A0A077Z7H1_TRITR Loading...

Gem-associated protein 2

The SMN complex catalyzes the assembly of small nuclear ribonucleoproteins (snRNPs), the building blocks of the spliceosome, and thereby plays an important role in the splicing of cellular pre-mRNAs.

AlphaFold DB , UniProt , Accession A0A077Z7H1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 258 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.9	Very low	47.9	Very low	244 Å²	244	160.5 Å²	160.5	100%	1.202	82%	0.824	S	S	*	*				0	92	0	-166.8	174.5	-173.5	0	0	106.4
2	Y	37.8	Very low	48.8	Very low	229 Å²	229	160.3 Å²	160.3	90%	0.898	82%	0.817	S	S	*	*			trans	-94.9	119.9	179.7	-81.6	-88.3	0	0	0	107.9
3	K	42.7	Very low	49.6	Very low	184 Å²	184	160.4 Å²	160.4	80%	0.8	82%	0.821	S	S	*	*			trans	-90	115.8	162	-100	-175.4	170.2	-173.1	0	106.9
4	F	40.5	Very low	50.7	Low	190 Å²	190	158.1 Å²	158.1	83%	0.833	82%	0.817	S	S	*	*			trans	-96	94.4	170.4	-135	-88.4	0	0	0	105.2	A6	F4-A6 HydrophobicContact CD1-CB 4.23Å; F4-A6 PolarHBondContact O-N 3.43Å
5	D	52.6	Low	51.6	Low	145 Å²	145	153.7 Å²	153.7	78%	0.775	80%	0.803	S	S	*	*			trans	-89.1	88.6	169.5	-66.1	-30.4	0	0	0	106.1
6	A	47.7	Very low	52.7	Low	69 Å²	69	156.3 Å²	156.3	57%	0.57	82%	0.817	S	S	*	*			trans	-98.1	97.3	168.1	0	0	0	0	0	106.4	F4	F4-A6 HydrophobicContact CD1-CB 4.23Å; F4-A6 PolarHBondContact O-N 3.43Å
7	D	47.1	Very low	53.6	Low	170 Å²	170	150.7 Å²	150.7	91%	0.909	81%	0.806	S	S	*	*			trans	176.9	85.8	159.4	-86.2	-20.6	0	0	0	108.2
8	S	50.2	Low	54.9	Low	91 Å²	91	152.8 Å²	152.8	64%	0.636	81%	0.806	S	S	*	*			trans	-157.5	81.4	165.1	-172	0	0	0	0	109.4	T10	S8-T10 PolarHBondContact O-N 3.49Å; S8-T10 PolarHBondContact OG-OG1 3.36Å
9	D	55.3	Low	56.1	Low	180 Å²	180	149.1 Å²	149.1	96%	0.963	80%	0.8	S	S	*	*			trans	-69.1	58.3	164.3	-87.6	-17.7	0	0	0	110.3
10	T	56.3	Low	57.4	Low	88 Å²	88	147.6 Å²	147.6	54%	0.54	80%	0.8	S	S	.	*			trans	-106.1	110.6	163.7	50.2	0	0	0	0	106.1	S8 E12	S8-T10 PolarHBondContact O-N 3.49Å; S8-T10 PolarHBondContact OG-OG1 3.36Å; T10-E12 PolarHBondContact O-N 3.15Å
11	D	57.8	Low	58.6	Low	175 Å²	175	147.4 Å²	147.4	94%	0.936	79%	0.792	S	S	*	*			trans	-62.4	40.1	166.7	-75	-33.3	0	0	0	111.7	D13	D11-D13 PolarHBondContact O-N 3.17Å
12	E	58.7	Low	60.7	Low	158 Å²	158	145.3 Å²	145.3	74%	0.738	78%	0.779	S	S	*	*			trans	-80.4	109.6	160.5	-68.7	-155.1	165.7	0	0	106	T10 V14	T10-E12 PolarHBondContact O-N 3.15Å; E12-V14 PolarHBondContact O-N 3.03Å
13	D	59.8	Low	62.8	Low	162 Å²	162	136 Å²	136	87%	0.866	75%	0.746	S	S	*	*			trans	-48.2	90.1	168.7	-75.8	-47.6	0	0	0	109.2	D11 P15	D11-D13 PolarHBondContact O-N 3.17Å; D13-P15 WeakPolarHBondContact O-CD 3.25Å
14	V	64.3	Low	64.7	Low	128 Å²	128	130.5 Å²	130.5	78%	0.776	73%	0.726	S	S	*	*			trans	-63.2	112.6	176.1	178.2	0	0	0	0	105.6	E12 L16	E12-V14 PolarHBondContact O-N 3.03Å; V14-L16 PolarHBondContact O-N 2.69Å; V14-L16 VanDerWaalsContact O-N 3.08Å
15	P	63.7	Low	66.6	Low	93 Å²	93	125.5 Å²	125.5	60%	0.604	71%	0.707	S	S	*	*			trans	-62.4	122.9	-176.5	23.2	-30.7	0	0	0	108.3	D13 G17	D13-P15 WeakPolarHBondContact O-CD 3.25Å; P15-G17 PolarHBondContact O-N 3.31Å
16	L	70	Confident	67.9	Low	195 Å²	195	123.6 Å²	123.6	100%	1.021	70%	0.697	S	S	*	*	S	Bend	trans	-54.6	-9.1	179.2	-82.8	151.9	0	0	0	113.8	V14	V14-L16 PolarHBondContact O-N 2.69Å; V14-L16 VanDerWaalsContact O-N 3.08Å
17	G	67.3	Low	69.4	Low	61 Å²	61	126.2 Å²	126.2	63%	0.629	70%	0.701	S	S	*	*	S	Bend	trans	-150.3	126.9	162.7	0	0	0	0	0	111	P15	P15-G17 PolarHBondContact O-N 3.31Å
18	K	77.3	Confident	70.8	Confident	188 Å²	188	118.4 Å²	118.4	82%	0.817	66%	0.659	S	S	*	*			trans	-83.2	135.2	168.5	-175.2	177	179	177.9	0	109.1	C20	K18-C20 PolarHBondContact O-N 3.02Å
19	A	78.2	Confident	72	Confident	83 Å²	83	121.7 Å²	121.7	69%	0.686	67%	0.67	S	S	*	*			trans	-61.7	124.1	172.8	0	0	0	0	0	110	F21	A19-F21 VanDerWaalsContact C-N 3.3Å
20	C	81.7	Confident	73	Confident	118 Å²	118	117.6 Å²	117.6	80%	0.797	66%	0.655	S	S	*	*	S	Bend	trans	-80.1	-14.2	177.4	-63.2	0	0	0	0	113.2	K18	K18-C20 PolarHBondContact O-N 3.02Å
21	F	83.4	Confident	74.1	Confident	144 Å²	144	114.2 Å²	114.2	63%	0.632	64%	0.635	S	S	*	*	S	Bend	trans	-127.1	132.8	-177.7	-57.9	-72.3	0	0	0	109.5	A19 V23 L44	A19-F21 VanDerWaalsContact C-N 3.3Å; F21-V23 HydrophobicContact CB-CG2 4.13Å; F21-L44 HydrophobicContact CB-CD1 3.81Å; F21-L44 HydrophobicContact CD2-CD1 4.35Å; F21-L44 HydrophobicContact CG-CD1 4.03Å
22	E	83	Confident	75.2	Confident	201 Å²	201	109.9 Å²	109.9	94%	0.939	61%	0.611	S	S	*	*			trans	-79.1	117.4	168.7	-66.1	-179.7	-178.1	0	0	107.9
23	V	80.6	Confident	76.3	Confident	32 Å²	32	104.5 Å²	104.5	19%	0.194	59%	0.589	C	S	.	*			trans	-130.6	129.6	-177.9	-176.5	0	0	0	0	107.6	F21 L25 L44 R45	F21-V23 HydrophobicContact CB-CG2 4.13Å; V23-L25 HydrophobicContact CB-CD2 4.37Å; V23-L25 HydrophobicContact CG1-CD2 4.3Å; V23-L25 PolarHBondContact O-N 2.69Å; V23-L44 HydrophobicContact CG1-CB 4.02Å; V23-L44 HydrophobicContact CG2-CB 3.7Å; V23-L44 HydrophobicContact CG2-CD1 3.5Å; V23-L44 HydrophobicContact CG2-CG 4.21Å; V23-R45 HydrophobicContact CG1-CG 3.54Å
24	D	82.5	Confident	77.3	Confident	70 Å²	70	102.9 Å²	102.9	37%	0.374	59%	0.585	S	S	.	*			trans	-68.1	113.2	173.1	-176.6	11.5	0	0	0	110.3	N26 R45	D24-N26 VanDerWaalsContact C-N 3.33Å; D24-N26 VanDerWaalsContact OD1-CB 3.28Å; D24-N26 WeakPolarHBondContact OD1-CB 3.07Å; D24-N26 PolarHBondContact OD1-N 3.12Å; D24-N26 PolarHBondContact OD1-ND2 2.78Å; D24-R45 VanDerWaalsContact O-CD 3.3Å; D24-R45 WeakPolarHBondContact O-CD 3.24Å; D24-R45 WeakPolarHBondContact O-CG 3.36Å; D24-R45 PolarHBondContact O-NE 3.49Å
25	L	80.4	Confident	78.3	Confident	84 Å²	84	101 Å²	101	44%	0.44	57%	0.568	S	S	.	*			trans	-90.3	5.2	-178.3	-56.8	-176.1	0	0	0	113.2	V23 L28 V48	V23-L25 HydrophobicContact CB-CD2 4.37Å; V23-L25 HydrophobicContact CG1-CD2 4.3Å; V23-L25 PolarHBondContact O-N 2.69Å; L25-L28 HydrophobicContact CB-CD1 3.99Å; L25-L28 HydrophobicContact CD2-CD1 4.21Å; L25-L28 VanDerWaalsContact O-CD1 3.27Å; L25-L28 WeakPolarHBondContact O-CD1 3.28Å; L25-L28 WeakPolarHBondContact O-CG 3.3Å; L25-V48 HydrophobicContact CD2-CB 4.47Å; L25-V48 HydrophobicContact CD2-CG1 4.07Å; L25-V48 HydrophobicContact CD2-CG2 4.22Å
26	N	81	Confident	79.5	Confident	105 Å²	105	100.1 Å²	100.1	56%	0.561	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	146.1	176.7	-66.2	-42.4	0	0	0	111.1	D24 L28 R45	D24-N26 VanDerWaalsContact C-N 3.33Å; D24-N26 VanDerWaalsContact OD1-CB 3.28Å; D24-N26 WeakPolarHBondContact OD1-CB 3.07Å; D24-N26 PolarHBondContact OD1-N 3.12Å; D24-N26 PolarHBondContact OD1-ND2 2.78Å; N26-L28 VanDerWaalsContact C-N 3.28Å; N26-L28 PolarHBondContact O-N 2.7Å; N26-L28 VanDerWaalsContact O-N 3.12Å; N26-R45 PolarHBondContact O-NH2 3.33Å
27	N	78.1	Confident	80.5	Confident	125 Å²	125	93.8 Å²	93.8	67%	0.668	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	35	173.3	-58.9	-27.7	0	0	0	115.9	D29 S30	N27-D29 PolarHBondContact O-N 3.07Å; N27-D29 VanDerWaalsContact O-N 3.12Å; N27-S30 PolarHBondContact O-N 3.38Å; N27-S30 VanDerWaalsContact O-N 3.09Å; N27-S30 PolarHBondContact O-OG 2.97Å
28	L	77.1	Confident	81.4	Confident	5 Å²	5	98.1 Å²	98.1	3%	0.026	54%	0.541	C	S	.	.	G	3₁₀ helix	trans	-58.3	-23.3	178.6	-76.4	161.8	0	0	0	113.8	L25 N26 S30 V31 R45 V48 A49 R52	L25-L28 HydrophobicContact CB-CD1 3.99Å; L25-L28 HydrophobicContact CD2-CD1 4.21Å; L25-L28 VanDerWaalsContact O-CD1 3.27Å; L25-L28 WeakPolarHBondContact O-CD1 3.28Å; L25-L28 WeakPolarHBondContact O-CG 3.3Å; N26-L28 VanDerWaalsContact C-N 3.28Å; N26-L28 PolarHBondContact O-N 2.7Å; N26-L28 VanDerWaalsContact O-N 3.12Å; L28-S30 PolarHBondContact O-N 3.2Å; L28-V31 PolarHBondContact O-N 3.18Å; L28-R45 HydrophobicContact CD2-CB 4.03Å; L28-R45 HydrophobicContact CD2-CG 4.37Å; L28-R45 VanDerWaalsContact CD2-O 3.31Å; L28-R45 WeakPolarHBondContact CD2-O 3.42Å; L28-V48 HydrophobicContact CD1-CG1 3.76Å; L28-V48 HydrophobicContact CD2-CB 4.18Å; L28-V48 HydrophobicContact CD2-CG1 4.28Å; L28-A49 HydrophobicContact CB-CB 4.43Å; L28-A49 HydrophobicContact CD2-CB 4.3Å; L28-R52 VanDerWaalsContact CD1-NH1 3.34Å
29	D	75.2	Confident	82	Confident	161 Å²	161	93.1 Å²	93.1	86%	0.861	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-71.8	-16.7	178.6	-57.6	-38.8	0	0	0	113.5	N27	N27-D29 PolarHBondContact O-N 3.07Å; N27-D29 VanDerWaalsContact O-N 3.12Å
30	S	77.2	Confident	82.4	Confident	93 Å²	93	93.9 Å²	93.9	65%	0.65	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-90.5	-4.8	178.9	67.3	0	0	0	0	114	N27 L28 D32	N27-S30 PolarHBondContact O-N 3.38Å; N27-S30 VanDerWaalsContact O-N 3.09Å; N27-S30 PolarHBondContact O-OG 2.97Å; L28-S30 PolarHBondContact O-N 3.2Å; S30-D32 PolarHBondContact O-N 3.39Å
31	V	78.7	Confident	82.7	Confident	18 Å²	18	92.7 Å²	92.7	11%	0.109	51%	0.509	C	S	.	.			trans	-79.6	115.8	-176.3	-177.7	0	0	0	0	109.3	L28 V33 R45 M46	L28-V31 PolarHBondContact O-N 3.18Å; V31-V33 PolarHBondContact O-N 3.36Å; V31-R45 HydrophobicContact CG2-CB 4.34Å; V31-M46 HydrophobicContact CG1-CB 4.22Å; V31-M46 HydrophobicContact CG1-CG 3.42Å; V31-M46 VanDerWaalsContact CG1-CG 3.42Å
32	D	81.1	Confident	82.9	Confident	83 Å²	83	88.4 Å²	88.4	44%	0.444	49%	0.491	S	S	.	.			trans	-72.3	112.8	172	-170.9	-5.9	0	0	0	109.7	S30 T34	S30-D32 PolarHBondContact O-N 3.39Å; D32-T34 VanDerWaalsContact CG-OG1 3.32Å; D32-T34 PolarHBondContact O-N 2.94Å; D32-T34 WeakPolarHBondContact OD1-CB 3.5Å; D32-T34 PolarHBondContact OD1-N 3.33Å; D32-T34 PolarHBondContact OD1-OG1 2.98Å; D32-T34 PolarHBondContact OD2-OG1 3.49Å
33	V	81.1	Confident	83.2	Confident	45 Å²	45	85 Å²	85	27%	0.273	47%	0.47	S	S	.	.	S	Bend	trans	-79.5	-8.8	-179.3	-170.5	0	0	0	0	111.3	V31 M46 E50	V31-V33 PolarHBondContact O-N 3.36Å; V33-M46 WeakPolarHBondContact O-CE 3.38Å; V33-E50 HydrophobicContact CG1-CB 4.49Å
34	T	81.5	Confident	83.7	Confident	129 Å²	129	85.8 Å²	85.8	79%	0.791	47%	0.473	S	S	*	.	S	Bend	trans	-93.3	-21.3	-175.7	67.3	0	0	0	0	114.4	D32	D32-T34 VanDerWaalsContact CG-OG1 3.32Å; D32-T34 PolarHBondContact O-N 2.94Å; D32-T34 WeakPolarHBondContact OD1-CB 3.5Å; D32-T34 PolarHBondContact OD1-N 3.33Å; D32-T34 PolarHBondContact OD1-OG1 2.98Å; D32-T34 PolarHBondContact OD2-OG1 3.49Å
35	E	85.8	Confident	84	Confident	89 Å²	89	84.8 Å²	84.8	42%	0.416	46%	0.464	S	S	.	.	S	Bend	trans	-80.9	148.7	175.3	-162.2	-176.2	-178.2	0	0	111.1	K38 M46	E35-K38 VanDerWaalsContact CD-NZ 3.3Å; E35-K38 WeakPolarHBondContact OE1-CE 3.37Å; E35-K38 IonicContact OE1-NZ 2.69Å; E35-K38 PolarHBondContact OE1-NZ 3.26Å; E35-K38 IonicContact OE2-NZ 3.17Å; E35-K38 PolarHBondContact OE2-NZ 3.38Å; E35-M46 WeakPolarHBondContact O-CE 3.43Å
36	A	88.8	Confident	84.4	Confident	73 Å²	73	81.6 Å²	81.6	60%	0.603	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-63.9	136	171.6	0	0	0	0	0	111	K38	A36-K38 PolarHBondContact O-N 3.37Å
37	P	89.6	Confident	84.7	Confident	62 Å²	62	79.1 Å²	79.1	40%	0.403	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-66.1	132.2	-178.2	27.1	-35.5	0	0	0	111.7	Y43 M46	P37-Y43 HydrophobicContact CB-CD2 4.35Å; P37-Y43 HydrophobicContact CG-CD2 3.99Å; P37-M46 HydrophobicContact CB-SD 3.84Å
38	K	86.2	Confident	85.2	Confident	153 Å²	153	75.2 Å²	75.2	67%	0.665	42%	0.416	S	S	*	.	S	Bend	trans	-87.5	-22.5	179.5	-66.2	171.2	-177.7	149.8	0	113.4	E35 A36	E35-K38 VanDerWaalsContact CD-NZ 3.3Å; E35-K38 WeakPolarHBondContact OE1-CE 3.37Å; E35-K38 IonicContact OE1-NZ 2.69Å; E35-K38 PolarHBondContact OE1-NZ 3.26Å; E35-K38 IonicContact OE2-NZ 3.17Å; E35-K38 PolarHBondContact OE2-NZ 3.38Å; A36-K38 PolarHBondContact O-N 3.37Å
39	T	90.1	Very high	85.7	Confident	82 Å²	82	75.4 Å²	75.4	50%	0.503	42%	0.418	S	S	.	.	S	Bend	trans	-142.3	161.7	179.9	65.7	0	0	0	0	111	E41 H42 Y43	T39-E41 VanDerWaalsContact C-N 3.33Å; T39-E41 PolarHBondContact O-N 3.09Å; T39-H42 PolarHBondContact O-N 2.87Å; T39-H42 VanDerWaalsContact OG1-CB 3.25Å; T39-H42 WeakPolarHBondContact OG1-CB 3.47Å; T39-H42 PolarHBondContact OG1-N 3.46Å; T39-H42 VanDerWaalsContact OG1-N 3.15Å; T39-Y43 PolarHBondContact O-N 3.17Å
40	S	86.8	Confident	86.4	Confident	100 Å²	100	72.4 Å²	72.4	70%	0.699	40%	0.399	S	S	*	.	H	α-helix	trans	-61.9	-39.2	175.7	50.3	0	0	0	0	112.6	Y43 L44	S40-Y43 WeakPolarHBondContact O-CB 3.42Å; S40-Y43 PolarHBondContact O-N 3.4Å; S40-L44 WeakPolarHBondContact O-CG 3.38Å; S40-L44 PolarHBondContact O-N 3.36Å
41	E	88.2	Confident	86.8	Confident	93 Å²	93	73.5 Å²	73.5	44%	0.435	39%	0.389	S	S	.	.	H	α-helix	trans	-67.1	-42.1	176.5	-171.1	-175.3	168.3	0	0	111.6	T39 Y43 L44 R45	T39-E41 VanDerWaalsContact C-N 3.33Å; T39-E41 PolarHBondContact O-N 3.09Å; E41-Y43 VanDerWaalsContact C-N 3.28Å; E41-Y43 PolarHBondContact O-N 3.27Å; E41-L44 PolarHBondContact O-N 2.85Å; E41-R45 WeakPolarHBondContact O-CG 3.3Å; E41-R45 PolarHBondContact O-N 3.12Å
42	H	88.1	Confident	87.1	Confident	53 Å²	53	80.1 Å²	80.1	25%	0.245	41%	0.412	C	S	.	.	H	α-helix	trans	-59.3	-42.4	174.9	-174	-93.1	0	0	0	111.1	T39 R45 M46	T39-H42 PolarHBondContact O-N 2.87Å; T39-H42 VanDerWaalsContact OG1-CB 3.25Å; T39-H42 WeakPolarHBondContact OG1-CB 3.47Å; T39-H42 PolarHBondContact OG1-N 3.46Å; T39-H42 VanDerWaalsContact OG1-N 3.15Å; H42-R45 PolarHBondContact O-N 3.3Å; H42-M46 PolarHBondContact CE1-SD 3.46Å; H42-M46 PolarHBondContact ND1-SD 2.85Å; H42-M46 VanDerWaalsContact ND1-SD 3.37Å; H42-M46 VanDerWaalsContact O-CG 3.3Å; H42-M46 WeakPolarHBondContact O-CG 3.17Å; H42-M46 PolarHBondContact O-N 2.65Å
43	Y	89.6	Confident	87.3	Confident	130 Å²	130	83.7 Å²	83.7	51%	0.51	42%	0.424	S	S	.	.	H	α-helix	trans	-58.8	-48.8	174.4	175.4	-104.2	0	0	0	112.3	P37 T39 S40 E41 R45 M46 V47	P37-Y43 HydrophobicContact CB-CD2 4.35Å; P37-Y43 HydrophobicContact CG-CD2 3.99Å; T39-Y43 PolarHBondContact O-N 3.17Å; S40-Y43 WeakPolarHBondContact O-CB 3.42Å; S40-Y43 PolarHBondContact O-N 3.4Å; E41-Y43 VanDerWaalsContact C-N 3.28Å; E41-Y43 PolarHBondContact O-N 3.27Å; Y43-R45 VanDerWaalsContact C-N 3.3Å; Y43-R45 PolarHBondContact O-N 2.98Å; Y43-M46 WeakPolarHBondContact O-CB 3.42Å; Y43-M46 PolarHBondContact O-N 3.34Å; Y43-V47 HydrophobicContact CD1-CG2 4.33Å; Y43-V47 HydrophobicContact CD2-CG2 4.41Å; Y43-V47 HydrophobicContact CE1-CG2 3.88Å; Y43-V47 HydrophobicContact CE2-CG2 3.99Å; Y43-V47 WeakPolarHBondContact O-CG2 3.27Å; Y43-V47 PolarHBondContact O-N 3.47Å
44	L	90.1	Very high	87.5	Confident	48 Å²	48	86.6 Å²	86.6	25%	0.251	44%	0.437	S	S	.	.	H	α-helix	trans	-62.4	-37.4	179.1	-68.3	175.6	0	0	0	112.2	F21 V23 S40 E41 V47 V48	F21-L44 HydrophobicContact CB-CD1 3.81Å; F21-L44 HydrophobicContact CD2-CD1 4.35Å; F21-L44 HydrophobicContact CG-CD1 4.03Å; V23-L44 HydrophobicContact CG1-CB 4.02Å; V23-L44 HydrophobicContact CG2-CB 3.7Å; V23-L44 HydrophobicContact CG2-CD1 3.5Å; V23-L44 HydrophobicContact CG2-CG 4.21Å; S40-L44 WeakPolarHBondContact O-CG 3.38Å; S40-L44 PolarHBondContact O-N 3.36Å; E41-L44 PolarHBondContact O-N 2.85Å; L44-V47 PolarHBondContact O-N 3.29Å; L44-V48 WeakPolarHBondContact O-CG2 3.38Å; L44-V48 PolarHBondContact O-N 2.93Å
45	R	88.4	Confident	87.7	Confident	50 Å²	50	84.2 Å²	84.2	19%	0.189	43%	0.425	C	S	.	.	H	α-helix	trans	-64.7	-42.2	173.7	-71.1	179.2	66.3	173.2	-0.4	112.4	V23 D24 N26 L28 V31 E41 H42 Y43 V47 V48 A49	V23-R45 HydrophobicContact CG1-CG 3.54Å; D24-R45 VanDerWaalsContact O-CD 3.3Å; D24-R45 WeakPolarHBondContact O-CD 3.24Å; D24-R45 WeakPolarHBondContact O-CG 3.36Å; D24-R45 PolarHBondContact O-NE 3.49Å; N26-R45 PolarHBondContact O-NH2 3.33Å; L28-R45 HydrophobicContact CD2-CB 4.03Å; L28-R45 HydrophobicContact CD2-CG 4.37Å; L28-R45 VanDerWaalsContact CD2-O 3.31Å; L28-R45 WeakPolarHBondContact CD2-O 3.42Å; V31-R45 HydrophobicContact CG2-CB 4.34Å; E41-R45 WeakPolarHBondContact O-CG 3.3Å; E41-R45 PolarHBondContact O-N 3.12Å; H42-R45 PolarHBondContact O-N 3.3Å; Y43-R45 VanDerWaalsContact C-N 3.3Å; Y43-R45 PolarHBondContact O-N 2.98Å; R45-V47 VanDerWaalsContact C-N 3.32Å; R45-V47 PolarHBondContact O-N 3.06Å; R45-V48 PolarHBondContact O-N 3.37Å; R45-A49 WeakPolarHBondContact O-CB 3.41Å; R45-A49 PolarHBondContact O-N 3.25Å
46	M	89.4	Confident	87.6	Confident	16 Å²	16	83.6 Å²	83.6	8%	0.079	44%	0.435	C	S	.	.	H	α-helix	trans	-58	-45.7	173.4	-69.9	170.3	77.7	0	0	111.1	V31 V33 E35 P37 H42 Y43 V48 A49 E50	V31-M46 HydrophobicContact CG1-CB 4.22Å; V31-M46 HydrophobicContact CG1-CG 3.42Å; V31-M46 VanDerWaalsContact CG1-CG 3.42Å; V33-M46 WeakPolarHBondContact O-CE 3.38Å; E35-M46 WeakPolarHBondContact O-CE 3.43Å; P37-M46 HydrophobicContact CB-SD 3.84Å; H42-M46 PolarHBondContact CE1-SD 3.46Å; H42-M46 PolarHBondContact ND1-SD 2.85Å; H42-M46 VanDerWaalsContact ND1-SD 3.37Å; H42-M46 VanDerWaalsContact O-CG 3.3Å; H42-M46 WeakPolarHBondContact O-CG 3.17Å; H42-M46 PolarHBondContact O-N 2.65Å; Y43-M46 WeakPolarHBondContact O-CB 3.42Å; Y43-M46 PolarHBondContact O-N 3.34Å; M46-V48 PolarHBondContact O-N 3.34Å; M46-A49 PolarHBondContact O-N 3.08Å; M46-E50 WeakPolarHBondContact O-CB 3.38Å; M46-E50 PolarHBondContact O-N 3.44Å
47	V	88.4	Confident	87.4	Confident	54 Å²	54	85.7 Å²	85.7	33%	0.327	44%	0.441	S	S	.	.	H	α-helix	trans	-62.3	-43.4	178.8	171.8	0	0	0	0	111.5	Y43 L44 R45 E50 R51	Y43-V47 HydrophobicContact CD1-CG2 4.33Å; Y43-V47 HydrophobicContact CD2-CG2 4.41Å; Y43-V47 HydrophobicContact CE1-CG2 3.88Å; Y43-V47 HydrophobicContact CE2-CG2 3.99Å; Y43-V47 WeakPolarHBondContact O-CG2 3.27Å; Y43-V47 PolarHBondContact O-N 3.47Å; L44-V47 PolarHBondContact O-N 3.29Å; R45-V47 VanDerWaalsContact C-N 3.32Å; R45-V47 PolarHBondContact O-N 3.06Å; V47-E50 PolarHBondContact O-N 3.47Å; V47-R51 VanDerWaalsContact O-CB 3.24Å; V47-R51 WeakPolarHBondContact O-CB 3.31Å; V47-R51 PolarHBondContact O-N 2.84Å
48	V	88.4	Confident	87.1	Confident	43 Å²	43	87.6 Å²	87.6	26%	0.261	45%	0.453	S	S	.	.	H	α-helix	trans	-66.2	-41	177.1	177.3	0	0	0	0	111.2	L25 L28 L44 R45 M46 R51 R52	L25-V48 HydrophobicContact CD2-CB 4.47Å; L25-V48 HydrophobicContact CD2-CG1 4.07Å; L25-V48 HydrophobicContact CD2-CG2 4.22Å; L28-V48 HydrophobicContact CD1-CG1 3.76Å; L28-V48 HydrophobicContact CD2-CB 4.18Å; L28-V48 HydrophobicContact CD2-CG1 4.28Å; L44-V48 WeakPolarHBondContact O-CG2 3.38Å; L44-V48 PolarHBondContact O-N 2.93Å; R45-V48 PolarHBondContact O-N 3.37Å; M46-V48 PolarHBondContact O-N 3.34Å; V48-R51 PolarHBondContact O-N 2.69Å; V48-R52 WeakPolarHBondContact O-CG 3.41Å; V48-R52 PolarHBondContact O-N 2.96Å
49	A	88.1	Confident	87.1	Confident	8 Å²	8	86 Å²	86	7%	0.066	46%	0.456	C	S	.	.	H	α-helix	trans	-64.3	-42.1	176.8	0	0	0	0	0	112	L28 R45 M46 R52	L28-A49 HydrophobicContact CB-CB 4.43Å; L28-A49 HydrophobicContact CD2-CB 4.3Å; R45-A49 WeakPolarHBondContact O-CB 3.41Å; R45-A49 PolarHBondContact O-N 3.25Å; M46-A49 PolarHBondContact O-N 3.08Å; A49-R52 PolarHBondContact O-N 2.89Å
50	E	89.1	Confident	86.7	Confident	99 Å²	99	85.7 Å²	85.7	46%	0.463	46%	0.462	S	S	.	.	H	α-helix	trans	-63.2	-46.3	173.3	-175.3	-178.4	-162.1	0	0	111.3	V33 M46 V47 R52 K53 L54	V33-E50 HydrophobicContact CG1-CB 4.49Å; M46-E50 WeakPolarHBondContact O-CB 3.38Å; M46-E50 PolarHBondContact O-N 3.44Å; V47-E50 PolarHBondContact O-N 3.47Å; E50-R52 VanDerWaalsContact C-N 3.26Å; E50-R52 PolarHBondContact O-N 3.25Å; E50-K53 WeakPolarHBondContact O-CB 3.12Å; E50-K53 PolarHBondContact O-N 2.98Å; E50-L54 PolarHBondContact O-N 2.86Å
