HydrophobicContact CG-CG 4.42Å; K185-F220 VanDerWaalsContact N-CE2 3.31Å
186	E	90.4	Very high	86.8	Confident	136 Å²	136	43.4 Å²	43.4	64%	0.636	22%	0.218	S	C	*	.	H	α-helix	trans	-62.7	-44.9	177.5	-68.4	68.6	-152.2	0	0	111.3	T184 L189 A190	T184-E186 PolarHBondContact O-N 2.89Å; E186-L189 PolarHBondContact O-N 3.45Å; E186-A190 PolarHBondContact O-N 2.99Å
187	E	90.6	Very high	86.2	Confident	15 Å²	15	47.1 Å²	47.1	7%	0.07	24%	0.238	C	C	.	.	H	α-helix	trans	-66.9	-44.8	177.8	-71.2	168.6	129	0	0	111.8	I177 N178 T184 L189 A190 I191	I177-E187 HydrophobicContact CB-CG 4.15Å; I177-E187 HydrophobicContact CD1-CB 4.09Å; I177-E187 HydrophobicContact CD1-CG 4.15Å; I177-E187 HydrophobicContact CG1-CB 4.36Å; I177-E187 HydrophobicContact CG1-CG 4.32Å; I177-E187 PolarHBondContact N-OE1 3.34Å; N178-E187 VanDerWaalsContact CG-OE1 3.25Å; N178-E187 PolarHBondContact N-OE1 3.42Å; N178-E187 PolarHBondContact OD1-OE1 2.61Å; T184-E187 WeakPolarHBondContact CB-OE2 3.42Å; T184-E187 PolarHBondContact N-OE2 2.96Å; T184-E187 PolarHBondContact O-N 3.07Å; T184-E187 VanDerWaalsContact OG1-CD 3.29Å; T184-E187 WeakPolarHBondContact OG1-CG 3.47Å; T184-E187 PolarHBondContact OG1-N 3.43Å; T184-E187 PolarHBondContact OG1-OE2 2.72Å; E187-L189 PolarHBondContact O-N 2.94Å; E187-A190 WeakPolarHBondContact O-CB 3.26Å; E187-A190 PolarHBondContact O-N 3.44Å; E187-A190 VanDerWaalsContact O-N 3.11Å; E187-I191 WeakPolarHBondContact O-CG1 3.46Å; E187-I191 PolarHBondContact O-N 2.85Å
188	M	88.1	Confident	85.5	Confident	9 Å²	9	45.3 Å²	45.3	4%	0.044	23%	0.229	C	C	.	.	H	α-helix	trans	-59.2	-39.6	175.6	-170.3	176.6	-74.5	0	0	111.5	Y175 I183 T184 M192 V216 F219 F220 M223	Y175-M188 HydrophobicContact CD1-CG 4.32Å; Y175-M188 HydrophobicContact CE1-CG 4.28Å; I183-M188 HydrophobicContact CG2-CB 4.22Å; I183-M188 HydrophobicContact CG2-CE 4.13Å; T184-M188 PolarHBondContact O-N 3.09Å; M188-M192 VanDerWaalsContact O-CB 3.29Å; M188-M192 WeakPolarHBondContact O-CB 3.48Å; M188-M192 PolarHBondContact O-N 3.28Å; M188-V216 HydrophobicContact CB-CG1 4.16Å; M188-V216 HydrophobicContact CG-CG1 4.1Å; M188-V216 HydrophobicContact CG-CG2 4.26Å; M188-V216 HydrophobicContact SD-CG1 4.12Å; M188-F219 HydrophobicContact SD-CB 4.07Å; M188-F220 HydrophobicContact CE-CD2 4.38Å; M188-F220 HydrophobicContact SD-CD2 4.32Å; M188-M223 HydrophobicContact CE-SD 3.73Å
189	L	86.9	Confident	84.5	Confident	41 Å²	41	44.7 Å²	44.7	22%	0.215	22%	0.224	C	C	.	.	H	α-helix	trans	-66.8	-40.4	175.5	-175.3	66.8	0	0	0	112.4	K185 E186 E187 M192 K193 P212 V216	K185-L189 WeakPolarHBondContact O-CB 3.4Å; K185-L189 PolarHBondContact O-N 2.97Å; E186-L189 PolarHBondContact O-N 3.45Å; E187-L189 PolarHBondContact O-N 2.94Å; L189-M192 PolarHBondContact O-N 2.95Å; L189-K193 HydrophobicContact CD1-CG 4.42Å; L189-K193 HydrophobicContact CG-CD 4.22Å; L189-K193 HydrophobicContact CG-CG 4.48Å; L189-K193 WeakPolarHBondContact O-CB 3.37Å; L189-K193 VanDerWaalsContact O-CG 3.32Å; L189-K193 WeakPolarHBondContact O-CG 3.23Å; L189-K193 PolarHBondContact O-N 2.73Å; L189-P212 HydrophobicContact CD1-CB 4.45Å; L189-V216 HydrophobicContact CB-CG1 4.48Å; L189-V216 HydrophobicContact CB-CG2 4.32Å; L189-V216 HydrophobicContact CD1-CG2 3.97Å
190	A	88.2	Confident	83.4	Confident	34 Å²	34	43.8 Å²	43.8	28%	0.281	23%	0.227	S	C	.	.	H	α-helix	trans	-62.2	-46.7	177.8	0	0	0	0	0	111.6	F134 I177 E186 E187 K193 S194	F134-A190 HydrophobicContact CE2-CB 4.46Å; F134-A190 HydrophobicContact CZ-CB 4.13Å; I177-A190 HydrophobicContact CD1-CB 3.92Å; E186-A190 PolarHBondContact O-N 2.99Å; E187-A190 WeakPolarHBondContact O-CB 3.26Å; E187-A190 PolarHBondContact O-N 3.44Å; E187-A190 VanDerWaalsContact O-N 3.11Å; A190-K193 PolarHBondContact O-N 2.89Å; A190-S194 PolarHBondContact O-N 2.97Å; A190-S194 PolarHBondContact O-OG 3.46Å
191	I	85.1	Confident	81.7	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.7	-49.2	175.2	-63	-72.9	0	0	0	110.2	F134 L174 Y175 I177 E187 K193 S194 I195	F134-I191 HydrophobicContact CB-CD1 3.78Å; F134-I191 HydrophobicContact CD1-CD1 4.38Å; F134-I191 HydrophobicContact CD2-CD1 3.49Å; F134-I191 VanDerWaalsContact CD2-CD1 3.49Å; F134-I191 HydrophobicContact CE2-CD1 4.09Å; F134-I191 HydrophobicContact CG-CD1 3.64Å; L174-I191 VanDerWaalsContact O-CD1 3.3Å; L174-I191 WeakPolarHBondContact O-CD1 3.3Å; Y175-I191 HydrophobicContact CD1-CB 3.99Å; Y175-I191 HydrophobicContact CD1-CG1 4.02Å; Y175-I191 HydrophobicContact CD1-CG2 3.96Å; Y175-I191 HydrophobicContact CE1-CB 3.84Å; Y175-I191 HydrophobicContact CE1-CG1 4.37Å; Y175-I191 HydrophobicContact CE1-CG2 3.47Å; Y175-I191 VanDerWaalsContact CE1-CG2 3.47Å; I177-I191 HydrophobicContact CD1-CD1 4.22Å; I177-I191 HydrophobicContact CD1-CG1 4.17Å; I177-I191 HydrophobicContact CG1-CD1 4.19Å; I177-I191 HydrophobicContact CG1-CG1 4.4Å; E187-I191 WeakPolarHBondContact O-CG1 3.46Å; E187-I191 PolarHBondContact O-N 2.85Å; I191-K193 PolarHBondContact O-N 3.42Å; I191-S194 PolarHBondContact O-N 3.35Å; I191-S194 VanDerWaalsContact O-N 3.17Å; I191-S194 PolarHBondContact O-OG 3.39Å; I191-I195 HydrophobicContact CG2-CD1 3.96Å; I191-I195 WeakPolarHBondContact O-CG1 3.26Å; I191-I195 PolarHBondContact O-N 3.49Å; I191-I195 VanDerWaalsContact O-N 3.08Å
192	M	81.6	Confident	79.7	Confident	8 Å²	8	57.5 Å²	57.5	4%	0.039	26%	0.263	C	S	.	.	H	α-helix	trans	-59.2	-47.3	-178.3	-168.3	62.6	148.6	0	0	111.5	M188 L189 S194 I195 Y196 P212 H215 V216 F253	M188-M192 VanDerWaalsContact O-CB 3.29Å; M188-M192 WeakPolarHBondContact O-CB 3.48Å; M188-M192 PolarHBondContact O-N 3.28Å; L189-M192 PolarHBondContact O-N 2.95Å; M192-S194 VanDerWaalsContact C-N 3.35Å; M192-S194 PolarHBondContact O-N 3.34Å; M192-I195 PolarHBondContact O-N 3.46Å; M192-Y196 HydrophobicContact CE-CE2 3.9Å; M192-Y196 HydrophobicContact CG-CD2 4Å; M192-Y196 HydrophobicContact CG-CE2 3.67Å; M192-Y196 WeakPolarHBondContact O-CD2 3.13Å; M192-Y196 PolarHBondContact O-N 3.46Å; M192-Y196 VanDerWaalsContact O-N 3.1Å; M192-Y196 HydrophobicContact SD-CD2 4.46Å; M192-Y196 HydrophobicContact SD-CE2 3.9Å; M192-P212 HydrophobicContact CG-CB 4.27Å; M192-H215 HydrophobicContact CE-CB 3.8Å; M192-H215 WeakPolarHBondContact CE-ND1 3.23Å; M192-V216 HydrophobicContact CB-CG2 4.02Å; M192-V216 HydrophobicContact CG-CG2 4.21Å; M192-F253 HydrophobicContact CE-CE2 4.45Å; M192-F253 HydrophobicContact CE-CZ 3.86Å; M192-F253 HydrophobicContact SD-CE1 4.27Å; M192-F253 HydrophobicContact SD-CE2 4.37Å; M192-F253 HydrophobicContact SD-CZ 3.83Å
