A0A087YJZ3_POEFO Loading...

Monocyte to macrophage differentiation-associated

AlphaFold DB , UniProt , Accession A0A087YJZ3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 276 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.1	Very low	35.9	Very low	241 Å²	241	149.5 Å²	149.5	100%	1.187	85%	0.853	S	S	*	*				0	85.2	0	-85.2	176.8	157.4	0	0	108.1
2	F	31.7	Very low	36.3	Very low	203 Å²	203	145.8 Å²	145.8	89%	0.89	85%	0.854	S	S	*	*			trans	-109.6	120.9	176.5	-82.4	-87.9	0	0	0	106.4	L4	F2-L4 PolarHBondContact O-N 2.69Å
3	G	34	Very low	36.1	Very low	88 Å²	88	141 Å²	141	91%	0.907	86%	0.855	S	S	*	*			trans	-76.3	104.7	178.2	0	0	0	0	0	110.7
4	L	32.3	Very low	36.5	Very low	147 Å²	147	142.2 Å²	142.2	77%	0.77	85%	0.853	S	S	*	*			trans	-69.4	133.4	156.3	-90.1	102.8	0	0	0	108.8	F2	F2-L4 PolarHBondContact O-N 2.69Å
5	S	32.1	Very low	36.5	Very low	129 Å²	129	141.7 Å²	141.7	90%	0.902	84%	0.843	S	S	*	*			trans	-129.8	126.3	152.2	-94.4	0	0	0	0	109.4
6	I	34.1	Very low	36.3	Very low	140 Å²	140	144.8 Å²	144.8	72%	0.718	84%	0.843	S	S	*	*			trans	-88	136.5	-165	-70.3	163.9	0	0	0	109	V8	I6-V8 HydrophobicContact CG2-CG2 4.3Å
7	S	32.7	Very low	36.3	Very low	113 Å²	113	148.5 Å²	148.5	79%	0.79	84%	0.841	S	S	*	*			trans	-65.9	130.1	166.8	-178.3	0	0	0	0	110.7
8	V	36.8	Very low	36.3	Very low	126 Å²	126	146.7 Å²	146.7	76%	0.764	84%	0.839	S	S	*	*			trans	-135.8	109.7	163.4	-175.5	0	0	0	0	108.7	I6	I6-V8 HydrophobicContact CG2-CG2 4.3Å
9	A	38.4	Very low	36.7	Very low	87 Å²	87	142.9 Å²	142.9	72%	0.719	82%	0.823	S	S	*	*			trans	-87.5	153.5	158.6	0	0	0	0	0	109.6
10	P	43.4	Very low	36.9	Very low	125 Å²	125	139.8 Å²	139.8	81%	0.812	81%	0.81	S	S	*	*			trans	-126.1	149	140.8	28.4	-13.1	0	0	0	113.1
11	R	37.8	Very low	37.3	Very low	245 Å²	245	143.6 Å²	143.6	93%	0.925	81%	0.811	S	S	*	*			trans	-66.7	148.6	-178.8	-82.9	170	167.7	177.3	-3.5	113.8
12	A	41.5	Very low	37.5	Very low	105 Å²	105	136.7 Å²	136.7	87%	0.868	78%	0.782	S	S	*	*			trans	46	112.7	133.7	0	0	0	0	0	119.9
13	G	33.2	Very low	38	Very low	84 Å²	84	130.5 Å²	130.5	87%	0.866	76%	0.764	S	S	*	*			trans	-136.5	115.5	152.3	0	0	0	0	0	108.8
14	L	41.7	Very low	38.5	Very low	158 Å²	158	128.6 Å²	128.6	83%	0.827	75%	0.745	S	S	*	*			trans	-85	159.6	177.5	-132.5	122.5	0	0	0	109.7
15	L	36.7	Very low	39.3	Very low	135 Å²	135	127.8 Å²	127.8	71%	0.707	74%	0.741	S	S	*	*			trans	86.2	125.6	169.3	-50.8	158.6	0	0	0	113.8
16	F	33.2	Very low	40	Very low	191 Å²	191	130.1 Å²	130.1	84%	0.838	73%	0.731	S	S	*	*			cis	-146.2	142.1	41.7	-86.4	-97.3	0	0	0	113.1
17	Y	37	Very low	40.5	Very low	208 Å²	208	127.2 Å²	127.2	82%	0.816	72%	0.722	S	S	*	*			trans	-70.5	120.1	162.3	-177.9	-96.8	0	0	0	109.4
18	S	35.1	Very low	41.4	Very low	115 Å²	115	128.7 Å²	128.7	80%	0.804	71%	0.714	S	S	*	*			trans	-135	111.7	159.5	-178.5	0	0	0	0	109.1	S20	S18-S20 PolarHBondContact O-N 3.44Å
19	S	44.3	Very low	42.1	Very low	76 Å²	76	129.1 Å²	129.1	53%	0.531	71%	0.708	S	S	.	*			trans	-71	113.5	179.9	150.5	0	0	0	0	110.8
20	S	41.2	Very low	42.7	Very low	79 Å²	79	129.9 Å²	129.9	55%	0.552	70%	0.699	S	S	*	*			trans	-115.8	91.4	150.3	55.6	0	0	0	0	109	S18 T22 S23	S18-S20 PolarHBondContact O-N 3.44Å; S20-T22 PolarHBondContact O-N 2.96Å; S20-S23 PolarHBondContact O-N 2.84Å
21	R	45.5	Very low	42.8	Very low	220 Å²	220	133.3 Å²	133.3	83%	0.83	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	6.1	-178.3	-137.6	-179.7	-129.1	-158.1	1.9	114.3
22	T	43.8	Very low	43.6	Very low	96 Å²	96	126.5 Å²	126.5	59%	0.589	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	-24.7	-178.2	45.3	0	0	0	0	113.2	S20 Y26	S20-T22 PolarHBondContact O-N 2.96Å; T22-Y26 WeakPolarHBondContact O-CD2 3.33Å
23	S	43.6	Very low	44.2	Very low	73 Å²	73	128.2 Å²	128.2	51%	0.51	67%	0.666	S	S	.	*	H	α-helix	trans	-75	-28.4	-176.8	-46.5	0	0	0	0	113.9	S20 C27	S20-S23 PolarHBondContact O-N 2.84Å; S23-C27 WeakPolarHBondContact O-CB 3.36Å; S23-C27 PolarHBondContact O-N 3.14Å