51	R	85.7	Confident	86.1	Confident	116 Å²	116	90.6 Å²	90.6	44%	0.438	47%	0.47	S	S	.	.	H	α-helix	trans	-58.7	-36.2	179.1	177.1	59.7	-176.1	117.6	-15.1	112.8	V47 V48 K53 L54 S55 A56	V47-R51 VanDerWaalsContact O-CB 3.24Å; V47-R51 WeakPolarHBondContact O-CB 3.31Å; V47-R51 PolarHBondContact O-N 2.84Å; V48-R51 PolarHBondContact O-N 2.69Å; R51-K53 VanDerWaalsContact C-N 3.26Å; R51-K53 PolarHBondContact O-N 3.32Å; R51-L54 PolarHBondContact NH1-O 3.39Å; R51-L54 PolarHBondContact O-N 2.74Å; R51-S55 PolarHBondContact NH1-O 3.37Å; R51-A56 PolarHBondContact NH2-O 2.93Å
52	R	85.7	Confident	85.3	Confident	156 Å²	156	94.9 Å²	94.9	59%	0.589	49%	0.49	S	S	*	.	H	α-helix	trans	-66.4	-24.3	175.8	-76.5	-179.6	177.6	-173.1	1.9	113.2	L28 V48 A49 E50	L28-R52 VanDerWaalsContact CD1-NH1 3.34Å; V48-R52 WeakPolarHBondContact O-CG 3.41Å; V48-R52 PolarHBondContact O-N 2.96Å; A49-R52 PolarHBondContact O-N 2.89Å; E50-R52 VanDerWaalsContact C-N 3.26Å; E50-R52 PolarHBondContact O-N 3.25Å
53	K	85.3	Confident	84.3	Confident	159 Å²	159	98.8 Å²	98.8	69%	0.691	51%	0.512	S	S	*	.	H	α-helix	trans	-80.7	-24.2	174.9	-62.1	174.5	-175	176.3	0	112.4	E50 R51	E50-K53 WeakPolarHBondContact O-CB 3.12Å; E50-K53 PolarHBondContact O-N 2.98Å; R51-K53 VanDerWaalsContact C-N 3.26Å; R51-K53 PolarHBondContact O-N 3.32Å
54	L	84.6	Confident	83.1	Confident	106 Å²	106	100.8 Å²	100.8	56%	0.555	53%	0.531	S	S	*	.	S	Bend	trans	-84.4	145.7	178.3	-62.7	173.3	0	0	0	110.8	E50 R51	E50-L54 PolarHBondContact O-N 2.86Å; R51-L54 PolarHBondContact NH1-O 3.39Å; R51-L54 PolarHBondContact O-N 2.74Å
55	S	85.4	Confident	81.7	Confident	78 Å²	78	102.7 Å²	102.7	55%	0.545	54%	0.544	S	S	.	.			trans	-60.3	142.1	173.8	57.1	0	0	0	0	111	R51 V57	R51-S55 PolarHBondContact NH1-O 3.37Å; S55-V57 VanDerWaalsContact C-N 3.33Å; S55-V57 PolarHBondContact O-N 3.46Å
56	A	83.4	Confident	80.2	Confident	76 Å²	76	107.6 Å²	107.6	63%	0.628	57%	0.574	S	S	*	*	S	Bend	trans	-62.2	-43.4	-178.1	0	0	0	0	0	111.6	R51	R51-A56 PolarHBondContact NH2-O 2.93Å
57	V	85.4	Confident	78.8	Confident	117 Å²	117	110.9 Å²	110.9	71%	0.709	61%	0.612	S	S	*	*	S	Bend	trans	-131.5	96.6	179.9	-176.7	0	0	0	0	108.3	S55	S55-V57 VanDerWaalsContact C-N 3.33Å; S55-V57 PolarHBondContact O-N 3.46Å
58	P	83.7	Confident	77.2	Confident	103 Å²	103	111.5 Å²	111.5	67%	0.669	62%	0.623	S	S	*	*			trans	-73	133.9	172.5	29.1	-32.4	0	0	0	110.1
59	V	85.3	Confident	75.7	Confident	120 Å²	120	121.1 Å²	121.1	73%	0.727	66%	0.655	S	S	*	*			trans	-114.5	116	174.9	-178.4	0	0	0	0	108.9	K61	V59-K61 PolarHBondContact O-N 3.3Å
60	A	81.1	Confident	74.4	Confident	75 Å²	75	124.7 Å²	124.7	62%	0.62	68%	0.679	S	S	*	*			trans	-76.5	115.5	173.9	0	0	0	0	0	110
61	K	74.1	Confident	73.3	Confident	202 Å²	202	131.7 Å²	131.7	88%	0.878	70%	0.701	S	S	*	*	S	Bend	trans	-79.6	-30.3	-179	-68.6	-175.2	179.1	179.4	0	113.4	V59	V59-K61 PolarHBondContact O-N 3.3Å
62	E	71.6	Confident	72.7	Confident	183 Å²	183	133.5 Å²	133.5	86%	0.855	72%	0.715	S	S	*	*			trans	-117.5	91.5	-177.4	-69.4	-178.4	-176	0	0	109.2
63	L	68	Low	72.4	Confident	135 Å²	135	132 Å²	132	71%	0.707	72%	0.723	S	S	*	*			trans	-80.2	123.3	162	-68	165.1	0	0	0	106.6	V65	L63-V65 HydrophobicContact CB-CG2 3.75Å; L63-V65 PolarHBondContact O-N 3.37Å
64	L	62.9	Low	72	Confident	173 Å²	173	130.9 Å²	130.9	91%	0.906	72%	0.723	S	S	*	*			trans	-66.2	69.9	171.2	-73.5	166	0	0	0	109.7	N66	L64-N66 PolarHBondContact O-N 3.32Å
65	V	61.7	Low	71.6	Confident	87 Å²	87	135.2 Å²	135.2	53%	0.527	74%	0.738	S	S	.	*			trans	-90.8	92	174.5	-173.2	0	0	0	0	106.7	L63 G67	L63-V65 HydrophobicContact CB-CG2 3.75Å; L63-V65 PolarHBondContact O-N 3.37Å; V65-G67 VanDerWaalsContact C-N 3.35Å; V65-G67 PolarHBondContact O-N 3.05Å
66	N	57.9	Low	70.8	Confident	153 Å²	153	137.2 Å²	137.2	82%	0.818	75%	0.746	S	S	*	*			trans	-58.7	96.9	167	-76.5	-21.3	0	0	0	109.1	L64 A68	L64-N66 PolarHBondContact O-N 3.32Å; N66-A68 PolarHBondContact O-N 3.33Å
67	G	58.2	Low	69.9	Low	85 Å²	85	142.5 Å²	142.5	88%	0.876	75%	0.75	S	S	*	*	S	Bend	trans	64.9	-10.8	158.5	0	0	0	0	0	119	V65 R69	V65-G67 VanDerWaalsContact C-N 3.35Å; V65-G67 PolarHBondContact O-N 3.05Å; G67-R69 PolarHBondContact O-N 3.28Å
68	A	55.4	Low	68.6	Low	67 Å²	67	145.4 Å²	145.4	55%	0.554	76%	0.756	S	S	*	*			trans	-97.4	63.7	-176.9	0	0	0	0	0	111.3	N66 S70	N66-A68 PolarHBondContact O-N 3.33Å; A68-S70 PolarHBondContact O-N 3.23Å
69	R	56.7	Low	67.1	Low	246 Å²	246	146.5 Å²	146.5	93%	0.928	75%	0.752	S	S	*	*			trans	-67	91.9	164.1	-84.6	-175.5	175.6	179.5	-0.8	108.4	G67	G67-R69 PolarHBondContact O-N 3.28Å
70	S	61	Low	65.5	Low	82 Å²	82	151 Å²	151	57%	0.573	76%	0.756	S	S	*	*			trans	73.8	93.6	158.8	-159.9	0	0	0	0	117.4	A68 Q72	A68-S70 PolarHBondContact O-N 3.23Å; S70-Q72 PolarHBondContact O-N 2.94Å; S70-Q72 WeakPolarHBondContact OG-CB 3.36Å; S70-Q72 PolarHBondContact OG-N 3.15Å
71	R	66.2	Low	64.1	Low	247 Å²	247	155.9 Å²	155.9	93%	0.932	76%	0.759	S	S	*	*			trans	-85.8	44	148.6	-67.8	-177.7	178.1	169.4	-1	109.8	T73	R71-T73 PolarHBondContact O-N 3.11Å
72	Q	73.7	Confident	63.1	Low	154 Å²	154	149.6 Å²	149.6	72%	0.72	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-67.3	123.1	-178.6	-176.4	170.4	19.2	0	0	109	S70 I74	S70-Q72 PolarHBondContact O-N 2.94Å; S70-Q72 WeakPolarHBondContact OG-CB 3.36Å; S70-Q72 PolarHBondContact OG-N 3.15Å; Q72-I74 PolarHBondContact O-N 3.47Å; Q72-I74 VanDerWaalsContact O-N 3.12Å
73	T	77.9	Confident	62.4	Low	123 Å²	123	142.5 Å²	142.5	76%	0.755	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-59.9	117.2	169.9	-45.8	0	0	0	0	107.6	R71 F75	R71-T73 PolarHBondContact O-N 3.11Å; T73-F75 PolarHBondContact O-N 3.42Å
74	I	76.8	Confident	62	Low	136 Å²	136	141.1 Å²	141.1	70%	0.697	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-69.5	131.4	170.2	56.6	170.6	0	0	0	107.8	Q72 V76	Q72-I74 PolarHBondContact O-N 3.47Å; Q72-I74 VanDerWaalsContact O-N 3.12Å; I74-V76 HydrophobicContact CD1-CG2 4.47Å; I74-V76 HydrophobicContact CG1-CG2 4.37Å; I74-V76 PolarHBondContact O-N 3.03Å
75	F	76.4	Confident	62.1	Low	198 Å²	198	133.4 Å²	133.4	87%	0.868	67%	0.668	S	S	*	*			trans	-68.4	105.7	162.9	-75.8	-83.5	0	0	0	106.5	T73 R77	T73-F75 PolarHBondContact O-N 3.42Å; F75-R77 PolarHBondContact O-N 3.15Å
76	V	70.3	Confident	62.6	Low	119 Å²	119	131.2 Å²	131.2	72%	0.721	65%	0.653	S	S	*	*			trans	-66	92.8	171.8	-178	0	0	0	0	106.4	I74 Q78	I74-V76 HydrophobicContact CD1-CG2 4.47Å; I74-V76 HydrophobicContact CG1-CG2 4.37Å; I74-V76 PolarHBondContact O-N 3.03Å; V76-Q78 PolarHBondContact O-N 3.48Å
77	R	63.6	Low	63.8	Low	188 Å²	188	132.4 Å²	132.4	71%	0.709	65%	0.646	S	S	*	*			trans	-59	126.3	160.2	-70.7	-176.8	170.9	-173.6	-1.8	105.3	F75 E79	F75-R77 PolarHBondContact O-N 3.15Å; R77-E79 HydrophobicContact CB-CG 3.83Å; R77-E79 WeakPolarHBondContact CD-OE1 3.48Å; R77-E79 IonicContact NH1-OE1 3.8Å; R77-E79 PolarHBondContact O-N 2.85Å
78	Q	57.8	Low	65.1	Low	178 Å²	178	134 Å²	134	83%	0.832	63%	0.629	S	S	*	*			trans	-68.1	66	166.7	-81.5	-178.5	-20.1	0	0	108.6	V76 R80	V76-Q78 PolarHBondContact O-N 3.48Å; Q78-R80 PolarHBondContact O-N 2.91Å
79	E	53.5	Low	66.6	Low	125 Å²	125	131.2 Å²	131.2	58%	0.584	60%	0.604	S	S	*	*			trans	-79.7	69.9	167.9	-77.2	170.8	-166.6	0	0	106.9	R77 Y81	R77-E79 HydrophobicContact CB-CG 3.83Å; R77-E79 WeakPolarHBondContact CD-OE1 3.48Å; R77-E79 IonicContact NH1-OE1 3.8Å; R77-E79 PolarHBondContact O-N 2.85Å; E79-Y81 PolarHBondContact O-N 3.23Å
80	R	50.1	Low	68	Low	214 Å²	214	120.5 Å²	120.5	81%	0.808	57%	0.568	S	S	*	*			trans	-71.5	82.4	145.5	-76.2	-172.2	178.8	177.2	0.9	104.9	Q78	Q78-R80 PolarHBondContact O-N 2.91Å
81	Y	51.8	Low	69.3	Low	178 Å²	178	118.8 Å²	118.8	70%	0.698	55%	0.552	S	S	*	*			trans	12	112	168.8	-44.4	-83.2	0	0	0	112.2	E79 L83	E79-Y81 PolarHBondContact O-N 3.23Å; Y81-L83 PolarHBondContact O-N 3.05Å
82	V	53.4	Low	70.4	Confident	70 Å²	70	109.3 Å²	109.3	42%	0.424	53%	0.527	S	S	.	.			trans	-58.3	88.8	146.9	-179.9	0	0	0	0	103.7	S84	V82-S84 PolarHBondContact O-N 3.42Å; V82-S84 VanDerWaalsContact O-N 3.14Å
83	L	58	Low	71.1	Confident	35 Å²	35	105 Å²	105	18%	0.183	51%	0.513	C	S	.	.			trans	-50.4	124.5	-179.2	-71.7	166.9	0	0	0	105.1	Y81 S85 R215 R219	Y81-L83 PolarHBondContact O-N 3.05Å; L83-S85 PolarHBondContact O-N 2.84Å; L83-R215 PolarHBondContact O-NE 3.1Å; L83-R215 PolarHBondContact O-NH2 3.08Å; L83-R219 VanDerWaalsContact CD1-NH1 3.34Å
84	S	59.5	Low	71.8	Confident	105 Å²	105	105.3 Å²	105.3	73%	0.734	51%	0.509	S	S	*	.			trans	-39.9	130.7	-179.8	175.2	0	0	0	0	110.5	V82 D86	V82-S84 PolarHBondContact O-N 3.42Å; V82-S84 VanDerWaalsContact O-N 3.14Å; S84-D86 PolarHBondContact O-N 3.02Å; S84-D86 VanDerWaalsContact O-N 3.07Å
85	S	64.1	Low	72.5	Confident	11 Å²	11	101.8 Å²	101.8	8%	0.077	50%	0.497	C	S	.	.			trans	-42.2	114.3	178.2	31.8	0	0	0	0	110	L83 R87 E253	L83-S85 PolarHBondContact O-N 2.84Å; S85-R87 PolarHBondContact O-N 3.27Å; S85-R87 VanDerWaalsContact O-N 3.09Å; S85-E253 VanDerWaalsContact OG-CB 3.31Å; S85-E253 WeakPolarHBondContact OG-CB 3.26Å; S85-E253 WeakPolarHBondContact OG-CG 3.27Å; S85-E253 PolarHBondContact OG-OE1 3.07Å; S85-E253 PolarHBondContact OG-OE2 2.73Å
86	D	72.4	Confident	73.3	Confident	41 Å²	41	92.8 Å²	92.8	22%	0.219	46%	0.458	C	S	.	.			trans	-81.4	99.9	179.2	-169.8	-8.6	0	0	0	107.3	S84 K88 F89	S84-D86 PolarHBondContact O-N 3.02Å; S84-D86 VanDerWaalsContact O-N 3.07Å; D86-K88 PolarHBondContact O-N 3.26Å; D86-K88 WeakPolarHBondContact OD1-CB 3.33Å; D86-K88 WeakPolarHBondContact OD1-CD 3.26Å; D86-K88 VanDerWaalsContact OD1-CG 3.26Å; D86-K88 WeakPolarHBondContact OD1-CG 3.5Å; D86-K88 PolarHBondContact OD1-N 3Å; D86-F89 HydrophobicContact CB-CD2 3.91Å; D86-F89 HydrophobicContact CB-CE2 4.29Å; D86-F89 PolarHBondContact O-N 2.9Å; D86-F89 WeakPolarHBondContact OD2-CE2 3.41Å
87	R	82.2	Confident	74.4	Confident	178 Å²	178	92.9 Å²	92.9	67%	0.672	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-50.8	-22.8	-178	-68.4	-174.8	177.4	-169	-2.6	112.9	S85 F89 A90	S85-R87 PolarHBondContact O-N 3.27Å; S85-R87 VanDerWaalsContact O-N 3.09Å; R87-F89 PolarHBondContact O-N 3.41Å; R87-A90 WeakPolarHBondContact O-CB 3.48Å; R87-A90 PolarHBondContact O-N 2.56Å
88	K	85.8	Confident	75.9	Confident	120 Å²	120	86.9 Å²	86.9	52%	0.522	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-58.2	-30.1	174.9	-64.5	177.2	-177.6	-176.1	0	113.8	D86 S223 P226	D86-K88 PolarHBondContact O-N 3.26Å; D86-K88 WeakPolarHBondContact OD1-CB 3.33Å; D86-K88 WeakPolarHBondContact OD1-CD 3.26Å; D86-K88 VanDerWaalsContact OD1-CG 3.26Å; D86-K88 WeakPolarHBondContact OD1-CG 3.5Å; D86-K88 PolarHBondContact OD1-N 3Å; K88-S223 PolarHBondContact NZ-OG 3.05Å; K88-P226 HydrophobicContact CB-CB 4.48Å; K88-P226 VanDerWaalsContact O-CB 3.27Å; K88-P226 WeakPolarHBondContact O-CB 3.43Å
89	F	88	Confident	77.7	Confident	8 Å²	8	79.4 Å²	79.4	4%	0.035	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-106.4	2.5	-178.6	-56.2	-83	0	0	0	113	D86 R87 L91 R218 F222 P226 A231 T235	D86-F89 HydrophobicContact CB-CD2 3.91Å; D86-F89 HydrophobicContact CB-CE2 4.29Å; D86-F89 PolarHBondContact O-N 2.9Å; D86-F89 WeakPolarHBondContact OD2-CE2 3.41Å; R87-F89 PolarHBondContact O-N 3.41Å; F89-L91 PolarHBondContact O-N 3.45Å; F89-R218 VanDerWaalsContact CD1-CD 3.5Å; F89-R218 HydrophobicContact CD1-CG 3.79Å; F89-R218 HydrophobicContact CE1-CG 3.52Å; F89-R218 HydrophobicContact CE2-CG 4.32Å; F89-R218 HydrophobicContact CG-CG 4.29Å; F89-R218 HydrophobicContact CZ-CG 3.8Å; F89-F222 HydrophobicContact CE1-CB 4.26Å; F89-F222 WeakPolarHBondContact CE1-O 3.4Å; F89-F222 WeakPolarHBondContact CZ-O 3.34Å; F89-P226 HydrophobicContact CD1-CB 3.72Å; F89-P226 HydrophobicContact CE1-CB 3.81Å; F89-P226 HydrophobicContact CG-CB 4.44Å; F89-A231 HydrophobicContact CE1-CB 4.29Å; F89-T235 VanDerWaalsContact O-CG2 3.29Å; F89-T235 WeakPolarHBondContact O-CG2 3.47Å
90	A	85.8	Confident	79.7	Confident	21 Å²	21	74.7 Å²	74.7	17%	0.174	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-66.2	129.7	-175.2	0	0	0	0	0	110.7	R87 E253	R87-A90 WeakPolarHBondContact O-CB 3.48Å; R87-A90 PolarHBondContact O-N 2.56Å; A90-E253 VanDerWaalsContact CB-O 3.25Å; A90-E253 WeakPolarHBondContact CB-O 3.4Å
91	L	88.2	Confident	82	Confident	45 Å²	45	68.9 Å²	68.9	24%	0.236	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-78.7	150.3	172.3	-65.2	174	0	0	0	110.1	F89 V96 L99 T235 C239	F89-L91 PolarHBondContact O-N 3.45Å; L91-V96 HydrophobicContact CB-CG2 3.6Å; L91-V96 HydrophobicContact CD1-CG2 4.17Å; L91-L99 HydrophobicContact CD1-CD2 4.43Å; L91-T235 HydrophobicContact CD1-CG2 3.85Å; L91-T235 HydrophobicContact CD2-CG2 4.07Å; L91-T235 HydrophobicContact CG-CG2 3.65Å; L91-C239 HydrophobicContact CD1-CB 4.3Å
92	A	89.6	Confident	84.1	Confident	48 Å²	48	66.4 Å²	66.4	40%	0.397	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-63.9	145.2	168	0	0	0	0	0	110.3	D94 S95 V96	A92-D94 VanDerWaalsContact C-N 3.31Å; A92-D94 PolarHBondContact O-N 3.15Å; A92-S95 WeakPolarHBondContact O-CB 3.38Å; A92-S95 PolarHBondContact O-N 2.94Å; A92-S95 VanDerWaalsContact O-N 3.08Å; A92-V96 WeakPolarHBondContact O-CG2 3.32Å; A92-V96 PolarHBondContact O-N 3.11Å; A92-V96 VanDerWaalsContact O-N 3.07Å
93	P	88.5	Confident	86.2	Confident	65 Å²	65	63.1 Å²	63.1	42%	0.422	34%	0.344	S	S	.	.	H	α-helix	trans	-53.1	-44.1	178.9	-27.4	34.8	0	0	0	113.6	S95 V96 E97	P93-S95 VanDerWaalsContact C-N 3.31Å; P93-S95 PolarHBondContact O-N 2.9Å; P93-V96 WeakPolarHBondContact O-CB 3.35Å; P93-V96 PolarHBondContact O-N 2.82Å; P93-V96 VanDerWaalsContact O-N 3.09Å; P93-E97 PolarHBondContact O-N 3.2Å
94	D	92.2	Very high	88	Confident	128 Å²	128	64.6 Å²	64.6	68%	0.684	36%	0.355	S	S	*	.	H	α-helix	trans	-62.8	-38.4	179.4	-56.7	-10.4	0	0	0	111.8	A92 V96 E97 A98	A92-D94 VanDerWaalsContact C-N 3.31Å; A92-D94 PolarHBondContact O-N 3.15Å; D94-V96 VanDerWaalsContact C-N 3.31Å; D94-V96 PolarHBondContact O-N 3.21Å; D94-E97 PolarHBondContact O-N 2.96Å; D94-A98 WeakPolarHBondContact O-CB 3.44Å; D94-A98 PolarHBondContact O-N 3.1Å
95	S	91.3	Very high	89.8	Confident	63 Å²	63	62.7 Å²	62.7	44%	0.441	35%	0.346	S	S	.	.	H	α-helix	trans	-67.2	-33.9	176.1	-59.4	0	0	0	0	112	A92 P93 L99	A92-S95 WeakPolarHBondContact O-CB 3.38Å; A92-S95 PolarHBondContact O-N 2.94Å; A92-S95 VanDerWaalsContact O-N 3.08Å; P93-S95 VanDerWaalsContact C-N 3.31Å; P93-S95 PolarHBondContact O-N 2.9Å; S95-L99 WeakPolarHBondContact O-CB 3.4Å; S95-L99 PolarHBondContact O-N 3.41Å
96	V	92.7	Very high	91.3	Very high	8 Å²	8	65.6 Å²	65.6	5%	0.048	36%	0.357	C	S	.	.	H	α-helix	trans	-68.7	-47.1	176.5	170.5	0	0	0	0	110	L91 A92 P93 D94 L99 V100 Y254	L91-V96 HydrophobicContact CB-CG2 3.6Å; L91-V96 HydrophobicContact CD1-CG2 4.17Å; A92-V96 WeakPolarHBondContact O-CG2 3.32Å; A92-V96 PolarHBondContact O-N 3.11Å; A92-V96 VanDerWaalsContact O-N 3.07Å; P93-V96 WeakPolarHBondContact O-CB 3.35Å; P93-V96 PolarHBondContact O-N 2.82Å; P93-V96 VanDerWaalsContact O-N 3.09Å; D94-V96 VanDerWaalsContact C-N 3.31Å; D94-V96 PolarHBondContact O-N 3.21Å; V96-L99 PolarHBondContact O-N 3.41Å; V96-V100 HydrophobicContact CG1-CG2 4.39Å; V96-V100 WeakPolarHBondContact O-CB 3.43Å; V96-V100 VanDerWaalsContact O-CG2 3.26Å; V96-V100 WeakPolarHBondContact O-CG2 3.5Å; V96-V100 PolarHBondContact O-N 2.96Å; V96-Y254 HydrophobicContact CB-CE1 4.08Å; V96-Y254 HydrophobicContact CG1-CE1 3.89Å; V96-Y254 HydrophobicContact CG2-CD1 3.9Å; V96-Y254 HydrophobicContact CG2-CE1 3.51Å
97	E	93.8	Very high	92.4	Very high	122 Å²	122	64 Å²	64	57%	0.57	35%	0.348	S	S	*	.	H	α-helix	trans	-60	-48.3	176.5	-177	175.4	178.4	0	0	111.3	P93 D94 L99 V100 N101	P93-E97 PolarHBondContact O-N 3.2Å; D94-E97 PolarHBondContact O-N 2.96Å; E97-L99 VanDerWaalsContact C-N 3.34Å; E97-L99 PolarHBondContact O-N 3.44Å; E97-V100 PolarHBondContact O-N 3.15Å; E97-N101 WeakPolarHBondContact CG-ND2 3.38Å; E97-N101 VanDerWaalsContact O-CB 3.3Å; E97-N101 WeakPolarHBondContact O-CB 3.35Å; E97-N101 PolarHBondContact O-N 2.77Å; E97-N101 PolarHBondContact O-ND2 3.16Å
98	A	95.7	Very high	92.9	Very high	61 Å²	61	59.8 Å²	59.8	50%	0.504	34%	0.336	S	S	.	.	H	α-helix	trans	-59.3	-43.2	177.2	0	0	0	0	0	112.4	D94 F102	D94-A98 WeakPolarHBondContact O-CB 3.44Å; D94-A98 PolarHBondContact O-N 3.1Å; A98-F102 WeakPolarHBondContact O-CB 3.4Å; A98-F102 PolarHBondContact O-N 3.17Å
99	L	95.6	Very high	93.4	Very high	22 Å²	22	60.8 Å²	60.8	12%	0.115	34%	0.336	C	S	.	.	H	α-helix	trans	-63.1	-47.9	177.9	176.1	62.4	0	0	0	112	L91 S95 V96 E97 F102 F103 M236 C239 L240	L91-L99 HydrophobicContact CD1-CD2 4.43Å; S95-L99 WeakPolarHBondContact O-CB 3.4Å; S95-L99 PolarHBondContact O-N 3.41Å; V96-L99 PolarHBondContact O-N 3.41Å; E97-L99 VanDerWaalsContact C-N 3.34Å; E97-L99 PolarHBondContact O-N 3.44Å; L99-F102 PolarHBondContact O-N 3.02Å; L99-F103 WeakPolarHBondContact O-CB 3.49Å; L99-F103 PolarHBondContact O-N 3.35Å; L99-M236 HydrophobicContact CD1-CE 3.55Å; L99-M236 HydrophobicContact CD1-CG 4.5Å; L99-M236 HydrophobicContact CD2-CB 4.1Å; L99-M236 HydrophobicContact CD2-CG 3.96Å; L99-C239 HydrophobicContact CD2-CB 4.15Å; L99-L240 HydrophobicContact CD1-CD2 4.42Å; L99-L240 HydrophobicContact CD2-CD2 4.41Å; L99-L240 HydrophobicContact CD2-CG 4.44Å; L99-L240 HydrophobicContact CG-CD2 4.02Å
100	V	95.6	Very high	93.7	Very high	26 Å²	26	60.6 Å²	60.6	16%	0.158	34%	0.336	C	S	.	.	H	α-helix	trans	-64.4	-45.8	-179.7	170.4	0	0	0	0	110.3	V96 E97 F102 F103 V104 H243	V96-V100 HydrophobicContact CG1-CG2 4.39Å; V96-V100 WeakPolarHBondContact O-CB 3.43Å; V96-V100 VanDerWaalsContact O-CG2 3.26Å; V96-V100 WeakPolarHBondContact O-CG2 3.5Å; V96-V100 PolarHBondContact O-N 2.96Å; E97-V100 PolarHBondContact O-N 3.15Å; V100-F102 PolarHBondContact O-N 2.7Å; V100-F103 PolarHBondContact O-N 3.22Å; V100-V104 HydrophobicContact CG1-CG2 4.34Å; V100-V104 VanDerWaalsContact O-CG2 3.31Å; V100-V104 WeakPolarHBondContact O-CG2 3.5Å; V100-V104 PolarHBondContact O-N 2.83Å; V100-H243 HydrophobicContact CG1-CB 4.48Å; V100-H243 HydrophobicContact CG2-CB 3.54Å
101	N	97.1	Very high	94	Very high	91 Å²	91	63.2 Å²	63.2	49%	0.487	34%	0.343	S	S	.	.	H	α-helix	trans	-61.1	-44	178.2	-73.2	-19.3	0	0	0	111.7	E97 V104 A105	E97-N101 WeakPolarHBondContact CG-ND2 3.38Å; E97-N101 VanDerWaalsContact O-CB 3.3Å; E97-N101 WeakPolarHBondContact O-CB 3.35Å; E97-N101 PolarHBondContact O-N 2.77Å; E97-N101 PolarHBondContact O-ND2 3.16Å; N101-V104 PolarHBondContact O-N 3.25Å; N101-A105 WeakPolarHBondContact O-CB 3.41Å; N101-A105 PolarHBondContact O-N 2.71Å
102	F	97.3	Very high	94.2	Very high	126 Å²	126	66 Å²	66	55%	0.553	36%	0.355	S	S	*	.	H	α-helix	trans	-60.9	-47	175.2	178.9	-92.9	0	0	0	111.7	A98 L99 V100 V104 A105 F106	A98-F102 WeakPolarHBondContact O-CB 3.4Å; A98-F102 PolarHBondContact O-N 3.17Å; L99-F102 PolarHBondContact O-N 3.02Å; V100-F102 PolarHBondContact O-N 2.7Å; F102-V104 PolarHBondContact O-N 2.85Å; F102-A105 PolarHBondContact O-N 3.1Å; F102-F106 HydrophobicContact CE1-CD1 4.43Å; F102-F106 WeakPolarHBondContact O-CB 3.41Å; F102-F106 PolarHBondContact O-N 3.34Å