193	K	82.9	Confident	77.5	Confident	106 Å²	106	53.6 Å²	53.6	46%	0.461	25%	0.251	S	S	.	.	H	α-helix	trans	-57.5	-46.1	175.3	-76.9	177.7	176.3	-178.8	0	112.1	L189 A190 I191 I195 Y196 D197	L189-K193 HydrophobicContact CD1-CG 4.42Å; L189-K193 HydrophobicContact CG-CD 4.22Å; L189-K193 HydrophobicContact CG-CG 4.48Å; L189-K193 WeakPolarHBondContact O-CB 3.37Å; L189-K193 VanDerWaalsContact O-CG 3.32Å; L189-K193 WeakPolarHBondContact O-CG 3.23Å; L189-K193 PolarHBondContact O-N 2.73Å; A190-K193 PolarHBondContact O-N 2.89Å; I191-K193 PolarHBondContact O-N 3.42Å; K193-I195 PolarHBondContact O-N 3.26Å; K193-Y196 WeakPolarHBondContact O-CA 3.07Å; K193-Y196 WeakPolarHBondContact O-CB 3.41Å; K193-Y196 PolarHBondContact O-N 3.38Å; K193-D197 VanDerWaalsContact O-CG 3.31Å; K193-D197 PolarHBondContact O-N 2.98Å
194	S	82.9	Confident	74.8	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.007	29%	0.287	C	S	.	.	H	α-helix	trans	-61.6	-32.8	179.7	72.3	0	0	0	0	113.3	Y131 A190 I191 M192 M198	Y131-S194 WeakPolarHBondContact CD2-OG 3.37Å; A190-S194 PolarHBondContact O-N 2.97Å; A190-S194 PolarHBondContact O-OG 3.46Å; I191-S194 PolarHBondContact O-N 3.35Å; I191-S194 VanDerWaalsContact O-N 3.17Å; I191-S194 PolarHBondContact O-OG 3.39Å; M192-S194 VanDerWaalsContact C-N 3.35Å; M192-S194 PolarHBondContact O-N 3.34Å; S194-M198 VanDerWaalsContact O-CB 3.3Å; S194-M198 WeakPolarHBondContact O-CB 3.48Å; S194-M198 PolarHBondContact O-N 2.96Å
195	I	77.3	Confident	72.4	Confident	4 Å²	4	65.8 Å²	65.8	2%	0.021	31%	0.307	C	S	.	.	H	α-helix	trans	-69.2	-42.5	173.7	-64.9	166	0	0	0	110.6	Y131 I191 M192 K193 M198 M199 F253	Y131-I195 HydrophobicContact CD2-CG1 3.79Å; Y131-I195 HydrophobicContact CE2-CD1 4.09Å; Y131-I195 HydrophobicContact CE2-CG1 3.62Å; I191-I195 HydrophobicContact CG2-CD1 3.96Å; I191-I195 WeakPolarHBondContact O-CG1 3.26Å; I191-I195 PolarHBondContact O-N 3.49Å; I191-I195 VanDerWaalsContact O-N 3.08Å; M192-I195 PolarHBondContact O-N 3.46Å; K193-I195 PolarHBondContact O-N 3.26Å; I195-M198 HydrophobicContact CG2-CE 4.43Å; I195-M198 PolarHBondContact O-N 2.98Å; I195-M199 HydrophobicContact CG2-CG 4.32Å; I195-M199 HydrophobicContact CG2-SD 3.91Å; I195-M199 WeakPolarHBondContact O-CB 3.48Å; I195-M199 VanDerWaalsContact O-CG 3.29Å; I195-M199 WeakPolarHBondContact O-CG 3.4Å; I195-M199 PolarHBondContact O-N 3.17Å; I195-F253 HydrophobicContact CD1-CB 4.2Å; I195-F253 HydrophobicContact CD1-CD1 3.75Å; I195-F253 HydrophobicContact CD1-CE1 4.35Å; I195-F253 HydrophobicContact CD1-CG 4.03Å; I195-F253 HydrophobicContact CG2-CD1 3.89Å; I195-F253 HydrophobicContact CG2-CE1 4.04Å
196	Y	74.1	Confident	70.1	Confident	48 Å²	48	66.5 Å²	66.5	19%	0.188	32%	0.322	C	S	.	.	H	α-helix	trans	-61	-44.8	175.3	-82.8	-74.9	0	0	0	112	M192 K193 M198 M199 G200 V207 P212	M192-Y196 HydrophobicContact CE-CE2 3.9Å; M192-Y196 HydrophobicContact CG-CD2 4Å; M192-Y196 HydrophobicContact CG-CE2 3.67Å; M192-Y196 WeakPolarHBondContact O-CD2 3.13Å; M192-Y196 PolarHBondContact O-N 3.46Å; M192-Y196 VanDerWaalsContact O-N 3.1Å; M192-Y196 HydrophobicContact SD-CD2 4.46Å; M192-Y196 HydrophobicContact SD-CE2 3.9Å; K193-Y196 WeakPolarHBondContact O-CA 3.07Å; K193-Y196 WeakPolarHBondContact O-CB 3.41Å; K193-Y196 PolarHBondContact O-N 3.38Å; Y196-M198 VanDerWaalsContact C-N 3.33Å; Y196-M198 PolarHBondContact O-N 3.2Å; Y196-M199 PolarHBondContact O-N 2.98Å; Y196-G200 PolarHBondContact O-N 2.85Å; Y196-V207 HydrophobicContact CD1-CB 4.42Å; Y196-V207 HydrophobicContact CE1-CB 3.63Å; Y196-V207 HydrophobicContact CE1-CG1 3.74Å; Y196-V207 HydrophobicContact CE1-CG2 3.73Å; Y196-V207 WeakPolarHBondContact OH-CG1 3.48Å; Y196-P212 HydrophobicContact CD2-CB 4.02Å; Y196-P212 HydrophobicContact CD2-CG 3.8Å; Y196-P212 HydrophobicContact CE2-CB 3.87Å; Y196-P212 HydrophobicContact CE2-CG 3.79Å; Y196-P212 HydrophobicContact CG-CG 4.39Å
197	D	76.9	Confident	68	Low	85 Å²	85	62 Å²	62	46%	0.455	30%	0.304	S	S	.	.	H	α-helix	trans	-62.7	-40.6	178	-64.9	-25.3	0	0	0	111.5	D127 K193 G200	D127-D197 PolarHBondContact N-O 3Å; D127-D197 CarbonylContact O-C 3.5Å; K193-D197 VanDerWaalsContact O-CG 3.31Å; K193-D197 PolarHBondContact O-N 2.98Å; D197-G200 PolarHBondContact O-N 3.33Å
198	M	72.4	Confident	65.9	Low	3 Å²	3	70.1 Å²	70.1	2%	0.015	33%	0.333	C	S	.	.	H	α-helix	trans	-67.2	-42	176.1	177.9	-175.4	63.3	0	0	112.7	Y119 F123 D127 A128 Y131 S194 I195 Y196 G200 V256	Y119-M198 HydrophobicContact CE1-SD 4.09Å; F123-M198 HydrophobicContact CB-CG 4.36Å; F123-M198 HydrophobicContact CD1-CG 3.8Å; F123-M198 HydrophobicContact CD1-SD 4.37Å; F123-M198 HydrophobicContact CD2-CG 4.07Å; F123-M198 HydrophobicContact CD2-SD 4.07Å; F123-M198 HydrophobicContact CE1-CG 4.05Å; F123-M198 HydrophobicContact CE1-SD 4.1Å; F123-M198 HydrophobicContact CE2-CG 4.31Å; F123-M198 HydrophobicContact CE2-SD 3.78Å; F123-M198 HydrophobicContact CG-CG 3.81Å; F123-M198 HydrophobicContact CG-SD 4.36Å; F123-M198 HydrophobicContact CZ-CE 4.42Å; F123-M198 HydrophobicContact CZ-CG 4.3Å; F123-M198 HydrophobicContact CZ-SD 3.79Å; D127-M198 WeakPolarHBondContact O-CA 3.47Å; D127-M198 PolarHBondContact O-N 2.91Å; A128-M198 HydrophobicContact CB-CB 4.46Å; A128-M198 HydrophobicContact CB-CG 3.9Å; A128-M198 HydrophobicContact CB-SD 4.42Å; Y131-M198 HydrophobicContact CD1-CE 3.85Å; Y131-M198 HydrophobicContact CD1-SD 3.47Å; Y131-M198 WeakPolarHBondContact CD1-SD 3.25Å; Y131-M198 HydrophobicContact CE1-CE 4Å; Y131-M198 HydrophobicContact CE1-SD 4.06Å; Y131-M198 HydrophobicContact CG-CE 4.37Å; Y131-M198 HydrophobicContact CG-SD 4.15Å; S194-M198 VanDerWaalsContact O-CB 3.3Å; S194-M198 WeakPolarHBondContact O-CB 3.48Å; S194-M198 PolarHBondContact O-N 2.96Å; I195-M198 HydrophobicContact CG2-CE 4.43Å; I195-M198 PolarHBondContact O-N 2.98Å; Y196-M198 VanDerWaalsContact C-N 3.33Å; Y196-M198 PolarHBondContact O-N 3.2Å; M198-G200 VanDerWaalsContact C-N 3.26Å; M198-G200 PolarHBondContact O-N 2.91Å; M198-V256 HydrophobicContact CE-CG1 3.25Å; M198-V256 HydrophobicContact SD-CG1 4.43Å
199	M	66.9	Low	64.1	Low	67 Å²	67	77.2 Å²	77.2	33%	0.33	37%	0.372	S	S	.	.	H	α-helix	trans	-74.8	-18	179.6	-69.1	-176.1	74.2	0	0	112.8	I195 Y196 T203	I195-M199 HydrophobicContact CG2-CG 4.32Å; I195-M199 HydrophobicContact CG2-SD 3.91Å; I195-M199 WeakPolarHBondContact O-CB 3.48Å; I195-M199 VanDerWaalsContact O-CG 3.29Å; I195-M199 WeakPolarHBondContact O-CG 3.4Å; I195-M199 PolarHBondContact O-N 3.17Å; Y196-M199 PolarHBondContact O-N 2.98Å; M199-T203 HydrophobicContact CB-CG2 4.2Å; M199-T203 HydrophobicContact CE-CG2 3.75Å; M199-T203 HydrophobicContact SD-CG2 4.1Å