24	G	44.1	Very low	45.1	Very low	49 Å²	49	131.3 Å²	131.3	51%	0.505	66%	0.656	S	S	.	*	H	α-helix	trans	-71.3	-35.4	179.9	0	0	0	0	0	113.6	F28	G24-F28 WeakPolarHBondContact O-CB 3.47Å; G24-F28 PolarHBondContact O-N 3.39Å
25	L	48.5	Very low	45.7	Very low	130 Å²	130	124.7 Å²	124.7	68%	0.681	63%	0.625	S	S	*	*	H	α-helix	trans	-69.1	-40.7	178.2	-91	146.3	0	0	0	112	H29	L25-H29 WeakPolarHBondContact O-CB 3.44Å; L25-H29 PolarHBondContact O-N 3.26Å
26	Y	46.3	Very low	46.7	Very low	177 Å²	177	121.1 Å²	121.1	69%	0.694	62%	0.616	S	S	*	*	H	α-helix	trans	-66.7	-42.4	174.8	-79.4	-85.3	0	0	0	112.2	T22 H29 L30	T22-Y26 WeakPolarHBondContact O-CD2 3.33Å; Y26-H29 PolarHBondContact O-N 3.03Å; Y26-L30 WeakPolarHBondContact O-CB 3.49Å; Y26-L30 VanDerWaalsContact O-CG 3.3Å; Y26-L30 WeakPolarHBondContact O-CG 3.29Å; Y26-L30 PolarHBondContact O-N 3.39Å
27	C	46.3	Very low	48	Very low	79 Å²	79	117.9 Å²	117.9	53%	0.534	61%	0.607	S	S	.	*	H	α-helix	trans	-67.5	-39.8	177.8	-163.7	0	0	0	0	111.9	S23 L30 W31	S23-C27 WeakPolarHBondContact O-CB 3.36Å; S23-C27 PolarHBondContact O-N 3.14Å; C27-L30 PolarHBondContact O-N 3.36Å; C27-W31 WeakPolarHBondContact O-CB 3.42Å; C27-W31 PolarHBondContact O-N 3.27Å
28	F	50.3	Low	48.9	Very low	144 Å²	144	113.6 Å²	113.6	63%	0.632	60%	0.596	S	S	*	*	H	α-helix	trans	-68	-39.7	175.1	-165.7	-96.6	0	0	0	112	G24 W31 N32	G24-F28 WeakPolarHBondContact O-CB 3.47Å; G24-F28 PolarHBondContact O-N 3.39Å; F28-W31 PolarHBondContact O-N 2.89Å; F28-N32 VanDerWaalsContact O-CB 3.31Å; F28-N32 WeakPolarHBondContact O-CB 3.47Å; F28-N32 PolarHBondContact O-N 3.3Å
29	H	51.5	Low	49.9	Very low	135 Å²	135	116 Å²	116	63%	0.625	59%	0.591	S	S	*	*	H	α-helix	trans	-66.3	-40.6	175.1	-160	83	0	0	0	111.6	L25 Y26 N32 K33	L25-H29 WeakPolarHBondContact O-CB 3.44Å; L25-H29 PolarHBondContact O-N 3.26Å; Y26-H29 PolarHBondContact O-N 3.03Å; H29-N32 PolarHBondContact O-N 3.17Å; H29-K33 VanDerWaalsContact O-CB 3.23Å; H29-K33 WeakPolarHBondContact O-CB 3.28Å; H29-K33 PolarHBondContact O-N 3.49Å
30	L	51.2	Low	50.6	Low	103 Å²	103	114.3 Å²	114.3	54%	0.539	59%	0.586	S	S	.	*	H	α-helix	trans	-67.6	-37.5	173.9	-74.7	167.6	0	0	0	112.8	Y26 C27 K34	Y26-L30 WeakPolarHBondContact O-CB 3.49Å; Y26-L30 VanDerWaalsContact O-CG 3.3Å; Y26-L30 WeakPolarHBondContact O-CG 3.29Å; Y26-L30 PolarHBondContact O-N 3.39Å; C27-L30 PolarHBondContact O-N 3.36Å; L30-K34 WeakPolarHBondContact O-CB 3.24Å; L30-K34 WeakPolarHBondContact O-CG 3.13Å; L30-K34 PolarHBondContact O-N 3.43Å
31	W	45.6	Very low	51.4	Low	198 Å²	198	112.5 Å²	112.5	75%	0.75	58%	0.576	S	S	*	*	H	α-helix	trans	-62.8	-49.4	172.1	-174.8	-45.4	0	0	0	110.3	C27 F28 K33 K34 G35	C27-W31 WeakPolarHBondContact O-CB 3.42Å; C27-W31 PolarHBondContact O-N 3.27Å; F28-W31 PolarHBondContact O-N 2.89Å; W31-K33 VanDerWaalsContact C-N 3.3Å; W31-K33 PolarHBondContact O-N 3.3Å; W31-K34 PolarHBondContact O-N 3.41Å; W31-G35 PolarHBondContact O-N 3.04Å
32	N	55.9	Low	52.1	Low	101 Å²	101	110.8 Å²	110.8	54%	0.54	57%	0.571	S	S	.	*	H	α-helix	trans	-66.5	-36.2	-177.8	-144.8	-2.5	0	0	0	111.1	F28 H29 G35 A36	F28-N32 VanDerWaalsContact O-CB 3.31Å; F28-N32 WeakPolarHBondContact O-CB 3.47Å; F28-N32 PolarHBondContact O-N 3.3Å; H29-N32 PolarHBondContact O-N 3.17Å; N32-G35 PolarHBondContact O-N 2.98Å; N32-A36 VanDerWaalsContact O-CB 3.24Å; N32-A36 WeakPolarHBondContact O-CB 3.46Å; N32-A36 PolarHBondContact O-N 3.48Å
33	K	52.8	Low	53.1	Low	142 Å²	142	109 Å²	109	62%	0.617	56%	0.563	S	S	*	*	H	α-helix	trans	-65.5	-47	172.5	-151.7	175.9	-171.2	-178.8	0	111.5	H29 W31 G35 A36 D37	H29-K33 VanDerWaalsContact O-CB 3.23Å; H29-K33 WeakPolarHBondContact O-CB 3.28Å; H29-K33 PolarHBondContact O-N 3.49Å; W31-K33 VanDerWaalsContact C-N 3.3Å; W31-K33 PolarHBondContact O-N 3.3Å; K33-G35 PolarHBondContact O-N 2.94Å; K33-A36 PolarHBondContact O-N 2.9Å; K33-D37 WeakPolarHBondContact O-CB 3.4Å; K33-D37 PolarHBondContact O-N 2.71Å