103	F	96.9	Very high	94.3	Very high	1 Å²	1	66.2 Å²	66.2	0%	0.004	35%	0.349	C	S	.	.	H	α-helix	trans	-62.2	-44.4	-179.8	-177.5	-91.2	0	0	0	112.1	L99 V100 F106 K107 Y189 L192 I193 L240 C244 F245	L99-F103 WeakPolarHBondContact O-CB 3.49Å; L99-F103 PolarHBondContact O-N 3.35Å; V100-F103 PolarHBondContact O-N 3.22Å; F103-F106 PolarHBondContact O-N 3.14Å; F103-K107 HydrophobicContact CE1-CD 4.2Å; F103-K107 VanDerWaalsContact O-CB 3.29Å; F103-K107 WeakPolarHBondContact O-CB 3.39Å; F103-K107 PolarHBondContact O-N 2.83Å; F103-Y189 AromaticContact CD2-CE2 3.75Å; F103-Y189 HydrophobicContact CD2-CE2 3.75Å; F103-Y189 HydrophobicContact CE2-CE2 4.13Å; F103-L192 HydrophobicContact CE2-CB 4.29Å; F103-L192 HydrophobicContact CZ-CB 4.08Å; F103-I193 HydrophobicContact CD2-CG1 4.03Å; F103-I193 HydrophobicContact CE2-CB 4.49Å; F103-I193 HydrophobicContact CE2-CD1 4.37Å; F103-I193 HydrophobicContact CE2-CG1 3.54Å; F103-I193 HydrophobicContact CZ-CG1 3.97Å; F103-L240 HydrophobicContact CB-CD2 3.52Å; F103-L240 HydrophobicContact CD1-CD2 4.09Å; F103-L240 HydrophobicContact CD2-CD1 3.61Å; F103-L240 HydrophobicContact CD2-CD2 3.67Å; F103-L240 HydrophobicContact CD2-CG 4.2Å; F103-L240 HydrophobicContact CE2-CD1 3.81Å; F103-L240 HydrophobicContact CE2-CD2 4.36Å; F103-L240 HydrophobicContact CG-CD1 4.34Å; F103-L240 HydrophobicContact CG-CD2 3.5Å; F103-L240 VanDerWaalsContact CG-CD2 3.5Å; F103-L240 HydrophobicContact CG-CG 4.47Å; F103-C244 HydrophobicContact CD1-CB 4.01Å; F103-C244 VanDerWaalsContact CD1-SG 3.53Å; F103-C244 HydrophobicContact CE1-CB 3.93Å; F103-F245 HydrophobicContact CE1-CE2 4.36Å; F103-F245 HydrophobicContact CZ-CE2 4.26Å; F103-F245 HydrophobicContact CZ-CZ 4.43Å
104	V	95.6	Very high	94.4	Very high	67 Å²	67	63.6 Å²	63.6	41%	0.406	33%	0.331	S	S	.	.	H	α-helix	trans	-64	-47.6	178	172	0	0	0	0	110.8	V100 N101 F102 F106 K107 E108	V100-V104 HydrophobicContact CG1-CG2 4.34Å; V100-V104 VanDerWaalsContact O-CG2 3.31Å; V100-V104 WeakPolarHBondContact O-CG2 3.5Å; V100-V104 PolarHBondContact O-N 2.83Å; N101-V104 PolarHBondContact O-N 3.25Å; F102-V104 PolarHBondContact O-N 2.85Å; V104-F106 VanDerWaalsContact C-N 3.29Å; V104-F106 PolarHBondContact O-N 2.99Å; V104-K107 WeakPolarHBondContact O-CB 3.5Å; V104-K107 PolarHBondContact O-N 3.35Å; V104-E108 PolarHBondContact O-N 3.23Å
105	A	96.4	Very high	94.3	Very high	65 Å²	65	62.1 Å²	62.1	54%	0.537	32%	0.322	S	S	.	.	H	α-helix	trans	-59.7	-41	176.9	0	0	0	0	0	111.9	N101 F102 E108 R109	N101-A105 WeakPolarHBondContact O-CB 3.41Å; N101-A105 PolarHBondContact O-N 2.71Å; F102-A105 PolarHBondContact O-N 3.1Å; A105-E108 PolarHBondContact O-N 2.96Å; A105-R109 PolarHBondContact O-N 3.15Å; A105-R109 VanDerWaalsContact O-N 3.1Å
106	F	96	Very high	94.2	Very high	72 Å²	72	64.5 Å²	64.5	32%	0.316	33%	0.329	S	S	.	.	H	α-helix	trans	-70.6	-38.2	178.6	-169.5	-149.2	0	0	0	112	F102 F103 V104 E108 R109 I110 Y189 I193	F102-F106 HydrophobicContact CE1-CD1 4.43Å; F102-F106 WeakPolarHBondContact O-CB 3.41Å; F102-F106 PolarHBondContact O-N 3.34Å; F103-F106 PolarHBondContact O-N 3.14Å; V104-F106 VanDerWaalsContact C-N 3.29Å; V104-F106 PolarHBondContact O-N 2.99Å; F106-E108 VanDerWaalsContact C-N 3.33Å; F106-E108 PolarHBondContact O-N 2.95Å; F106-R109 HydrophobicContact CD2-CB 4.45Å; F106-R109 WeakPolarHBondContact O-CB 3.45Å; F106-R109 PolarHBondContact O-N 3.08Å; F106-R109 VanDerWaalsContact O-N 3.17Å; F106-I110 HydrophobicContact CD2-CG1 4.23Å; F106-I110 HydrophobicContact CE2-CD1 3.89Å; F106-I110 HydrophobicContact CE2-CG1 4.02Å; F106-I110 HydrophobicContact CZ-CD1 4.07Å; F106-I110 HydrophobicContact CZ-CG1 4.3Å; F106-I110 WeakPolarHBondContact O-CG1 3.46Å; F106-I110 PolarHBondContact O-N 3.1Å; F106-Y189 HydrophobicContact CD1-CE1 4.36Å; F106-Y189 HydrophobicContact CE1-CE1 4.3Å; F106-I193 HydrophobicContact CD1-CD1 3.18Å; F106-I193 HydrophobicContact CD1-CG1 4.38Å; F106-I193 HydrophobicContact CE1-CD1 3.38Å; F106-I193 HydrophobicContact CG-CD1 4.17Å; F106-I193 HydrophobicContact CZ-CD1 4.49Å
107	K	95.2	Very high	93.9	Very high	8 Å²	8	64.6 Å²	64.6	4%	0.035	33%	0.332	C	S	.	.	H	α-helix	trans	-58.2	-43.4	173	-173	171.6	-175.2	177.9	0	111.5	F103 V104 I110 K111 M195 E197	F103-K107 HydrophobicContact CE1-CD 4.2Å; F103-K107 VanDerWaalsContact O-CB 3.29Å; F103-K107 WeakPolarHBondContact O-CB 3.39Å; F103-K107 PolarHBondContact O-N 2.83Å; V104-K107 WeakPolarHBondContact O-CB 3.5Å; V104-K107 PolarHBondContact O-N 3.35Å; K107-I110 PolarHBondContact O-N 3.1Å; K107-K111 WeakPolarHBondContact O-CG 3.45Å; K107-K111 PolarHBondContact O-N 3.32Å; K107-M195 WeakPolarHBondContact CE-O 3.2Å; K107-M195 PolarHBondContact NZ-O 2.96Å; K107-E197 IonicContact NZ-OE1 2.77Å; K107-E197 PolarHBondContact NZ-OE1 3.42Å
108	E	94.6	Very high	93.5	Very high	88 Å²	88	66 Å²	66	41%	0.411	33%	0.332	S	S	.	.	H	α-helix	trans	-62.4	-43.4	174.2	-68.3	-49.9	122.9	0	0	112.1	V104 A105 F106 I110 K111 E112	V104-E108 PolarHBondContact O-N 3.23Å; A105-E108 PolarHBondContact O-N 2.96Å; F106-E108 VanDerWaalsContact C-N 3.33Å; F106-E108 PolarHBondContact O-N 2.95Å; E108-I110 VanDerWaalsContact C-N 3.3Å; E108-I110 PolarHBondContact O-N 3.31Å; E108-K111 WeakPolarHBondContact O-CB 3.46Å; E108-K111 PolarHBondContact O-N 3.26Å; E108-K111 VanDerWaalsContact O-N 3.15Å; E108-K111 WeakPolarHBondContact OE1-CE 3.4Å; E108-K111 IonicContact OE1-NZ 2.82Å; E108-K111 PolarHBondContact OE1-NZ 3.42Å; E108-K111 IonicContact OE2-NZ 2.7Å; E108-E112 PolarHBondContact O-N 3.29Å
109	R	95	Very high	93.1	Very high	141 Å²	141	71.1 Å²	71.1	53%	0.532	34%	0.342	S	S	.	.	H	α-helix	trans	-61.2	-39	175.6	-174.2	55.6	171.9	176.5	-3.6	112.6	A105 F106 E112 L113	A105-R109 PolarHBondContact O-N 3.15Å; A105-R109 VanDerWaalsContact O-N 3.1Å; F106-R109 HydrophobicContact CD2-CB 4.45Å; F106-R109 WeakPolarHBondContact O-CB 3.45Å; F106-R109 PolarHBondContact O-N 3.08Å; F106-R109 VanDerWaalsContact O-N 3.17Å; R109-E112 WeakPolarHBondContact CD-OE2 3.46Å; R109-E112 IonicContact CZ-OE2 3.89Å; R109-E112 IonicContact NH1-OE2 3.78Å; R109-E112 PolarHBondContact NH1-OE2 3.2Å; R109-E112 WeakPolarHBondContact O-CB 3.29Å; R109-E112 PolarHBondContact O-N 3.18Å; R109-L113 WeakPolarHBondContact O-CG 3.46Å; R109-L113 PolarHBondContact O-N 3.5Å; R109-L113 VanDerWaalsContact O-N 3.1Å
110	I	94.1	Very high	92.7	Very high	4 Å²	4	74 Å²	74	2%	0.021	37%	0.365	C	S	.	.	H	α-helix	trans	-65.5	-42	175.5	-68	-62.6	0	0	0	110.8	F106 K107 E108 E112 L113 R114 L153 L157 I193 L194	F106-I110 HydrophobicContact CD2-CG1 4.23Å; F106-I110 HydrophobicContact CE2-CD1 3.89Å; F106-I110 HydrophobicContact CE2-CG1 4.02Å; F106-I110 HydrophobicContact CZ-CD1 4.07Å; F106-I110 HydrophobicContact CZ-CG1 4.3Å; F106-I110 WeakPolarHBondContact O-CG1 3.46Å; F106-I110 PolarHBondContact O-N 3.1Å; K107-I110 PolarHBondContact O-N 3.1Å; E108-I110 VanDerWaalsContact C-N 3.3Å; E108-I110 PolarHBondContact O-N 3.31Å; I110-E112 VanDerWaalsContact C-N 3.33Å; I110-E112 PolarHBondContact O-N 3.24Å; I110-L113 HydrophobicContact CD1-CD1 4.2Å; I110-L113 WeakPolarHBondContact O-CB 3.28Å; I110-L113 PolarHBondContact O-N 2.87Å; I110-L113 VanDerWaalsContact O-N 3.16Å; I110-R114 WeakPolarHBondContact O-CG 3.35Å; I110-R114 PolarHBondContact O-N 2.9Å; I110-L153 HydrophobicContact CD1-CD2 3.71Å; I110-L157 HydrophobicContact CG2-CD2 3.88Å; I110-I193 HydrophobicContact CB-CG2 4.14Å; I110-I193 HydrophobicContact CG1-CG2 3.72Å; I110-I193 HydrophobicContact CG2-CG2 4.01Å; I110-L194 HydrophobicContact CG2-CD2 3.77Å
111	K	92.3	Very high	92	Very high	76 Å²	76	74.6 Å²	74.6	33%	0.33	38%	0.376	S	S	.	.	H	α-helix	trans	-57.3	-45	174.1	-71	173.9	-176.5	171.8	0	111.8	K107 E108 L113 R114 I115	K107-K111 WeakPolarHBondContact O-CG 3.45Å; K107-K111 PolarHBondContact O-N 3.32Å; E108-K111 WeakPolarHBondContact O-CB 3.46Å; E108-K111 PolarHBondContact O-N 3.26Å; E108-K111 VanDerWaalsContact O-N 3.15Å; E108-K111 WeakPolarHBondContact OE1-CE 3.4Å; E108-K111 IonicContact OE1-NZ 2.82Å; E108-K111 PolarHBondContact OE1-NZ 3.42Å; E108-K111 IonicContact OE2-NZ 2.7Å; K111-L113 VanDerWaalsContact C-N 3.34Å; K111-L113 PolarHBondContact O-N 3.3Å; K111-R114 PolarHBondContact O-N 3.12Å; K111-I115 WeakPolarHBondContact O-CG1 3.46Å; K111-I115 PolarHBondContact O-N 3.38Å
112	E	92.7	Very high	91	Very high	104 Å²	104	74 Å²	74	49%	0.486	38%	0.384	S	S	.	.	H	α-helix	trans	-58	-45.3	175.1	-68.7	178.1	170.2	0	0	112	E108 R109 I110 R114 I115 L116	E108-E112 PolarHBondContact O-N 3.29Å; R109-E112 WeakPolarHBondContact CD-OE2 3.46Å; R109-E112 IonicContact CZ-OE2 3.89Å; R109-E112 IonicContact NH1-OE2 3.78Å; R109-E112 PolarHBondContact NH1-OE2 3.2Å; R109-E112 WeakPolarHBondContact O-CB 3.29Å; R109-E112 PolarHBondContact O-N 3.18Å; I110-E112 VanDerWaalsContact C-N 3.33Å; I110-E112 PolarHBondContact O-N 3.24Å; E112-R114 VanDerWaalsContact C-N 3.32Å; E112-R114 PolarHBondContact O-N 2.95Å; E112-I115 PolarHBondContact O-N 3.26Å; E112-L116 WeakPolarHBondContact O-CB 3.46Å; E112-L116 PolarHBondContact O-N 2.83Å
113	L	91.9	Very high	89.9	Confident	53 Å²	53	69.2 Å²	69.2	28%	0.277	36%	0.364	S	S	.	.	H	α-helix	trans	-62.5	-37.3	177.6	-71.3	173.7	0	0	0	112.3	R109 I110 K111 L116 G117 L157	R109-L113 WeakPolarHBondContact O-CG 3.46Å; R109-L113 PolarHBondContact O-N 3.5Å; R109-L113 VanDerWaalsContact O-N 3.1Å; I110-L113 HydrophobicContact CD1-CD1 4.2Å; I110-L113 WeakPolarHBondContact O-CB 3.28Å; I110-L113 PolarHBondContact O-N 2.87Å; I110-L113 VanDerWaalsContact O-N 3.16Å; K111-L113 VanDerWaalsContact C-N 3.34Å; K111-L113 PolarHBondContact O-N 3.3Å; L113-L116 PolarHBondContact O-N 3.18Å; L113-G117 PolarHBondContact O-N 3.21Å; L113-L157 HydrophobicContact CB-CD1 4.32Å
114	R	90.6	Very high	88.4	Confident	10 Å²	10	76.6 Å²	76.6	4%	0.038	40%	0.398	C	S	.	.	H	α-helix	trans	-65.1	-42	174.8	-64.6	-172.9	97.3	164.5	33.5	111.9	I110 K111 E112 R118 L157 L159 E196	I110-R114 WeakPolarHBondContact O-CG 3.35Å; I110-R114 PolarHBondContact O-N 2.9Å; K111-R114 PolarHBondContact O-N 3.12Å; E112-R114 VanDerWaalsContact C-N 3.32Å; E112-R114 PolarHBondContact O-N 2.95Å; R114-R118 WeakPolarHBondContact O-CB 3.4Å; R114-R118 VanDerWaalsContact O-CG 3.26Å; R114-R118 WeakPolarHBondContact O-CG 3.48Å; R114-R118 PolarHBondContact O-N 3.08Å; R114-L157 HydrophobicContact CG-CD2 3.67Å; R114-L157 PolarHBondContact NE-O 3.11Å; R114-L157 VanDerWaalsContact NE-O 3.11Å; R114-L157 PolarHBondContact NH2-O 2.82Å; R114-L159 PolarHBondContact NH2-O 3.43Å; R114-E196 IonicContact CZ-OE1 3.91Å; R114-E196 IonicContact NH1-OE1 2.82Å; R114-E196 PolarHBondContact NH1-OE1 3.28Å
115	I	89.2	Confident	86.7	Confident	96 Å²	96	82.7 Å²	82.7	49%	0.492	42%	0.419	S	S	.	.	H	α-helix	trans	-64	-47.3	177.4	-65.1	166.2	0	0	0	109.9	K111 E112 R118 K119	K111-I115 WeakPolarHBondContact O-CG1 3.46Å; K111-I115 PolarHBondContact O-N 3.38Å; E112-I115 PolarHBondContact O-N 3.26Å; I115-R118 PolarHBondContact O-N 3.28Å; I115-K119 HydrophobicContact CG2-CD 4.29Å; I115-K119 WeakPolarHBondContact O-CG 3.49Å; I115-K119 PolarHBondContact O-N 3.18Å; I115-K119 VanDerWaalsContact O-N 3.11Å
116	L	90.7	Very high	84.9	Confident	114 Å²	114	82.9 Å²	82.9	60%	0.597	43%	0.428	S	S	*	.	H	α-helix	trans	-64	-46.1	179.9	-173.5	66.1	0	0	0	111.6	E112 L113 R118 K119 S120	E112-L116 WeakPolarHBondContact O-CB 3.46Å; E112-L116 PolarHBondContact O-N 2.83Å; L113-L116 PolarHBondContact O-N 3.18Å; L116-R118 VanDerWaalsContact C-N 3.33Å; L116-R118 PolarHBondContact O-N 2.77Å; L116-K119 PolarHBondContact O-N 2.9Å; L116-K119 VanDerWaalsContact O-N 3.15Å; L116-S120 PolarHBondContact O-N 3.43Å; L116-S120 PolarHBondContact O-OG 3.44Å
117	G	86.5	Confident	83.2	Confident	9 Å²	9	84.3 Å²	84.3	9%	0.093	44%	0.442	C	S	.	.	H	α-helix	trans	-65.8	-31.9	-179.7	0	0	0	0	0	113.8	L113 S120 G121 A122 L123	L113-G117 PolarHBondContact O-N 3.21Å; G117-S120 WeakPolarHBondContact CA-OG 3.17Å; G117-S120 PolarHBondContact O-OG 3.01Å; G117-G121 PolarHBondContact O-N 3.23Å; G117-A122 PolarHBondContact O-N 3.36Å; G117-L123 PolarHBondContact O-N 3.37Å; G117-L123 VanDerWaalsContact O-N 3.15Å
118	R	85.1	Confident	81.7	Confident	151 Å²	151	84.8 Å²	84.8	57%	0.57	44%	0.444	S	S	*	.	H	α-helix	trans	-71.2	-36.8	171.7	-74.1	178.1	-174.5	-174.9	5.8	111.9	R114 I115 L116 L123	R114-R118 WeakPolarHBondContact O-CB 3.4Å; R114-R118 VanDerWaalsContact O-CG 3.26Å; R114-R118 WeakPolarHBondContact O-CG 3.48Å; R114-R118 PolarHBondContact O-N 3.08Å; I115-R118 PolarHBondContact O-N 3.28Å; L116-R118 VanDerWaalsContact C-N 3.33Å; L116-R118 PolarHBondContact O-N 2.77Å; R118-L123 HydrophobicContact CG-CB 4.45Å; R118-L123 HydrophobicContact CG-CD1 4.23Å
119	K	86.7	Confident	80	Confident	169 Å²	169	81.9 Å²	81.9	74%	0.735	43%	0.433	S	S	*	.	H	α-helix	trans	-70.2	-35.3	176.7	-73.4	178.2	-179.3	-177.6	0	112.9	I115 L116 G121	I115-K119 HydrophobicContact CG2-CD 4.29Å; I115-K119 WeakPolarHBondContact O-CG 3.49Å; I115-K119 PolarHBondContact O-N 3.18Å; I115-K119 VanDerWaalsContact O-N 3.11Å; L116-K119 PolarHBondContact O-N 2.9Å; L116-K119 VanDerWaalsContact O-N 3.15Å; K119-G121 VanDerWaalsContact C-N 3.33Å
120	S	86.9	Confident	78.1	Confident	83 Å²	83	82.3 Å²	82.3	58%	0.58	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-9.4	179.4	64.3	0	0	0	0	114.1	L116 G117 A122	L116-S120 PolarHBondContact O-N 3.43Å; L116-S120 PolarHBondContact O-OG 3.44Å; G117-S120 WeakPolarHBondContact CA-OG 3.17Å; G117-S120 PolarHBondContact O-OG 3.01Å; S120-A122 PolarHBondContact O-N 3.37Å; S120-A122 WeakPolarHBondContact OG-CB 3.31Å; S120-A122 PolarHBondContact OG-N 2.9Å
121	G	80.9	Confident	76.6	Confident	38 Å²	38	86.1 Å²	86.1	39%	0.392	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.1	6.1	-170.6	0	0	0	0	0	113.8	G117 K119 L123 E124	G117-G121 PolarHBondContact O-N 3.23Å; K119-G121 VanDerWaalsContact C-N 3.33Å; G121-L123 PolarHBondContact O-N 2.84Å; G121-E124 WeakPolarHBondContact O-CG 3.43Å
122	A	76.9	Confident	75.3	Confident	79 Å²	79	87.2 Å²	87.2	65%	0.653	48%	0.479	S	S	*	.			trans	-68.7	-20.5	177.6	0	0	0	0	0	113	G117 S120	G117-A122 PolarHBondContact O-N 3.36Å; S120-A122 PolarHBondContact O-N 3.37Å; S120-A122 WeakPolarHBondContact OG-CB 3.31Å; S120-A122 PolarHBondContact OG-N 2.9Å
123	L	74.4	Confident	74.5	Confident	25 Å²	25	84.2 Å²	84.2	13%	0.131	47%	0.469	C	S	.	.	S	Bend	trans	-105.4	63	177.9	-57.5	177.4	0	0	0	110.4	G117 R118 G121 L157 P158	G117-L123 PolarHBondContact O-N 3.37Å; G117-L123 VanDerWaalsContact O-N 3.15Å; R118-L123 HydrophobicContact CG-CB 4.45Å; R118-L123 HydrophobicContact CG-CD1 4.23Å; G121-L123 PolarHBondContact O-N 2.84Å; L123-L157 HydrophobicContact CD1-CB 4.07Å; L123-L157 HydrophobicContact CD2-CB 3.57Å; L123-P158 HydrophobicContact CD2-CG 3.81Å
124	E	64	Low	73.8	Confident	156 Å²	156	84.3 Å²	84.3	73%	0.729	47%	0.47	S	S	*	.			trans	-72.3	136.4	169.3	-76.7	-177.4	179.2	0	0	110.6	G121 G126	G121-E124 WeakPolarHBondContact O-CG 3.43Å; E124-G126 PolarHBondContact O-N 2.9Å
125	K	61.1	Low	73.2	Confident	196 Å²	196	89 Å²	89	85%	0.852	49%	0.492	S	S	*	.	S	Bend	trans	-68.6	20.8	-169.7	-73.8	-179.7	172	-179.7	0	115.5
126	G	57.9	Low	72.6	Confident	69 Å²	69	85.6 Å²	85.6	71%	0.711	48%	0.477	S	S	*	.			trans	-98.4	-5.1	-155.9	0	0	0	0	0	118.5	E124	E124-G126 PolarHBondContact O-N 2.9Å
127	V	60.7	Low	72	Confident	102 Å²	102	80.5 Å²	80.5	62%	0.618	45%	0.45	S	S	*	.	S	Bend	trans	-105.6	-16.8	-165.2	-170.4	0	0	0	0	113.8
128	H	64.1	Low	71.6	Confident	17 Å²	17	85.6 Å²	85.6	8%	0.079	47%	0.466	C	S	.	.	S	Bend	trans	-91.2	139.9	-172.2	-59.1	-60.1	0	0	0	112.4	L130 L140 L155 L159	H128-L130 PolarHBondContact O-N 3.49Å; H128-L140 WeakPolarHBondContact ND1-CD2 3.45Å; H128-L155 PolarHBondContact CE1-O 3.49Å; H128-L155 PolarHBondContact NE2-O 2.97Å; H128-L155 VanDerWaalsContact NE2-O 3.14Å; H128-L159 HydrophobicContact CB-CD2 4.24Å; H128-L159 WeakPolarHBondContact CD2-CD2 3.34Å; H128-L159 VanDerWaalsContact CE1-CD2 3.46Å; H128-L159 WeakPolarHBondContact CE1-CD2 3.37Å; H128-L159 WeakPolarHBondContact ND1-CD2 3.03Å; H128-L159 WeakPolarHBondContact NE2-CD2 3.34Å
129	P	58.6	Low	71.1	Confident	28 Å²	28	85.1 Å²	85.1	18%	0.182	48%	0.475	C	S	.	.			trans	-60.4	103.1	171.7	14.7	-17.4	0	0	0	109.1	D131	P129-D131 WeakPolarHBondContact CB-OD1 3.49Å; P129-D131 PolarHBondContact O-N 2.74Å
130	L	55.7	Low	70.6	Confident	150 Å²	150	78.7 Å²	78.7	79%	0.785	45%	0.448	S	S	*	.			trans	-62.1	-16.8	167.9	-71.8	164.3	0	0	0	110.7	H128	H128-L130 PolarHBondContact O-N 3.49Å
131	D	62.6	Low	70.2	Confident	84 Å²	84	74.7 Å²	74.7	45%	0.449	42%	0.42	S	S	.	.	S	Bend	trans	-74	132.9	174.9	80.3	-31.2	0	0	0	110.7	P129 S133 S136	P129-D131 WeakPolarHBondContact CB-OD1 3.49Å; P129-D131 PolarHBondContact O-N 2.74Å; D131-S133 PolarHBondContact O-N 3.49Å; D131-S136 WeakPolarHBondContact OD1-CB 3.29Å; D131-S136 PolarHBondContact OD1-OG 3.32Å; D131-S136 PolarHBondContact OD2-OG 3.49Å
132	T	64.6	Low	70	Confident	98 Å²	98	73.6 Å²	73.6	60%	0.601	41%	0.406	S	S	*	.			trans	-63.1	1.3	-176.8	-75.7	0	0	0	0	113.3	R166	T132-R166 VanDerWaalsContact CB-NH2 3.34Å; T132-R166 PolarHBondContact OG1-NH1 2.97Å; T132-R166 PolarHBondContact OG1-NH2 2.68Å
133	S	74.8	Confident	69.8	Low	42 Å²	42	74.7 Å²	74.7	29%	0.294	40%	0.399	S	S	.	.			trans	-75.1	130.5	-170	115.7	0	0	0	0	111.2	D131 E135 S136	D131-S133 PolarHBondContact O-N 3.49Å; S133-E135 PolarHBondContact O-N 3.48Å; S133-E135 PolarHBondContact OG-N 2.87Å; S133-S136 PolarHBondContact O-N 3.09Å; S133-S136 PolarHBondContact OG-N 2.77Å; S133-S136 VanDerWaalsContact OG-N 3.09Å; S133-S136 PolarHBondContact OG-OG 3.23Å
134	L	78.3	Confident	69.6	Low	54 Å²	54	83.5 Å²	83.5	28%	0.283	44%	0.44	S	S	.	.	H	α-helix	trans	-58.7	-36.7	174.3	-176.8	75.4	0	0	0	111.2	S136 W137 R138 A170 F173 W174	L134-S136 VanDerWaalsContact C-N 3.32Å; L134-S136 PolarHBondContact O-N 3.33Å; L134-W137 PolarHBondContact O-N 3.4Å; L134-R138 PolarHBondContact O-N 2.85Å; L134-R138 VanDerWaalsContact O-N 3.14Å; L134-A170 HydrophobicContact CD1-CB 3.5Å; L134-F173 HydrophobicContact CD1-CD1 4.32Å; L134-F173 HydrophobicContact CD2-CD1 3.41Å; L134-F173 VanDerWaalsContact CD2-CD1 3.41Å; L134-F173 HydrophobicContact CD2-CE1 3.34Å; L134-F173 HydrophobicContact CD2-CG 4.25Å; L134-F173 HydrophobicContact CD2-CZ 4.17Å; L134-F173 HydrophobicContact CG-CD1 4.47Å; L134-W174 HydrophobicContact CD1-CZ2 3.97Å; L134-W174 HydrophobicContact CG-CZ2 4.07Å; L134-W174 WeakPolarHBondContact O-CZ2 3.48Å
135	E	77.1	Confident	69.9	Low	108 Å²	108	81.1 Å²	81.1	51%	0.505	43%	0.432	S	S	.	.	H	α-helix	trans	-68.5	-30.8	-177.7	-63.5	-54.8	134.8	0	0	112.6	S133 W137 R138 L139	S133-E135 PolarHBondContact O-N 3.48Å; S133-E135 PolarHBondContact OG-N 2.87Å; E135-W137 VanDerWaalsContact C-N 3.34Å; E135-W137 PolarHBondContact O-N 3.27Å; E135-R138 WeakPolarHBondContact O-CA 3.33Å; E135-R138 VanDerWaalsContact O-CB 3.31Å; E135-R138 WeakPolarHBondContact O-CB 3.18Å; E135-R138 PolarHBondContact O-N 2.88Å; E135-R138 VanDerWaalsContact O-N 3.1Å; E135-R138 WeakPolarHBondContact OE2-CD 3.31Å; E135-R138 IonicContact OE2-NH1 3.72Å; E135-L139 PolarHBondContact O-N 3.26Å
136	S	77.7	Confident	70.5	Confident	26 Å²	26	74 Å²	74	18%	0.182	41%	0.414	C	S	.	.	H	α-helix	trans	-64.6	-40.8	176.1	-52.3	0	0	0	0	111.7	D131 S133 L134 R138 L139 L140	D131-S136 WeakPolarHBondContact OD1-CB 3.29Å; D131-S136 PolarHBondContact OD1-OG 3.32Å; D131-S136 PolarHBondContact OD2-OG 3.49Å; S133-S136 PolarHBondContact O-N 3.09Å; S133-S136 PolarHBondContact OG-N 2.77Å; S133-S136 VanDerWaalsContact OG-N 3.09Å; S133-S136 PolarHBondContact OG-OG 3.23Å; L134-S136 VanDerWaalsContact C-N 3.32Å; L134-S136 PolarHBondContact O-N 3.33Å; S136-R138 VanDerWaalsContact C-N 3.29Å; S136-R138 PolarHBondContact O-N 3.47Å; S136-L139 PolarHBondContact O-N 3.11Å; S136-L140 PolarHBondContact O-N 3.41Å; S136-L140 VanDerWaalsContact O-N 3.11Å