200	G	63.2	Low	62.4	Low	23 Å²	23	79 Å²	79	24%	0.237	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	58.7	-154.6	179.7	0	0	0	0	0	113.3	Y196 D197 M198 Y202	Y196-G200 PolarHBondContact O-N 2.85Å; D197-G200 PolarHBondContact O-N 3.33Å; M198-G200 VanDerWaalsContact C-N 3.26Å; M198-G200 PolarHBondContact O-N 2.91Å; G200-Y202 PolarHBondContact O-N 3.31Å
201	R	51.6	Low	61.3	Low	233 Å²	233	78.6 Å²	78.6	88%	0.879	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-73.3	14.8	-176.1	-66	-172.8	-73.3	-168.1	-4.8	115.4
202	Y	49	Very low	60.4	Low	168 Å²	168	79.3 Å²	79.3	66%	0.659	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-104.4	2.1	-173.8	-72.3	-80	0	0	0	115.2	Q125 G200 Y204	Q125-Y202 VanDerWaalsContact OE1-CE2 3.24Å; Q125-Y202 PolarHBondContact OE1-OH 3.14Å; G200-Y202 PolarHBondContact O-N 3.31Å; Y202-Y204 PolarHBondContact O-N 3.11Å
203	T	46.1	Very low	60.1	Low	28 Å²	28	81.4 Å²	81.4	17%	0.172	40%	0.398	C	S	.	.	S	Bend	trans	-68.3	106.3	159.3	54.1	0	0	0	0	107.3	M199 P205 C206	M199-T203 HydrophobicContact CB-CG2 4.2Å; M199-T203 HydrophobicContact CE-CG2 3.75Å; M199-T203 HydrophobicContact SD-CG2 4.1Å; T203-P205 CarbonylContact C-O 3.36Å; T203-P205 CarbonylContact O-C 2.95Å; T203-C206 WeakPolarHBondContact O-CA 3.19Å; T203-C206 PolarHBondContact O-N 3.3Å; T203-C206 VanDerWaalsContact O-N 3.1Å
204	Y	33.8	Very low	59.9	Low	192 Å²	192	81.1 Å²	81.1	75%	0.753	40%	0.398	S	S	*	.	S	Bend	trans	-96.7	121.5	167.5	-134.1	-90	0	0	0	108.6	Y202	Y202-Y204 PolarHBondContact O-N 3.11Å
205	P	42.7	Very low	59.6	Low	96 Å²	96	83.7 Å²	83.7	62%	0.623	41%	0.41	S	S	*	.	S	Bend	cis	-77.3	149.4	6.4	32.9	-31.8	0	0	0	112.2	T203 V207	T203-P205 CarbonylContact C-O 3.36Å; T203-P205 CarbonylContact O-C 2.95Å; P205-V207 WeakPolarHBondContact O-CG2 3.49Å; P205-V207 PolarHBondContact O-N 3.43Å
206	C	41.3	Very low	59.9	Low	99 Å²	99	83.7 Å²	83.7	67%	0.669	41%	0.411	S	S	*	.			trans	-49.5	111.3	170.5	-179.9	0	0	0	0	108.2	T203 R208	T203-C206 WeakPolarHBondContact O-CA 3.19Å; T203-C206 PolarHBondContact O-N 3.3Å; T203-C206 VanDerWaalsContact O-N 3.1Å; C206-R208 PolarHBondContact O-N 3.39Å
207	V	46.5	Very low	60.4	Low	43 Å²	43	84.6 Å²	84.6	26%	0.261	42%	0.419	S	S	.	.			trans	-82.1	107.6	-171.7	-164.2	0	0	0	0	104.5	Y196 P205 A211	Y196-V207 HydrophobicContact CD1-CB 4.42Å; Y196-V207 HydrophobicContact CE1-CB 3.63Å; Y196-V207 HydrophobicContact CE1-CG1 3.74Å; Y196-V207 HydrophobicContact CE1-CG2 3.73Å; Y196-V207 WeakPolarHBondContact OH-CG1 3.48Å; P205-V207 WeakPolarHBondContact O-CG2 3.49Å; P205-V207 PolarHBondContact O-N 3.43Å; V207-A211 HydrophobicContact CB-CB 4.35Å; V207-A211 HydrophobicContact CG1-CB 3.1Å
208	R	47.2	Very low	60.7	Low	184 Å²	184	86.2 Å²	86.2	69%	0.694	42%	0.421	S	S	*	.			trans	-47.8	148.8	176.4	-77.7	172.9	60.3	167.6	-2.6	109.3	C206 D210 A211	C206-R208 PolarHBondContact O-N 3.39Å; R208-D210 IonicContact CZ-OD2 3.79Å; R208-D210 IonicContact NE-OD2 2.78Å; R208-D210 PolarHBondContact NE-OD2 2.82Å; R208-D210 IonicContact NH2-OD2 3.66Å; R208-D210 PolarHBondContact NH2-OD2 2.74Å; R208-D210 PolarHBondContact O-N 3.25Å; R208-A211 VanDerWaalsContact O-CB 3.25Å; R208-A211 WeakPolarHBondContact O-CB 3.19Å; R208-A211 PolarHBondContact O-N 3.04Å
209	D	50.1	Low	61.2	Low	158 Å²	158	87.1 Å²	87.1	85%	0.845	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-20.1	178.5	-67.2	-28.3	0	0	0	114	A211 P212	D209-A211 VanDerWaalsContact C-N 3.33Å; D209-P212 VanDerWaalsContact O-CD 3.32Å; D209-P212 WeakPolarHBondContact O-CD 3.28Å
210	D	50.4	Low	62.1	Low	79 Å²	79	84.8 Å²	84.8	42%	0.422	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-17.6	176.4	-43.7	-36.5	0	0	0	113.6	R208 S213 E214	R208-D210 IonicContact CZ-OD2 3.79Å; R208-D210 IonicContact NE-OD2 2.78Å; R208-D210 PolarHBondContact NE-OD2 2.82Å; R208-D210 IonicContact NH2-OD2 3.66Å; R208-D210 PolarHBondContact NH2-OD2 2.74Å; R208-D210 PolarHBondContact O-N 3.25Å; D210-S213 PolarHBondContact O-OG 2.63Å; D210-E214 PolarHBondContact O-N 2.88Å
211	A	65.4	Low	63.3	Low	26 Å²	26	90.2 Å²	90.2	22%	0.215	43%	0.433	C	S	.	.	H	α-helix	trans	-85.8	-27.7	-168.2	0	0	0	0	0	116	V207 R208 D209 H215	V207-A211 HydrophobicContact CB-CB 4.35Å; V207-A211 HydrophobicContact CG1-CB 3.1Å; R208-A211 VanDerWaalsContact O-CB 3.25Å; R208-A211 WeakPolarHBondContact O-CB 3.19Å; R208-A211 PolarHBondContact O-N 3.04Å; D209-A211 VanDerWaalsContact C-N 3.33Å; A211-H215 VanDerWaalsContact O-CB 3.23Å; A211-H215 WeakPolarHBondContact O-CB 3.49Å; A211-H215 PolarHBondContact O-N 2.91Å
212	P	67.1	Low	64.9	Low	14 Å²	14	83.7 Å²	83.7	9%	0.091	41%	0.411	C	S	.	.	H	α-helix	trans	-63.6	-43.5	170.2	-19.6	31.5	0	0	0	111.9	L189 M192 Y196 D209 H215 V216	L189-P212 HydrophobicContact CD1-CB 4.45Å; M192-P212 HydrophobicContact CG-CB 4.27Å; Y196-P212 HydrophobicContact CD2-CB 4.02Å; Y196-P212 HydrophobicContact CD2-CG 3.8Å; Y196-P212 HydrophobicContact CE2-CB 3.87Å; Y196-P212 HydrophobicContact CE2-CG 3.79Å; Y196-P212 HydrophobicContact CG-CG 4.39Å; D209-P212 VanDerWaalsContact O-CD 3.32Å; D209-P212 WeakPolarHBondContact O-CD 3.28Å; P212-H215 PolarHBondContact O-N 3.1Å; P212-V216 WeakPolarHBondContact O-CB 3.43Å; P212-V216 WeakPolarHBondContact O-CG2 3.06Å; P212-V216 PolarHBondContact O-N 2.9Å
213	S	75	Confident	66.6	Low	52 Å²	52	75.7 Å²	75.7	36%	0.364	38%	0.379	S	S	.	.	H	α-helix	trans	-67.8	-42.5	179.3	68.2	0	0	0	0	111.8	D210 H215 V216 D217	D210-S213 PolarHBondContact O-OG 2.63Å; S213-H215 VanDerWaalsContact C-N 3.27Å; S213-H215 PolarHBondContact O-N 2.82Å; S213-V216 PolarHBondContact O-N 3.03Å; S213-D217 WeakPolarHBondContact O-CB 3.4Å; S213-D217 PolarHBondContact O-N 3.33Å
214	E	77.7	Confident	68.7	Low	100 Å²	100	75 Å²	75	47%	0.467	38%	0.375	S	S	.	.	H	α-helix	trans	-62.6	-34.4	174	-80.6	-166.8	-162	0	0	112.9	D210 K218	D210-E214 PolarHBondContact O-N 2.88Å; E214-K218 WeakPolarHBondContact O-CD 3.34Å; E214-K218 VanDerWaalsContact O-CG 3.28Å; E214-K218 WeakPolarHBondContact O-CG 3.3Å; E214-K218 PolarHBondContact O-N 3.34Å; E214-K218 VanDerWaalsContact O-N 3.16Å; E214-K218 IonicContact OE2-NZ 2.97Å; E214-K218 PolarHBondContact OE2-NZ 3.22Å; E214-K218 VanDerWaalsContact OE2-NZ 3.12Å