34	K	52.3	Low	54.1	Low	149 Å²	149	111 Å²	111	65%	0.648	56%	0.562	S	S	*	*	H	α-helix	trans	-62.7	-37.4	173.6	-79.9	-176.5	176.3	-176.6	0	112.9	L30 W31 M38	L30-K34 WeakPolarHBondContact O-CB 3.24Å; L30-K34 WeakPolarHBondContact O-CG 3.13Å; L30-K34 PolarHBondContact O-N 3.43Å; W31-K34 PolarHBondContact O-N 3.41Å; K34-M38 WeakPolarHBondContact O-CB 3.46Å; K34-M38 VanDerWaalsContact O-CG 3.3Å; K34-M38 WeakPolarHBondContact O-CG 3.34Å; K34-M38 PolarHBondContact O-N 2.96Å
35	G	54.6	Low	55.4	Low	18 Å²	18	116 Å²	116	19%	0.186	57%	0.567	C	S	.	*	H	α-helix	trans	-70.2	-37.7	176.7	0	0	0	0	0	112.6	W31 N32 K33 K39	W31-G35 PolarHBondContact O-N 3.04Å; N32-G35 PolarHBondContact O-N 2.98Å; K33-G35 PolarHBondContact O-N 2.94Å; G35-K39 WeakPolarHBondContact O-CB 3.44Å; G35-K39 VanDerWaalsContact O-CG 3.3Å; G35-K39 WeakPolarHBondContact O-CG 3.43Å; G35-K39 PolarHBondContact O-N 3.27Å
36	A	58.3	Low	56.7	Low	61 Å²	61	116.7 Å²	116.7	50%	0.504	56%	0.561	S	S	.	*	H	α-helix	trans	-68.4	-41.9	171.3	0	0	0	0	0	111.7	N32 K33 K39 G40	N32-A36 VanDerWaalsContact O-CB 3.24Å; N32-A36 WeakPolarHBondContact O-CB 3.46Å; N32-A36 PolarHBondContact O-N 3.48Å; K33-A36 PolarHBondContact O-N 2.9Å; A36-K39 PolarHBondContact O-N 3.37Å; A36-G40 PolarHBondContact O-N 3.4Å
37	D	59	Low	58.4	Low	122 Å²	122	110.6 Å²	110.6	65%	0.652	54%	0.538	S	S	*	.	H	α-helix	trans	-63.1	-43.3	175.5	-126.2	-13.3	0	0	0	111.5	K33 G40 A41	K33-D37 WeakPolarHBondContact O-CB 3.4Å; K33-D37 PolarHBondContact O-N 2.71Å; D37-G40 PolarHBondContact O-N 2.97Å; D37-A41 VanDerWaalsContact O-CB 3.3Å; D37-A41 WeakPolarHBondContact O-CB 3.34Å; D37-A41 PolarHBondContact O-N 3Å
38	M	56.8	Low	60.1	Low	119 Å²	119	109.5 Å²	109.5	59%	0.586	53%	0.525	S	S	*	.	H	α-helix	trans	-65	-40.5	175.3	-79.1	-167.6	-56.8	0	0	112.1	K34 A41 Y42	K34-M38 WeakPolarHBondContact O-CB 3.46Å; K34-M38 VanDerWaalsContact O-CG 3.3Å; K34-M38 WeakPolarHBondContact O-CG 3.34Å; K34-M38 PolarHBondContact O-N 2.96Å; M38-A41 PolarHBondContact O-N 3.2Å; M38-Y42 WeakPolarHBondContact O-CB 3.38Å; M38-Y42 WeakPolarHBondContact O-CD2 3.46Å; M38-Y42 PolarHBondContact O-N 3.36Å
39	K	56.2	Low	61.7	Low	164 Å²	164	103 Å²	103	71%	0.713	50%	0.497	S	S	*	.	H	α-helix	trans	-65	-40.2	174.6	-75.8	179.7	-177.2	-174.8	0	111.7	G35 A36 S43	G35-K39 WeakPolarHBondContact O-CB 3.44Å; G35-K39 VanDerWaalsContact O-CG 3.3Å; G35-K39 WeakPolarHBondContact O-CG 3.43Å; G35-K39 PolarHBondContact O-N 3.27Å; A36-K39 PolarHBondContact O-N 3.37Å; K39-S43 WeakPolarHBondContact O-CB 3.49Å; K39-S43 PolarHBondContact O-N 3.3Å
40	G	58.8	Low	62.9	Low	41 Å²	41	106.2 Å²	106.2	42%	0.423	50%	0.504	S	S	.	.	H	α-helix	trans	-62.3	-46.2	173.8	0	0	0	0	0	112.3	A36 D37 S43 F44	A36-G40 PolarHBondContact O-N 3.4Å; D37-G40 PolarHBondContact O-N 2.97Å; G40-S43 WeakPolarHBondContact O-CB 3.39Å; G40-S43 PolarHBondContact O-N 2.91Å; G40-F44 PolarHBondContact O-N 3.41Å
41	A	58.9	Low	64.1	Low	41 Å²	41	110.8 Å²	110.8	34%	0.339	51%	0.514	S	S	.	.	H	α-helix	trans	-61.5	-48.4	175.8	0	0	0	0	0	111.6	D37 M38 S43 F44 Y45	D37-A41 VanDerWaalsContact O-CB 3.3Å; D37-A41 WeakPolarHBondContact O-CB 3.34Å; D37-A41 PolarHBondContact O-N 3Å; M38-A41 PolarHBondContact O-N 3.2Å; A41-S43 VanDerWaalsContact C-N 3.27Å; A41-S43 PolarHBondContact O-N 3.35Å; A41-F44 PolarHBondContact O-N 2.85Å; A41-Y45 HydrophobicContact CB-CE2 4.09Å; A41-Y45 WeakPolarHBondContact O-CD2 3.28Å; A41-Y45 PolarHBondContact O-N 3Å
42	Y	59.8	Low	65.3	Low	185 Å²	185	103 Å²	103	73%	0.725	49%	0.492	S	S	*	.	H	α-helix	trans	-58.4	-37.2	175.1	-98.6	-92.6	0	0	0	112.8	M38	M38-Y42 WeakPolarHBondContact O-CB 3.38Å; M38-Y42 WeakPolarHBondContact O-CD2 3.46Å; M38-Y42 PolarHBondContact O-N 3.36Å