137	W	77.8	Confident	71.4	Confident	6 Å²	6	76.8 Å²	76.8	2%	0.023	41%	0.409	C	S	.	.	H	α-helix	trans	-63.2	-37.8	171.8	-72.5	102.2	0	0	0	111.8	L134 E135 L140 H141 L159 E163 R166 A167 A170 W174	L134-W137 PolarHBondContact O-N 3.4Å; E135-W137 VanDerWaalsContact C-N 3.34Å; E135-W137 PolarHBondContact O-N 3.27Å; W137-L140 HydrophobicContact CE3-CD2 4.31Å; W137-L140 HydrophobicContact CZ3-CD2 4.27Å; W137-L140 PolarHBondContact O-N 3.41Å; W137-H141 AromaticContact CE3-CE1 3.25Å; W137-H141 AromaticContact CE3-NE2 3.68Å; W137-H141 AromaticContact CZ3-CE1 3.66Å; W137-H141 AromaticContact CZ3-NE2 3.83Å; W137-H141 WeakPolarHBondContact O-CB 3.45Å; W137-H141 VanDerWaalsContact O-CG 3.29Å; W137-H141 PolarHBondContact O-N 3.36Å; W137-H141 PolarHBondContact O-ND1 2.98Å; W137-L159 HydrophobicContact CH2-CD2 3.71Å; W137-L159 HydrophobicContact CZ3-CD2 4.03Å; W137-E163 HydrophobicContact CH2-CB 4.03Å; W137-E163 HydrophobicContact CZ2-CB 4.25Å; W137-E163 HydrophobicContact CZ2-CG 4.45Å; W137-R166 HydrophobicContact CZ2-CB 4.35Å; W137-A167 HydrophobicContact CD2-CB 4.48Å; W137-A167 HydrophobicContact CE3-CB 3.98Å; W137-A167 HydrophobicContact CH2-CB 3.97Å; W137-A167 HydrophobicContact CZ3-CB 3.68Å; W137-A170 HydrophobicContact CB-CB 4.17Å; W137-A170 HydrophobicContact CG-CB 4.41Å; W137-W174 HydrophobicContact CB-CH2 3.73Å; W137-W174 HydrophobicContact CB-CZ2 4.24Å
138	R	77.1	Confident	72.3	Confident	116 Å²	116	73.5 Å²	73.5	44%	0.438	39%	0.388	S	S	.	.	H	α-helix	trans	-63.3	-46.6	177.7	-165.5	179.8	179.1	-177.5	-2.3	110.9	L134 E135 S136 L140 H141 S142 W174	L134-R138 PolarHBondContact O-N 2.85Å; L134-R138 VanDerWaalsContact O-N 3.14Å; E135-R138 WeakPolarHBondContact O-CA 3.33Å; E135-R138 VanDerWaalsContact O-CB 3.31Å; E135-R138 WeakPolarHBondContact O-CB 3.18Å; E135-R138 PolarHBondContact O-N 2.88Å; E135-R138 VanDerWaalsContact O-N 3.1Å; E135-R138 WeakPolarHBondContact OE2-CD 3.31Å; E135-R138 IonicContact OE2-NH1 3.72Å; S136-R138 VanDerWaalsContact C-N 3.29Å; S136-R138 PolarHBondContact O-N 3.47Å; R138-L140 VanDerWaalsContact C-N 3.27Å; R138-L140 PolarHBondContact O-N 2.89Å; R138-H141 PolarHBondContact O-N 3.5Å; R138-S142 WeakPolarHBondContact O-CA 3.04Å; R138-S142 WeakPolarHBondContact O-CB 3.34Å; R138-S142 PolarHBondContact O-N 3.47Å; R138-S142 PolarHBondContact O-OG 2.95Å; R138-W174 VanDerWaalsContact CA-CH2 3.47Å; R138-W174 HydrophobicContact CB-CH2 3.95Å; R138-W174 HydrophobicContact CB-CZ2 3.48Å; R138-W174 VanDerWaalsContact CB-CZ2 3.48Å; R138-W174 HydrophobicContact CG-CZ2 4.07Å; R138-W174 VanDerWaalsContact N-CH2 3.31Å
139	L	76.2	Confident	73.3	Confident	142 Å²	142	76.5 Å²	76.5	74%	0.743	40%	0.401	S	S	*	.	H	α-helix	trans	-63.7	-35.5	179.3	-172.9	66.2	0	0	0	112.2	E135 S136	E135-L139 PolarHBondContact O-N 3.26Å; S136-L139 PolarHBondContact O-N 3.11Å
140	L	75.8	Confident	74.7	Confident	33 Å²	33	82.8 Å²	82.8	17%	0.173	43%	0.427	C	S	.	.	H	α-helix	trans	-67.1	-43.2	177.9	-170.3	65.5	0	0	0	111.5	H128 S136 W137 R138 L155	H128-L140 WeakPolarHBondContact ND1-CD2 3.45Å; S136-L140 PolarHBondContact O-N 3.41Å; S136-L140 VanDerWaalsContact O-N 3.11Å; W137-L140 HydrophobicContact CE3-CD2 4.31Å; W137-L140 HydrophobicContact CZ3-CD2 4.27Å; W137-L140 PolarHBondContact O-N 3.41Å; R138-L140 VanDerWaalsContact C-N 3.27Å; R138-L140 PolarHBondContact O-N 2.89Å; L140-L155 HydrophobicContact CD1-CD1 3.88Å; L140-L155 HydrophobicContact CD2-CD1 4.1Å; L140-L155 HydrophobicContact CG-CD1 4.04Å
141	H	78	Confident	76.3	Confident	0 Å²	0	76.8 Å²	76.8	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-99.1	-16.3	-170	-56.5	160.7	0	0	0	114.4	W137 R138 L148 K149 H171 W187	W137-H141 AromaticContact CE3-CE1 3.25Å; W137-H141 AromaticContact CE3-NE2 3.68Å; W137-H141 AromaticContact CZ3-CE1 3.66Å; W137-H141 AromaticContact CZ3-NE2 3.83Å; W137-H141 WeakPolarHBondContact O-CB 3.45Å; W137-H141 VanDerWaalsContact O-CG 3.29Å; W137-H141 PolarHBondContact O-N 3.36Å; W137-H141 PolarHBondContact O-ND1 2.98Å; R138-H141 PolarHBondContact O-N 3.5Å; H141-L148 HydrophobicContact CB-CD2 4.22Å; H141-L148 CarbonylContact O-C 3.51Å; H141-L148 WeakPolarHBondContact O-CA 3.02Å; H141-K149 PolarHBondContact O-N 2.91Å; H141-H171 AromaticContact CE1-CE1 3.5Å; H141-H171 PolarHBondContact CE1-CE1 3.35Å; H141-H171 VanDerWaalsContact CE1-CE1 3.5Å; H141-H171 AromaticContact CG-CE1 3.84Å; H141-H171 AromaticContact ND1-CE1 2.97Å; H141-H171 PolarHBondContact ND1-CE1 3.34Å; H141-H171 AromaticContact ND1-ND1 3.89Å; H141-H171 AromaticContact ND1-NE2 3.52Å; H141-W187 HydrophobicContact CB-CH2 4.07Å; H141-W187 HydrophobicContact CB-CZ2 3.9Å; H141-W187 AromaticContact CD2-CH2 3.29Å; H141-W187 WeakPolarHBondContact CD2-CH2 3.43Å; H141-W187 AromaticContact CD2-CZ2 4Å; H141-W187 AromaticContact CD2-CZ3 3.78Å; H141-W187 AromaticContact CE1-CZ3 3.91Å; H141-W187 AromaticContact CG-CH2 3.63Å; H141-W187 AromaticContact CG-CZ2 3.99Å; H141-W187 AromaticContact NE2-CH2 3.72Å; H141-W187 AromaticContact NE2-CZ3 3.74Å
142	S	77.4	Confident	77.5	Confident	15 Å²	15	76.7 Å²	76.7	11%	0.105	40%	0.4	C	S	.	.	B	Isolated β-bridge	trans	-101.6	147.1	177.9	-59.3	0	0	0	0	112	R138 Q147 K149	R138-S142 WeakPolarHBondContact O-CA 3.04Å; R138-S142 WeakPolarHBondContact O-CB 3.34Å; R138-S142 PolarHBondContact O-N 3.47Å; R138-S142 PolarHBondContact O-OG 2.95Å; S142-Q147 CarbonylContact C-O 3.59Å; S142-Q147 WeakPolarHBondContact CA-O 3.43Å; S142-K149 VanDerWaalsContact O-CE 3.27Å; S142-K149 WeakPolarHBondContact O-CE 3.45Å; S142-K149 PolarHBondContact O-NZ 3.42Å
143	M	72.2	Confident	78.7	Confident	102 Å²	102	75.9 Å²	75.9	50%	0.502	39%	0.391	S	S	.	.			trans	-78	164.7	163.3	-67.6	-67	-84.5	0	0	109.5	D145 G146 Q147 K149	M143-D145 WeakPolarHBondContact CB-OD1 3.26Å; M143-D145 PolarHBondContact O-N 3.34Å; M143-G146 PolarHBondContact O-N 2.94Å; M143-Q147 PolarHBondContact N-O 2.95Å; M143-K149 HydrophobicContact CG-CG 3.63Å; M143-K149 HydrophobicContact SD-CD 4Å; M143-K149 WeakPolarHBondContact SD-CE 3.43Å; M143-K149 HydrophobicContact SD-CG 3.5Å; M143-K149 VanDerWaalsContact SD-CG 3.5Å
144	E	70.6	Confident	79.2	Confident	210 Å²	210	78.3 Å²	78.3	98%	0.981	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-25.1	-179.9	-64.9	-177.1	171.2	0	0	113.1	G146	E144-G146 PolarHBondContact O-N 3.41Å
145	D	69.9	Low	79.5	Confident	105 Å²	105	77 Å²	77	56%	0.561	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-1.7	176.2	68	-7.9	0	0	0	113.7	M143 Q147	M143-D145 WeakPolarHBondContact CB-OD1 3.26Å; M143-D145 PolarHBondContact O-N 3.34Å; D145-Q147 VanDerWaalsContact C-N 3.34Å; D145-Q147 WeakPolarHBondContact OD1-CB 3.42Å; D145-Q147 PolarHBondContact OD1-N 3.42Å; D145-Q147 WeakPolarHBondContact OD2-CG 3.45Å
146	G	72.9	Confident	80	Confident	47 Å²	47	72 Å²	72	49%	0.485	38%	0.378	S	S	.	.	S	Bend	trans	83.7	0.2	-177	0	0	0	0	0	114.9	M143 E144	M143-G146 PolarHBondContact O-N 2.94Å; E144-G146 PolarHBondContact O-N 3.41Å
147	Q	76.7	Confident	80.6	Confident	128 Å²	128	71.6 Å²	71.6	60%	0.598	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-73	154.3	170.9	-64.2	-168.5	19.4	0	0	110.9	S142 M143 D145	S142-Q147 CarbonylContact C-O 3.59Å; S142-Q147 WeakPolarHBondContact CA-O 3.43Å; M143-Q147 PolarHBondContact N-O 2.95Å; D145-Q147 VanDerWaalsContact C-N 3.34Å; D145-Q147 WeakPolarHBondContact OD1-CB 3.42Å; D145-Q147 PolarHBondContact OD1-N 3.42Å; D145-Q147 WeakPolarHBondContact OD2-CG 3.45Å
148	L	80.2	Confident	81.1	Confident	33 Å²	33	72.3 Å²	72.3	17%	0.173	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-82.4	131.6	174.1	-70.8	169.8	0	0	0	109.9	H141 T184	H141-L148 HydrophobicContact CB-CD2 4.22Å; H141-L148 CarbonylContact O-C 3.51Å; H141-L148 WeakPolarHBondContact O-CA 3.02Å; L148-T184 HydrophobicContact CD1-CG2 3.64Å
149	K	84.7	Confident	81.6	Confident	80 Å²	80	66.8 Å²	66.8	35%	0.348	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-60.4	157.1	167.2	-68.2	178.3	-174.3	159.4	0	109.9	H141 S142 M143 W187	H141-K149 PolarHBondContact O-N 2.91Å; S142-K149 VanDerWaalsContact O-CE 3.27Å; S142-K149 WeakPolarHBondContact O-CE 3.45Å; S142-K149 PolarHBondContact O-NZ 3.42Å; M143-K149 HydrophobicContact CG-CG 3.63Å; M143-K149 HydrophobicContact SD-CD 4Å; M143-K149 WeakPolarHBondContact SD-CE 3.43Å; M143-K149 HydrophobicContact SD-CG 3.5Å; M143-K149 VanDerWaalsContact SD-CG 3.5Å; K149-W187 VanDerWaalsContact O-CE2 3.28Å; K149-W187 WeakPolarHBondContact O-CZ2 3.15Å; K149-W187 PolarHBondContact O-NE1 2.93Å
150	E	87.7	Confident	82.1	Confident	159 Å²	159	63.2 Å²	63.2	74%	0.743	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-70.3	140.9	174.1	-67.6	-176.6	171.3	0	0	111.5	V152	E150-V152 WeakPolarHBondContact O-CG2 3.33Å; E150-V152 PolarHBondContact O-N 3.44Å
151	P	89.8	Confident	82.7	Confident	25 Å²	25	64.4 Å²	64.4	16%	0.162	35%	0.351	C	S	.	.			trans	-72.6	87.3	177.6	28	-33.4	0	0	0	111.5	L156 C186 W187 S190	P151-L156 HydrophobicContact CB-CD1 3.68Å; P151-C186 HydrophobicContact CG-CB 3.85Å; P151-W187 HydrophobicContact CB-CD2 3.94Å; P151-W187 HydrophobicContact CB-CE3 3.96Å; P151-W187 HydrophobicContact CB-CH2 4.32Å; P151-W187 HydrophobicContact CB-CZ2 4.28Å; P151-W187 HydrophobicContact CB-CZ3 4.17Å; P151-W187 HydrophobicContact CG-CD2 4.47Å; P151-S190 WeakPolarHBondContact CG-OG 3.39Å
152	V	89.2	Confident	83.2	Confident	81 Å²	81	68.4 Å²	68.4	49%	0.491	38%	0.378	S	S	.	.			trans	-78.4	143.1	178.1	-114.9	0	0	0	0	112.3	E150 S154 L155 L156	E150-V152 WeakPolarHBondContact O-CG2 3.33Å; E150-V152 PolarHBondContact O-N 3.44Å; V152-S154 VanDerWaalsContact C-N 3.29Å; V152-S154 PolarHBondContact O-N 2.92Å; V152-L155 HydrophobicContact CG2-CB 4.35Å; V152-L155 WeakPolarHBondContact O-CB 3.43Å; V152-L155 PolarHBondContact O-N 3.35Å; V152-L155 VanDerWaalsContact O-N 3.1Å; V152-L156 PolarHBondContact O-N 2.92Å; V152-L156 VanDerWaalsContact O-N 3.08Å
153	L	89	Confident	83.7	Confident	81 Å²	81	68.9 Å²	68.9	42%	0.424	38%	0.379	S	S	.	.	H	α-helix	trans	-59.4	-36.6	179.1	-68.4	178.4	0	0	0	113.1	I110 L155 L156 L157	I110-L153 HydrophobicContact CD1-CD2 3.71Å; L153-L155 PolarHBondContact O-N 3.41Å; L153-L156 PolarHBondContact O-N 3.48Å; L153-L157 HydrophobicContact CB-CD1 4.05Å; L153-L157 HydrophobicContact CB-CG 4.28Å; L153-L157 VanDerWaalsContact O-CB 3.31Å; L153-L157 WeakPolarHBondContact O-CB 3.21Å; L153-L157 WeakPolarHBondContact O-CG 3.42Å; L153-L157 PolarHBondContact O-N 3.04Å
154	S	84.6	Confident	84.5	Confident	93 Å²	93	64.1 Å²	64.1	65%	0.65	36%	0.355	S	S	*	.	H	α-helix	trans	-61.6	-32.8	177.7	52.3	0	0	0	0	112.7	V152 P158	V152-S154 VanDerWaalsContact C-N 3.29Å; V152-S154 PolarHBondContact O-N 2.92Å; S154-P158 WeakPolarHBondContact O-CD 3.43Å; S154-P158 WeakPolarHBondContact O-CG 3.48Å
155	L	84.5	Confident	85.5	Confident	28 Å²	28	55.9 Å²	55.9	15%	0.147	32%	0.318	C	S	.	.	H	α-helix	trans	-78.8	-37.5	176	-177.9	67.6	0	0	0	111.5	H128 L140 V152 L153 W187	H128-L155 PolarHBondContact CE1-O 3.49Å; H128-L155 PolarHBondContact NE2-O 2.97Å; H128-L155 VanDerWaalsContact NE2-O 3.14Å; L140-L155 HydrophobicContact CD1-CD1 3.88Å; L140-L155 HydrophobicContact CD2-CD1 4.1Å; L140-L155 HydrophobicContact CG-CD1 4.04Å; V152-L155 HydrophobicContact CG2-CB 4.35Å; V152-L155 WeakPolarHBondContact O-CB 3.43Å; V152-L155 PolarHBondContact O-N 3.35Å; V152-L155 VanDerWaalsContact O-N 3.1Å; L153-L155 PolarHBondContact O-N 3.41Å; L155-W187 HydrophobicContact CD2-CH2 3.8Å
156	L	89.2	Confident	86.4	Confident	2 Å²	2	55.5 Å²	55.5	1%	0.01	31%	0.308	C	S	.	.	H	α-helix	trans	-89.8	-37.3	-168.5	-77.2	179.8	0	0	0	114.8	P151 V152 L153 P158 L159 W187 L191 L194	P151-L156 HydrophobicContact CB-CD1 3.68Å; V152-L156 PolarHBondContact O-N 2.92Å; V152-L156 VanDerWaalsContact O-N 3.08Å; L153-L156 PolarHBondContact O-N 3.48Å; L156-P158 VanDerWaalsContact C-CD 3.41Å; L156-L159 HydrophobicContact CD2-CD1 3.69Å; L156-L159 WeakPolarHBondContact O-CB 3.18Å; L156-L159 WeakPolarHBondContact O-CG 3.4Å; L156-L159 PolarHBondContact O-N 2.7Å; L156-W187 HydrophobicContact CD2-CZ3 3.85Å; L156-L191 HydrophobicContact CD2-CD2 4.25Å; L156-L194 HydrophobicContact CB-CD1 3.69Å; L156-L194 HydrophobicContact CD1-CD1 4.14Å; L156-L194 HydrophobicContact CD2-CD1 3.95Å; L156-L194 HydrophobicContact CG-CD1 4.15Å
157	L	89.8	Confident	87.2	Confident	17 Å²	17	53.2 Å²	53.2	9%	0.089	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-34.3	-175.7	-68.1	175.2	0	0	0	114.3	I110 L113 R114 L123 L153 L159 L194	I110-L157 HydrophobicContact CG2-CD2 3.88Å; L113-L157 HydrophobicContact CB-CD1 4.32Å; R114-L157 HydrophobicContact CG-CD2 3.67Å; R114-L157 PolarHBondContact NE-O 3.11Å; R114-L157 VanDerWaalsContact NE-O 3.11Å; R114-L157 PolarHBondContact NH2-O 2.82Å; L123-L157 HydrophobicContact CD1-CB 4.07Å; L123-L157 HydrophobicContact CD2-CB 3.57Å; L153-L157 HydrophobicContact CB-CD1 4.05Å; L153-L157 HydrophobicContact CB-CG 4.28Å; L153-L157 VanDerWaalsContact O-CB 3.31Å; L153-L157 WeakPolarHBondContact O-CB 3.21Å; L153-L157 WeakPolarHBondContact O-CG 3.42Å; L153-L157 PolarHBondContact O-N 3.04Å; L157-L159 VanDerWaalsContact C-N 3.31Å; L157-L159 PolarHBondContact O-N 2.96Å; L157-L194 HydrophobicContact CD2-CD2 4.33Å
158	P	87.6	Confident	88	Confident	22 Å²	22	47.1 Å²	47.1	14%	0.143	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-23.2	177.6	-21.2	33.2	0	0	0	115.2	L123 S154 L156 N160	L123-P158 HydrophobicContact CD2-CG 3.81Å; S154-P158 WeakPolarHBondContact O-CD 3.43Å; S154-P158 WeakPolarHBondContact O-CG 3.48Å; L156-P158 VanDerWaalsContact C-CD 3.41Å; P158-N160 PolarHBondContact O-N 2.79Å
159	L	87.1	Confident	88.6	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.274	C	S	.	.			trans	-59	129.9	-172.7	-66.2	170.4	0	0	0	113	R114 H128 W137 L156 L157 E163 I164	R114-L159 PolarHBondContact NH2-O 3.43Å; H128-L159 HydrophobicContact CB-CD2 4.24Å; H128-L159 WeakPolarHBondContact CD2-CD2 3.34Å; H128-L159 VanDerWaalsContact CE1-CD2 3.46Å; H128-L159 WeakPolarHBondContact CE1-CD2 3.37Å; H128-L159 WeakPolarHBondContact ND1-CD2 3.03Å; H128-L159 WeakPolarHBondContact NE2-CD2 3.34Å; W137-L159 HydrophobicContact CH2-CD2 3.71Å; W137-L159 HydrophobicContact CZ3-CD2 4.03Å; L156-L159 HydrophobicContact CD2-CD1 3.69Å; L156-L159 WeakPolarHBondContact O-CB 3.18Å; L156-L159 WeakPolarHBondContact O-CG 3.4Å; L156-L159 PolarHBondContact O-N 2.7Å; L157-L159 VanDerWaalsContact C-N 3.31Å; L157-L159 PolarHBondContact O-N 2.96Å; L159-E163 WeakPolarHBondContact CA-OE2 3.13Å; L159-E163 HydrophobicContact CB-CB 4.24Å; L159-E163 HydrophobicContact CD2-CB 3.85Å; L159-I164 HydrophobicContact CB-CD1 4.4Å; L159-I164 HydrophobicContact CB-CG1 3.78Å; L159-I164 HydrophobicContact CD1-CG1 4.42Å
160	N	87	Confident	88.9	Confident	67 Å²	67	47.4 Å²	47.4	36%	0.358	26%	0.259	S	S	.	.			trans	-75.2	169.1	170.9	71.1	58.4	0	0	0	112.2	P158 C162 E163 I164	P158-N160 PolarHBondContact O-N 2.79Å; N160-C162 VanDerWaalsContact C-N 3.27Å; N160-C162 PolarHBondContact O-N 3.05Å; N160-C162 WeakPolarHBondContact OD1-CA 3.26Å; N160-C162 VanDerWaalsContact OD1-CB 3.32Å; N160-C162 WeakPolarHBondContact OD1-CB 3.32Å; N160-C162 PolarHBondContact OD1-N 3.18Å; N160-E163 PolarHBondContact N-OE2 3.45Å; N160-E163 WeakPolarHBondContact ND2-CG 3.39Å; N160-E163 PolarHBondContact ND2-OE1 2.95Å; N160-E163 PolarHBondContact ND2-OE2 3.45Å; N160-E163 WeakPolarHBondContact O-CB 3.44Å; N160-E163 PolarHBondContact O-N 3.36Å; N160-E163 VanDerWaalsContact O-N 3.1Å; N160-E163 PolarHBondContact OD1-N 3.45Å; N160-I164 WeakPolarHBondContact O-CD1 3.33Å; N160-I164 WeakPolarHBondContact O-CG1 3.35Å; N160-I164 PolarHBondContact O-N 3.44Å
161	S	88.9	Confident	89.1	Confident	57 Å²	57	40.2 Å²	40.2	40%	0.399	23%	0.225	S	C	.	.	H	α-helix	trans	-61	-33.7	-175.4	-37.7	0	0	0	0	113	L165 E196	S161-L165 PolarHBondContact O-N 2.98Å; S161-E196 PolarHBondContact OG-OE2 2.94Å
162	C	87.5	Confident	89.3	Confident	85 Å²	85	39.1 Å²	39.1	57%	0.574	22%	0.218	S	C	*	.	H	α-helix	trans	-69.3	-44.9	173.5	-61.8	0	0	0	0	111.3	N160 I164 L165 R166	N160-C162 VanDerWaalsContact C-N 3.27Å; N160-C162 PolarHBondContact O-N 3.05Å; N160-C162 WeakPolarHBondContact OD1-CA 3.26Å; N160-C162 VanDerWaalsContact OD1-CB 3.32Å; N160-C162 WeakPolarHBondContact OD1-CB 3.32Å; N160-C162 PolarHBondContact OD1-N 3.18Å; C162-I164 VanDerWaalsContact C-N 3.31Å; C162-I164 PolarHBondContact O-N 3.45Å; C162-L165 PolarHBondContact O-N 3.11Å; C162-R166 VanDerWaalsContact O-CG 3.28Å; C162-R166 WeakPolarHBondContact O-CG 3.3Å; C162-R166 PolarHBondContact O-N 2.95Å
163	E	88	Confident	89.4	Confident	25 Å²	25	39.3 Å²	39.3	12%	0.117	21%	0.212	C	C	.	.	H	α-helix	trans	-60.7	-39.5	177.9	-73.7	168.7	164.7	0	0	112.1	W137 L159 N160 R166 A167	W137-E163 HydrophobicContact CH2-CB 4.03Å; W137-E163 HydrophobicContact CZ2-CB 4.25Å; W137-E163 HydrophobicContact CZ2-CG 4.45Å; L159-E163 WeakPolarHBondContact CA-OE2 3.13Å; L159-E163 HydrophobicContact CB-CB 4.24Å; L159-E163 HydrophobicContact CD2-CB 3.85Å; N160-E163 PolarHBondContact N-OE2 3.45Å; N160-E163 WeakPolarHBondContact ND2-CG 3.39Å; N160-E163 PolarHBondContact ND2-OE1 2.95Å; N160-E163 PolarHBondContact ND2-OE2 3.45Å; N160-E163 WeakPolarHBondContact O-CB 3.44Å; N160-E163 PolarHBondContact O-N 3.36Å; N160-E163 VanDerWaalsContact O-N 3.1Å; N160-E163 PolarHBondContact OD1-N 3.45Å; E163-R166 PolarHBondContact O-N 3.42Å; E163-A167 VanDerWaalsContact O-CB 3.29Å; E163-A167 WeakPolarHBondContact O-CB 3.47Å; E163-A167 PolarHBondContact O-N 3.23Å
164	I	90.7	Very high	89.5	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-60.6	-47.1	175	-67.2	157.5	0	0	0	110.9	L159 N160 C162 A167 F168 L191 L194 M195	L159-I164 HydrophobicContact CB-CD1 4.4Å; L159-I164 HydrophobicContact CB-CG1 3.78Å; L159-I164 HydrophobicContact CD1-CG1 4.42Å; N160-I164 WeakPolarHBondContact O-CD1 3.33Å; N160-I164 WeakPolarHBondContact O-CG1 3.35Å; N160-I164 PolarHBondContact O-N 3.44Å; C162-I164 VanDerWaalsContact C-N 3.31Å; C162-I164 PolarHBondContact O-N 3.45Å; I164-A167 PolarHBondContact O-N 2.92Å; I164-F168 WeakPolarHBondContact O-CB 3.43Å; I164-F168 PolarHBondContact O-N 3.36Å; I164-L191 HydrophobicContact CG2-CD2 4.42Å; I164-L194 HydrophobicContact CD1-CB 3.69Å; I164-L194 WeakPolarHBondContact CD1-O 3.31Å; I164-L194 HydrophobicContact CG1-CB 4.1Å; I164-L194 HydrophobicContact CG2-CB 4.19Å; I164-M195 HydrophobicContact CG2-CG 3.86Å
165	L	91.1	Very high	89.9	Confident	36 Å²	36	33.2 Å²	33.2	19%	0.188	17%	0.17	C	C	.	.	H	α-helix	trans	-63.4	-41.9	178	-74.4	173.1	0	0	0	111.8	S161 C162 F168 E169 M195 M199	S161-L165 PolarHBondContact O-N 2.98Å; C162-L165 PolarHBondContact O-N 3.11Å; L165-F168 WeakPolarHBondContact O-CB 3.49Å; L165-F168 PolarHBondContact O-N 3.38Å; L165-E169 PolarHBondContact O-N 2.9Å; L165-M195 HydrophobicContact CD2-CE 4.11Å; L165-M199 HydrophobicContact CD2-SD 4.23Å