215	H	76.6	Confident	71.2	Confident	56 Å²	56	71.1 Å²	71.1	26%	0.259	36%	0.362	S	S	.	.	H	α-helix	trans	-68.8	-46.3	177.4	-156.2	135.8	0	0	0	110.3	M192 A211 P212 S213 K218 F219	M192-H215 HydrophobicContact CE-CB 3.8Å; M192-H215 WeakPolarHBondContact CE-ND1 3.23Å; A211-H215 VanDerWaalsContact O-CB 3.23Å; A211-H215 WeakPolarHBondContact O-CB 3.49Å; A211-H215 PolarHBondContact O-N 2.91Å; P212-H215 PolarHBondContact O-N 3.1Å; S213-H215 VanDerWaalsContact C-N 3.27Å; S213-H215 PolarHBondContact O-N 2.82Å; H215-K218 PolarHBondContact O-N 3.31Å; H215-F219 AromaticContact CD2-CD2 3.27Å; H215-F219 WeakPolarHBondContact CD2-CD2 3.33Å; H215-F219 AromaticContact CD2-CE2 3.28Å; H215-F219 WeakPolarHBondContact CD2-CE2 3.38Å; H215-F219 AromaticContact NE2-CD2 3.61Å; H215-F219 AromaticContact NE2-CE2 3.04Å; H215-F219 WeakPolarHBondContact NE2-CE2 3.31Å; H215-F219 AromaticContact NE2-CZ 3.7Å; H215-F219 WeakPolarHBondContact O-CD2 3.39Å; H215-F219 PolarHBondContact O-N 2.83Å
216	V	83.7	Confident	73.5	Confident	4 Å²	4	70.9 Å²	70.9	2%	0.024	36%	0.355	C	S	.	.	H	α-helix	trans	-59.9	-46.6	175.2	172.3	0	0	0	0	110.1	K185 M188 L189 M192 P212 S213 K218 F219 F220	K185-V216 HydrophobicContact CG-CG1 3.94Å; M188-V216 HydrophobicContact CB-CG1 4.16Å; M188-V216 HydrophobicContact CG-CG1 4.1Å; M188-V216 HydrophobicContact CG-CG2 4.26Å; M188-V216 HydrophobicContact SD-CG1 4.12Å; L189-V216 HydrophobicContact CB-CG1 4.48Å; L189-V216 HydrophobicContact CB-CG2 4.32Å; L189-V216 HydrophobicContact CD1-CG2 3.97Å; M192-V216 HydrophobicContact CB-CG2 4.02Å; M192-V216 HydrophobicContact CG-CG2 4.21Å; P212-V216 WeakPolarHBondContact O-CB 3.43Å; P212-V216 WeakPolarHBondContact O-CG2 3.06Å; P212-V216 PolarHBondContact O-N 2.9Å; S213-V216 PolarHBondContact O-N 3.03Å; V216-K218 VanDerWaalsContact C-N 3.31Å; V216-K218 PolarHBondContact O-N 3.21Å; V216-F219 PolarHBondContact O-N 3.16Å; V216-F219 VanDerWaalsContact O-N 3.12Å; V216-F220 WeakPolarHBondContact O-CB 3.29Å; V216-F220 PolarHBondContact O-N 2.91Å
217	D	85.8	Confident	75.7	Confident	67 Å²	67	75.4 Å²	75.4	36%	0.358	36%	0.358	S	S	.	.	H	α-helix	trans	-55.3	-45.9	177.6	-73.8	-18.9	0	0	0	112.4	K185 S213 Q221	K185-D217 WeakPolarHBondContact CE-OD1 3.22Å; K185-D217 IonicContact NZ-OD1 2.59Å; K185-D217 PolarHBondContact NZ-OD1 3.43Å; S213-D217 WeakPolarHBondContact O-CB 3.4Å; S213-D217 PolarHBondContact O-N 3.33Å; D217-Q221 VanDerWaalsContact O-CB 3.23Å; D217-Q221 WeakPolarHBondContact O-CB 3.41Å; D217-Q221 PolarHBondContact O-N 3.36Å
218	K	82.3	Confident	77.8	Confident	118 Å²	118	77.4 Å²	77.4	51%	0.513	37%	0.367	S	S	.	.	H	α-helix	trans	-67.9	-35.7	179.2	-72.2	165.5	-171.3	149	0	112.4	E214 H215 V216 K222	E214-K218 WeakPolarHBondContact O-CD 3.34Å; E214-K218 VanDerWaalsContact O-CG 3.28Å; E214-K218 WeakPolarHBondContact O-CG 3.3Å; E214-K218 PolarHBondContact O-N 3.34Å; E214-K218 VanDerWaalsContact O-N 3.16Å; E214-K218 IonicContact OE2-NZ 2.97Å; E214-K218 PolarHBondContact OE2-NZ 3.22Å; E214-K218 VanDerWaalsContact OE2-NZ 3.12Å; H215-K218 PolarHBondContact O-N 3.31Å; V216-K218 VanDerWaalsContact C-N 3.31Å; V216-K218 PolarHBondContact O-N 3.21Å; K218-K222 WeakPolarHBondContact O-CG 3.48Å
219	F	82.8	Confident	79.7	Confident	23 Å²	23	70.4 Å²	70.4	10%	0.101	35%	0.352	C	S	.	.	H	α-helix	trans	-73.5	-49.1	177.3	-93.6	-113	0	0	0	111.2	M188 H215 V216 Q221 K222 M223 I246	M188-F219 HydrophobicContact SD-CB 4.07Å; H215-F219 AromaticContact CD2-CD2 3.27Å; H215-F219 WeakPolarHBondContact CD2-CD2 3.33Å; H215-F219 AromaticContact CD2-CE2 3.28Å; H215-F219 WeakPolarHBondContact CD2-CE2 3.38Å; H215-F219 AromaticContact NE2-CD2 3.61Å; H215-F219 AromaticContact NE2-CE2 3.04Å; H215-F219 WeakPolarHBondContact NE2-CE2 3.31Å; H215-F219 AromaticContact NE2-CZ 3.7Å; H215-F219 WeakPolarHBondContact O-CD2 3.39Å; H215-F219 PolarHBondContact O-N 2.83Å; V216-F219 PolarHBondContact O-N 3.16Å; V216-F219 VanDerWaalsContact O-N 3.12Å; F219-Q221 PolarHBondContact O-N 3.39Å; F219-K222 WeakPolarHBondContact O-CB 3.35Å; F219-K222 PolarHBondContact O-N 3.3Å; F219-M223 HydrophobicContact CD1-CE 3.92Å; F219-M223 HydrophobicContact CE1-CE 4.5Å; F219-M223 WeakPolarHBondContact O-CG 3.35Å; F219-M223 PolarHBondContact O-N 3.14Å; F219-I246 HydrophobicContact CD1-CG1 4.34Å; F219-I246 HydrophobicContact CD1-CG2 4.27Å; F219-I246 HydrophobicContact CE1-CB 4.12Å; F219-I246 HydrophobicContact CE1-CG1 3.92Å; F219-I246 HydrophobicContact CE1-CG2 3.83Å; F219-I246 HydrophobicContact CZ-CG1 4.11Å
220	F	86.3	Confident	81.7	Confident	17 Å²	17	64.6 Å²	64.6	8%	0.075	32%	0.323	C	S	.	.	H	α-helix	trans	-58.3	-48.5	-179.8	-155.9	-87.1	0	0	0	110.6	K185 M188 V216 K222 M223 D224 G229 V231	K185-F220 HydrophobicContact CB-CD2 3.97Å; K185-F220 HydrophobicContact CB-CE2 3.88Å; K185-F220 HydrophobicContact CB-CG 4.37Å; K185-F220 HydrophobicContact CB-CZ 4.19Å; K185-F220 HydrophobicContact CG-CD2 4.32Å; K185-F220 HydrophobicContact CG-CG 4.42Å; K185-F220 VanDerWaalsContact N-CE2 3.31Å; M188-F220 HydrophobicContact CE-CD2 4.38Å; M188-F220 HydrophobicContact SD-CD2 4.32Å; V216-F220 WeakPolarHBondContact O-CB 3.29Å; V216-F220 PolarHBondContact O-N 2.91Å; F220-K222 PolarHBondContact O-N 3.07Å; F220-K222 VanDerWaalsContact O-N 3.08Å; F220-M223 PolarHBondContact O-N 3.1Å; F220-M223 VanDerWaalsContact O-N 3.13Å; F220-D224 HydrophobicContact CD1-CB 3.95Å; F220-D224 HydrophobicContact CE1-CB 3.79Å; F220-D224 WeakPolarHBondContact CE1-OD2 3.22Å; F220-D224 HydrophobicContact CZ-CB 4.5Å; F220-D224 VanDerWaalsContact O-CB 3.23Å; F220-D224 WeakPolarHBondContact O-CB 3.31Å; F220-D224 PolarHBondContact O-N 3.42Å; F220-G229 VanDerWaalsContact CZ-O 3.3Å; F220-G229 WeakPolarHBondContact CZ-O 3.32Å; F220-V231 HydrophobicContact CD2-CG2 4.2Å; F220-V231 HydrophobicContact CE2-CG2 3.8Å; F220-V231 HydrophobicContact CZ-CG2 4.01Å
221	Q	87.2	Confident	83.7	Confident	138 Å²	138	60.9 Å²	60.9	65%	0.645	30%	0.303	S	S	*	.	H	α-helix	trans	-60.3	-24.9	177.5	-173	174.9	44.5	0	0	114	D217 F219	D217-Q221 VanDerWaalsContact O-CB 3.23Å; D217-Q221 WeakPolarHBondContact O-CB 3.41Å; D217-Q221 PolarHBondContact O-N 3.36Å; F219-Q221 PolarHBondContact O-N 3.39Å
222	K	85.5	Confident	85	Confident	95 Å²	95	61 Å²	61	41%	0.413	30%	0.301	S	S	.	.	H	α-helix	trans	-87.9	-34.1	177.6	-77.2	-176.3	170.8	-165.2	0	112.8	K218 F219 F220 K225 D243 I246	K218-K222 WeakPolarHBondContact O-CG 3.48Å; F219-K222 WeakPolarHBondContact O-CB 3.35Å; F219-K222 PolarHBondContact O-N 3.3Å; F220-K222 PolarHBondContact O-N 3.07Å; F220-K222 VanDerWaalsContact O-N 3.08Å; K222-K225 PolarHBondContact O-NZ 2.84Å; K222-D243 IonicContact NZ-OD2 3.97Å; K222-D243 PolarHBondContact NZ-OD2 3.35Å; K222-I246 HydrophobicContact CB-CD1 3.72Å; K222-I246 HydrophobicContact CD-CD1 3.62Å; K222-I246 HydrophobicContact CD-CG1 4.36Å; K222-I246 HydrophobicContact CG-CD1 4.37Å