43	S	64.4	Low	65.8	Low	59 Å²	59	101.7 Å²	101.7	41%	0.413	49%	0.491	S	S	.	.	H	α-helix	trans	-67.3	-36.3	174.7	-177	0	0	0	0	112.5	K39 G40 A41 R46 F47	K39-S43 WeakPolarHBondContact O-CB 3.49Å; K39-S43 PolarHBondContact O-N 3.3Å; G40-S43 WeakPolarHBondContact O-CB 3.39Å; G40-S43 PolarHBondContact O-N 2.91Å; A41-S43 VanDerWaalsContact C-N 3.27Å; A41-S43 PolarHBondContact O-N 3.35Å; S43-R46 WeakPolarHBondContact O-CB 3.28Å; S43-F47 WeakPolarHBondContact O-CD2 3.15Å
44	F	65.4	Low	66.4	Low	114 Å²	114	99.2 Å²	99.2	50%	0.5	50%	0.497	S	S	.	.	H	α-helix	trans	-72.9	-41.2	-180	-159.1	-98.7	0	0	0	112.2	G40 A41 R46 F47 M48 P239	G40-F44 PolarHBondContact O-N 3.41Å; A41-F44 PolarHBondContact O-N 2.85Å; F44-R46 PolarHBondContact O-N 3.46Å; F44-R46 VanDerWaalsContact O-N 3.16Å; F44-F47 PolarHBondContact O-N 3.13Å; F44-F47 VanDerWaalsContact O-N 3.12Å; F44-M48 HydrophobicContact CD1-CE 4.02Å; F44-M48 HydrophobicContact CE1-CE 4.17Å; F44-M48 HydrophobicContact CE1-SD 4.37Å; F44-M48 PolarHBondContact O-N 2.94Å; F44-P239 HydrophobicContact CD1-CG 4.34Å; F44-P239 HydrophobicContact CD2-CG 4.5Å; F44-P239 HydrophobicContact CE1-CG 3.58Å; F44-P239 HydrophobicContact CE2-CG 3.76Å; F44-P239 VanDerWaalsContact CZ-CD 3.48Å; F44-P239 HydrophobicContact CZ-CG 3.26Å
45	Y	70.3	Confident	67.1	Low	155 Å²	155	97 Å²	97	61%	0.608	49%	0.492	S	S	*	.	H	α-helix	trans	-59.7	-26.5	175.8	-72.5	-66.3	0	0	0	113.3	A41 F47 M48	A41-Y45 HydrophobicContact CB-CE2 4.09Å; A41-Y45 WeakPolarHBondContact O-CD2 3.28Å; A41-Y45 PolarHBondContact O-N 3Å; Y45-F47 PolarHBondContact O-N 3.28Å; Y45-M48 HydrophobicContact CD1-CE 3.97Å; Y45-M48 HydrophobicContact CE1-CE 4.03Å; Y45-M48 PolarHBondContact O-N 3.47Å
46	R	76.6	Confident	67.8	Low	144 Å²	144	98.9 Å²	98.9	54%	0.543	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-30.7	177.1	-173.8	176.1	67.5	174.1	-2.1	113.4	S43 F44	S43-R46 WeakPolarHBondContact O-CB 3.28Å; F44-R46 PolarHBondContact O-N 3.46Å; F44-R46 VanDerWaalsContact O-N 3.16Å
47	F	80.8	Confident	68.5	Low	48 Å²	48	98.4 Å²	98.4	21%	0.211	49%	0.487	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-2.2	-179.6	-58.7	-69.6	0	0	0	112.8	S43 F44 Y45 Y63 P239 F240	S43-F47 WeakPolarHBondContact O-CD2 3.15Å; F44-F47 PolarHBondContact O-N 3.13Å; F44-F47 VanDerWaalsContact O-N 3.12Å; Y45-F47 PolarHBondContact O-N 3.28Å; F47-Y63 AromaticContact CD1-CD2 3.72Å; F47-Y63 HydrophobicContact CD1-CD2 3.72Å; F47-Y63 HydrophobicContact CD1-CE2 4.27Å; F47-Y63 AromaticContact CD1-CG 3.95Å; F47-Y63 HydrophobicContact CD1-CG 3.95Å; F47-Y63 HydrophobicContact CE1-CD1 4.17Å; F47-Y63 AromaticContact CE1-CD2 3.82Å; F47-Y63 HydrophobicContact CE1-CD2 3.82Å; F47-Y63 HydrophobicContact CE1-CE1 4.38Å; F47-Y63 HydrophobicContact CE1-CE2 4.06Å; F47-Y63 AromaticContact CE1-CG 3.88Å; F47-Y63 HydrophobicContact CE1-CG 3.88Å; F47-P239 HydrophobicContact CB-CB 4.05Å; F47-P239 WeakPolarHBondContact O-CB 3.42Å; F47-F240 HydrophobicContact CB-CD2 4.4Å; F47-F240 HydrophobicContact CB-CE2 3.71Å; F47-F240 HydrophobicContact CB-CZ 4.37Å; F47-F240 AromaticContact CD1-CE2 3.79Å; F47-F240 HydrophobicContact CD1-CE2 3.79Å; F47-F240 AromaticContact CD1-CZ 3.76Å; F47-F240 HydrophobicContact CD1-CZ 3.76Å; F47-F240 HydrophobicContact CE1-CZ 4.39Å; F47-F240 AromaticContact CG-CE2 3.85Å; F47-F240 HydrophobicContact CG-CE2 3.85Å; F47-F240 HydrophobicContact CG-CZ 4.3Å
48	M	83	Confident	69.5	Low	57 Å²	57	93.5 Å²	93.5	28%	0.281	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-79.9	127.8	-178.7	-162.4	100	77.3	0	0	110	F44 Y45	F44-M48 HydrophobicContact CD1-CE 4.02Å; F44-M48 HydrophobicContact CE1-CE 4.17Å; F44-M48 HydrophobicContact CE1-SD 4.37Å; F44-M48 PolarHBondContact O-N 2.94Å; Y45-M48 HydrophobicContact CD1-CE 3.97Å; Y45-M48 HydrophobicContact CE1-CE 4.03Å; Y45-M48 PolarHBondContact O-N 3.47Å