166	R	88.9	Confident	90.2	Very high	97 Å²	97	37.2 Å²	37.2	37%	0.366	18%	0.183	S	C	.	.	H	α-helix	trans	-67.1	-40.5	177.6	-66.2	-173.5	86	146.2	19.6	112.4	T132 W137 C162 E163 F168 E169 A170	T132-R166 VanDerWaalsContact CB-NH2 3.34Å; T132-R166 PolarHBondContact OG1-NH1 2.97Å; T132-R166 PolarHBondContact OG1-NH2 2.68Å; W137-R166 HydrophobicContact CZ2-CB 4.35Å; C162-R166 VanDerWaalsContact O-CG 3.28Å; C162-R166 WeakPolarHBondContact O-CG 3.3Å; C162-R166 PolarHBondContact O-N 2.95Å; E163-R166 PolarHBondContact O-N 3.42Å; R166-F168 VanDerWaalsContact C-N 3.29Å; R166-F168 PolarHBondContact O-N 3.38Å; R166-E169 PolarHBondContact O-N 2.89Å; R166-A170 WeakPolarHBondContact O-CB 3.36Å; R166-A170 PolarHBondContact O-N 3.34Å
167	A	89.7	Confident	90.2	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.8	-41.5	173.1	0	0	0	0	0	110.9	W137 E163 I164 A170 H171 L191	W137-A167 HydrophobicContact CD2-CB 4.48Å; W137-A167 HydrophobicContact CE3-CB 3.98Å; W137-A167 HydrophobicContact CH2-CB 3.97Å; W137-A167 HydrophobicContact CZ3-CB 3.68Å; E163-A167 VanDerWaalsContact O-CB 3.29Å; E163-A167 WeakPolarHBondContact O-CB 3.47Å; E163-A167 PolarHBondContact O-N 3.23Å; I164-A167 PolarHBondContact O-N 2.92Å; A167-A170 PolarHBondContact O-N 3.4Å; A167-H171 PolarHBondContact O-N 3.14Å; A167-H171 PolarHBondContact O-ND1 3.33Å; A167-L191 HydrophobicContact CB-CD1 4.3Å; A167-L191 HydrophobicContact CB-CD2 3.87Å
168	F	93.5	Very high	90.2	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.6	-46.6	176.5	-167.1	-80.4	0	0	0	111.8	I164 L165 R166 A170 H171 F172 F188 L191 L192 M195 L206 L207 F210	I164-F168 WeakPolarHBondContact O-CB 3.43Å; I164-F168 PolarHBondContact O-N 3.36Å; L165-F168 WeakPolarHBondContact O-CB 3.49Å; L165-F168 PolarHBondContact O-N 3.38Å; R166-F168 VanDerWaalsContact C-N 3.29Å; R166-F168 PolarHBondContact O-N 3.38Å; F168-A170 VanDerWaalsContact C-N 3.35Å; F168-A170 PolarHBondContact O-N 3.25Å; F168-H171 PolarHBondContact O-N 3.42Å; F168-F172 WeakPolarHBondContact O-CB 3.45Å; F168-F172 PolarHBondContact O-N 3.29Å; F168-F188 HydrophobicContact CD2-CD1 4.04Å; F168-F188 HydrophobicContact CE1-CD1 4.46Å; F168-F188 HydrophobicContact CE1-CE1 4.47Å; F168-F188 AromaticContact CE2-CD1 3.65Å; F168-F188 HydrophobicContact CE2-CD1 3.65Å; F168-F188 HydrophobicContact CE2-CE1 4.38Å; F168-F188 AromaticContact CZ-CD1 3.88Å; F168-F188 HydrophobicContact CZ-CD1 3.88Å; F168-F188 HydrophobicContact CZ-CE1 4.32Å; F168-L191 HydrophobicContact CB-CD1 4.23Å; F168-L191 HydrophobicContact CD2-CB 3.93Å; F168-L191 HydrophobicContact CD2-CD1 4.3Å; F168-L192 HydrophobicContact CE2-CD2 3.92Å; F168-L192 HydrophobicContact CE2-CG 4.07Å; F168-L192 HydrophobicContact CZ-CD2 4.44Å; F168-M195 HydrophobicContact CB-CE 3.75Å; F168-M195 HydrophobicContact CD1-CE 4.24Å; F168-M195 HydrophobicContact CD2-CE 3.28Å; F168-M195 HydrophobicContact CE2-CE 3.86Å; F168-M195 HydrophobicContact CG-CE 3.49Å; F168-M195 VanDerWaalsContact CG-CE 3.49Å; F168-L206 HydrophobicContact CB-CD2 4.45Å; F168-L206 HydrophobicContact CD1-CD1 4.49Å; F168-L206 HydrophobicContact CD1-CD2 3.72Å; F168-L206 HydrophobicContact CD1-CG 3.88Å; F168-L206 HydrophobicContact CE1-CD2 4.49Å; F168-L206 HydrophobicContact CE1-CG 4.19Å; F168-L206 HydrophobicContact CG-CD2 4.48Å; F168-L207 HydrophobicContact CE1-CD2 3.91Å; F168-L207 HydrophobicContact CE2-CD2 4.01Å; F168-L207 HydrophobicContact CZ-CD2 3.56Å; F168-F210 HydrophobicContact CE1-CB 3.9Å; F168-F210 HydrophobicContact CE1-CD1 4.24Å; F168-F210 HydrophobicContact CE1-CD2 4.22Å; F168-F210 AromaticContact CE1-CG 3.86Å; F168-F210 HydrophobicContact CE1-CG 3.86Å; F168-F210 HydrophobicContact CZ-CB 4.18Å; F168-F210 AromaticContact CZ-CD1 3.65Å; F168-F210 HydrophobicContact CZ-CD1 3.65Å; F168-F210 HydrophobicContact CZ-CD2 4.2Å; F168-F210 HydrophobicContact CZ-CE1 4.01Å; F168-F210 AromaticContact CZ-CG 3.74Å; F168-F210 HydrophobicContact CZ-CG 3.74Å; F168-F210 HydrophobicContact CZ-CZ 4.43Å
169	E	92.6	Very high	90.4	Very high	116 Å²	116	52.1 Å²	52.1	54%	0.542	26%	0.256	S	S	.	.	H	α-helix	trans	-60.2	-43.2	176.5	-172.6	179.8	-165	0	0	111.8	L165 R166 F172 F173 L206	L165-E169 PolarHBondContact O-N 2.9Å; R166-E169 PolarHBondContact O-N 2.89Å; E169-F172 PolarHBondContact O-N 3.47Å; E169-F173 WeakPolarHBondContact O-CB 3.27Å; E169-F173 PolarHBondContact O-N 2.77Å; E169-L206 HydrophobicContact CB-CD1 4.43Å; E169-L206 HydrophobicContact CB-CD2 4.07Å; E169-L206 HydrophobicContact CG-CD1 4.42Å
170	A	90.3	Very high	90.8	Very high	3 Å²	3	52.8 Å²	52.8	3%	0.025	26%	0.259	C	S	.	.	H	α-helix	trans	-61.4	-49.2	177.5	0	0	0	0	0	112.2	L134 W137 R166 A167 F168 F172 F173 W174	L134-A170 HydrophobicContact CD1-CB 3.5Å; W137-A170 HydrophobicContact CB-CB 4.17Å; W137-A170 HydrophobicContact CG-CB 4.41Å; R166-A170 WeakPolarHBondContact O-CB 3.36Å; R166-A170 PolarHBondContact O-N 3.34Å; A167-A170 PolarHBondContact O-N 3.4Å; F168-A170 VanDerWaalsContact C-N 3.35Å; F168-A170 PolarHBondContact O-N 3.25Å; A170-F172 VanDerWaalsContact C-N 3.29Å; A170-F172 PolarHBondContact O-N 2.76Å; A170-F173 WeakPolarHBondContact O-CB 3.38Å; A170-F173 PolarHBondContact O-N 3.3Å; A170-W174 HydrophobicContact CB-CH2 3.8Å; A170-W174 HydrophobicContact CB-CZ2 4.02Å; A170-W174 HydrophobicContact CB-CZ3 4.23Å; A170-W174 VanDerWaalsContact O-CD2 3.23Å; A170-W174 PolarHBondContact O-N 3.1Å
171	H	91.4	Very high	91	Very high	7 Å²	7	51.9 Å²	51.9	3%	0.032	26%	0.258	C	S	.	.	H	α-helix	trans	-61.7	-39.2	175.4	-75.6	94.2	0	0	0	112	H141 A167 F168 F173 W174 L175 W187 F188	H141-H171 AromaticContact CE1-CE1 3.5Å; H141-H171 PolarHBondContact CE1-CE1 3.35Å; H141-H171 VanDerWaalsContact CE1-CE1 3.5Å; H141-H171 AromaticContact CG-CE1 3.84Å; H141-H171 AromaticContact ND1-CE1 2.97Å; H141-H171 PolarHBondContact ND1-CE1 3.34Å; H141-H171 AromaticContact ND1-ND1 3.89Å; H141-H171 AromaticContact ND1-NE2 3.52Å; A167-H171 PolarHBondContact O-N 3.14Å; A167-H171 PolarHBondContact O-ND1 3.33Å; F168-H171 PolarHBondContact O-N 3.42Å; H171-F173 VanDerWaalsContact C-N 3.34Å; H171-W174 AromaticContact CD2-CZ3 4Å; H171-W174 PolarHBondContact O-N 3.04Å; H171-L175 VanDerWaalsContact O-CB 3.3Å; H171-L175 WeakPolarHBondContact O-CB 3.46Å; H171-L175 PolarHBondContact O-N 3.12Å; H171-W187 AromaticContact CD2-CG 3.97Å; H171-W187 AromaticContact CE1-CD2 3.79Å; H171-W187 AromaticContact CE1-CE3 3.48Å; H171-W187 VanDerWaalsContact CE1-CE3 3.48Å; H171-W187 AromaticContact CE1-CZ3 3.97Å; H171-W187 AromaticContact NE2-CD2 3.34Å; H171-W187 VanDerWaalsContact NE2-CD2 3.34Å; H171-W187 AromaticContact NE2-CE2 3.9Å; H171-W187 AromaticContact NE2-CE3 3.55Å; H171-W187 AromaticContact NE2-CG 3.49Å; H171-F188 HydrophobicContact CB-CE1 3.78Å; H171-F188 HydrophobicContact CB-CZ 3.8Å
172	F	94.8	Very high	91.2	Very high	3 Å²	3	55.1 Å²	55.1	1%	0.013	27%	0.266	C	S	.	.	H	α-helix	trans	-65.2	-40.1	177.1	-175.5	-153.6	0	0	0	111.8	F168 E169 A170 W174 L175 R176 F188 L206 E209 F210 Y213	F168-F172 WeakPolarHBondContact O-CB 3.45Å; F168-F172 PolarHBondContact O-N 3.29Å; E169-F172 PolarHBondContact O-N 3.47Å; A170-F172 VanDerWaalsContact C-N 3.29Å; A170-F172 PolarHBondContact O-N 2.76Å; F172-W174 PolarHBondContact O-N 3.06Å; F172-L175 HydrophobicContact CD2-CD2 4.37Å; F172-L175 PolarHBondContact O-N 3.03Å; F172-R176 HydrophobicContact CD2-CG 4.25Å; F172-R176 HydrophobicContact CE2-CG 4.06Å; F172-R176 VanDerWaalsContact CZ-CZ 3.46Å; F172-R176 VanDerWaalsContact CZ-NE 3.32Å; F172-R176 WeakPolarHBondContact O-CG 3.42Å; F172-R176 PolarHBondContact O-N 3.04Å; F172-R176 VanDerWaalsContact O-N 3.08Å; F172-F188 HydrophobicContact CB-CE1 4.34Å; F172-L206 HydrophobicContact CD1-CD1 3.89Å; F172-L206 HydrophobicContact CE1-CD1 4.47Å; F172-E209 HydrophobicContact CE1-CB 4.13Å; F172-E209 HydrophobicContact CE1-CG 3.9Å; F172-E209 HydrophobicContact CZ-CG 4.2Å; F172-F210 HydrophobicContact CD1-CB 4.34Å; F172-F210 AromaticContact CD2-CD2 3.67Å; F172-F210 HydrophobicContact CD2-CD2 3.67Å; F172-F210 HydrophobicContact CD2-CE2 4.41Å; F172-F210 HydrophobicContact CE1-CB 4.11Å; F172-F210 HydrophobicContact CE2-CB 4.46Å; F172-F210 AromaticContact CE2-CD2 3.89Å; F172-F210 HydrophobicContact CE2-CD2 3.89Å; F172-F210 HydrophobicContact CG-CD2 4.04Å; F172-F210 VanDerWaalsContact CZ-CA 3.48Å; F172-F210 HydrophobicContact CZ-CB 4.16Å; F172-F210 HydrophobicContact CZ-CD2 4.43Å; F172-Y213 AromaticContact CE2-CD1 3.8Å; F172-Y213 HydrophobicContact CE2-CD1 3.8Å; F172-Y213 HydrophobicContact CE2-CD2 4.32Å; F172-Y213 AromaticContact CE2-CG 3.67Å; F172-Y213 HydrophobicContact CE2-CG 3.67Å; F172-Y213 HydrophobicContact CZ-CG 4.19Å
173	F	92.3	Very high	91.4	Very high	85 Å²	85	53.1 Å²	53.1	37%	0.373	25%	0.253	S	S	.	.	H	α-helix	trans	-60.9	-42.8	174.3	177.9	-91.8	0	0	0	112.5	L134 E169 A170 H171 K177	L134-F173 HydrophobicContact CD1-CD1 4.32Å; L134-F173 HydrophobicContact CD2-CD1 3.41Å; L134-F173 VanDerWaalsContact CD2-CD1 3.41Å; L134-F173 HydrophobicContact CD2-CE1 3.34Å; L134-F173 HydrophobicContact CD2-CG 4.25Å; L134-F173 HydrophobicContact CD2-CZ 4.17Å; L134-F173 HydrophobicContact CG-CD1 4.47Å; E169-F173 WeakPolarHBondContact O-CB 3.27Å; E169-F173 PolarHBondContact O-N 2.77Å; A170-F173 WeakPolarHBondContact O-CB 3.38Å; A170-F173 PolarHBondContact O-N 3.3Å; H171-F173 VanDerWaalsContact C-N 3.34Å; F173-K177 HydrophobicContact CE1-CD 4.27Å; F173-K177 VanDerWaalsContact CE1-CE 3.49Å; F173-K177 VanDerWaalsContact CE1-NZ 3.3Å; F173-K177 VanDerWaalsContact CZ-CE 3.42Å; F173-K177 VanDerWaalsContact CZ-NZ 3.26Å
174	W	89.3	Confident	91.7	Very high	40 Å²	40	52.6 Å²	52.6	15%	0.152	25%	0.252	C	S	.	.	H	α-helix	trans	-71	-39.2	176.6	-57.8	-41.9	0	0	0	112.7	L134 W137 R138 A170 H171 F172 R176 K177 G178	L134-W174 HydrophobicContact CD1-CZ2 3.97Å; L134-W174 HydrophobicContact CG-CZ2 4.07Å; L134-W174 WeakPolarHBondContact O-CZ2 3.48Å; W137-W174 HydrophobicContact CB-CH2 3.73Å; W137-W174 HydrophobicContact CB-CZ2 4.24Å; R138-W174 VanDerWaalsContact CA-CH2 3.47Å; R138-W174 HydrophobicContact CB-CH2 3.95Å; R138-W174 HydrophobicContact CB-CZ2 3.48Å; R138-W174 VanDerWaalsContact CB-CZ2 3.48Å; R138-W174 HydrophobicContact CG-CZ2 4.07Å; R138-W174 VanDerWaalsContact N-CH2 3.31Å; A170-W174 HydrophobicContact CB-CH2 3.8Å; A170-W174 HydrophobicContact CB-CZ2 4.02Å; A170-W174 HydrophobicContact CB-CZ3 4.23Å; A170-W174 VanDerWaalsContact O-CD2 3.23Å; A170-W174 PolarHBondContact O-N 3.1Å; H171-W174 AromaticContact CD2-CZ3 4Å; H171-W174 PolarHBondContact O-N 3.04Å; F172-W174 PolarHBondContact O-N 3.06Å; W174-R176 PolarHBondContact O-N 3.22Å; W174-K177 CarbonylContact O-C 3.53Å; W174-K177 PolarHBondContact O-N 3.39Å; W174-G178 PolarHBondContact O-N 2.97Å
175	L	92.9	Very high	91.9	Very high	6 Å²	6	53.4 Å²	53.4	3%	0.031	26%	0.256	C	S	.	.	H	α-helix	trans	-56.1	-41.2	175.8	176	68.4	0	0	0	110.9	H171 F172 K177 G178 F180 F188 F210 Y213	H171-L175 VanDerWaalsContact O-CB 3.3Å; H171-L175 WeakPolarHBondContact O-CB 3.46Å; H171-L175 PolarHBondContact O-N 3.12Å; F172-L175 HydrophobicContact CD2-CD2 4.37Å; F172-L175 PolarHBondContact O-N 3.03Å; L175-K177 PolarHBondContact O-N 3.41Å; L175-K177 VanDerWaalsContact O-N 3.16Å; L175-G178 CarbonylContact O-C 3.57Å; L175-G178 PolarHBondContact O-N 2.77Å; L175-F180 HydrophobicContact CD1-CD1 3.96Å; L175-F180 HydrophobicContact CD1-CD2 3.84Å; L175-F180 HydrophobicContact CD1-CE1 4.06Å; L175-F180 HydrophobicContact CD1-CE2 3.96Å; L175-F180 HydrophobicContact CD1-CG 3.87Å; L175-F180 HydrophobicContact CD1-CZ 4.07Å; L175-F180 HydrophobicContact CD2-CD1 4.47Å; L175-F180 HydrophobicContact CD2-CD2 4.44Å; L175-F180 HydrophobicContact CD2-CE1 3.72Å; L175-F180 HydrophobicContact CD2-CE2 3.71Å; L175-F180 HydrophobicContact CD2-CZ 3.3Å; L175-F180 HydrophobicContact CG-CE2 4.29Å; L175-F180 HydrophobicContact CG-CZ 4.26Å; L175-F188 HydrophobicContact CB-CE2 4.32Å; L175-F188 HydrophobicContact CB-CZ 4.15Å; L175-F188 HydrophobicContact CD2-CE2 3.67Å; L175-F188 HydrophobicContact CD2-CZ 3.84Å; L175-F188 HydrophobicContact CG-CE2 4.41Å; L175-F210 HydrophobicContact CD2-CE2 3.87Å; L175-Y213 HydrophobicContact CD2-CD1 4.05Å; L175-Y213 HydrophobicContact CD2-CE1 3.69Å; L175-Y213 HydrophobicContact CG-CE1 3.82Å; L175-Y213 PolarHBondContact O-OH 3.41Å
176	R	92.2	Very high	92.1	Very high	111 Å²	111	54.7 Å²	54.7	42%	0.419	27%	0.267	S	S	.	.	H	α-helix	trans	-58.5	-27.1	176.6	-76	171.8	167.4	-172.4	-14.3	114.1	F172 W174 E209 Y213	F172-R176 HydrophobicContact CD2-CG 4.25Å; F172-R176 HydrophobicContact CE2-CG 4.06Å; F172-R176 VanDerWaalsContact CZ-CZ 3.46Å; F172-R176 VanDerWaalsContact CZ-NE 3.32Å; F172-R176 WeakPolarHBondContact O-CG 3.42Å; F172-R176 PolarHBondContact O-N 3.04Å; F172-R176 VanDerWaalsContact O-N 3.08Å; W174-R176 PolarHBondContact O-N 3.22Å; R176-E209 IonicContact CZ-OE1 3.33Å; R176-E209 IonicContact NH1-OE1 3.13Å; R176-E209 PolarHBondContact NH1-OE1 2.83Å; R176-E209 VanDerWaalsContact NH1-OE1 3.13Å; R176-E209 IonicContact NH2-OE1 2.64Å; R176-E209 PolarHBondContact NH2-OE1 3.44Å; R176-Y213 HydrophobicContact CG-CD2 4.27Å; R176-Y213 HydrophobicContact CG-CE2 3.95Å
177	K	89.4	Confident	92.4	Very high	159 Å²	159	50 Å²	50	69%	0.691	25%	0.25	S	C	*	.	H	α-helix	trans	-94.4	-12.2	176.2	-61.1	-177.3	-179.8	-177	0	112.8	F173 W174 L175	F173-K177 HydrophobicContact CE1-CD 4.27Å; F173-K177 VanDerWaalsContact CE1-CE 3.49Å; F173-K177 VanDerWaalsContact CE1-NZ 3.3Å; F173-K177 VanDerWaalsContact CZ-CE 3.42Å; F173-K177 VanDerWaalsContact CZ-NZ 3.26Å; W174-K177 CarbonylContact O-C 3.53Å; W174-K177 PolarHBondContact O-N 3.39Å; L175-K177 PolarHBondContact O-N 3.41Å; L175-K177 VanDerWaalsContact O-N 3.16Å
178	G	89.4	Confident	92.7	Very high	38 Å²	38	50.1 Å²	50.1	39%	0.392	25%	0.25	S	C	.	.	S	Bend	trans	-119.7	-149.7	-173.1	0	0	0	0	0	112.5	W174 L175	W174-G178 PolarHBondContact O-N 2.97Å; L175-G178 CarbonylContact O-C 3.57Å; L175-G178 PolarHBondContact O-N 2.77Å
179	K	92.3	Very high	92.9	Very high	158 Å²	158	52.4 Å²	52.4	69%	0.687	26%	0.259	S	S	*	.			trans	-135.3	155.7	178.9	-65.3	-173.7	-177.6	178.7	0	109.4	S181 Y217	K179-S181 PolarHBondContact O-N 3.45Å; K179-Y217 VanDerWaalsContact CA-OH 3.24Å; K179-Y217 WeakPolarHBondContact CA-OH 3.29Å; K179-Y217 WeakPolarHBondContact CB-OH 3.46Å; K179-Y217 WeakPolarHBondContact CG-OH 3.43Å
180	F	94.1	Very high	93	Very high	14 Å²	14	48 Å²	48	6%	0.061	24%	0.241	C	C	.	.			trans	-64.5	130.9	168.1	-80.9	-81.5	0	0	0	110.9	L175 T184 L185 F188 F210 Y213 C214 Y217 I230 I234	L175-F180 HydrophobicContact CD1-CD1 3.96Å; L175-F180 HydrophobicContact CD1-CD2 3.84Å; L175-F180 HydrophobicContact CD1-CE1 4.06Å; L175-F180 HydrophobicContact CD1-CE2 3.96Å; L175-F180 HydrophobicContact CD1-CG 3.87Å; L175-F180 HydrophobicContact CD1-CZ 4.07Å; L175-F180 HydrophobicContact CD2-CD1 4.47Å; L175-F180 HydrophobicContact CD2-CD2 4.44Å; L175-F180 HydrophobicContact CD2-CE1 3.72Å; L175-F180 HydrophobicContact CD2-CE2 3.71Å; L175-F180 HydrophobicContact CD2-CZ 3.3Å; L175-F180 HydrophobicContact CG-CE2 4.29Å; L175-F180 HydrophobicContact CG-CZ 4.26Å; F180-T184 WeakPolarHBondContact CA-OG1 3.5Å; F180-L185 HydrophobicContact CD1-CD2 3.62Å; F180-L185 HydrophobicContact CD1-CG 4.13Å; F180-L185 HydrophobicContact CE1-CD2 3.89Å; F180-F188 HydrophobicContact CE1-CD2 4.23Å; F180-F188 HydrophobicContact CE1-CE2 4.28Å; F180-F210 HydrophobicContact CZ-CE2 4.41Å; F180-F210 HydrophobicContact CZ-CZ 4.48Å; F180-Y213 HydrophobicContact CE2-CE1 4.15Å; F180-C214 VanDerWaalsContact CZ-SG 3.59Å; F180-Y217 HydrophobicContact CB-CE1 4.31Å; F180-Y217 AromaticContact CD2-CD1 3.49Å; F180-Y217 HydrophobicContact CD2-CD1 3.49Å; F180-Y217 VanDerWaalsContact CD2-CD1 3.49Å; F180-Y217 HydrophobicContact CD2-CD2 4.39Å; F180-Y217 AromaticContact CD2-CE1 3.6Å; F180-Y217 HydrophobicContact CD2-CE1 3.6Å; F180-Y217 HydrophobicContact CD2-CE2 4.45Å; F180-Y217 AromaticContact CD2-CG 3.93Å; F180-Y217 HydrophobicContact CD2-CG 3.93Å; F180-Y217 AromaticContact CE2-CD1 3.97Å; F180-Y217 HydrophobicContact CE2-CD1 3.97Å; F180-Y217 HydrophobicContact CE2-CE1 4.49Å; F180-Y217 HydrophobicContact CE2-CG 4.03Å; F180-Y217 HydrophobicContact CG-CE1 4.44Å; F180-Y217 PolarHBondContact N-OH 2.86Å; F180-I230 HydrophobicContact CB-CG2 3.52Å; F180-I230 HydrophobicContact CG-CG2 4.45Å; F180-I234 HydrophobicContact CB-CD1 4.34Å; F180-I234 HydrophobicContact CD1-CD1 4.45Å; F180-I234 HydrophobicContact CD1-CG1 4.11Å; F180-I234 HydrophobicContact CD2-CD1 3.57Å; F180-I234 HydrophobicContact CD2-CG1 4.04Å; F180-I234 HydrophobicContact CE1-CG1 4.14Å; F180-I234 HydrophobicContact CE2-CD1 3.86Å; F180-I234 HydrophobicContact CE2-CG1 4.06Å; F180-I234 HydrophobicContact CG-CD1 3.87Å; F180-I234 HydrophobicContact CG-CG1 4.04Å; F180-I234 HydrophobicContact CZ-CD1 4.42Å; F180-I234 HydrophobicContact CZ-CG1 4.1Å
181	S	92.6	Very high	93.2	Very high	48 Å²	48	47.8 Å²	47.8	34%	0.336	24%	0.24	S	C	.	.			trans	-124	168.6	164.5	71.9	0	0	0	0	110	K179 S183 T184 L185	K179-S181 PolarHBondContact O-N 3.45Å; S181-S183 VanDerWaalsContact C-N 3.27Å; S181-S183 PolarHBondContact O-N 3.13Å; S181-T184 PolarHBondContact N-OG1 2.9Å; S181-T184 PolarHBondContact O-N 2.82Å; S181-T184 VanDerWaalsContact O-N 3.12Å; S181-T184 PolarHBondContact O-OG1 3.44Å; S181-T184 PolarHBondContact OG-N 3.27Å; S181-L185 WeakPolarHBondContact O-CG 3.37Å; S181-L185 PolarHBondContact O-N 3.28Å; S181-L185 VanDerWaalsContact O-N 3.08Å
182	E	92.9	Very high	93.5	Very high	124 Å²	124	47.5 Å²	47.5	58%	0.579	24%	0.238	S	C	*	.	H	α-helix	trans	-56	-43.8	174.4	-64.8	-175.8	-169.9	0	0	111.5	T184 L185 C186 I230	E182-T184 VanDerWaalsContact C-N 3.34Å; E182-T184 PolarHBondContact O-N 2.67Å; E182-L185 WeakPolarHBondContact O-CB 3.36Å; E182-L185 PolarHBondContact O-N 2.9Å; E182-L185 VanDerWaalsContact O-N 3.1Å; E182-C186 PolarHBondContact O-N 3.46Å; E182-C186 PolarHBondContact O-SG 2.64Å; E182-C186 VanDerWaalsContact O-SG 3.33Å; E182-I230 HydrophobicContact CG-CD1 3.88Å
183	S	91.8	Very high	93.5	Very high	43 Å²	43	47.8 Å²	47.8	30%	0.301	24%	0.24	S	C	.	.	H	α-helix	trans	-58	-44.1	175.8	-42.3	0	0	0	0	112.1	S181 L185 C186 W187	S181-S183 VanDerWaalsContact C-N 3.27Å; S181-S183 PolarHBondContact O-N 3.13Å; S183-L185 VanDerWaalsContact C-N 3.31Å; S183-L185 PolarHBondContact O-N 3.25Å; S183-C186 PolarHBondContact O-N 2.7Å; S183-W187 PolarHBondContact O-N 3.12Å
184	T	93.5	Very high	93.6	Very high	15 Å²	15	44 Å²	44	9%	0.092	22%	0.224	C	C	.	.	H	α-helix	trans	-62.8	-38.8	177.6	62.6	0	0	0	0	112	L148 F180 S181 E182 W187 F188	L148-T184 HydrophobicContact CD1-CG2 3.64Å; F180-T184 WeakPolarHBondContact CA-OG1 3.5Å; S181-T184 PolarHBondContact N-OG1 2.9Å; S181-T184 PolarHBondContact O-N 2.82Å; S181-T184 VanDerWaalsContact O-N 3.12Å; S181-T184 PolarHBondContact O-OG1 3.44Å; S181-T184 PolarHBondContact OG-N 3.27Å; E182-T184 VanDerWaalsContact C-N 3.34Å; E182-T184 PolarHBondContact O-N 2.67Å; T184-W187 PolarHBondContact O-N 3.04Å; T184-F188 WeakPolarHBondContact O-CD2 3.29Å; T184-F188 PolarHBondContact O-N 3.03Å; T184-F188 VanDerWaalsContact O-N 3.09Å