223	M	86.3	Confident	86.2	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-81.3	-45.1	-178.8	-73.1	-178.5	173.7	0	0	112	M188 F219 F220 K225 V231 F236 T239 I246 M250	M188-M223 HydrophobicContact CE-SD 3.73Å; F219-M223 HydrophobicContact CD1-CE 3.92Å; F219-M223 HydrophobicContact CE1-CE 4.5Å; F219-M223 WeakPolarHBondContact O-CG 3.35Å; F219-M223 PolarHBondContact O-N 3.14Å; F220-M223 PolarHBondContact O-N 3.1Å; F220-M223 VanDerWaalsContact O-N 3.13Å; M223-K225 PolarHBondContact O-N 3.08Å; M223-V231 HydrophobicContact CB-CG1 3.92Å; M223-V231 HydrophobicContact CB-CG2 3.8Å; M223-F236 HydrophobicContact CE-CD2 4Å; M223-F236 HydrophobicContact CE-CE2 3.84Å; M223-F236 HydrophobicContact SD-CD2 3.89Å; M223-F236 HydrophobicContact SD-CE2 4.18Å; M223-T239 HydrophobicContact CB-CG2 4.48Å; M223-T239 HydrophobicContact CG-CG2 3.76Å; M223-I246 HydrophobicContact CE-CG2 3.48Å; M223-I246 VanDerWaalsContact CE-CG2 3.48Å; M223-M250 HydrophobicContact CE-CG 4.4Å; M223-M250 HydrophobicContact CE-SD 4.02Å
224	D	89.8	Confident	86.9	Confident	14 Å²	14	68.1 Å²	68.1	8%	0.075	33%	0.329	C	S	.	.			trans	-72	92.1	176.1	179.6	2.6	0	0	0	109.6	F220 N226 R227 D228 G229 V231	F220-D224 HydrophobicContact CD1-CB 3.95Å; F220-D224 HydrophobicContact CE1-CB 3.79Å; F220-D224 WeakPolarHBondContact CE1-OD2 3.22Å; F220-D224 HydrophobicContact CZ-CB 4.5Å; F220-D224 VanDerWaalsContact O-CB 3.23Å; F220-D224 WeakPolarHBondContact O-CB 3.31Å; F220-D224 PolarHBondContact O-N 3.42Å; D224-N226 PolarHBondContact OD1-OD1 3.35Å; D224-R227 VanDerWaalsContact CG-CA 3.49Å; D224-R227 WeakPolarHBondContact OD1-CA 3.29Å; D224-R227 PolarHBondContact OD1-N 3.2Å; D224-R227 WeakPolarHBondContact OD2-CA 3.49Å; D224-D228 PolarHBondContact OD1-N 3.02Å; D224-G229 PolarHBondContact OD2-N 2.9Å; D224-V231 HydrophobicContact CB-CG2 4.08Å
225	K	86.8	Confident	87.6	Confident	110 Å²	110	64.2 Å²	64.2	48%	0.478	31%	0.31	S	S	.	.	S	Bend	trans	-78.9	-41.7	-173.6	-69.4	-57.3	-172.4	-154.5	0	111.3	K222 M223 R227 E235	K222-K225 PolarHBondContact O-NZ 2.84Å; M223-K225 PolarHBondContact O-N 3.08Å; K225-R227 VanDerWaalsContact C-N 3.32Å; K225-E235 HydrophobicContact CB-CG 4.44Å; K225-E235 HydrophobicContact CG-CG 4.37Å; K225-E235 PolarHBondContact N-OE1 2.79Å; K225-E235 VanDerWaalsContact N-OE1 3.12Å
226	N	89.4	Confident	88.1	Confident	91 Å²	91	61.5 Å²	61.5	49%	0.487	30%	0.298	S	S	.	.	S	Bend	trans	-83.3	-11.5	-177.3	67.4	1.5	0	0	0	112.4	D224 D228 E235	D224-N226 PolarHBondContact OD1-OD1 3.35Å; N226-D228 VanDerWaalsContact C-N 3.29Å; N226-D228 VanDerWaalsContact CG-CG 3.49Å; N226-D228 PolarHBondContact ND2-OD2 2.88Å; N226-D228 PolarHBondContact OD1-N 3.44Å; N226-D228 VanDerWaalsContact OD1-N 3.11Å; N226-D228 PolarHBondContact OD1-OD1 3.44Å; N226-D228 VanDerWaalsContact OD1-OD1 3.12Å; N226-D228 PolarHBondContact OD1-OD2 3.39Å; N226-E235 PolarHBondContact N-OE1 3.46Å; N226-E235 PolarHBondContact OD1-OE1 3.37Å
227	R	88.2	Confident	88.4	Confident	195 Å²	195	62.8 Å²	62.8	74%	0.736	30%	0.304	S	S	*	.			trans	61.6	35.3	-179.5	-58.1	-176.6	-178.1	174.8	1.2	112.9	D224 K225 G229	D224-R227 VanDerWaalsContact CG-CA 3.49Å; D224-R227 WeakPolarHBondContact OD1-CA 3.29Å; D224-R227 PolarHBondContact OD1-N 3.2Å; D224-R227 WeakPolarHBondContact OD2-CA 3.49Å; K225-R227 VanDerWaalsContact C-N 3.32Å; R227-G229 VanDerWaalsContact C-N 3.27Å
228	D	89.9	Confident	88.5	Confident	84 Å²	84	63.3 Å²	63.3	45%	0.449	31%	0.305	S	S	.	.	S	Bend	trans	-84.5	-4.8	177.2	70	4.5	0	0	0	112.8	D224 N226 V230	D224-D228 PolarHBondContact OD1-N 3.02Å; N226-D228 VanDerWaalsContact C-N 3.29Å; N226-D228 VanDerWaalsContact CG-CG 3.49Å; N226-D228 PolarHBondContact ND2-OD2 2.88Å; N226-D228 PolarHBondContact OD1-N 3.44Å; N226-D228 VanDerWaalsContact OD1-N 3.11Å; N226-D228 PolarHBondContact OD1-OD1 3.44Å; N226-D228 VanDerWaalsContact OD1-OD1 3.12Å; N226-D228 PolarHBondContact OD1-OD2 3.39Å; D228-V230 VanDerWaalsContact CG-CG2 3.49Å; D228-V230 WeakPolarHBondContact OD1-CG2 3.32Å; D228-V230 PolarHBondContact OD1-N 3.3Å; D228-V230 WeakPolarHBondContact OD2-CG2 3.21Å
229	G	88.1	Confident	88.8	Confident	37 Å²	37	57.8 Å²	57.8	38%	0.381	28%	0.281	S	S	.	.	S	Bend	trans	86.9	7.6	179	0	0	0	0	0	113.9	F220 D224 R227	F220-G229 VanDerWaalsContact CZ-O 3.3Å; F220-G229 WeakPolarHBondContact CZ-O 3.32Å; D224-G229 PolarHBondContact OD2-N 2.9Å; R227-G229 VanDerWaalsContact C-N 3.27Å
230	V	92.3	Very high	88.9	Confident	37 Å²	37	56.7 Å²	56.7	22%	0.224	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	157.2	172.5	-65.6	0	0	0	0	110.7	Y182 T184 D228	Y182-V230 HydrophobicContact CD1-CB 4.23Å; Y182-V230 HydrophobicContact CD1-CG2 3.8Å; Y182-V230 HydrophobicContact CE1-CG2 4.47Å; Y182-V230 HydrophobicContact CG-CG2 4.47Å; T184-V230 HydrophobicContact CG2-CG1 4.33Å; D228-V230 VanDerWaalsContact CG-CG2 3.49Å; D228-V230 WeakPolarHBondContact OD1-CG2 3.32Å; D228-V230 PolarHBondContact OD1-N 3.3Å; D228-V230 WeakPolarHBondContact OD2-CG2 3.21Å
231	V	92.3	Very high	88.8	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	118.2	174.8	176.8	0	0	0	0	109.1	I183 F220 M223 D224 E235 F236	I183-V231 HydrophobicContact CB-CB 4.24Å; I183-V231 PolarHBondContact N-O 2.76Å; I183-V231 PolarHBondContact O-N 3.05Å; F220-V231 HydrophobicContact CD2-CG2 4.2Å; F220-V231 HydrophobicContact CE2-CG2 3.8Å; F220-V231 HydrophobicContact CZ-CG2 4.01Å; M223-V231 HydrophobicContact CB-CG1 3.92Å; M223-V231 HydrophobicContact CB-CG2 3.8Å; D224-V231 HydrophobicContact CB-CG2 4.08Å; V231-E235 HydrophobicContact CG1-CB 4.26Å; V231-F236 HydrophobicContact CG1-CB 4.07Å
232	T	93.1	Very high	88.7	Confident	30 Å²	30	61.6 Å²	61.6	18%	0.184	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	161.3	174.6	60.2	0	0	0	0	112	Y182 E234 E235 F236	Y182-T232 HydrophobicContact CD1-CG2 3.85Å; Y182-T232 HydrophobicContact CE1-CG2 3.74Å; T232-E234 PolarHBondContact O-N 3.4Å; T232-E235 PolarHBondContact N-OE2 2.82Å; T232-E235 PolarHBondContact O-N 2.91Å; T232-E235 WeakPolarHBondContact OG1-CB 3.34Å; T232-E235 VanDerWaalsContact OG1-CG 3.27Å; T232-E235 WeakPolarHBondContact OG1-CG 3.16Å; T232-E235 PolarHBondContact OG1-N 2.93Å; T232-E235 PolarHBondContact OG1-OE2 2.96Å; T232-F236 WeakPolarHBondContact O-CB 3.13Å; T232-F236 PolarHBondContact O-N 3.42Å