49	N	83.4	Confident	70.7	Confident	6 Å²	6	94.3 Å²	94.3	3%	0.032	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-84.4	155.4	178	-54.5	-69.3	0	0	0	110.4	R51 Y58 P60 T61 E64	N49-R51 PolarHBondContact O-N 3.46Å; N49-Y58 HydrophobicContact CB-CD2 4.43Å; N49-Y58 HydrophobicContact CB-CE1 4.49Å; N49-Y58 HydrophobicContact CB-CE2 3.23Å; N49-Y58 WeakPolarHBondContact CB-OH 3.4Å; N49-Y58 PolarHBondContact ND2-OH 3.18Å; N49-P60 WeakPolarHBondContact OD1-CA 3.39Å; N49-T61 WeakPolarHBondContact OD1-CB 3.17Å; N49-T61 WeakPolarHBondContact OD1-CG2 3.49Å; N49-T61 PolarHBondContact OD1-N 2.86Å; N49-T61 PolarHBondContact OD1-OG1 3.01Å; N49-T61 VanDerWaalsContact OD1-OG1 3.1Å; N49-E64 PolarHBondContact ND2-OE2 2.96Å; N49-E64 PolarHBondContact OD1-OE2 3.4Å; N49-E64 VanDerWaalsContact OD1-OE2 3.04Å
50	R	77.9	Confident	72.1	Confident	204 Å²	204	87.6 Å²	87.6	77%	0.77	44%	0.435	S	S	*	.	B	Isolated β-bridge	trans	-66.9	133	175.4	-70.3	-174	179	-174.9	0.3	109	A52	R50-A52 PolarHBondContact O-N 2.74Å
51	R	75.2	Confident	73.4	Confident	198 Å²	198	87.2 Å²	87.2	75%	0.747	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-59.3	126.2	174	-161.2	174.9	-168.6	179.9	3.4	109.1	N49 S53	N49-R51 PolarHBondContact O-N 3.46Å; R51-S53 PolarHBondContact O-N 3.21Å
52	A	70.1	Confident	74.8	Confident	35 Å²	35	89.7 Å²	89.7	29%	0.289	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-64.1	131.2	177.7	0	0	0	0	0	109.8	R50	R50-A52 PolarHBondContact O-N 2.74Å
53	S	67.8	Low	76.2	Confident	74 Å²	74	86.6 Å²	86.6	52%	0.517	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-66.5	158.5	169.1	43	0	0	0	0	110.7	R51 N55 C56	R51-S53 PolarHBondContact O-N 3.21Å; S53-N55 PolarHBondContact O-N 2.82Å; S53-C56 PolarHBondContact O-N 3.03Å; S53-C56 WeakPolarHBondContact OG-CB 3.26Å; S53-C56 PolarHBondContact OG-SG 3.48Å
54	A	64.9	Low	77.4	Confident	90 Å²	90	83.8 Å²	83.8	74%	0.744	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	127.2	176	0	0	0	0	0	109.8	C56	A54-C56 PolarHBondContact O-N 3.07Å
55	N	65.9	Low	78.5	Confident	102 Å²	102	79.5 Å²	79.5	55%	0.545	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	65	13.3	-178.3	-48.3	-27.5	0	0	0	116	S53 K186	S53-N55 PolarHBondContact O-N 2.82Å; N55-K186 PolarHBondContact OD1-O 3.43Å
56	C	69.4	Low	79.6	Confident	58 Å²	58	73.1 Å²	73.1	39%	0.392	36%	0.364	S	S	.	.	S	Bend	trans	-106	152.6	170	-62.2	0	0	0	0	111	S53 A54 K188	S53-C56 PolarHBondContact O-N 3.03Å; S53-C56 WeakPolarHBondContact OG-CB 3.26Å; S53-C56 PolarHBondContact OG-SG 3.48Å; A54-C56 PolarHBondContact O-N 3.07Å; C56-K188 PolarHBondContact O-NZ 2.84Å
57	R	73.1	Confident	80.4	Confident	50 Å²	50	67.5 Å²	67.5	19%	0.189	35%	0.348	C	S	.	.			trans	-65.5	144.9	172.8	-164.9	-178	155.4	-179.4	-12.1	111.1	E130 E185	R57-E130 IonicContact CZ-OE1 2.94Å; R57-E130 IonicContact NH1-OE1 3.39Å; R57-E130 PolarHBondContact NH1-OE1 2.95Å; R57-E130 IonicContact NH2-OE1 3.9Å; R57-E185 WeakPolarHBondContact CA-OE1 3.26Å; R57-E185 WeakPolarHBondContact CB-OE1 3.46Å
58	Y	80.4	Confident	81	Confident	19 Å²	19	65.2 Å²	65.2	8%	0.075	34%	0.338	C	S	.	.			trans	-66.2	139.8	166.7	170.5	-112.2	0	0	0	111.9	N49 P60 E64 D235 H242	N49-Y58 HydrophobicContact CB-CD2 4.43Å; N49-Y58 HydrophobicContact CB-CE1 4.49Å; N49-Y58 HydrophobicContact CB-CE2 3.23Å; N49-Y58 WeakPolarHBondContact CB-OH 3.4Å; N49-Y58 PolarHBondContact ND2-OH 3.18Å; Y58-P60 HydrophobicContact CD1-CB 4.35Å; Y58-P60 HydrophobicContact CE1-CB 3.73Å; Y58-P60 HydrophobicContact CE1-CG 4.35Å; Y58-P60 WeakPolarHBondContact O-CD 3.14Å; Y58-E64 VanDerWaalsContact CE1-OE2 3.29Å; Y58-E64 WeakPolarHBondContact CE1-OE2 3.28Å; Y58-E64 VanDerWaalsContact CZ-OE2 3.23Å; Y58-E64 VanDerWaalsContact OH-CD 3.22Å; Y58-E64 PolarHBondContact OH-OE1 3.31Å; Y58-E64 VanDerWaalsContact OH-OE1 3.11Å; Y58-E64 PolarHBondContact OH-OE2 3.39Å; Y58-D235 HydrophobicContact CD1-CB 4.29Å; Y58-D235 HydrophobicContact CD2-CB 3.92Å; Y58-D235 HydrophobicContact CE1-CB 4.46Å; Y58-D235 HydrophobicContact CE2-CB 4.09Å; Y58-D235 HydrophobicContact CG-CB 3.94Å; Y58-H242 HydrophobicContact CE1-CB 4.32Å