185	L	95.8	Very high	93.8	Very high	19 Å²	19	42.4 Å²	42.4	10%	0.099	22%	0.218	C	C	.	.	H	α-helix	trans	-65.5	-43.1	178.1	-68.5	169.4	0	0	0	111.1	F180 S181 E182 S183 W187 F188 Y189 I230 I234 L237	F180-L185 HydrophobicContact CD1-CD2 3.62Å; F180-L185 HydrophobicContact CD1-CG 4.13Å; F180-L185 HydrophobicContact CE1-CD2 3.89Å; S181-L185 WeakPolarHBondContact O-CG 3.37Å; S181-L185 PolarHBondContact O-N 3.28Å; S181-L185 VanDerWaalsContact O-N 3.08Å; E182-L185 WeakPolarHBondContact O-CB 3.36Å; E182-L185 PolarHBondContact O-N 2.9Å; E182-L185 VanDerWaalsContact O-N 3.1Å; S183-L185 VanDerWaalsContact C-N 3.31Å; S183-L185 PolarHBondContact O-N 3.25Å; L185-W187 VanDerWaalsContact C-N 3.34Å; L185-W187 PolarHBondContact O-N 2.96Å; L185-F188 PolarHBondContact O-N 3.46Å; L185-Y189 WeakPolarHBondContact O-CB 3.42Å; L185-Y189 PolarHBondContact O-N 3.33Å; L185-I230 HydrophobicContact CD1-CD1 3.77Å; L185-I230 HydrophobicContact CD1-CG2 4.35Å; L185-I234 HydrophobicContact CD2-CG1 4.09Å; L185-L237 HydrophobicContact CD2-CD1 3.64Å
186	C	95.1	Very high	93.4	Very high	62 Å²	62	45.8 Å²	45.8	42%	0.419	23%	0.233	S	C	.	.	H	α-helix	trans	-57.6	-46.3	174	-66.4	0	0	0	0	111.1	P151 E182 S183 Y189 S190	P151-C186 HydrophobicContact CG-CB 3.85Å; E182-C186 PolarHBondContact O-N 3.46Å; E182-C186 PolarHBondContact O-SG 2.64Å; E182-C186 VanDerWaalsContact O-SG 3.33Å; S183-C186 PolarHBondContact O-N 2.7Å; C186-Y189 PolarHBondContact O-N 3.37Å; C186-S190 WeakPolarHBondContact O-CB 3.14Å; C186-S190 PolarHBondContact O-N 3.46Å; C186-S190 PolarHBondContact O-OG 2.92Å
187	W	94.5	Very high	93.1	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-59.1	-49.6	177.6	-85.3	103.9	0	0	0	113.1	H141 K149 P151 L155 L156 H171 S183 T184 L185 Y189 S190 L191	H141-W187 HydrophobicContact CB-CH2 4.07Å; H141-W187 HydrophobicContact CB-CZ2 3.9Å; H141-W187 AromaticContact CD2-CH2 3.29Å; H141-W187 WeakPolarHBondContact CD2-CH2 3.43Å; H141-W187 AromaticContact CD2-CZ2 4Å; H141-W187 AromaticContact CD2-CZ3 3.78Å; H141-W187 AromaticContact CE1-CZ3 3.91Å; H141-W187 AromaticContact CG-CH2 3.63Å; H141-W187 AromaticContact CG-CZ2 3.99Å; H141-W187 AromaticContact NE2-CH2 3.72Å; H141-W187 AromaticContact NE2-CZ3 3.74Å; K149-W187 VanDerWaalsContact O-CE2 3.28Å; K149-W187 WeakPolarHBondContact O-CZ2 3.15Å; K149-W187 PolarHBondContact O-NE1 2.93Å; P151-W187 HydrophobicContact CB-CD2 3.94Å; P151-W187 HydrophobicContact CB-CE3 3.96Å; P151-W187 HydrophobicContact CB-CH2 4.32Å; P151-W187 HydrophobicContact CB-CZ2 4.28Å; P151-W187 HydrophobicContact CB-CZ3 4.17Å; P151-W187 HydrophobicContact CG-CD2 4.47Å; L155-W187 HydrophobicContact CD2-CH2 3.8Å; L156-W187 HydrophobicContact CD2-CZ3 3.85Å; H171-W187 AromaticContact CD2-CG 3.97Å; H171-W187 AromaticContact CE1-CD2 3.79Å; H171-W187 AromaticContact CE1-CE3 3.48Å; H171-W187 VanDerWaalsContact CE1-CE3 3.48Å; H171-W187 AromaticContact CE1-CZ3 3.97Å; H171-W187 AromaticContact NE2-CD2 3.34Å; H171-W187 VanDerWaalsContact NE2-CD2 3.34Å; H171-W187 AromaticContact NE2-CE2 3.9Å; H171-W187 AromaticContact NE2-CE3 3.55Å; H171-W187 AromaticContact NE2-CG 3.49Å; S183-W187 PolarHBondContact O-N 3.12Å; T184-W187 PolarHBondContact O-N 3.04Å; L185-W187 VanDerWaalsContact C-N 3.34Å; L185-W187 PolarHBondContact O-N 2.96Å; W187-Y189 VanDerWaalsContact C-N 3.34Å; W187-Y189 PolarHBondContact O-N 2.85Å; W187-S190 PolarHBondContact O-N 3.32Å; W187-L191 WeakPolarHBondContact O-CB 3.31Å; W187-L191 VanDerWaalsContact O-CG 3.26Å; W187-L191 WeakPolarHBondContact O-CG 3.35Å; W187-L191 PolarHBondContact O-N 3.39Å
188	F	96.6	Very high	92.9	Very high	1 Å²	1	44.7 Å²	44.7	0%	0.004	25%	0.247	C	C	.	.	H	α-helix	trans	-63.3	-41.8	178.3	-71.7	-63	0	0	0	111.7	F168 H171 F172 L175 F180 T184 L185 L191 L192 F210 L237	F168-F188 HydrophobicContact CD2-CD1 4.04Å; F168-F188 HydrophobicContact CE1-CD1 4.46Å; F168-F188 HydrophobicContact CE1-CE1 4.47Å; F168-F188 AromaticContact CE2-CD1 3.65Å; F168-F188 HydrophobicContact CE2-CD1 3.65Å; F168-F188 HydrophobicContact CE2-CE1 4.38Å; F168-F188 AromaticContact CZ-CD1 3.88Å; F168-F188 HydrophobicContact CZ-CD1 3.88Å; F168-F188 HydrophobicContact CZ-CE1 4.32Å; H171-F188 HydrophobicContact CB-CE1 3.78Å; H171-F188 HydrophobicContact CB-CZ 3.8Å; F172-F188 HydrophobicContact CB-CE1 4.34Å; L175-F188 HydrophobicContact CB-CE2 4.32Å; L175-F188 HydrophobicContact CB-CZ 4.15Å; L175-F188 HydrophobicContact CD2-CE2 3.67Å; L175-F188 HydrophobicContact CD2-CZ 3.84Å; L175-F188 HydrophobicContact CG-CE2 4.41Å; F180-F188 HydrophobicContact CE1-CD2 4.23Å; F180-F188 HydrophobicContact CE1-CE2 4.28Å; T184-F188 WeakPolarHBondContact O-CD2 3.29Å; T184-F188 PolarHBondContact O-N 3.03Å; T184-F188 VanDerWaalsContact O-N 3.09Å; L185-F188 PolarHBondContact O-N 3.46Å; F188-L191 PolarHBondContact O-N 3.09Å; F188-L192 WeakPolarHBondContact O-CB 3.41Å; F188-L192 WeakPolarHBondContact O-CG 3.26Å; F188-L192 PolarHBondContact O-N 3.44Å; F188-F210 HydrophobicContact CB-CZ 4.09Å; F188-F210 HydrophobicContact CD1-CD2 4.46Å; F188-F210 HydrophobicContact CD1-CE1 4.46Å; F188-F210 AromaticContact CD1-CE2 3.71Å; F188-F210 HydrophobicContact CD1-CE2 3.71Å; F188-F210 AromaticContact CD1-CZ 3.7Å; F188-F210 HydrophobicContact CD1-CZ 3.7Å; F188-F210 AromaticContact CD2-CE2 3.95Å; F188-F210 HydrophobicContact CD2-CE2 3.95Å; F188-F210 AromaticContact CD2-CZ 3.8Å; F188-F210 HydrophobicContact CD2-CZ 3.8Å; F188-F210 HydrophobicContact CE1-CD2 4.12Å; F188-F210 AromaticContact CE1-CE2 3.54Å; F188-F210 HydrophobicContact CE1-CE2 3.54Å; F188-F210 HydrophobicContact CE1-CZ 4.05Å; F188-F210 AromaticContact CE2-CE2 3.82Å; F188-F210 HydrophobicContact CE2-CE2 3.82Å; F188-F210 HydrophobicContact CE2-CZ 4.17Å; F188-F210 HydrophobicContact CG-CE1 4.47Å; F188-F210 AromaticContact CG-CE2 3.92Å; F188-F210 HydrophobicContact CG-CE2 3.92Å; F188-F210 AromaticContact CG-CZ 3.58Å; F188-F210 HydrophobicContact CG-CZ 3.58Å; F188-F210 HydrophobicContact CZ-CD2 4.38Å; F188-F210 AromaticContact CZ-CE2 3.61Å; F188-F210 HydrophobicContact CZ-CE2 3.61Å; F188-F210 HydrophobicContact CZ-CZ 4.27Å; F188-L237 HydrophobicContact CB-CD1 3.86Å; F188-L237 HydrophobicContact CB-CD2 4.12Å
189	Y	96.8	Very high	92.8	Very high	48 Å²	48	44 Å²	44	19%	0.188	23%	0.234	C	C	.	.	H	α-helix	trans	-60.6	-47.5	176.3	-177.4	-94.5	0	0	0	112	F103 F106 L185 C186 W187 L191 L192 I193 L240	F103-Y189 AromaticContact CD2-CE2 3.75Å; F103-Y189 HydrophobicContact CD2-CE2 3.75Å; F103-Y189 HydrophobicContact CE2-CE2 4.13Å; F106-Y189 HydrophobicContact CD1-CE1 4.36Å; F106-Y189 HydrophobicContact CE1-CE1 4.3Å; L185-Y189 WeakPolarHBondContact O-CB 3.42Å; L185-Y189 PolarHBondContact O-N 3.33Å; C186-Y189 PolarHBondContact O-N 3.37Å; W187-Y189 VanDerWaalsContact C-N 3.34Å; W187-Y189 PolarHBondContact O-N 2.85Å; Y189-L191 PolarHBondContact O-N 2.87Å; Y189-L192 PolarHBondContact O-N 2.9Å; Y189-I193 HydrophobicContact CD1-CD1 3.91Å; Y189-I193 HydrophobicContact CE1-CD1 3.27Å; Y189-I193 HydrophobicContact CE1-CG1 4.36Å; Y189-I193 PolarHBondContact O-N 3.24Å; Y189-L240 HydrophobicContact CD2-CD1 3.84Å; Y189-L240 HydrophobicContact CE2-CD1 3.74Å
190	S	95.4	Very high	92.7	Very high	23 Å²	23	41.6 Å²	41.6	16%	0.161	23%	0.228	C	C	.	.	H	α-helix	trans	-62.9	-41.1	178.6	-63.7	0	0	0	0	112.4	P151 C186 W187 I193 L194	P151-S190 WeakPolarHBondContact CG-OG 3.39Å; C186-S190 WeakPolarHBondContact O-CB 3.14Å; C186-S190 PolarHBondContact O-N 3.46Å; C186-S190 PolarHBondContact O-OG 2.92Å; W187-S190 PolarHBondContact O-N 3.32Å; S190-I193 PolarHBondContact O-N 3.42Å; S190-L194 WeakPolarHBondContact O-CD1 3.5Å; S190-L194 WeakPolarHBondContact O-CG 3.44Å; S190-L194 PolarHBondContact O-N 3.06Å
191	L	95	Very high	92.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-68.3	-41.3	177	-69.9	170.9	0	0	0	111.8	L156 I164 A167 F168 W187 F188 Y189 I193 L194 M195	L156-L191 HydrophobicContact CD2-CD2 4.25Å; I164-L191 HydrophobicContact CG2-CD2 4.42Å; A167-L191 HydrophobicContact CB-CD1 4.3Å; A167-L191 HydrophobicContact CB-CD2 3.87Å; F168-L191 HydrophobicContact CB-CD1 4.23Å; F168-L191 HydrophobicContact CD2-CB 3.93Å; F168-L191 HydrophobicContact CD2-CD1 4.3Å; W187-L191 WeakPolarHBondContact O-CB 3.31Å; W187-L191 VanDerWaalsContact O-CG 3.26Å; W187-L191 WeakPolarHBondContact O-CG 3.35Å; W187-L191 PolarHBondContact O-N 3.39Å; F188-L191 PolarHBondContact O-N 3.09Å; Y189-L191 PolarHBondContact O-N 2.87Å; L191-I193 VanDerWaalsContact C-N 3.3Å; L191-I193 PolarHBondContact O-N 3.3Å; L191-L194 PolarHBondContact O-N 3.49Å; L191-L194 VanDerWaalsContact O-N 3.12Å; L191-M195 WeakPolarHBondContact O-CG 3.42Å; L191-M195 PolarHBondContact O-N 3.23Å
192	L	96.5	Very high	92.5	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-59.2	-41.9	174.7	-73.6	171.7	0	0	0	111.6	F103 F168 F188 Y189 L194 M195 L207 L237 I241 F245	F103-L192 HydrophobicContact CE2-CB 4.29Å; F103-L192 HydrophobicContact CZ-CB 4.08Å; F168-L192 HydrophobicContact CE2-CD2 3.92Å; F168-L192 HydrophobicContact CE2-CG 4.07Å; F168-L192 HydrophobicContact CZ-CD2 4.44Å; F188-L192 WeakPolarHBondContact O-CB 3.41Å; F188-L192 WeakPolarHBondContact O-CG 3.26Å; F188-L192 PolarHBondContact O-N 3.44Å; Y189-L192 PolarHBondContact O-N 2.9Å; L192-L194 PolarHBondContact O-N 3.45Å; L192-M195 HydrophobicContact CD2-SD 4.07Å; L192-M195 PolarHBondContact O-N 3.19Å; L192-L207 HydrophobicContact CD2-CD1 4.32Å; L192-L207 HydrophobicContact CD2-CD2 3.59Å; L192-L237 HydrophobicContact CD1-CD2 3.66Å; L192-I241 HydrophobicContact CD1-CG1 4.39Å; L192-I241 HydrophobicContact CD2-CG1 4.14Å; L192-F245 HydrophobicContact CB-CE2 4.33Å; L192-F245 HydrophobicContact CB-CZ 4.18Å; L192-F245 HydrophobicContact CD2-CE2 3.82Å; L192-F245 HydrophobicContact CD2-CZ 3.85Å; L192-F245 WeakPolarHBondContact O-CZ 3.49Å
193	I	95.7	Very high	92.5	Very high	10 Å²	10	43.3 Å²	43.3	5%	0.051	24%	0.239	C	C	.	.	H	α-helix	trans	-56.9	-36.5	176	-96.8	169.5	0	0	0	112.6	F103 F106 I110 Y189 S190 L191	F103-I193 HydrophobicContact CD2-CG1 4.03Å; F103-I193 HydrophobicContact CE2-CB 4.49Å; F103-I193 HydrophobicContact CE2-CD1 4.37Å; F103-I193 HydrophobicContact CE2-CG1 3.54Å; F103-I193 HydrophobicContact CZ-CG1 3.97Å; F106-I193 HydrophobicContact CD1-CD1 3.18Å; F106-I193 HydrophobicContact CD1-CG1 4.38Å; F106-I193 HydrophobicContact CE1-CD1 3.38Å; F106-I193 HydrophobicContact CG-CD1 4.17Å; F106-I193 HydrophobicContact CZ-CD1 4.49Å; I110-I193 HydrophobicContact CB-CG2 4.14Å; I110-I193 HydrophobicContact CG1-CG2 3.72Å; I110-I193 HydrophobicContact CG2-CG2 4.01Å; Y189-I193 HydrophobicContact CD1-CD1 3.91Å; Y189-I193 HydrophobicContact CE1-CD1 3.27Å; Y189-I193 HydrophobicContact CE1-CG1 4.36Å; Y189-I193 PolarHBondContact O-N 3.24Å; S190-I193 PolarHBondContact O-N 3.42Å; L191-I193 VanDerWaalsContact C-N 3.3Å; L191-I193 PolarHBondContact O-N 3.3Å
194	L	94	Very high	92.6	Very high	6 Å²	6	43.7 Å²	43.7	3%	0.031	24%	0.236	C	C	.	.	H	α-helix	trans	-83.6	-14.6	-176.6	-63.1	162	0	0	0	113	I110 L156 L157 I164 S190 L191 L192 E196	I110-L194 HydrophobicContact CG2-CD2 3.77Å; L156-L194 HydrophobicContact CB-CD1 3.69Å; L156-L194 HydrophobicContact CD1-CD1 4.14Å; L156-L194 HydrophobicContact CD2-CD1 3.95Å; L156-L194 HydrophobicContact CG-CD1 4.15Å; L157-L194 HydrophobicContact CD2-CD2 4.33Å; I164-L194 HydrophobicContact CD1-CB 3.69Å; I164-L194 WeakPolarHBondContact CD1-O 3.31Å; I164-L194 HydrophobicContact CG1-CB 4.1Å; I164-L194 HydrophobicContact CG2-CB 4.19Å; S190-L194 WeakPolarHBondContact O-CD1 3.5Å; S190-L194 WeakPolarHBondContact O-CG 3.44Å; S190-L194 PolarHBondContact O-N 3.06Å; L191-L194 PolarHBondContact O-N 3.49Å; L191-L194 VanDerWaalsContact O-N 3.12Å; L192-L194 PolarHBondContact O-N 3.45Å; L194-E196 PolarHBondContact O-N 2.97Å
195	M	93.4	Very high	92.6	Very high	6 Å²	6	45.7 Å²	45.7	3%	0.03	25%	0.254	C	S	.	.			trans	-66.9	116.7	179	-72.7	-175.6	-176.8	0	0	110.6	K107 I164 L165 F168 L191 L192 M199 L207 F245	K107-M195 WeakPolarHBondContact CE-O 3.2Å; K107-M195 PolarHBondContact NZ-O 2.96Å; I164-M195 HydrophobicContact CG2-CG 3.86Å; L165-M195 HydrophobicContact CD2-CE 4.11Å; F168-M195 HydrophobicContact CB-CE 3.75Å; F168-M195 HydrophobicContact CD1-CE 4.24Å; F168-M195 HydrophobicContact CD2-CE 3.28Å; F168-M195 HydrophobicContact CE2-CE 3.86Å; F168-M195 HydrophobicContact CG-CE 3.49Å; F168-M195 VanDerWaalsContact CG-CE 3.49Å; L191-M195 WeakPolarHBondContact O-CG 3.42Å; L191-M195 PolarHBondContact O-N 3.23Å; L192-M195 HydrophobicContact CD2-SD 4.07Å; L192-M195 PolarHBondContact O-N 3.19Å; M195-M199 HydrophobicContact SD-SD 4.09Å; M195-L207 HydrophobicContact CE-CD2 4.01Å; M195-L207 HydrophobicContact SD-CD1 4.15Å; M195-L207 HydrophobicContact SD-CD2 3.91Å; M195-L207 HydrophobicContact SD-CG 4.32Å; M195-F245 HydrophobicContact CB-CE1 3.72Å; M195-F245 HydrophobicContact CB-CZ 4.16Å; M195-F245 HydrophobicContact SD-CE1 4.19Å; M195-F245 HydrophobicContact SD-CZ 4.47Å
196	E	84.4	Confident	92.5	Very high	77 Å²	77	45.8 Å²	45.8	36%	0.36	26%	0.255	S	S	.	.			trans	-83.9	143.9	-179.5	-68.2	168.9	-177.5	0	0	110.8	R114 S161 L194	R114-E196 IonicContact CZ-OE1 3.91Å; R114-E196 IonicContact NH1-OE1 2.82Å; R114-E196 PolarHBondContact NH1-OE1 3.28Å; S161-E196 PolarHBondContact OG-OE2 2.94Å; L194-E196 PolarHBondContact O-N 2.97Å
197	E	85.2	Confident	92.6	Very high	112 Å²	112	42.9 Å²	42.9	52%	0.523	24%	0.235	S	C	.	.	S	Bend	trans	-107.2	140.3	173.8	-70.1	166.6	-99.7	0	0	108.9	K107	K107-E197 IonicContact NZ-OE1 2.77Å; K107-E197 PolarHBondContact NZ-OE1 3.42Å
198	P	86.3	Confident	92.5	Very high	134 Å²	134	45.5 Å²	45.5	87%	0.87	25%	0.245	S	C	*	.	S	Bend	cis	-75.7	133.7	5	31	-34.6	0	0	0	112.7
199	M	87.5	Confident	92.4	Very high	24 Å²	24	49.5 Å²	49.5	12%	0.118	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-87.7	148.2	178.4	-172.8	173.1	56.2	0	0	110.5	L165 M195 H204 L207 F245	L165-M199 HydrophobicContact CD2-SD 4.23Å; M195-M199 HydrophobicContact SD-SD 4.09Å; M199-H204 HydrophobicContact CE-CB 4.13Å; M199-H204 VanDerWaalsContact CE-N 3.27Å; M199-H204 WeakPolarHBondContact CE-ND1 3.37Å; M199-L207 HydrophobicContact CE-CD1 3.56Å; M199-L207 HydrophobicContact CE-CG 4.13Å; M199-L207 HydrophobicContact SD-CD1 4.22Å; M199-F245 HydrophobicContact CE-CD1 4.27Å
200	L	89.3	Confident	92.4	Very high	108 Å²	108	47.2 Å²	47.2	57%	0.565	25%	0.254	S	S	*	.	P	Polyproline II helix	trans	-65.4	152.5	174.6	-65.1	174.4	0	0	0	111.7	E202 G203 H204	L200-E202 WeakPolarHBondContact CB-OE2 3.49Å; L200-E202 PolarHBondContact O-N 2.69Å; L200-E202 VanDerWaalsContact O-N 3.15Å; L200-G203 WeakPolarHBondContact O-CA 3.08Å; L200-G203 PolarHBondContact O-N 3.32Å; L200-H204 PolarHBondContact O-N 3.44Å
201	P	91.7	Very high	92.3	Very high	93 Å²	93	46.2 Å²	46.2	60%	0.604	25%	0.248	S	C	*	.	H	α-helix	trans	-53.5	-34.2	177.5	-27.1	35.6	0	0	0	114	G203 H204 A205	P201-G203 VanDerWaalsContact C-N 3.34Å; P201-G203 PolarHBondContact O-N 2.93Å; P201-H204 PolarHBondContact O-N 3.09Å; P201-A205 PolarHBondContact O-N 3.26Å
202	E	91	Very high	92.2	Very high	128 Å²	128	49.7 Å²	49.7	60%	0.598	26%	0.261	S	S	*	.	H	α-helix	trans	-62.8	-40.7	176.2	-64.1	72.2	-157.7	0	0	111.4	L200 A205 L206	L200-E202 WeakPolarHBondContact CB-OE2 3.49Å; L200-E202 PolarHBondContact O-N 2.69Å; L200-E202 VanDerWaalsContact O-N 3.15Å; E202-A205 PolarHBondContact O-N 2.71Å; E202-L206 WeakPolarHBondContact O-CB 3.35Å; E202-L206 PolarHBondContact O-N 2.99Å
203	G	93.1	Very high	92.1	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-64.4	-41.6	174.8	0	0	0	0	0	111.5	L200 P201 L206 L207	L200-G203 WeakPolarHBondContact O-CA 3.08Å; L200-G203 PolarHBondContact O-N 3.32Å; P201-G203 VanDerWaalsContact C-N 3.34Å; P201-G203 PolarHBondContact O-N 2.93Å; G203-L206 PolarHBondContact O-N 2.97Å; G203-L207 WeakPolarHBondContact O-CG 3.2Å; G203-L207 PolarHBondContact O-N 3.19Å
204	H	94.1	Very high	92.1	Very high	51 Å²	51	51.6 Å²	51.6	24%	0.236	27%	0.268	C	S	.	.	H	α-helix	trans	-63	-44.1	173.9	-77.7	-68.9	0	0	0	111.6	M199 L200 P201 L206 L207 R208 F245 Q247	M199-H204 HydrophobicContact CE-CB 4.13Å; M199-H204 VanDerWaalsContact CE-N 3.27Å; M199-H204 WeakPolarHBondContact CE-ND1 3.37Å; L200-H204 PolarHBondContact O-N 3.44Å; P201-H204 PolarHBondContact O-N 3.09Å; H204-L206 VanDerWaalsContact C-N 3.32Å; H204-L206 PolarHBondContact O-N 2.75Å; H204-L207 PolarHBondContact O-N 2.86Å; H204-R208 WeakPolarHBondContact O-CB 3.37Å; H204-R208 WeakPolarHBondContact O-CG 3.07Å; H204-R208 PolarHBondContact O-N 3.33Å; H204-F245 PolarHBondContact CE1-O 3.48Å; H204-Q247 PolarHBondContact ND1-NE2 3.07Å
205	A	93.2	Very high	91.9	Very high	57 Å²	57	52.3 Å²	52.3	47%	0.471	27%	0.27	S	S	.	.	H	α-helix	trans	-59.1	-43.1	176.8	0	0	0	0	0	112.1	P201 E202 R208 E209	P201-A205 PolarHBondContact O-N 3.26Å; E202-A205 PolarHBondContact O-N 2.71Å; A205-R208 PolarHBondContact O-N 3.08Å; A205-E209 WeakPolarHBondContact O-CB 3.42Å; A205-E209 PolarHBondContact O-N 3.37Å
206	L	94.8	Very high	91.8	Very high	21 Å²	21	54.2 Å²	54.2	11%	0.11	28%	0.282	C	S	.	.	H	α-helix	trans	-62.6	-47.3	176.5	-178.8	62	0	0	0	112.1	F168 E169 F172 E202 G203 H204 R208 E209 F210	F168-L206 HydrophobicContact CB-CD2 4.45Å; F168-L206 HydrophobicContact CD1-CD1 4.49Å; F168-L206 HydrophobicContact CD1-CD2 3.72Å; F168-L206 HydrophobicContact CD1-CG 3.88Å; F168-L206 HydrophobicContact CE1-CD2 4.49Å; F168-L206 HydrophobicContact CE1-CG 4.19Å; F168-L206 HydrophobicContact CG-CD2 4.48Å; E169-L206 HydrophobicContact CB-CD1 4.43Å; E169-L206 HydrophobicContact CB-CD2 4.07Å; E169-L206 HydrophobicContact CG-CD1 4.42Å; F172-L206 HydrophobicContact CD1-CD1 3.89Å; F172-L206 HydrophobicContact CE1-CD1 4.47Å; E202-L206 WeakPolarHBondContact O-CB 3.35Å; E202-L206 PolarHBondContact O-N 2.99Å; G203-L206 PolarHBondContact O-N 2.97Å; H204-L206 VanDerWaalsContact C-N 3.32Å; H204-L206 PolarHBondContact O-N 2.75Å; L206-R208 VanDerWaalsContact C-N 3.3Å; L206-R208 PolarHBondContact O-N 3.3Å; L206-E209 PolarHBondContact O-N 2.98Å; L206-F210 WeakPolarHBondContact O-CB 3.46Å; L206-F210 PolarHBondContact O-N 3.3Å
207	L	95.5	Very high	92.3	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.8	-38.7	176.2	-69.9	-169.1	0	0	0	112.2	F168 L192 M195 M199 G203 H204 F210 A211 I241 F245	F168-L207 HydrophobicContact CE1-CD2 3.91Å; F168-L207 HydrophobicContact CE2-CD2 4.01Å; F168-L207 HydrophobicContact CZ-CD2 3.56Å; L192-L207 HydrophobicContact CD2-CD1 4.32Å; L192-L207 HydrophobicContact CD2-CD2 3.59Å; M195-L207 HydrophobicContact CE-CD2 4.01Å; M195-L207 HydrophobicContact SD-CD1 4.15Å; M195-L207 HydrophobicContact SD-CD2 3.91Å; M195-L207 HydrophobicContact SD-CG 4.32Å; M199-L207 HydrophobicContact CE-CD1 3.56Å; M199-L207 HydrophobicContact CE-CG 4.13Å; M199-L207 HydrophobicContact SD-CD1 4.22Å; G203-L207 WeakPolarHBondContact O-CG 3.2Å; G203-L207 PolarHBondContact O-N 3.19Å; H204-L207 PolarHBondContact O-N 2.86Å; L207-F210 PolarHBondContact O-N 3.31Å; L207-A211 WeakPolarHBondContact O-CB 3.3Å; L207-A211 PolarHBondContact O-N 3.04Å; L207-I241 HydrophobicContact CB-CG2 4.07Å; L207-I241 HydrophobicContact CD2-CD1 4.38Å; L207-I241 HydrophobicContact CD2-CG1 4.49Å; L207-F245 HydrophobicContact CD1-CB 3.99Å; L207-F245 HydrophobicContact CD1-CD1 3.61Å; L207-F245 HydrophobicContact CD1-CD2 4.17Å; L207-F245 HydrophobicContact CD1-CE1 4.06Å; L207-F245 HydrophobicContact CD1-CG 3.65Å; L207-F245 HydrophobicContact CD1-CZ 4.49Å