233	I	90.6	Very high	88.6	Confident	62 Å²	62	58.7 Å²	58.7	32%	0.318	29%	0.286	S	S	.	.	H	α-helix	trans	-58.1	-35.5	175.7	-166.2	168.1	0	0	0	112.6	N169 F172 F236 I237	N169-I233 WeakPolarHBondContact OD1-CD1 3.47Å; F172-I233 HydrophobicContact CB-CG1 4.41Å; F172-I233 HydrophobicContact CD1-CB 4.27Å; F172-I233 HydrophobicContact CD1-CD1 4.16Å; F172-I233 HydrophobicContact CD1-CG1 4.16Å; F172-I233 HydrophobicContact CD2-CB 4.09Å; F172-I233 HydrophobicContact CD2-CG1 4.14Å; F172-I233 HydrophobicContact CE1-CB 4.18Å; F172-I233 VanDerWaalsContact CE2-CA 3.48Å; F172-I233 HydrophobicContact CE2-CB 3.98Å; F172-I233 HydrophobicContact CG-CB 4.25Å; F172-I233 HydrophobicContact CG-CD1 4.33Å; F172-I233 HydrophobicContact CG-CG1 3.95Å; F172-I233 HydrophobicContact CZ-CB 4.04Å; I233-F236 PolarHBondContact O-N 3.38Å; I233-I237 HydrophobicContact CG1-CD1 3.95Å; I233-I237 HydrophobicContact CG1-CG1 4.46Å; I233-I237 WeakPolarHBondContact O-CB 3.46Å; I233-I237 VanDerWaalsContact O-CG1 3.26Å; I233-I237 WeakPolarHBondContact O-CG1 3.46Å; I233-I237 PolarHBondContact O-N 3.17Å
234	E	90.9	Very high	88.3	Confident	153 Å²	153	65.7 Å²	65.7	72%	0.715	32%	0.318	S	S	*	.	H	α-helix	trans	-67.1	-48.1	179.1	-68.3	166.8	-176.7	0	0	110.6	T232 F236 I237 E238	T232-E234 PolarHBondContact O-N 3.4Å; E234-F236 VanDerWaalsContact C-N 3.31Å; E234-F236 PolarHBondContact O-N 2.68Å; E234-I237 PolarHBondContact O-N 3.33Å; E234-E238 WeakPolarHBondContact O-CB 3.17Å; E234-E238 PolarHBondContact O-N 3.03Å
235	E	91.3	Very high	87.6	Confident	17 Å²	17	70.5 Å²	70.5	8%	0.079	34%	0.344	C	S	.	.	H	α-helix	trans	-62.9	-38.2	175.2	-74	172.1	127.2	0	0	112.4	K225 N226 V231 T232 T239	K225-E235 HydrophobicContact CB-CG 4.44Å; K225-E235 HydrophobicContact CG-CG 4.37Å; K225-E235 PolarHBondContact N-OE1 2.79Å; K225-E235 VanDerWaalsContact N-OE1 3.12Å; N226-E235 PolarHBondContact N-OE1 3.46Å; N226-E235 PolarHBondContact OD1-OE1 3.37Å; V231-E235 HydrophobicContact CG1-CB 4.26Å; T232-E235 PolarHBondContact N-OE2 2.82Å; T232-E235 PolarHBondContact O-N 2.91Å; T232-E235 WeakPolarHBondContact OG1-CB 3.34Å; T232-E235 VanDerWaalsContact OG1-CG 3.27Å; T232-E235 WeakPolarHBondContact OG1-CG 3.16Å; T232-E235 PolarHBondContact OG1-N 2.93Å; T232-E235 PolarHBondContact OG1-OE2 2.96Å; E235-T239 WeakPolarHBondContact O-CB 3.22Å; E235-T239 PolarHBondContact O-N 3.4Å; E235-T239 PolarHBondContact O-OG1 3.02Å
236	F	88.9	Confident	87.2	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-63.1	-52	177.2	-177.1	-96.6	0	0	0	111.4	L168 A171 F172 I183 M223 V231 T232 I233 E234 T239 C240 M250	L168-F236 HydrophobicContact CB-CE1 4.42Å; L168-F236 HydrophobicContact CD2-CE1 4.12Å; L168-F236 WeakPolarHBondContact O-CE1 3.4Å; A171-F236 HydrophobicContact CB-CE1 4.46Å; A171-F236 HydrophobicContact CB-CZ 4.39Å; F172-F236 HydrophobicContact CB-CD1 4.07Å; F172-F236 HydrophobicContact CB-CE1 4.21Å; F172-F236 HydrophobicContact CD2-CB 3.79Å; F172-F236 HydrophobicContact CD2-CD1 4.09Å; F172-F236 HydrophobicContact CD2-CD2 4.39Å; F172-F236 AromaticContact CD2-CG 3.84Å; F172-F236 HydrophobicContact CD2-CG 3.84Å; F172-F236 HydrophobicContact CE2-CB 4.26Å; I183-F236 HydrophobicContact CD1-CD2 4.16Å; I183-F236 HydrophobicContact CD1-CE2 4.48Å; M223-F236 HydrophobicContact CE-CD2 4Å; M223-F236 HydrophobicContact CE-CE2 3.84Å; M223-F236 HydrophobicContact SD-CD2 3.89Å; M223-F236 HydrophobicContact SD-CE2 4.18Å; V231-F236 HydrophobicContact CG1-CB 4.07Å; T232-F236 WeakPolarHBondContact O-CB 3.13Å; T232-F236 PolarHBondContact O-N 3.42Å; I233-F236 PolarHBondContact O-N 3.38Å; E234-F236 VanDerWaalsContact C-N 3.31Å; E234-F236 PolarHBondContact O-N 2.68Å; F236-T239 PolarHBondContact O-N 2.88Å; F236-C240 VanDerWaalsContact O-CB 3.31Å; F236-C240 WeakPolarHBondContact O-CB 3.12Å; F236-C240 PolarHBondContact O-N 3.42Å; F236-C240 PolarHBondContact O-SG 2.85Å; F236-M250 HydrophobicContact CE2-SD 3.66Å; F236-M250 HydrophobicContact CZ-SD 3.6Å
237	I	88.1	Confident	86.6	Confident	30 Å²	30	63 Å²	63	15%	0.154	31%	0.308	C	S	.	.	H	α-helix	trans	-64.6	-46.5	179.5	-67.7	168.9	0	0	0	110.3	L168 N169 I233 E234 T239 C240 Q241	L168-I237 HydrophobicContact CB-CG1 4.31Å; L168-I237 HydrophobicContact CD1-CG2 4.37Å; N169-I237 WeakPolarHBondContact OD1-CD1 3.13Å; I233-I237 HydrophobicContact CG1-CD1 3.95Å; I233-I237 HydrophobicContact CG1-CG1 4.46Å; I233-I237 WeakPolarHBondContact O-CB 3.46Å; I233-I237 VanDerWaalsContact O-CG1 3.26Å; I233-I237 WeakPolarHBondContact O-CG1 3.46Å; I233-I237 PolarHBondContact O-N 3.17Å; E234-I237 PolarHBondContact O-N 3.33Å; I237-T239 VanDerWaalsContact C-N 3.33Å; I237-T239 PolarHBondContact O-N 3.08Å; I237-C240 PolarHBondContact O-N 3.25Å; I237-Q241 HydrophobicContact CG2-CG 4.29Å; I237-Q241 WeakPolarHBondContact O-CB 3.4Å; I237-Q241 VanDerWaalsContact O-CG 3.28Å; I237-Q241 WeakPolarHBondContact O-CG 3.41Å; I237-Q241 PolarHBondContact O-N 3.48Å
238	E	89.1	Confident	85.7	Confident	79 Å²	79	57.7 Å²	57.7	37%	0.369	30%	0.295	S	S	.	.	H	α-helix	trans	-60.5	-44.4	-179.5	-174.1	-176.1	-164.6	0	0	111.1	E234 Q241 K242	E234-E238 WeakPolarHBondContact O-CB 3.17Å; E234-E238 PolarHBondContact O-N 3.03Å; E238-Q241 PolarHBondContact O-N 3.09Å; E238-K242 HydrophobicContact CG-CD 3.93Å; E238-K242 WeakPolarHBondContact O-CB 3.24Å; E238-K242 VanDerWaalsContact O-CG 3.29Å; E238-K242 WeakPolarHBondContact O-CG 3.14Å; E238-K242 PolarHBondContact O-N 2.97Å; E238-K242 WeakPolarHBondContact OE1-CE 3.39Å; E238-K242 IonicContact OE1-NZ 3.49Å; E238-K242 PolarHBondContact OE1-NZ 3.48Å
239	T	87.9	Confident	84.7	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.012	28%	0.283	C	S	.	.	H	α-helix	trans	-68	-42.7	179.1	-60.6	0	0	0	0	111.5	M223 E235 F236 I237 Q241 K242 D243 I246	M223-T239 HydrophobicContact CB-CG2 4.48Å; M223-T239 HydrophobicContact CG-CG2 3.76Å; E235-T239 WeakPolarHBondContact O-CB 3.22Å; E235-T239 PolarHBondContact O-N 3.4Å; E235-T239 PolarHBondContact O-OG1 3.02Å; F236-T239 PolarHBondContact O-N 2.88Å; I237-T239 VanDerWaalsContact C-N 3.33Å; I237-T239 PolarHBondContact O-N 3.08Å; T239-Q241 VanDerWaalsContact C-N 3.3Å; T239-Q241 PolarHBondContact O-N 2.86Å; T239-K242 PolarHBondContact O-N 2.96Å; T239-D243 PolarHBondContact O-N 3.15Å; T239-I246 HydrophobicContact CG2-CD1 3.5Å; T239-I246 VanDerWaalsContact CG2-CD1 3.5Å; T239-I246 HydrophobicContact CG2-CG2 4.5Å