59	Q	82.7	Confident	81.4	Confident	137 Å²	137	63 Å²	63	64%	0.64	33%	0.328	S	S	*	.	B	Isolated β-bridge	trans	-112.1	101.3	179.1	-69.2	-171	-5.6	0	0	110.1
60	P	84.3	Confident	82	Confident	22 Å²	22	70 Å²	70	14%	0.143	36%	0.355	C	S	.	.			trans	-75	150.9	179	28.3	-31.6	0	0	0	111.6	N49 Y58 E64 H65	N49-P60 WeakPolarHBondContact OD1-CA 3.39Å; Y58-P60 HydrophobicContact CD1-CB 4.35Å; Y58-P60 HydrophobicContact CE1-CB 3.73Å; Y58-P60 HydrophobicContact CE1-CG 4.35Å; Y58-P60 WeakPolarHBondContact O-CD 3.14Å; P60-E64 HydrophobicContact CB-CB 4.04Å; P60-E64 HydrophobicContact CB-CG 4.13Å; P60-E64 VanDerWaalsContact CB-OE2 3.32Å; P60-E64 WeakPolarHBondContact CB-OE2 3.33Å; P60-H65 WeakPolarHBondContact CG-NE2 3.24Å
61	T	87.8	Confident	82.8	Confident	33 Å²	33	61.8 Å²	61.8	20%	0.202	33%	0.328	C	S	.	.			trans	-68.2	165	169.9	55.2	0	0	0	0	110.5	N49 Y63 E64 H65	N49-T61 WeakPolarHBondContact OD1-CB 3.17Å; N49-T61 WeakPolarHBondContact OD1-CG2 3.49Å; N49-T61 PolarHBondContact OD1-N 2.86Å; N49-T61 PolarHBondContact OD1-OG1 3.01Å; N49-T61 VanDerWaalsContact OD1-OG1 3.1Å; T61-Y63 PolarHBondContact O-N 3.48Å; T61-E64 PolarHBondContact O-N 2.95Å; T61-E64 PolarHBondContact OG1-N 2.57Å; T61-H65 PolarHBondContact O-N 3.44Å
62	V	87.3	Confident	83.7	Confident	93 Å²	93	52.5 Å²	52.5	56%	0.564	29%	0.293	S	S	*	.	H	α-helix	trans	-56.5	-37.8	175.7	-179.9	0	0	0	0	111.7	A66 W121	V62-A66 PolarHBondContact O-N 3.41Å; V62-A66 VanDerWaalsContact O-N 3.09Å; V62-W121 HydrophobicContact CG1-CZ2 3.89Å
63	Y	89.9	Confident	84.9	Confident	120 Å²	120	52.5 Å²	52.5	47%	0.471	29%	0.293	S	S	.	.	H	α-helix	trans	-66.1	-45.2	178.1	-57.4	-73.2	0	0	0	112	F47 T61 A66 A67	F47-Y63 AromaticContact CD1-CD2 3.72Å; F47-Y63 HydrophobicContact CD1-CD2 3.72Å; F47-Y63 HydrophobicContact CD1-CE2 4.27Å; F47-Y63 AromaticContact CD1-CG 3.95Å; F47-Y63 HydrophobicContact CD1-CG 3.95Å; F47-Y63 HydrophobicContact CE1-CD1 4.17Å; F47-Y63 AromaticContact CE1-CD2 3.82Å; F47-Y63 HydrophobicContact CE1-CD2 3.82Å; F47-Y63 HydrophobicContact CE1-CE1 4.38Å; F47-Y63 HydrophobicContact CE1-CE2 4.06Å; F47-Y63 AromaticContact CE1-CG 3.88Å; F47-Y63 HydrophobicContact CE1-CG 3.88Å; T61-Y63 PolarHBondContact O-N 3.48Å; Y63-A66 WeakPolarHBondContact O-CB 3.35Å; Y63-A66 PolarHBondContact O-N 3.29Å; Y63-A67 PolarHBondContact O-N 2.84Å
64	E	89.6	Confident	86.3	Confident	0 Å²	0	55 Å²	55	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-72	-34	179	-173	179	-146.4	0	0	112	N49 Y58 P60 T61 A66 A67 N68 F240 A241 H242 A243	N49-E64 PolarHBondContact ND2-OE2 2.96Å; N49-E64 PolarHBondContact OD1-OE2 3.4Å; N49-E64 VanDerWaalsContact OD1-OE2 3.04Å; Y58-E64 VanDerWaalsContact CE1-OE2 3.29Å; Y58-E64 WeakPolarHBondContact CE1-OE2 3.28Å; Y58-E64 VanDerWaalsContact CZ-OE2 3.23Å; Y58-E64 VanDerWaalsContact OH-CD 3.22Å; Y58-E64 PolarHBondContact OH-OE1 3.31Å; Y58-E64 VanDerWaalsContact OH-OE1 3.11Å; Y58-E64 PolarHBondContact OH-OE2 3.39Å; P60-E64 HydrophobicContact CB-CB 4.04Å; P60-E64 HydrophobicContact CB-CG 4.13Å; P60-E64 VanDerWaalsContact CB-OE2 3.32Å; P60-E64 WeakPolarHBondContact CB-OE2 3.33Å; T61-E64 PolarHBondContact O-N 2.95Å; T61-E64 PolarHBondContact OG1-N 2.57Å; E64-A66 VanDerWaalsContact C-N 3.3Å; E64-A66 PolarHBondContact O-N 2.87Å; E64-A67 PolarHBondContact O-N 3.12Å; E64-N68 WeakPolarHBondContact O-CB 3.29Å; E64-N68 PolarHBondContact O-N 3.33Å; E64-N68 PolarHBondContact O-ND2 3.37Å; E64-N68 PolarHBondContact O-OD1 3.34Å; E64-F240 HydrophobicContact CB-CD1 3.89Å; E64-F240 HydrophobicContact CB-CE1 4.16Å; E64-F240 HydrophobicContact CG-CD1 4.09Å; E64-F240 VanDerWaalsContact OE1-C 3.27Å; E64-F240 VanDerWaalsContact OE1-CA 3.23Å; E64-F240 WeakPolarHBondContact OE1-CA 3.43Å; E64-A241 PolarHBondContact OE1-N 2.84Å; E64-H242 WeakPolarHBondContact OE1-CB 3.43Å; E64-H242 PolarHBondContact OE1-N 2.75Å; E64-H242 VanDerWaalsContact OE1-N 3.14Å; E64-A243 HydrophobicContact CG-CB 4.43Å