208	R	94.1	Very high	92.6	Very high	56 Å²	56	46 Å²	46	21%	0.211	24%	0.243	C	C	.	.	H	α-helix	trans	-63.7	-45.2	176.1	-69.8	175	74.7	61.2	5.4	111.5	H204 A205 L206 R212 Q247 D249 L250	H204-R208 WeakPolarHBondContact O-CB 3.37Å; H204-R208 WeakPolarHBondContact O-CG 3.07Å; H204-R208 PolarHBondContact O-N 3.33Å; A205-R208 PolarHBondContact O-N 3.08Å; L206-R208 VanDerWaalsContact C-N 3.3Å; L206-R208 PolarHBondContact O-N 3.3Å; R208-R212 VanDerWaalsContact NH2-NH2 3.12Å; R208-R212 VanDerWaalsContact O-CG 3.29Å; R208-R212 WeakPolarHBondContact O-CG 3.47Å; R208-R212 PolarHBondContact O-N 3.39Å; R208-R212 VanDerWaalsContact O-N 3.12Å; R208-Q247 HydrophobicContact CG-CG 4.28Å; R208-D249 IonicContact CZ-OD1 3.29Å; R208-D249 IonicContact CZ-OD2 2.77Å; R208-D249 VanDerWaalsContact CZ-OD2 3.29Å; R208-D249 VanDerWaalsContact NH1-CG 3.3Å; R208-D249 IonicContact NH1-OD1 2.96Å; R208-D249 PolarHBondContact NH1-OD1 3.5Å; R208-D249 IonicContact NH1-OD2 3.98Å; R208-D249 PolarHBondContact NH1-OD2 3.48Å; R208-D249 IonicContact NH2-OD1 2.7Å; R208-D249 IonicContact NH2-OD2 3.85Å; R208-D249 PolarHBondContact NH2-OD2 2.66Å; R208-L250 HydrophobicContact CB-CD1 4.24Å; R208-L250 HydrophobicContact CG-CD1 3.95Å
209	E	94.2	Very high	92.8	Very high	84 Å²	84	44.3 Å²	44.3	39%	0.393	22%	0.219	S	C	.	.	H	α-helix	trans	-64.1	-42.4	177.5	-167.1	-177.4	-175.6	0	0	111.6	F172 R176 A205 L206 R212 Y213	F172-E209 HydrophobicContact CE1-CB 4.13Å; F172-E209 HydrophobicContact CE1-CG 3.9Å; F172-E209 HydrophobicContact CZ-CG 4.2Å; R176-E209 IonicContact CZ-OE1 3.33Å; R176-E209 IonicContact NH1-OE1 3.13Å; R176-E209 PolarHBondContact NH1-OE1 2.83Å; R176-E209 VanDerWaalsContact NH1-OE1 3.13Å; R176-E209 IonicContact NH2-OE1 2.64Å; R176-E209 PolarHBondContact NH2-OE1 3.44Å; A205-E209 WeakPolarHBondContact O-CB 3.42Å; A205-E209 PolarHBondContact O-N 3.37Å; L206-E209 PolarHBondContact O-N 2.98Å; E209-R212 PolarHBondContact O-N 2.86Å; E209-Y213 PolarHBondContact O-N 3.35Å
210	F	95.9	Very high	93	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61.5	-51.6	175.1	175.5	-104.6	0	0	0	112.3	F168 F172 L175 F180 F188 L206 L207 R212 Y213 C214 L237 I241	F168-F210 HydrophobicContact CE1-CB 3.9Å; F168-F210 HydrophobicContact CE1-CD1 4.24Å; F168-F210 HydrophobicContact CE1-CD2 4.22Å; F168-F210 AromaticContact CE1-CG 3.86Å; F168-F210 HydrophobicContact CE1-CG 3.86Å; F168-F210 HydrophobicContact CZ-CB 4.18Å; F168-F210 AromaticContact CZ-CD1 3.65Å; F168-F210 HydrophobicContact CZ-CD1 3.65Å; F168-F210 HydrophobicContact CZ-CD2 4.2Å; F168-F210 HydrophobicContact CZ-CE1 4.01Å; F168-F210 AromaticContact CZ-CG 3.74Å; F168-F210 HydrophobicContact CZ-CG 3.74Å; F168-F210 HydrophobicContact CZ-CZ 4.43Å; F172-F210 HydrophobicContact CD1-CB 4.34Å; F172-F210 AromaticContact CD2-CD2 3.67Å; F172-F210 HydrophobicContact CD2-CD2 3.67Å; F172-F210 HydrophobicContact CD2-CE2 4.41Å; F172-F210 HydrophobicContact CE1-CB 4.11Å; F172-F210 HydrophobicContact CE2-CB 4.46Å; F172-F210 AromaticContact CE2-CD2 3.89Å; F172-F210 HydrophobicContact CE2-CD2 3.89Å; F172-F210 HydrophobicContact CG-CD2 4.04Å; F172-F210 VanDerWaalsContact CZ-CA 3.48Å; F172-F210 HydrophobicContact CZ-CB 4.16Å; F172-F210 HydrophobicContact CZ-CD2 4.43Å; L175-F210 HydrophobicContact CD2-CE2 3.87Å; F180-F210 HydrophobicContact CZ-CE2 4.41Å; F180-F210 HydrophobicContact CZ-CZ 4.48Å; F188-F210 HydrophobicContact CB-CZ 4.09Å; F188-F210 HydrophobicContact CD1-CD2 4.46Å; F188-F210 HydrophobicContact CD1-CE1 4.46Å; F188-F210 AromaticContact CD1-CE2 3.71Å; F188-F210 HydrophobicContact CD1-CE2 3.71Å; F188-F210 AromaticContact CD1-CZ 3.7Å; F188-F210 HydrophobicContact CD1-CZ 3.7Å; F188-F210 AromaticContact CD2-CE2 3.95Å; F188-F210 HydrophobicContact CD2-CE2 3.95Å; F188-F210 AromaticContact CD2-CZ 3.8Å; F188-F210 HydrophobicContact CD2-CZ 3.8Å; F188-F210 HydrophobicContact CE1-CD2 4.12Å; F188-F210 AromaticContact CE1-CE2 3.54Å; F188-F210 HydrophobicContact CE1-CE2 3.54Å; F188-F210 HydrophobicContact CE1-CZ 4.05Å; F188-F210 AromaticContact CE2-CE2 3.82Å; F188-F210 HydrophobicContact CE2-CE2 3.82Å; F188-F210 HydrophobicContact CE2-CZ 4.17Å; F188-F210 HydrophobicContact CG-CE1 4.47Å; F188-F210 AromaticContact CG-CE2 3.92Å; F188-F210 HydrophobicContact CG-CE2 3.92Å; F188-F210 AromaticContact CG-CZ 3.58Å; F188-F210 HydrophobicContact CG-CZ 3.58Å; F188-F210 HydrophobicContact CZ-CD2 4.38Å; F188-F210 AromaticContact CZ-CE2 3.61Å; F188-F210 HydrophobicContact CZ-CE2 3.61Å; F188-F210 HydrophobicContact CZ-CZ 4.27Å; L206-F210 WeakPolarHBondContact O-CB 3.46Å; L206-F210 PolarHBondContact O-N 3.3Å; L207-F210 PolarHBondContact O-N 3.31Å; F210-R212 VanDerWaalsContact C-N 3.3Å; F210-R212 PolarHBondContact O-N 3.09Å; F210-Y213 WeakPolarHBondContact O-CB 3.34Å; F210-Y213 PolarHBondContact O-N 3.04Å; F210-Y213 VanDerWaalsContact O-N 3.09Å; F210-C214 VanDerWaalsContact CE1-SG 3.53Å; F210-C214 WeakPolarHBondContact CZ-SG 3.47Å; F210-C214 WeakPolarHBondContact O-CB 3.44Å; F210-C214 PolarHBondContact O-N 3.41Å; F210-C214 PolarHBondContact O-SG 3.26Å; F210-L237 HydrophobicContact CE1-CB 4.36Å; F210-L237 HydrophobicContact CE1-CD1 4.27Å; F210-L237 HydrophobicContact CZ-CD1 4.01Å; F210-I241 HydrophobicContact CD1-CD1 3.56Å; F210-I241 HydrophobicContact CE1-CD1 3.98Å
211	A	94.6	Very high	93.2	Very high	2 Å²	2	48.9 Å²	48.9	2%	0.017	24%	0.237	C	C	.	.	H	α-helix	trans	-60.8	-37.5	179.9	0	0	0	0	0	112.6	L207 C214 R215 I241 L250	L207-A211 WeakPolarHBondContact O-CB 3.3Å; L207-A211 PolarHBondContact O-N 3.04Å; A211-C214 WeakPolarHBondContact O-CB 3.41Å; A211-C214 PolarHBondContact O-N 3.35Å; A211-R215 WeakPolarHBondContact O-CB 3.46Å; A211-R215 PolarHBondContact O-N 3.33Å; A211-I241 HydrophobicContact CB-CD1 4.1Å; A211-I241 HydrophobicContact CB-CG2 4.25Å; A211-L250 HydrophobicContact CB-CD1 3.73Å
212	R	92.6	Very high	93.3	Very high	73 Å²	73	46.1 Å²	46.1	28%	0.275	22%	0.216	S	C	.	.	H	α-helix	trans	-64	-45	173.2	-71.1	176	-164	133.7	-2.3	111.7	R208 E209 F210 R215 T216 L250	R208-R212 VanDerWaalsContact NH2-NH2 3.12Å; R208-R212 VanDerWaalsContact O-CG 3.29Å; R208-R212 WeakPolarHBondContact O-CG 3.47Å; R208-R212 PolarHBondContact O-N 3.39Å; R208-R212 VanDerWaalsContact O-N 3.12Å; E209-R212 PolarHBondContact O-N 2.86Å; F210-R212 VanDerWaalsContact C-N 3.3Å; F210-R212 PolarHBondContact O-N 3.09Å; R212-R215 PolarHBondContact O-N 3.28Å; R212-T216 PolarHBondContact O-N 3.5Å; R212-T216 PolarHBondContact O-OG1 2.89Å; R212-L250 HydrophobicContact CG-CD2 4.39Å
213	Y	94.3	Very high	93.2	Very high	51 Å²	51	41.7 Å²	41.7	20%	0.2	20%	0.199	C	C	.	.	H	α-helix	trans	-59.5	-48	175.2	176.6	-89.8	0	0	0	111.3	F172 L175 R176 F180 E209 F210 R215 T216 Y217	F172-Y213 AromaticContact CE2-CD1 3.8Å; F172-Y213 HydrophobicContact CE2-CD1 3.8Å; F172-Y213 HydrophobicContact CE2-CD2 4.32Å; F172-Y213 AromaticContact CE2-CG 3.67Å; F172-Y213 HydrophobicContact CE2-CG 3.67Å; F172-Y213 HydrophobicContact CZ-CG 4.19Å; L175-Y213 HydrophobicContact CD2-CD1 4.05Å; L175-Y213 HydrophobicContact CD2-CE1 3.69Å; L175-Y213 HydrophobicContact CG-CE1 3.82Å; L175-Y213 PolarHBondContact O-OH 3.41Å; R176-Y213 HydrophobicContact CG-CD2 4.27Å; R176-Y213 HydrophobicContact CG-CE2 3.95Å; F180-Y213 HydrophobicContact CE2-CE1 4.15Å; E209-Y213 PolarHBondContact O-N 3.35Å; F210-Y213 WeakPolarHBondContact O-CB 3.34Å; F210-Y213 PolarHBondContact O-N 3.04Å; F210-Y213 VanDerWaalsContact O-N 3.09Å; Y213-R215 VanDerWaalsContact C-N 3.3Å; Y213-R215 PolarHBondContact O-N 3.12Å; Y213-T216 PolarHBondContact O-N 3.31Å; Y213-Y217 AromaticContact CE1-CD2 4Å; Y213-Y217 HydrophobicContact CE1-CD2 4Å; Y213-Y217 HydrophobicContact CE1-CG 4.36Å; Y213-Y217 AromaticContact CZ-CD2 3.86Å; Y213-Y217 VanDerWaalsContact O-CB 3.3Å; Y213-Y217 WeakPolarHBondContact O-CB 3.29Å; Y213-Y217 PolarHBondContact O-N 2.96Å; Y213-Y217 WeakPolarHBondContact OH-CD2 3.36Å
214	C	94.2	Very high	93.1	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-52.4	-46.9	174.7	-75.4	0	0	0	0	112	F180 F210 A211 Y217 R218 I234 I238	F180-C214 VanDerWaalsContact CZ-SG 3.59Å; F210-C214 VanDerWaalsContact CE1-SG 3.53Å; F210-C214 WeakPolarHBondContact CZ-SG 3.47Å; F210-C214 WeakPolarHBondContact O-CB 3.44Å; F210-C214 PolarHBondContact O-N 3.41Å; F210-C214 PolarHBondContact O-SG 3.26Å; A211-C214 WeakPolarHBondContact O-CB 3.41Å; A211-C214 PolarHBondContact O-N 3.35Å; C214-Y217 PolarHBondContact O-N 2.8Å; C214-R218 WeakPolarHBondContact O-CB 3.43Å; C214-R218 PolarHBondContact O-N 3.14Å; C214-I234 HydrophobicContact CB-CG2 3.6Å; C214-I238 HydrophobicContact CB-CD1 3.89Å; C214-I238 HydrophobicContact CB-CG1 3.85Å
215	R	91.2	Very high	93	Very high	20 Å²	20	52.9 Å²	52.9	8%	0.075	26%	0.256	C	S	.	.	H	α-helix	trans	-62.5	-47	179.1	-167.8	-178	-166.5	133	-4.7	112	L83 A211 R212 Y213 R219 I238 L250 D252	L83-R215 PolarHBondContact O-NE 3.1Å; L83-R215 PolarHBondContact O-NH2 3.08Å; A211-R215 WeakPolarHBondContact O-CB 3.46Å; A211-R215 PolarHBondContact O-N 3.33Å; R212-R215 PolarHBondContact O-N 3.28Å; Y213-R215 VanDerWaalsContact C-N 3.3Å; Y213-R215 PolarHBondContact O-N 3.12Å; R215-R219 PolarHBondContact O-N 2.95Å; R215-R219 VanDerWaalsContact O-N 3.15Å; R215-I238 HydrophobicContact CB-CD1 4.19Å; R215-L250 PolarHBondContact NH1-O 3.29Å; R215-D252 IonicContact CZ-OD1 3.97Å
216	T	91.4	Very high	92.7	Very high	46 Å²	46	51.6 Å²	51.6	28%	0.282	24%	0.243	S	C	.	.	H	α-helix	trans	-62.7	-49.4	177.2	-61.6	0	0	0	0	111.2	R212 Y213 R218 R219 E220	R212-T216 PolarHBondContact O-N 3.5Å; R212-T216 PolarHBondContact O-OG1 2.89Å; Y213-T216 PolarHBondContact O-N 3.31Å; T216-R218 PolarHBondContact O-N 3.07Å; T216-R219 PolarHBondContact O-N 3.21Å; T216-E220 HydrophobicContact CG2-CG 4.45Å; T216-E220 WeakPolarHBondContact CG2-OE1 3.4Å; T216-E220 WeakPolarHBondContact O-CB 3.25Å; T216-E220 WeakPolarHBondContact O-CG 3.31Å; T216-E220 PolarHBondContact O-N 2.85Å
217	Y	93.5	Very high	92.4	Very high	15 Å²	15	56.4 Å²	56.4	6%	0.059	27%	0.269	C	S	.	.	H	α-helix	trans	-60.2	-46.3	179.2	-170.2	-76	0	0	0	111.5	K179 F180 Y213 C214 R219 E220 H221 F222 I234	K179-Y217 VanDerWaalsContact CA-OH 3.24Å; K179-Y217 WeakPolarHBondContact CA-OH 3.29Å; K179-Y217 WeakPolarHBondContact CB-OH 3.46Å; K179-Y217 WeakPolarHBondContact CG-OH 3.43Å; F180-Y217 HydrophobicContact CB-CE1 4.31Å; F180-Y217 AromaticContact CD2-CD1 3.49Å; F180-Y217 HydrophobicContact CD2-CD1 3.49Å; F180-Y217 VanDerWaalsContact CD2-CD1 3.49Å; F180-Y217 HydrophobicContact CD2-CD2 4.39Å; F180-Y217 AromaticContact CD2-CE1 3.6Å; F180-Y217 HydrophobicContact CD2-CE1 3.6Å; F180-Y217 HydrophobicContact CD2-CE2 4.45Å; F180-Y217 AromaticContact CD2-CG 3.93Å; F180-Y217 HydrophobicContact CD2-CG 3.93Å; F180-Y217 AromaticContact CE2-CD1 3.97Å; F180-Y217 HydrophobicContact CE2-CD1 3.97Å; F180-Y217 HydrophobicContact CE2-CE1 4.49Å; F180-Y217 HydrophobicContact CE2-CG 4.03Å; F180-Y217 HydrophobicContact CG-CE1 4.44Å; F180-Y217 PolarHBondContact N-OH 2.86Å; Y213-Y217 AromaticContact CE1-CD2 4Å; Y213-Y217 HydrophobicContact CE1-CD2 4Å; Y213-Y217 HydrophobicContact CE1-CG 4.36Å; Y213-Y217 AromaticContact CZ-CD2 3.86Å; Y213-Y217 VanDerWaalsContact O-CB 3.3Å; Y213-Y217 WeakPolarHBondContact O-CB 3.29Å; Y213-Y217 PolarHBondContact O-N 2.96Å; Y213-Y217 WeakPolarHBondContact OH-CD2 3.36Å; C214-Y217 PolarHBondContact O-N 2.8Å; Y217-R219 VanDerWaalsContact C-N 3.31Å; Y217-R219 PolarHBondContact O-N 3.33Å; Y217-E220 PolarHBondContact O-N 2.67Å; Y217-H221 HydrophobicContact CD1-CB 4.36Å; Y217-H221 AromaticContact CD1-CD2 3.68Å; Y217-H221 AromaticContact CD2-CD2 3.68Å; Y217-H221 HydrophobicContact CE1-CB 4.02Å; Y217-H221 AromaticContact CE1-CD2 3.52Å; Y217-H221 AromaticContact CE1-CG 3.93Å; Y217-H221 AromaticContact CE2-CD2 3.56Å; Y217-H221 AromaticContact CE2-NE2 3.7Å; Y217-H221 AromaticContact CG-CD2 3.74Å; Y217-H221 AromaticContact CZ-CD2 3.46Å; Y217-H221 VanDerWaalsContact CZ-CD2 3.46Å; Y217-H221 AromaticContact CZ-NE2 3.92Å; Y217-H221 WeakPolarHBondContact O-CB 3.41Å; Y217-H221 PolarHBondContact O-CD2 3.27Å; Y217-H221 PolarHBondContact O-N 3.41Å; Y217-F222 HydrophobicContact CD1-CE2 4.12Å; Y217-F222 AromaticContact CE1-CE2 3.74Å; Y217-F222 HydrophobicContact CE1-CE2 3.74Å; Y217-F222 HydrophobicContact CE1-CZ 4.43Å; Y217-I234 HydrophobicContact CD1-CD1 4.07Å
218	R	93	Very high	92.3	Very high	3 Å²	3	57.5 Å²	57.5	1%	0.011	28%	0.28	C	S	.	.	H	α-helix	trans	-58	-44.7	179.1	-173.6	-177.4	65.8	-175	-5.3	111.4	F89 C214 T216 F222 I234 T235 D252	F89-R218 VanDerWaalsContact CD1-CD 3.5Å; F89-R218 HydrophobicContact CD1-CG 3.79Å; F89-R218 HydrophobicContact CE1-CG 3.52Å; F89-R218 HydrophobicContact CE2-CG 4.32Å; F89-R218 HydrophobicContact CG-CG 4.29Å; F89-R218 HydrophobicContact CZ-CG 3.8Å; C214-R218 WeakPolarHBondContact O-CB 3.43Å; C214-R218 PolarHBondContact O-N 3.14Å; T216-R218 PolarHBondContact O-N 3.07Å; R218-F222 CarbonylContact O-C 3.46Å; R218-F222 WeakPolarHBondContact O-CA 3.33Å; R218-F222 WeakPolarHBondContact O-CB 3.29Å; R218-F222 PolarHBondContact O-N 2.93Å; R218-I234 HydrophobicContact CB-CD1 4.33Å; R218-I234 HydrophobicContact CB-CG2 3.98Å; R218-I234 HydrophobicContact CG-CG2 4.43Å; R218-T235 WeakPolarHBondContact CD-OG1 3.46Å; R218-T235 PolarHBondContact NH1-OG1 2.94Å; R218-D252 IonicContact CZ-OD2 3.24Å; R218-D252 VanDerWaalsContact CZ-OD2 3.24Å; R218-D252 IonicContact NH1-OD2 2.74Å; R218-D252 PolarHBondContact NH1-OD2 3.21Å; R218-D252 VanDerWaalsContact NH2-CG 3.25Å; R218-D252 IonicContact NH2-OD1 2.94Å; R218-D252 PolarHBondContact NH2-OD1 3.08Å; R218-D252 IonicContact NH2-OD2 2.81Å; R218-D252 PolarHBondContact NH2-OD2 3.01Å
219	R	90.1	Very high	92.3	Very high	97 Å²	97	58.8 Å²	58.8	37%	0.366	29%	0.294	S	S	.	.	H	α-helix	trans	-66.9	-45.4	177.8	-175.6	-174.4	63.3	176.2	-0.7	112.4	L83 R215 T216 Y217 H221 S223	L83-R219 VanDerWaalsContact CD1-NH1 3.34Å; R215-R219 PolarHBondContact O-N 2.95Å; R215-R219 VanDerWaalsContact O-N 3.15Å; T216-R219 PolarHBondContact O-N 3.21Å; Y217-R219 VanDerWaalsContact C-N 3.31Å; Y217-R219 PolarHBondContact O-N 3.33Å; R219-H221 PolarHBondContact O-N 3.46Å; R219-S223 VanDerWaalsContact O-CB 3.22Å; R219-S223 WeakPolarHBondContact O-CB 3.05Å
220	E	91.6	Very high	92.4	Very high	126 Å²	126	56.1 Å²	56.1	59%	0.589	28%	0.282	S	S	*	.	H	α-helix	trans	-68.4	-33.9	-176.4	-74.2	172.7	-172.9	0	0	112.7	T216 Y217	T216-E220 HydrophobicContact CG2-CG 4.45Å; T216-E220 WeakPolarHBondContact CG2-OE1 3.4Å; T216-E220 WeakPolarHBondContact O-CB 3.25Å; T216-E220 WeakPolarHBondContact O-CG 3.31Å; T216-E220 PolarHBondContact O-N 2.85Å; Y217-E220 PolarHBondContact O-N 2.67Å
221	H	92.9	Very high	92.3	Very high	102 Å²	102	56.1 Å²	56.1	47%	0.472	28%	0.282	S	S	.	.	H	α-helix	trans	-106.2	-23.7	-173.9	-66.7	-69.2	0	0	0	115.2	Y217 R219	Y217-H221 HydrophobicContact CD1-CB 4.36Å; Y217-H221 AromaticContact CD1-CD2 3.68Å; Y217-H221 AromaticContact CD2-CD2 3.68Å; Y217-H221 HydrophobicContact CE1-CB 4.02Å; Y217-H221 AromaticContact CE1-CD2 3.52Å; Y217-H221 AromaticContact CE1-CG 3.93Å; Y217-H221 AromaticContact CE2-CD2 3.56Å; Y217-H221 AromaticContact CE2-NE2 3.7Å; Y217-H221 AromaticContact CG-CD2 3.74Å; Y217-H221 AromaticContact CZ-CD2 3.46Å; Y217-H221 VanDerWaalsContact CZ-CD2 3.46Å; Y217-H221 AromaticContact CZ-NE2 3.92Å; Y217-H221 WeakPolarHBondContact O-CB 3.41Å; Y217-H221 PolarHBondContact O-CD2 3.27Å; Y217-H221 PolarHBondContact O-N 3.41Å; R219-H221 PolarHBondContact O-N 3.46Å
222	F	93.8	Very high	92.3	Very high	35 Å²	35	62.1 Å²	62.1	15%	0.154	31%	0.305	C	S	.	.	H	α-helix	trans	-129	16.1	-171.5	-54.5	-74.2	0	0	0	114.4	F89 Y217 R218 N224 E225 I230 A231 I234	F89-F222 HydrophobicContact CE1-CB 4.26Å; F89-F222 WeakPolarHBondContact CE1-O 3.4Å; F89-F222 WeakPolarHBondContact CZ-O 3.34Å; Y217-F222 HydrophobicContact CD1-CE2 4.12Å; Y217-F222 AromaticContact CE1-CE2 3.74Å; Y217-F222 HydrophobicContact CE1-CE2 3.74Å; Y217-F222 HydrophobicContact CE1-CZ 4.43Å; R218-F222 CarbonylContact O-C 3.46Å; R218-F222 WeakPolarHBondContact O-CA 3.33Å; R218-F222 WeakPolarHBondContact O-CB 3.29Å; R218-F222 PolarHBondContact O-N 2.93Å; F222-N224 PolarHBondContact O-N 3.24Å; F222-N224 VanDerWaalsContact O-N 3.07Å; F222-E225 CarbonylContact O-C 3.31Å; F222-E225 VanDerWaalsContact O-C 3.31Å; F222-E225 PolarHBondContact O-N 3.4Å; F222-I230 HydrophobicContact CE1-CB 4.13Å; F222-I230 HydrophobicContact CE1-CG2 4.3Å; F222-I230 HydrophobicContact CE2-CB 4.3Å; F222-I230 HydrophobicContact CE2-CG2 3.65Å; F222-I230 HydrophobicContact CZ-CB 3.75Å; F222-I230 HydrophobicContact CZ-CG2 3.42Å; F222-I230 VanDerWaalsContact CZ-CG2 3.42Å; F222-A231 HydrophobicContact CB-CB 3.75Å; F222-A231 HydrophobicContact CD1-CB 4.44Å; F222-A231 HydrophobicContact CD2-CB 4.38Å; F222-A231 HydrophobicContact CG-CB 3.96Å; F222-I234 HydrophobicContact CD2-CD1 4.21Å; F222-I234 HydrophobicContact CE2-CD1 3.9Å
223	S	88.5	Confident	92.5	Very high	35 Å²	35	59.2 Å²	59.2	25%	0.245	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-22	175.9	171.5	0	0	0	0	113.9	K88 R219	K88-S223 PolarHBondContact NZ-OG 3.05Å; R219-S223 VanDerWaalsContact O-CB 3.22Å; R219-S223 WeakPolarHBondContact O-CB 3.05Å
224	N	90.7	Very high	92.5	Very high	156 Å²	156	56.8 Å²	56.8	83%	0.834	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-10.7	178.3	-62.1	-21.5	0	0	0	113.2	F222	F222-N224 PolarHBondContact O-N 3.24Å; F222-N224 VanDerWaalsContact O-N 3.07Å
225	E	92.2	Very high	92.6	Very high	131 Å²	131	57 Å²	57	61%	0.612	29%	0.289	S	S	*	.			trans	-138.2	61.6	-176.7	-65.5	-178.4	-176.9	0	0	110.5	F222 D227 G228	F222-E225 CarbonylContact O-C 3.31Å; F222-E225 VanDerWaalsContact O-C 3.31Å; F222-E225 PolarHBondContact O-N 3.4Å; E225-D227 PolarHBondContact O-N 2.93Å; E225-G228 PolarHBondContact O-N 2.81Å; E225-G228 VanDerWaalsContact O-N 3.08Å
226	P	87.8	Confident	92.8	Very high	31 Å²	31	59.6 Å²	59.6	20%	0.201	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-27.8	-176.1	25.4	-34.3	0	0	0	113.5	K88 F89 G228 A231	K88-P226 HydrophobicContact CB-CB 4.48Å; K88-P226 VanDerWaalsContact O-CB 3.27Å; K88-P226 WeakPolarHBondContact O-CB 3.43Å; F89-P226 HydrophobicContact CD1-CB 3.72Å; F89-P226 HydrophobicContact CE1-CB 3.81Å; F89-P226 HydrophobicContact CG-CB 4.44Å; P226-G228 VanDerWaalsContact C-N 3.34Å; P226-A231 WeakPolarHBondContact O-CB 3.24Å
227	D	88	Confident	93	Very high	122 Å²	122	57.6 Å²	57.6	65%	0.652	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	0.6	179.6	-61.5	-44.1	0	0	0	113.7	E225 R232	E225-D227 PolarHBondContact O-N 2.93Å; D227-R232 VanDerWaalsContact O-CZ 3.28Å; D227-R232 PolarHBondContact O-NE 3.3Å; D227-R232 PolarHBondContact O-NH2 2.82Å
228	G	92.7	Very high	93	Very high	22 Å²	22	57 Å²	57	23%	0.227	29%	0.288	C	S	.	.	S	Bend	trans	-60	147.2	177	0	0	0	0	0	111.9	E225 P226 I230 A231 R232	E225-G228 PolarHBondContact O-N 2.81Å; E225-G228 VanDerWaalsContact O-N 3.08Å; P226-G228 VanDerWaalsContact C-N 3.34Å; G228-I230 VanDerWaalsContact C-N 3.28Å; G228-I230 PolarHBondContact O-N 2.94Å; G228-A231 PolarHBondContact O-N 2.99Å; G228-A231 VanDerWaalsContact O-N 3.1Å; G228-R232 PolarHBondContact O-N 3.31Å