240	C	85.4	Confident	83.8	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62	-37.6	175.1	-71.3	0	0	0	0	111.9	L168 F236 I237 M247	L168-C240 HydrophobicContact CD1-CB 4.04Å; L168-C240 HydrophobicContact CD2-CB 3.72Å; F236-C240 VanDerWaalsContact O-CB 3.31Å; F236-C240 WeakPolarHBondContact O-CB 3.12Å; F236-C240 PolarHBondContact O-N 3.42Å; F236-C240 PolarHBondContact O-SG 2.85Å; I237-C240 PolarHBondContact O-N 3.25Å; C240-M247 WeakPolarHBondContact O-CB 3.48Å; C240-M247 WeakPolarHBondContact O-CE 3.43Å
241	Q	84.1	Confident	82.4	Confident	110 Å²	110	55.1 Å²	55.1	51%	0.514	27%	0.271	S	S	.	.	H	α-helix	trans	-74.7	-30.1	178.3	-72.7	179.1	0.9	0	0	113.3	I237 E238 T239	I237-Q241 HydrophobicContact CG2-CG 4.29Å; I237-Q241 WeakPolarHBondContact O-CB 3.4Å; I237-Q241 VanDerWaalsContact O-CG 3.28Å; I237-Q241 WeakPolarHBondContact O-CG 3.41Å; I237-Q241 PolarHBondContact O-N 3.48Å; E238-Q241 PolarHBondContact O-N 3.09Å; T239-Q241 VanDerWaalsContact C-N 3.3Å; T239-Q241 PolarHBondContact O-N 2.86Å
242	K	85.4	Confident	80.6	Confident	148 Å²	148	60.3 Å²	60.3	64%	0.643	30%	0.298	S	S	*	.	H	α-helix	trans	-86.8	-35.4	-177.7	-74.2	179.9	178.9	-179.6	0	114.2	E238 T239	E238-K242 HydrophobicContact CG-CD 3.93Å; E238-K242 WeakPolarHBondContact O-CB 3.24Å; E238-K242 VanDerWaalsContact O-CG 3.29Å; E238-K242 WeakPolarHBondContact O-CG 3.14Å; E238-K242 PolarHBondContact O-N 2.97Å; E238-K242 WeakPolarHBondContact OE1-CE 3.39Å; E238-K242 IonicContact OE1-NZ 3.49Å; E238-K242 PolarHBondContact OE1-NZ 3.48Å; T239-K242 PolarHBondContact O-N 2.96Å
243	D	83.5	Confident	78.8	Confident	33 Å²	33	60.5 Å²	60.5	18%	0.176	30%	0.297	C	S	.	.			trans	-108.8	101.7	-177.3	-170.1	-23	0	0	0	110.6	K222 T239 N245 I246 M247	K222-D243 IonicContact NZ-OD2 3.97Å; K222-D243 PolarHBondContact NZ-OD2 3.35Å; T239-D243 PolarHBondContact O-N 3.15Å; D243-N245 PolarHBondContact O-N 2.84Å; D243-N245 VanDerWaalsContact O-N 3.16Å; D243-N245 WeakPolarHBondContact OD1-CA 3.32Å; D243-N245 VanDerWaalsContact OD1-CB 3.3Å; D243-N245 WeakPolarHBondContact OD1-CB 3.27Å; D243-N245 PolarHBondContact OD1-N 2.69Å; D243-N245 PolarHBondContact OD1-ND2 3.44Å; D243-I246 HydrophobicContact CB-CB 4.06Å; D243-I246 HydrophobicContact CB-CD1 4.07Å; D243-I246 HydrophobicContact CB-CG1 4.09Å; D243-I246 PolarHBondContact O-N 3.17Å; D243-I246 VanDerWaalsContact O-N 3.1Å; D243-I246 PolarHBondContact OD1-N 2.87Å; D243-M247 PolarHBondContact O-N 3.39Å
244	E	78.9	Confident	77	Confident	147 Å²	147	59.1 Å²	59.1	69%	0.687	29%	0.289	S	S	*	.	H	α-helix	trans	-57.9	-28.1	177.1	-70.5	-169	173.8	0	0	112.9	N248	E244-N248 VanDerWaalsContact O-CB 3.22Å; E244-N248 WeakPolarHBondContact O-CB 3.43Å; E244-N248 PolarHBondContact O-N 2.85Å; E244-N248 PolarHBondContact O-ND2 3.43Å
245	N	76.4	Confident	74.8	Confident	115 Å²	115	55 Å²	55	62%	0.615	27%	0.271	S	S	*	.	H	α-helix	trans	-72.5	-40.1	178.2	-58.3	-69.4	0	0	0	111	D243 N248 S249	D243-N245 PolarHBondContact O-N 2.84Å; D243-N245 VanDerWaalsContact O-N 3.16Å; D243-N245 WeakPolarHBondContact OD1-CA 3.32Å; D243-N245 VanDerWaalsContact OD1-CB 3.3Å; D243-N245 WeakPolarHBondContact OD1-CB 3.27Å; D243-N245 PolarHBondContact OD1-N 2.69Å; D243-N245 PolarHBondContact OD1-ND2 3.44Å; N245-N248 PolarHBondContact O-N 3.37Å; N245-S249 WeakPolarHBondContact O-CB 3.17Å; N245-S249 PolarHBondContact O-N 2.71Å; N245-S249 PolarHBondContact O-OG 2.94Å; N245-S249 VanDerWaalsContact O-OG 3.13Å
246	I	76.6	Confident	72.5	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-64.3	-47	173.6	-71.3	-179.8	0	0	0	109.5	F219 K222 M223 T239 D243 N248 S249 M250	F219-I246 HydrophobicContact CD1-CG1 4.34Å; F219-I246 HydrophobicContact CD1-CG2 4.27Å; F219-I246 HydrophobicContact CE1-CB 4.12Å; F219-I246 HydrophobicContact CE1-CG1 3.92Å; F219-I246 HydrophobicContact CE1-CG2 3.83Å; F219-I246 HydrophobicContact CZ-CG1 4.11Å; K222-I246 HydrophobicContact CB-CD1 3.72Å; K222-I246 HydrophobicContact CD-CD1 3.62Å; K222-I246 HydrophobicContact CD-CG1 4.36Å; K222-I246 HydrophobicContact CG-CD1 4.37Å; M223-I246 HydrophobicContact CE-CG2 3.48Å; M223-I246 VanDerWaalsContact CE-CG2 3.48Å; T239-I246 HydrophobicContact CG2-CD1 3.5Å; T239-I246 VanDerWaalsContact CG2-CD1 3.5Å; T239-I246 HydrophobicContact CG2-CG2 4.5Å; D243-I246 HydrophobicContact CB-CB 4.06Å; D243-I246 HydrophobicContact CB-CD1 4.07Å; D243-I246 HydrophobicContact CB-CG1 4.09Å; D243-I246 PolarHBondContact O-N 3.17Å; D243-I246 VanDerWaalsContact O-N 3.1Å; D243-I246 PolarHBondContact OD1-N 2.87Å; I246-N248 VanDerWaalsContact C-N 3.34Å; I246-N248 PolarHBondContact O-N 3.33Å; I246-S249 PolarHBondContact O-N 3.46Å; I246-M250 HydrophobicContact CG2-CG 4.12Å; I246-M250 WeakPolarHBondContact O-CB 3.37Å; I246-M250 VanDerWaalsContact O-CG 3.23Å; I246-M250 WeakPolarHBondContact O-CG 3.43Å; I246-M250 PolarHBondContact O-N 3.17Å
247	M	77.9	Confident	70.2	Confident	42 Å²	42	55.9 Å²	55.9	21%	0.207	28%	0.277	C	S	.	.	H	α-helix	trans	-57.7	-46.9	177.4	-162.4	-169.3	-75	0	0	111.5	C240 D243 S249 M250 Q251	C240-M247 WeakPolarHBondContact O-CB 3.48Å; C240-M247 WeakPolarHBondContact O-CE 3.43Å; D243-M247 PolarHBondContact O-N 3.39Å; M247-S249 PolarHBondContact O-N 3.01Å; M247-M250 PolarHBondContact O-N 3.46Å; M247-Q251 HydrophobicContact CG-CG 4.46Å; M247-Q251 VanDerWaalsContact O-CB 3.26Å; M247-Q251 WeakPolarHBondContact O-CB 3.43Å; M247-Q251 VanDerWaalsContact O-CG 3.26Å; M247-Q251 WeakPolarHBondContact O-CG 3.37Å; M247-Q251 PolarHBondContact O-N 3.14Å
248	N	69.9	Low	69.3	Low	84 Å²	84	57.2 Å²	57.2	45%	0.449	28%	0.283	S	S	.	.	H	α-helix	trans	-66.2	-36.6	180	-77.5	-52.2	0	0	0	112.5	E244 N245 I246 L252	E244-N248 VanDerWaalsContact O-CB 3.22Å; E244-N248 WeakPolarHBondContact O-CB 3.43Å; E244-N248 PolarHBondContact O-N 2.85Å; E244-N248 PolarHBondContact O-ND2 3.43Å; N245-N248 PolarHBondContact O-N 3.37Å; I246-N248 VanDerWaalsContact C-N 3.34Å; I246-N248 PolarHBondContact O-N 3.33Å; N248-L252 WeakPolarHBondContact O-CB 3.26Å; N248-L252 VanDerWaalsContact O-CG 3.29Å; N248-L252 WeakPolarHBondContact O-CG 3.23Å; N248-L252 PolarHBondContact O-N 3.1Å