65	H	89.1	Confident	87.9	Confident	24 Å²	24	53 Å²	53	11%	0.111	28%	0.276	C	S	.	.	H	α-helix	trans	-55.9	-46.1	169.4	-98.9	-58.6	0	0	0	111.7	P60 T61 C69 T120 W121	P60-H65 WeakPolarHBondContact CG-NE2 3.24Å; T61-H65 PolarHBondContact O-N 3.44Å; H65-C69 PolarHBondContact O-N 2.92Å; H65-C69 VanDerWaalsContact O-N 3.07Å; H65-C69 PolarHBondContact O-SG 3.49Å; H65-C69 VanDerWaalsContact O-SG 3.36Å; H65-T120 PolarHBondContact CE1-OG1 2.97Å; H65-T120 VanDerWaalsContact CE1-OG1 3.25Å; H65-W121 HydrophobicContact CB-CB 4.48Å; H65-W121 HydrophobicContact CB-CD2 4.13Å; H65-W121 HydrophobicContact CB-CE3 4.24Å; H65-W121 HydrophobicContact CB-CG 4.25Å
66	A	91.6	Very high	89.4	Confident	21 Å²	21	49.8 Å²	49.8	17%	0.174	26%	0.259	C	S	.	.	H	α-helix	trans	-61.6	-47.2	175.7	0	0	0	0	0	111.4	V62 Y63 E64 C69 Y70 W121	V62-A66 PolarHBondContact O-N 3.41Å; V62-A66 VanDerWaalsContact O-N 3.09Å; Y63-A66 WeakPolarHBondContact O-CB 3.35Å; Y63-A66 PolarHBondContact O-N 3.29Å; E64-A66 VanDerWaalsContact C-N 3.3Å; E64-A66 PolarHBondContact O-N 2.87Å; A66-C69 WeakPolarHBondContact O-CB 3.26Å; A66-C69 PolarHBondContact O-N 2.82Å; A66-Y70 HydrophobicContact CB-CD2 4.44Å; A66-Y70 HydrophobicContact CB-CE2 4.35Å; A66-Y70 WeakPolarHBondContact O-CD2 3.4Å; A66-Y70 PolarHBondContact O-N 3.43Å; A66-W121 HydrophobicContact CB-CH2 3.57Å; A66-W121 HydrophobicContact CB-CZ3 3.74Å
67	A	93.7	Very high	90.7	Very high	26 Å²	26	51.9 Å²	51.9	22%	0.215	27%	0.27	C	S	.	.	H	α-helix	trans	-59.3	-49.4	178.3	0	0	0	0	0	111.7	Y63 E64 C69 Y70 T71 F240 A243	Y63-A67 PolarHBondContact O-N 2.84Å; E64-A67 PolarHBondContact O-N 3.12Å; A67-C69 VanDerWaalsContact C-N 3.28Å; A67-C69 PolarHBondContact O-N 2.79Å; A67-Y70 PolarHBondContact O-N 2.71Å; A67-Y70 VanDerWaalsContact O-N 3.16Å; A67-T71 VanDerWaalsContact O-CG2 3.3Å; A67-T71 WeakPolarHBondContact O-CG2 3.28Å; A67-T71 PolarHBondContact O-N 2.78Å; A67-T71 PolarHBondContact O-OG1 2.76Å; A67-F240 HydrophobicContact CB-CD1 3.98Å; A67-F240 HydrophobicContact CB-CE1 4.16Å; A67-A243 HydrophobicContact CB-CB 3.64Å
68	N	93.5	Very high	91.9	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-56.2	-41.6	177.6	-69.7	-16.7	0	0	0	112.2	E64 T71 H117 A243 H246	E64-N68 WeakPolarHBondContact O-CB 3.29Å; E64-N68 PolarHBondContact O-N 3.33Å; E64-N68 PolarHBondContact O-ND2 3.37Å; E64-N68 PolarHBondContact O-OD1 3.34Å; N68-T71 PolarHBondContact O-OG1 3.01Å; N68-T71 VanDerWaalsContact O-OG1 3.12Å; N68-H117 HydrophobicContact CB-CB 4.46Å; N68-A243 WeakPolarHBondContact OD1-CA 3.34Å; N68-A243 VanDerWaalsContact OD1-CB 3.29Å; N68-A243 WeakPolarHBondContact OD1-CB 3.17Å; N68-A243 PolarHBondContact OD1-N 3.04Å; N68-H246 PolarHBondContact O-ND1 2.96Å
69	C	92.3	Very high	92.8	Very high	10 Å²	10	52.1 Å²	52.1	7%	0.068	28%	0.28	C	S	.	.	H	α-helix	trans	-63.7	-52.9	174.6	-75	0	0	0	0	111.6	H65 A66 A67 T71 H72 A73 H117	H65-C69 PolarHBondContact O-N 2.92Å; H65-C69 VanDerWaalsContact O-N 3.07Å; H65-C69 PolarHBondContact O-SG 3.49Å; H65-C69 VanDerWaalsContact O-SG 3.36Å; A66-C69 WeakPolarHBondContact O-CB 3.26Å; A66-C69 PolarHBondContact O-N 2.82Å; A67-C69 VanDerWaalsContact C-N 3.28Å; A67-C69 PolarHBondContact O-N 2.79Å; C69-T71 PolarHBondContact O-N 3.23Å; C69-H72 PolarHBondContact O-N 3.24Å; C69-A73 WeakPolarHBondContact O-CB 3.44Å; C69-A73 PolarHBondContact O-N 2.88Å; C69-H117 VanDerWaalsContact SG-C 3.56Å; C69-H117 WeakPolarHBondContact SG-CB 3.5Å
70	Y	94.5	Very high	93.5	Very high	154 Å²	154	50.1 Å²	50.1	60%	0.604	27%	0.269	S	S	*	.	H	α-helix	trans	-66.7	-39.1	-173.6	-75.9	-62.7	0	0	0	112.8	A66 A67 H72 A73 L74	A66-Y70 HydrophobicContact CB-CD2 4.44Å; A66-Y70 HydrophobicContact CB-CE2 4.35Å; A66-Y70 WeakPolarHBondContact O-CD2 3.4Å; A66-Y70 PolarHBondContact O-N 3.43Å; A67-Y70 PolarHBondContact O-N 2.71Å; A67-Y70 VanDerWaalsContact O-N 3.16Å; Y70-H72 PolarHBondContact O-N 2.87Å; Y70-A73 PolarHBondContact O-N 3.34Å; Y70-L74 WeakPolarHBondContact O-CB 3.4Å; Y70-L74 WeakPolarHBondContact O-CD1 3.49Å; Y70-L74 VanDerWaalsContact O-CG 3.23Å; Y70-L74 WeakPolarHBondContact O-CG 3.18Å; Y70-L74 PolarHBondContact O-N 3.45Å