229	T	95.1	Very high	93.1	Very high	83 Å²	83	57.3 Å²	57.3	51%	0.509	29%	0.291	S	S	.	.	H	α-helix	trans	-52.9	-45.4	-178.3	-56	0	0	0	0	112.2	G233	T229-G233 PolarHBondContact O-N 2.74Å
230	I	96.1	Very high	93.4	Very high	29 Å²	29	52.7 Å²	52.7	15%	0.149	27%	0.274	C	S	.	.	H	α-helix	trans	-67.5	-43.8	178.6	-57	-59.1	0	0	0	111.5	F180 E182 L185 F222 G228 R232 G233 I234	F180-I230 HydrophobicContact CB-CG2 3.52Å; F180-I230 HydrophobicContact CG-CG2 4.45Å; E182-I230 HydrophobicContact CG-CD1 3.88Å; L185-I230 HydrophobicContact CD1-CD1 3.77Å; L185-I230 HydrophobicContact CD1-CG2 4.35Å; F222-I230 HydrophobicContact CE1-CB 4.13Å; F222-I230 HydrophobicContact CE1-CG2 4.3Å; F222-I230 HydrophobicContact CE2-CB 4.3Å; F222-I230 HydrophobicContact CE2-CG2 3.65Å; F222-I230 HydrophobicContact CZ-CB 3.75Å; F222-I230 HydrophobicContact CZ-CG2 3.42Å; F222-I230 VanDerWaalsContact CZ-CG2 3.42Å; G228-I230 VanDerWaalsContact C-N 3.28Å; G228-I230 PolarHBondContact O-N 2.94Å; I230-R232 PolarHBondContact O-N 3.39Å; I230-G233 PolarHBondContact O-N 3.18Å; I230-I234 HydrophobicContact CG2-CD1 4.04Å; I230-I234 HydrophobicContact CG2-CG1 4.46Å; I230-I234 WeakPolarHBondContact O-CG1 3.32Å; I230-I234 PolarHBondContact O-N 3.43Å
231	A	94.5	Very high	93.5	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-60	-46.8	178.5	0	0	0	0	0	111.5	F89 F222 P226 G228 I234 T235	F89-A231 HydrophobicContact CE1-CB 4.29Å; F222-A231 HydrophobicContact CB-CB 3.75Å; F222-A231 HydrophobicContact CD1-CB 4.44Å; F222-A231 HydrophobicContact CD2-CB 4.38Å; F222-A231 HydrophobicContact CG-CB 3.96Å; P226-A231 WeakPolarHBondContact O-CB 3.24Å; G228-A231 PolarHBondContact O-N 2.99Å; G228-A231 VanDerWaalsContact O-N 3.1Å; A231-I234 PolarHBondContact O-N 2.9Å; A231-T235 PolarHBondContact O-N 2.98Å; A231-T235 PolarHBondContact O-OG1 2.6Å
232	R	94.1	Very high	93.6	Very high	128 Å²	128	41.9 Å²	41.9	48%	0.483	22%	0.223	S	C	.	.	H	α-helix	trans	-62.2	-41.7	174.7	-71.6	-170	-67.9	-170.8	-1.9	112.2	D227 G228 I230 I234 T235 M236	D227-R232 VanDerWaalsContact O-CZ 3.28Å; D227-R232 PolarHBondContact O-NE 3.3Å; D227-R232 PolarHBondContact O-NH2 2.82Å; G228-R232 PolarHBondContact O-N 3.31Å; I230-R232 PolarHBondContact O-N 3.39Å; R232-I234 VanDerWaalsContact C-N 3.35Å; R232-I234 PolarHBondContact O-N 3.02Å; R232-T235 WeakPolarHBondContact O-CB 3.3Å; R232-T235 PolarHBondContact O-N 3.08Å; R232-M236 VanDerWaalsContact O-CG 3.29Å; R232-M236 WeakPolarHBondContact O-CG 3.15Å; R232-M236 PolarHBondContact O-N 3.16Å
233	G	96.1	Very high	93.5	Very high	12 Å²	12	43.1 Å²	43.1	12%	0.124	23%	0.229	C	C	.	.	H	α-helix	trans	-58.8	-44.3	174.2	0	0	0	0	0	112.6	T229 I230 M236 L237	T229-G233 PolarHBondContact O-N 2.74Å; I230-G233 PolarHBondContact O-N 3.18Å; G233-M236 PolarHBondContact O-N 3.37Å; G233-L237 WeakPolarHBondContact O-CG 3.34Å; G233-L237 PolarHBondContact O-N 3.48Å
234	I	96	Very high	93.8	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.9	-44.3	175.5	-62.5	166.9	0	0	0	110.9	F180 L185 C214 Y217 R218 F222 I230 A231 R232 M236 L237 I238	F180-I234 HydrophobicContact CB-CD1 4.34Å; F180-I234 HydrophobicContact CD1-CD1 4.45Å; F180-I234 HydrophobicContact CD1-CG1 4.11Å; F180-I234 HydrophobicContact CD2-CD1 3.57Å; F180-I234 HydrophobicContact CD2-CG1 4.04Å; F180-I234 HydrophobicContact CE1-CG1 4.14Å; F180-I234 HydrophobicContact CE2-CD1 3.86Å; F180-I234 HydrophobicContact CE2-CG1 4.06Å; F180-I234 HydrophobicContact CG-CD1 3.87Å; F180-I234 HydrophobicContact CG-CG1 4.04Å; F180-I234 HydrophobicContact CZ-CD1 4.42Å; F180-I234 HydrophobicContact CZ-CG1 4.1Å; L185-I234 HydrophobicContact CD2-CG1 4.09Å; C214-I234 HydrophobicContact CB-CG2 3.6Å; Y217-I234 HydrophobicContact CD1-CD1 4.07Å; R218-I234 HydrophobicContact CB-CD1 4.33Å; R218-I234 HydrophobicContact CB-CG2 3.98Å; R218-I234 HydrophobicContact CG-CG2 4.43Å; F222-I234 HydrophobicContact CD2-CD1 4.21Å; F222-I234 HydrophobicContact CE2-CD1 3.9Å; I230-I234 HydrophobicContact CG2-CD1 4.04Å; I230-I234 HydrophobicContact CG2-CG1 4.46Å; I230-I234 WeakPolarHBondContact O-CG1 3.32Å; I230-I234 PolarHBondContact O-N 3.43Å; A231-I234 PolarHBondContact O-N 2.9Å; R232-I234 VanDerWaalsContact C-N 3.35Å; R232-I234 PolarHBondContact O-N 3.02Å; I234-M236 VanDerWaalsContact C-N 3.31Å; I234-M236 PolarHBondContact O-N 3.26Å; I234-L237 PolarHBondContact O-N 3.34Å; I234-I238 HydrophobicContact CG2-CD1 4.03Å; I234-I238 WeakPolarHBondContact O-CG1 3.38Å; I234-I238 PolarHBondContact O-N 3.22Å
235	T	94.5	Very high	93.9	Very high	5 Å²	5	35 Å²	35	3%	0.031	18%	0.184	C	C	.	.	H	α-helix	trans	-57.1	-43.8	175.3	-58.7	0	0	0	0	111.7	F89 L91 R218 A231 R232 I238 C239	F89-T235 VanDerWaalsContact O-CG2 3.29Å; F89-T235 WeakPolarHBondContact O-CG2 3.47Å; L91-T235 HydrophobicContact CD1-CG2 3.85Å; L91-T235 HydrophobicContact CD2-CG2 4.07Å; L91-T235 HydrophobicContact CG-CG2 3.65Å; R218-T235 WeakPolarHBondContact CD-OG1 3.46Å; R218-T235 PolarHBondContact NH1-OG1 2.94Å; A231-T235 PolarHBondContact O-N 2.98Å; A231-T235 PolarHBondContact O-OG1 2.6Å; R232-T235 WeakPolarHBondContact O-CB 3.3Å; R232-T235 PolarHBondContact O-N 3.08Å; T235-I238 PolarHBondContact O-N 2.82Å; T235-C239 WeakPolarHBondContact O-CB 3.16Å; T235-C239 PolarHBondContact O-N 3.15Å
236	M	95.2	Very high	93.8	Very high	73 Å²	73	31.3 Å²	31.3	36%	0.36	18%	0.181	S	C	.	.	H	α-helix	trans	-60.8	-46.3	176	-71.6	170	70.8	0	0	111.5	L99 R232 G233 I234 I238 C239 L240	L99-M236 HydrophobicContact CD1-CE 3.55Å; L99-M236 HydrophobicContact CD1-CG 4.5Å; L99-M236 HydrophobicContact CD2-CB 4.1Å; L99-M236 HydrophobicContact CD2-CG 3.96Å; R232-M236 VanDerWaalsContact O-CG 3.29Å; R232-M236 WeakPolarHBondContact O-CG 3.15Å; R232-M236 PolarHBondContact O-N 3.16Å; G233-M236 PolarHBondContact O-N 3.37Å; I234-M236 VanDerWaalsContact C-N 3.31Å; I234-M236 PolarHBondContact O-N 3.26Å; M236-I238 PolarHBondContact O-N 3.4Å; M236-C239 WeakPolarHBondContact O-CB 3.15Å; M236-C239 PolarHBondContact O-N 3.42Å; M236-L240 VanDerWaalsContact O-CG 3.26Å; M236-L240 WeakPolarHBondContact O-CG 3.45Å; M236-L240 PolarHBondContact O-N 2.82Å
237	L	96.4	Very high	93.9	Very high	4 Å²	4	30.9 Å²	30.9	2%	0.021	18%	0.176	C	C	.	.	H	α-helix	trans	-61	-42.9	178.8	-66.3	175.7	0	0	0	112.3	L185 F188 L192 F210 G233 I234 L240 I241	L185-L237 HydrophobicContact CD2-CD1 3.64Å; F188-L237 HydrophobicContact CB-CD1 3.86Å; F188-L237 HydrophobicContact CB-CD2 4.12Å; L192-L237 HydrophobicContact CD1-CD2 3.66Å; F210-L237 HydrophobicContact CE1-CB 4.36Å; F210-L237 HydrophobicContact CE1-CD1 4.27Å; F210-L237 HydrophobicContact CZ-CD1 4.01Å; G233-L237 WeakPolarHBondContact O-CG 3.34Å; G233-L237 PolarHBondContact O-N 3.48Å; I234-L237 PolarHBondContact O-N 3.34Å; L237-L240 PolarHBondContact O-N 3.23Å; L237-I241 VanDerWaalsContact O-CG1 3.31Å; L237-I241 WeakPolarHBondContact O-CG1 3.38Å; L237-I241 PolarHBondContact O-N 3.1Å
238	I	94.6	Very high	93.9	Very high	2 Å²	2	32.8 Å²	32.8	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-62	-46	176	-65.6	168.4	0	0	0	110.4	C214 R215 I234 T235 M236 L240 I241 A242	C214-I238 HydrophobicContact CB-CD1 3.89Å; C214-I238 HydrophobicContact CB-CG1 3.85Å; R215-I238 HydrophobicContact CB-CD1 4.19Å; I234-I238 HydrophobicContact CG2-CD1 4.03Å; I234-I238 WeakPolarHBondContact O-CG1 3.38Å; I234-I238 PolarHBondContact O-N 3.22Å; T235-I238 PolarHBondContact O-N 2.82Å; M236-I238 PolarHBondContact O-N 3.4Å; I238-L240 PolarHBondContact O-N 3.48Å; I238-I241 PolarHBondContact O-N 2.8Å; I238-A242 WeakPolarHBondContact O-CB 3.49Å; I238-A242 PolarHBondContact O-N 3.46Å
239	C	94.4	Very high	93.6	Very high	11 Å²	11	35.7 Å²	35.7	7%	0.074	19%	0.189	C	C	.	.	H	α-helix	trans	-58.2	-48.2	178.2	-176.6	0	0	0	0	111.5	L91 L99 T235 M236 I241 A242 H243	L91-C239 HydrophobicContact CD1-CB 4.3Å; L99-C239 HydrophobicContact CD2-CB 4.15Å; T235-C239 WeakPolarHBondContact O-CB 3.16Å; T235-C239 PolarHBondContact O-N 3.15Å; M236-C239 WeakPolarHBondContact O-CB 3.15Å; M236-C239 PolarHBondContact O-N 3.42Å; C239-I241 PolarHBondContact O-N 3.07Å; C239-A242 PolarHBondContact O-N 3.25Å; C239-H243 PolarHBondContact O-CD2 2.94Å; C239-H243 VanDerWaalsContact O-CD2 3.23Å; C239-H243 PolarHBondContact O-N 3.47Å
240	L	95.6	Very high	93.2	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-61.1	-43	178.1	-67.4	172	0	0	0	111.9	L99 F103 Y189 M236 L237 I238 A242 H243 C244 F245	L99-L240 HydrophobicContact CD1-CD2 4.42Å; L99-L240 HydrophobicContact CD2-CD2 4.41Å; L99-L240 HydrophobicContact CD2-CG 4.44Å; L99-L240 HydrophobicContact CG-CD2 4.02Å; F103-L240 HydrophobicContact CB-CD2 3.52Å; F103-L240 HydrophobicContact CD1-CD2 4.09Å; F103-L240 HydrophobicContact CD2-CD1 3.61Å; F103-L240 HydrophobicContact CD2-CD2 3.67Å; F103-L240 HydrophobicContact CD2-CG 4.2Å; F103-L240 HydrophobicContact CE2-CD1 3.81Å; F103-L240 HydrophobicContact CE2-CD2 4.36Å; F103-L240 HydrophobicContact CG-CD1 4.34Å; F103-L240 HydrophobicContact CG-CD2 3.5Å; F103-L240 VanDerWaalsContact CG-CD2 3.5Å; F103-L240 HydrophobicContact CG-CG 4.47Å; Y189-L240 HydrophobicContact CD2-CD1 3.84Å; Y189-L240 HydrophobicContact CE2-CD1 3.74Å; M236-L240 VanDerWaalsContact O-CG 3.26Å; M236-L240 WeakPolarHBondContact O-CG 3.45Å; M236-L240 PolarHBondContact O-N 2.82Å; L237-L240 PolarHBondContact O-N 3.23Å; I238-L240 PolarHBondContact O-N 3.48Å; L240-A242 VanDerWaalsContact C-N 3.32Å; L240-A242 PolarHBondContact O-N 2.88Å; L240-H243 PolarHBondContact O-N 2.99Å; L240-C244 WeakPolarHBondContact O-CA 3.36Å; L240-C244 WeakPolarHBondContact O-CB 3.22Å; L240-C244 PolarHBondContact O-N 3.25Å; L240-F245 WeakPolarHBondContact O-CD2 3.46Å
241	I	95.1	Very high	92.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61.8	-42	176.3	-68.3	166.8	0	0	0	111.3	L192 L207 F210 A211 L237 I238 C239 F245 Q247 L250	L192-I241 HydrophobicContact CD1-CG1 4.39Å; L192-I241 HydrophobicContact CD2-CG1 4.14Å; L207-I241 HydrophobicContact CB-CG2 4.07Å; L207-I241 HydrophobicContact CD2-CD1 4.38Å; L207-I241 HydrophobicContact CD2-CG1 4.49Å; F210-I241 HydrophobicContact CD1-CD1 3.56Å; F210-I241 HydrophobicContact CE1-CD1 3.98Å; A211-I241 HydrophobicContact CB-CD1 4.1Å; A211-I241 HydrophobicContact CB-CG2 4.25Å; L237-I241 VanDerWaalsContact O-CG1 3.31Å; L237-I241 WeakPolarHBondContact O-CG1 3.38Å; L237-I241 PolarHBondContact O-N 3.1Å; I238-I241 PolarHBondContact O-N 2.8Å; C239-I241 PolarHBondContact O-N 3.07Å; I241-F245 WeakPolarHBondContact O-CB 3.44Å; I241-F245 PolarHBondContact O-N 3.27Å; I241-Q247 HydrophobicContact CG2-CB 4.07Å; I241-Q247 HydrophobicContact CG2-CG 4.05Å; I241-Q247 PolarHBondContact O-N 3.09Å; I241-L250 HydrophobicContact CG2-CD1 4.02Å
242	A	93.3	Very high	92	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-66.9	-42.8	-179.6	0	0	0	0	0	112.8	I238 C239 L240 G246 Q247 K248	I238-A242 WeakPolarHBondContact O-CB 3.49Å; I238-A242 PolarHBondContact O-N 3.46Å; C239-A242 PolarHBondContact O-N 3.25Å; L240-A242 VanDerWaalsContact C-N 3.32Å; L240-A242 PolarHBondContact O-N 2.88Å; A242-G246 CarbonylContact O-C 3.35Å; A242-Q247 WeakPolarHBondContact CA-O 3.47Å; A242-Q247 CarbonylContact O-C 3.58Å; A242-Q247 PolarHBondContact O-N 2.87Å; A242-K248 PolarHBondContact O-N 3.21Å
243	H	93.3	Very high	91.1	Very high	61 Å²	61	31.5 Å²	31.5	28%	0.282	17%	0.174	S	C	.	.	H	α-helix	trans	-94.2	-44.8	-172.4	-72.5	-68.2	0	0	0	114.4	V100 C239 L240 Y254	V100-H243 HydrophobicContact CG1-CB 4.48Å; V100-H243 HydrophobicContact CG2-CB 3.54Å; C239-H243 PolarHBondContact O-CD2 2.94Å; C239-H243 VanDerWaalsContact O-CD2 3.23Å; C239-H243 PolarHBondContact O-N 3.47Å; L240-H243 PolarHBondContact O-N 2.99Å; H243-Y254 AromaticContact CE1-CZ 4Å; H243-Y254 PolarHBondContact CE1-OH 2.97Å; H243-Y254 AromaticContact NE2-CZ 3.77Å; H243-Y254 PolarHBondContact NE2-OH 3.39Å
244	C	93.5	Very high	89.8	Confident	16 Å²	16	35.1 Å²	35.1	11%	0.108	18%	0.184	C	C	.	.	H	α-helix	trans	-84.7	-20.7	-175.5	-54.4	0	0	0	0	112.8	F103 L240	F103-C244 HydrophobicContact CD1-CB 4.01Å; F103-C244 VanDerWaalsContact CD1-SG 3.53Å; F103-C244 HydrophobicContact CE1-CB 3.93Å; L240-C244 WeakPolarHBondContact O-CA 3.36Å; L240-C244 WeakPolarHBondContact O-CB 3.22Å; L240-C244 PolarHBondContact O-N 3.25Å
245	F	93.6	Very high	87.9	Confident	5 Å²	5	37.6 Å²	37.6	2%	0.022	20%	0.201	C	C	.	.	S	Bend	trans	-117.5	16.4	-179.7	-58.8	-94.4	0	0	0	113.1	F103 L192 M195 M199 H204 L207 L240 I241 Q247	F103-F245 HydrophobicContact CE1-CE2 4.36Å; F103-F245 HydrophobicContact CZ-CE2 4.26Å; F103-F245 HydrophobicContact CZ-CZ 4.43Å; L192-F245 HydrophobicContact CB-CE2 4.33Å; L192-F245 HydrophobicContact CB-CZ 4.18Å; L192-F245 HydrophobicContact CD2-CE2 3.82Å; L192-F245 HydrophobicContact CD2-CZ 3.85Å; L192-F245 WeakPolarHBondContact O-CZ 3.49Å; M195-F245 HydrophobicContact CB-CE1 3.72Å; M195-F245 HydrophobicContact CB-CZ 4.16Å; M195-F245 HydrophobicContact SD-CE1 4.19Å; M195-F245 HydrophobicContact SD-CZ 4.47Å; M199-F245 HydrophobicContact CE-CD1 4.27Å; H204-F245 PolarHBondContact CE1-O 3.48Å; L207-F245 HydrophobicContact CD1-CB 3.99Å; L207-F245 HydrophobicContact CD1-CD1 3.61Å; L207-F245 HydrophobicContact CD1-CD2 4.17Å; L207-F245 HydrophobicContact CD1-CE1 4.06Å; L207-F245 HydrophobicContact CD1-CG 3.65Å; L207-F245 HydrophobicContact CD1-CZ 4.49Å; L240-F245 WeakPolarHBondContact O-CD2 3.46Å; I241-F245 WeakPolarHBondContact O-CB 3.44Å; I241-F245 PolarHBondContact O-N 3.27Å; F245-Q247 PolarHBondContact O-N 2.93Å; F245-Q247 PolarHBondContact O-NE2 2.97Å; F245-Q247 VanDerWaalsContact O-NE2 3.11Å
246	G	90	Very high	85.8	Confident	53 Å²	53	43 Å²	43	55%	0.546	23%	0.234	S	C	.	.	S	Bend	trans	68.3	11.3	174.4	0	0	0	0	0	116	A242 K248	A242-G246 CarbonylContact O-C 3.35Å; G246-K248 VanDerWaalsContact C-N 3.25Å; G246-K248 PolarHBondContact O-N 2.91Å; G246-K248 VanDerWaalsContact O-N 3.11Å
247	Q	89.2	Confident	83.4	Confident	23 Å²	23	46.3 Å²	46.3	11%	0.107	25%	0.253	C	S	.	.			trans	-87.7	51.6	-178.5	-54.5	-55.3	-63.2	0	0	112.5	H204 R208 I241 A242 F245 D249 L250	H204-Q247 PolarHBondContact ND1-NE2 3.07Å; R208-Q247 HydrophobicContact CG-CG 4.28Å; I241-Q247 HydrophobicContact CG2-CB 4.07Å; I241-Q247 HydrophobicContact CG2-CG 4.05Å; I241-Q247 PolarHBondContact O-N 3.09Å; A242-Q247 WeakPolarHBondContact CA-O 3.47Å; A242-Q247 CarbonylContact O-C 3.58Å; A242-Q247 PolarHBondContact O-N 2.87Å; F245-Q247 PolarHBondContact O-N 2.93Å; F245-Q247 PolarHBondContact O-NE2 2.97Å; F245-Q247 VanDerWaalsContact O-NE2 3.11Å; Q247-D249 PolarHBondContact O-N 3.37Å; Q247-L250 HydrophobicContact CB-CD1 3.59Å; Q247-L250 HydrophobicContact CB-CG 4.01Å; Q247-L250 HydrophobicContact CG-CD1 4.21Å; Q247-L250 WeakPolarHBondContact O-CB 3.45Å; Q247-L250 PolarHBondContact O-N 2.88Å
248	K	87.7	Confident	80.6	Confident	162 Å²	162	55.5 Å²	55.5	70%	0.704	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-56.6	-27.9	-170.8	-66.2	-174.3	-179.8	-179	0	113.7	A242 G246 L250 G251	A242-K248 PolarHBondContact O-N 3.21Å; G246-K248 VanDerWaalsContact C-N 3.25Å; G246-K248 PolarHBondContact O-N 2.91Å; G246-K248 VanDerWaalsContact O-N 3.11Å; K248-L250 PolarHBondContact O-N 3.38Å; K248-G251 PolarHBondContact O-N 3.29Å
249	D	87.3	Confident	79.9	Confident	83 Å²	83	58.2 Å²	58.2	44%	0.444	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-66.7	-16.1	177.6	67.4	-55.2	0	0	0	114	R208 Q247	R208-D249 IonicContact CZ-OD1 3.29Å; R208-D249 IonicContact CZ-OD2 2.77Å; R208-D249 VanDerWaalsContact CZ-OD2 3.29Å; R208-D249 VanDerWaalsContact NH1-CG 3.3Å; R208-D249 IonicContact NH1-OD1 2.96Å; R208-D249 PolarHBondContact NH1-OD1 3.5Å; R208-D249 IonicContact NH1-OD2 3.98Å; R208-D249 PolarHBondContact NH1-OD2 3.48Å; R208-D249 IonicContact NH2-OD1 2.7Å; R208-D249 IonicContact NH2-OD2 3.85Å; R208-D249 PolarHBondContact NH2-OD2 2.66Å; Q247-D249 PolarHBondContact O-N 3.37Å
250	L	85.7	Confident	79.1	Confident	5 Å²	5	60.6 Å²	60.6	3%	0.026	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-90.8	-16.3	177.9	-56.1	178.7	0	0	0	113.6	R208 A211 R212 R215 I241 Q247 K248	R208-L250 HydrophobicContact CB-CD1 4.24Å; R208-L250 HydrophobicContact CG-CD1 3.95Å; A211-L250 HydrophobicContact CB-CD1 3.73Å; R212-L250 HydrophobicContact CG-CD2 4.39Å; R215-L250 PolarHBondContact NH1-O 3.29Å; I241-L250 HydrophobicContact CG2-CD1 4.02Å; Q247-L250 HydrophobicContact CB-CD1 3.59Å; Q247-L250 HydrophobicContact CB-CG 4.01Å; Q247-L250 HydrophobicContact CG-CD1 4.21Å; Q247-L250 WeakPolarHBondContact O-CB 3.45Å; Q247-L250 PolarHBondContact O-N 2.88Å; K248-L250 PolarHBondContact O-N 3.38Å
251	G	82.2	Confident	78.2	Confident	16 Å²	16	64 Å²	64	17%	0.165	36%	0.361	C	S	.	.	S	Bend	trans	-59.9	153.5	-176.1	0	0	0	0	0	112.6	K248	K248-G251 PolarHBondContact O-N 3.29Å
252	D	83.8	Confident	77.2	Confident	18 Å²	18	67.8 Å²	67.8	10%	0.096	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-74	139.3	165.4	-68.3	-42.8	0	0	0	108.6	R215 R218 Y254	R215-D252 IonicContact CZ-OD1 3.97Å; R218-D252 IonicContact CZ-OD2 3.24Å; R218-D252 VanDerWaalsContact CZ-OD2 3.24Å; R218-D252 IonicContact NH1-OD2 2.74Å; R218-D252 PolarHBondContact NH1-OD2 3.21Å; R218-D252 VanDerWaalsContact NH2-CG 3.25Å; R218-D252 IonicContact NH2-OD1 2.94Å; R218-D252 PolarHBondContact NH2-OD1 3.08Å; R218-D252 IonicContact NH2-OD2 2.81Å; R218-D252 PolarHBondContact NH2-OD2 3.01Å; D252-Y254 PolarHBondContact O-N 2.96Å
253	E	74.8	Confident	76.2	Confident	113 Å²	113	72 Å²	72	53%	0.528	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-62.6	126.3	169.1	-72.3	172	-177.4	0	0	108.3	S85 A90	S85-E253 VanDerWaalsContact OG-CB 3.31Å; S85-E253 WeakPolarHBondContact OG-CB 3.26Å; S85-E253 WeakPolarHBondContact OG-CG 3.27Å; S85-E253 PolarHBondContact OG-OE1 3.07Å; S85-E253 PolarHBondContact OG-OE2 2.73Å; A90-E253 VanDerWaalsContact CB-O 3.25Å; A90-E253 WeakPolarHBondContact CB-O 3.4Å
254	Y	68.6	Low	75.1	Confident	87 Å²	87	72.7 Å²	72.7	34%	0.341	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-63	147.5	177.7	-48.5	-63.7	0	0	0	110.6	V96 H243 D252 T256	V96-Y254 HydrophobicContact CB-CE1 4.08Å; V96-Y254 HydrophobicContact CG1-CE1 3.89Å; V96-Y254 HydrophobicContact CG2-CD1 3.9Å; V96-Y254 HydrophobicContact CG2-CE1 3.51Å; H243-Y254 AromaticContact CE1-CZ 4Å; H243-Y254 PolarHBondContact CE1-OH 2.97Å; H243-Y254 AromaticContact NE2-CZ 3.77Å; H243-Y254 PolarHBondContact NE2-OH 3.39Å; D252-Y254 PolarHBondContact O-N 2.96Å; Y254-T256 PolarHBondContact O-N 3.3Å
255	C	56.6	Low	73.8	Confident	52 Å²	52	76.8 Å²	76.8	35%	0.351	44%	0.436	S	S	.	.			trans	-64	92	160.8	-78	0	0	0	0	108	N257	C255-N257 PolarHBondContact O-N 3.38Å
256	T	51.8	Low	72.3	Confident	118 Å²	118	82.3 Å²	82.3	72%	0.724	47%	0.467	S	S	*	.			trans	-64.5	111	154.7	54.5	0	0	0	0	105.2	Y254	Y254-T256 PolarHBondContact O-N 3.3Å
257	N	44.2	Very low	70.8	Confident	144 Å²	144	84.8 Å²	84.8	77%	0.77	46%	0.461	S	S	*	.			trans	-50	136.6	167.3	-80	-32.6	0	0	0	108	C255	C255-N257 PolarHBondContact O-N 3.38Å
258	P	37.4	Very low	69.1	Low	196 Å²	196	90.4 Å²	90.4	100%	1.273	49%	0.493	S	S	*	.			trans	-58.5	0	171.4	26.7	-33.1	0	0	0	111.5

Retrieved 258 of 258 residues in 159.6 ms (Link to these results)

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