249	S	68.6	Low	68.2	Low	30 Å²	30	56.1 Å²	56.1	21%	0.21	28%	0.279	C	S	.	.	H	α-helix	trans	-69.2	-44.5	174.6	-69.3	0	0	0	0	111.8	N245 I246 M247 Q251 L252 F253	N245-S249 WeakPolarHBondContact O-CB 3.17Å; N245-S249 PolarHBondContact O-N 2.71Å; N245-S249 PolarHBondContact O-OG 2.94Å; N245-S249 VanDerWaalsContact O-OG 3.13Å; I246-S249 PolarHBondContact O-N 3.46Å; M247-S249 PolarHBondContact O-N 3.01Å; S249-Q251 PolarHBondContact O-N 3.35Å; S249-L252 WeakPolarHBondContact O-CB 3.08Å; S249-L252 PolarHBondContact O-N 2.81Å; S249-L252 VanDerWaalsContact O-N 3.17Å; S249-F253 WeakPolarHBondContact O-CD2 3.49Å; S249-F253 VanDerWaalsContact O-CE2 3.26Å; S249-F253 WeakPolarHBondContact O-CE2 3.19Å; S249-F253 PolarHBondContact O-N 2.89Å
250	M	67.8	Low	67.1	Low	11 Å²	11	59.1 Å²	59.1	5%	0.054	29%	0.294	C	S	.	.	H	α-helix	trans	-60.3	-45.8	174.3	-69.5	-90.1	77.7	0	0	111.3	Y175 M223 F236 I246 M247 L252 F253 E254	Y175-M250 HydrophobicContact CD2-CE 4.49Å; Y175-M250 HydrophobicContact CE1-CE 4.25Å; Y175-M250 HydrophobicContact CE2-CE 3.42Å; Y175-M250 VanDerWaalsContact CE2-CE 3.42Å; Y175-M250 HydrophobicContact CE2-SD 4.01Å; Y175-M250 WeakPolarHBondContact OH-CE 3.48Å; M223-M250 HydrophobicContact CE-CG 4.4Å; M223-M250 HydrophobicContact CE-SD 4.02Å; F236-M250 HydrophobicContact CE2-SD 3.66Å; F236-M250 HydrophobicContact CZ-SD 3.6Å; I246-M250 HydrophobicContact CG2-CG 4.12Å; I246-M250 WeakPolarHBondContact O-CB 3.37Å; I246-M250 VanDerWaalsContact O-CG 3.23Å; I246-M250 WeakPolarHBondContact O-CG 3.43Å; I246-M250 PolarHBondContact O-N 3.17Å; M247-M250 PolarHBondContact O-N 3.46Å; M250-L252 VanDerWaalsContact C-N 3.29Å; M250-L252 PolarHBondContact O-N 2.64Å; M250-F253 HydrophobicContact CE-CD2 3.99Å; M250-F253 WeakPolarHBondContact O-CA 2.99Å; M250-F253 WeakPolarHBondContact O-CB 3.43Å; M250-F253 PolarHBondContact O-N 2.72Å; M250-E254 PolarHBondContact O-N 3.25Å
251	Q	62.9	Low	66.1	Low	63 Å²	63	62.5 Å²	62.5	29%	0.294	31%	0.311	S	S	.	.	H	α-helix	trans	-64.9	-31.9	175.6	-76.9	179.4	6.4	0	0	112.3	M247 S249 F253 E254 N255	M247-Q251 HydrophobicContact CG-CG 4.46Å; M247-Q251 VanDerWaalsContact O-CB 3.26Å; M247-Q251 WeakPolarHBondContact O-CB 3.43Å; M247-Q251 VanDerWaalsContact O-CG 3.26Å; M247-Q251 WeakPolarHBondContact O-CG 3.37Å; M247-Q251 PolarHBondContact O-N 3.14Å; S249-Q251 PolarHBondContact O-N 3.35Å; Q251-F253 PolarHBondContact O-N 2.98Å; Q251-E254 PolarHBondContact O-N 3.21Å; Q251-N255 VanDerWaalsContact O-CB 3.31Å; Q251-N255 WeakPolarHBondContact O-CB 3.29Å; Q251-N255 PolarHBondContact O-N 3.25Å; Q251-N255 PolarHBondContact O-ND2 3.27Å
252	L	55.5	Low	64.9	Low	109 Å²	109	59.6 Å²	59.6	57%	0.571	30%	0.298	S	S	*	.	H	α-helix	trans	-60.8	-35.9	172.6	-87.6	164.1	0	0	0	111	N248 S249 M250 V256	N248-L252 WeakPolarHBondContact O-CB 3.26Å; N248-L252 VanDerWaalsContact O-CG 3.29Å; N248-L252 WeakPolarHBondContact O-CG 3.23Å; N248-L252 PolarHBondContact O-N 3.1Å; S249-L252 WeakPolarHBondContact O-CB 3.08Å; S249-L252 PolarHBondContact O-N 2.81Å; S249-L252 VanDerWaalsContact O-N 3.17Å; M250-L252 VanDerWaalsContact C-N 3.29Å; M250-L252 PolarHBondContact O-N 2.64Å; L252-V256 VanDerWaalsContact O-CG2 3.31Å; L252-V256 WeakPolarHBondContact O-CG2 3.08Å
253	F	55	Low	63.6	Low	34 Å²	34	53.7 Å²	53.7	15%	0.149	28%	0.275	C	S	.	.	H	α-helix	trans	-76.7	-37.4	174.6	-55.9	-57.9	0	0	0	112.5	M192 I195 S249 M250 Q251 N255 V256	M192-F253 HydrophobicContact CE-CE2 4.45Å; M192-F253 HydrophobicContact CE-CZ 3.86Å; M192-F253 HydrophobicContact SD-CE1 4.27Å; M192-F253 HydrophobicContact SD-CE2 4.37Å; M192-F253 HydrophobicContact SD-CZ 3.83Å; I195-F253 HydrophobicContact CD1-CB 4.2Å; I195-F253 HydrophobicContact CD1-CD1 3.75Å; I195-F253 HydrophobicContact CD1-CE1 4.35Å; I195-F253 HydrophobicContact CD1-CG 4.03Å; I195-F253 HydrophobicContact CG2-CD1 3.89Å; I195-F253 HydrophobicContact CG2-CE1 4.04Å; S249-F253 WeakPolarHBondContact O-CD2 3.49Å; S249-F253 VanDerWaalsContact O-CE2 3.26Å; S249-F253 WeakPolarHBondContact O-CE2 3.19Å; S249-F253 PolarHBondContact O-N 2.89Å; M250-F253 HydrophobicContact CE-CD2 3.99Å; M250-F253 WeakPolarHBondContact O-CA 2.99Å; M250-F253 WeakPolarHBondContact O-CB 3.43Å; M250-F253 PolarHBondContact O-N 2.72Å; Q251-F253 PolarHBondContact O-N 2.98Å; F253-N255 VanDerWaalsContact C-N 3.3Å; F253-N255 PolarHBondContact O-N 3.27Å; F253-V256 WeakPolarHBondContact O-CB 3.23Å; F253-V256 PolarHBondContact O-N 3.49Å; F253-V256 VanDerWaalsContact O-N 3.14Å
254	E	53.9	Low	62.1	Low	33 Å²	33	55.1 Å²	55.1	15%	0.154	28%	0.282	C	S	.	.	H	α-helix	trans	-63.2	-34.8	171.1	-71.3	-177.3	157.1	0	0	112.6	M250 Q251 V256 I257	M250-E254 PolarHBondContact O-N 3.25Å; Q251-E254 PolarHBondContact O-N 3.21Å; E254-V256 PolarHBondContact O-N 3Å; E254-I257 WeakPolarHBondContact O-CB 3.09Å; E254-I257 PolarHBondContact O-N 2.81Å; E254-I257 VanDerWaalsContact O-N 3.11Å
255	N	44.3	Very low	60.8	Low	65 Å²	65	48.1 Å²	48.1	35%	0.348	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-5.9	177.2	-72.3	-54.1	0	0	0	113.1	Q251 F253	Q251-N255 VanDerWaalsContact O-CB 3.31Å; Q251-N255 WeakPolarHBondContact O-CB 3.29Å; Q251-N255 PolarHBondContact O-N 3.25Å; Q251-N255 PolarHBondContact O-ND2 3.27Å; F253-N255 VanDerWaalsContact C-N 3.3Å; F253-N255 PolarHBondContact O-N 3.27Å
256	V	42.6	Very low	59.6	Low	16 Å²	16	42.5 Å²	42.5	10%	0.097	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-14.9	170.1	175.2	0	0	0	0	111	L42 F123 M198 L252 F253 E254	L42-V256 HydrophobicContact CD2-CG2 4.42Å; F123-V256 HydrophobicContact CZ-CG1 4.43Å; M198-V256 HydrophobicContact CE-CG1 3.25Å; M198-V256 HydrophobicContact SD-CG1 4.43Å; L252-V256 VanDerWaalsContact O-CG2 3.31Å; L252-V256 WeakPolarHBondContact O-CG2 3.08Å; F253-V256 WeakPolarHBondContact O-CB 3.23Å; F253-V256 PolarHBondContact O-N 3.49Å; F253-V256 VanDerWaalsContact O-N 3.14Å; E254-V256 PolarHBondContact O-N 3Å
257	I	39.8	Very low	58	Low	21 Å²	21	46.2 Å²	46.2	11%	0.108	24%	0.24	C	C	.	.			trans	-86.1	0	170.7	-47.4	174.7	0	0	0	109.3	Y131 L135 L159 W170 L174 E254	Y131-I257 HydrophobicContact CE1-CG1 4.49Å; Y131-I257 WeakPolarHBondContact OH-CD1 3.5Å; Y131-I257 WeakPolarHBondContact OH-CG1 3.17Å; L135-I257 HydrophobicContact CD2-CD1 4.06Å; L135-I257 HydrophobicContact CD2-CG1 4.34Å; L135-I257 HydrophobicContact CD2-CG2 4.15Å; L159-I257 HydrophobicContact CD1-CG2 4.14Å; W170-I257 HydrophobicContact CH2-CD1 3.81Å; W170-I257 HydrophobicContact CH2-CG2 4.24Å; W170-I257 HydrophobicContact CZ3-CD1 3.46Å; W170-I257 VanDerWaalsContact CZ3-CD1 3.46Å; L174-I257 HydrophobicContact CD2-CD1 3.81Å; E254-I257 WeakPolarHBondContact O-CB 3.09Å; E254-I257 PolarHBondContact O-N 2.81Å; E254-I257 VanDerWaalsContact O-N 3.11Å

Retrieved 257 of 257 residues in 213.4 ms (Link to these results)

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