71	T	95.6	Very high	94.2	Very high	30 Å²	30	53.4 Å²	53.4	18%	0.184	29%	0.289	C	S	.	.	H	α-helix	trans	-59.3	-35.1	-178.4	52.9	0	0	0	0	112.5	A67 N68 C69 L75 H246 V247	A67-T71 VanDerWaalsContact O-CG2 3.3Å; A67-T71 WeakPolarHBondContact O-CG2 3.28Å; A67-T71 PolarHBondContact O-N 2.78Å; A67-T71 PolarHBondContact O-OG1 2.76Å; N68-T71 PolarHBondContact O-OG1 3.01Å; N68-T71 VanDerWaalsContact O-OG1 3.12Å; C69-T71 PolarHBondContact O-N 3.23Å; T71-L75 VanDerWaalsContact O-CD1 3.29Å; T71-L75 WeakPolarHBondContact O-CD1 3.41Å; T71-H246 VanDerWaalsContact OG1-CB 3.27Å; T71-H246 WeakPolarHBondContact OG1-CB 3.37Å; T71-H246 PolarHBondContact OG1-ND1 3.07Å; T71-H246 VanDerWaalsContact OG1-ND1 3.17Å; T71-V247 HydrophobicContact CG2-CG2 3.8Å
72	H	94.6	Very high	94.6	Very high	3 Å²	3	52.1 Å²	52.1	1%	0.014	28%	0.282	C	S	.	.	H	α-helix	trans	-95.4	-37.1	177.6	-76.8	-171.6	0	0	0	113.4	C69 Y70 L74 L75 I76 F110 S113 H246	C69-H72 PolarHBondContact O-N 3.24Å; Y70-H72 PolarHBondContact O-N 2.87Å; H72-L74 VanDerWaalsContact C-N 3.26Å; H72-L74 PolarHBondContact O-N 2.93Å; H72-L75 PolarHBondContact O-N 2.85Å; H72-I76 PolarHBondContact O-N 3.01Å; H72-F110 HydrophobicContact CB-CD1 4.14Å; H72-F110 AromaticContact CD2-CD1 3.92Å; H72-F110 AromaticContact CG-CD1 3.91Å; H72-S113 PolarHBondContact CE1-OG 2.84Å; H72-S113 WeakPolarHBondContact ND1-CB 3.25Å; H72-S113 PolarHBondContact ND1-OG 2.73Å; H72-H246 AromaticContact CD2-CG 3.79Å; H72-H246 AromaticContact CD2-ND1 3.91Å; H72-H246 AromaticContact CE1-CD2 3.41Å; H72-H246 PolarHBondContact CE1-CD2 3.42Å; H72-H246 VanDerWaalsContact CE1-CD2 3.41Å; H72-H246 AromaticContact CE1-CE1 3.81Å; H72-H246 AromaticContact CE1-CG 3.54Å; H72-H246 AromaticContact CE1-ND1 3.8Å; H72-H246 AromaticContact CE1-NE2 3.6Å; H72-H246 AromaticContact CG-ND1 3.98Å; H72-H246 AromaticContact ND1-CE1 3.84Å; H72-H246 AromaticContact ND1-ND1 3.9Å; H72-H246 VanDerWaalsContact NE2-CB 3.32Å; H72-H246 WeakPolarHBondContact NE2-CB 3.38Å; H72-H246 AromaticContact NE2-CD2 3.56Å; H72-H246 AromaticContact NE2-CG 3.31Å; H72-H246 VanDerWaalsContact NE2-CG 3.31Å; H72-H246 AromaticContact NE2-ND1 3.81Å
73	A	95.6	Very high	95.2	Very high	35 Å²	35	48.3 Å²	48.3	29%	0.289	26%	0.258	S	S	.	.	H	α-helix	trans	-59	-39.5	-178.8	0	0	0	0	0	112.2	C69 Y70 L75 I76 T114	C69-A73 WeakPolarHBondContact O-CB 3.44Å; C69-A73 PolarHBondContact O-N 2.88Å; Y70-A73 PolarHBondContact O-N 3.34Å; A73-L75 PolarHBondContact O-N 3.35Å; A73-I76 PolarHBondContact O-N 2.84Å; A73-T114 WeakPolarHBondContact CA-OG1 3.18Å; A73-T114 HydrophobicContact CB-CG2 3.69Å; A73-T114 PolarHBondContact N-OG1 3.16Å
74	L	96.5	Very high	95.5	Very high	126 Å²	126	46.3 Å²	46.3	66%	0.66	26%	0.259	S	S	*	.	H	α-helix	trans	-64.4	-21.5	178.3	-68.2	173.9	0	0	0	113.1	Y70 H72 P78	Y70-L74 WeakPolarHBondContact O-CB 3.4Å; Y70-L74 WeakPolarHBondContact O-CD1 3.49Å; Y70-L74 VanDerWaalsContact O-CG 3.23Å; Y70-L74 WeakPolarHBondContact O-CG 3.18Å; Y70-L74 PolarHBondContact O-N 3.45Å; H72-L74 VanDerWaalsContact C-N 3.26Å; H72-L74 PolarHBondContact O-N 2.93Å; L74-P78 WeakPolarHBondContact O-CD 3.18Å
75	L	97.6	Very high	95.9	Very high	48 Å²	48	49.7 Å²	49.7	25%	0.251	28%	0.276	S	S	.	.	H	α-helix	trans	-94.6	-7.8	-177.2	-62.4	172.2	0	0	0	113.6	T71 H72 A73 P78 A79 F110 A250	T71-L75 VanDerWaalsContact O-CD1 3.29Å; T71-L75 WeakPolarHBondContact O-CD1 3.41Å; H72-L75 PolarHBondContact O-N 2.85Å; A73-L75 PolarHBondContact O-N 3.35Å; L75-P78 WeakPolarHBondContact O-CD 3.17Å; L75-A79 VanDerWaalsContact O-CB 3.29Å; L75-A79 WeakPolarHBondContact O-CB 3.5Å; L75-A79 PolarHBondContact O-N 3.06Å; L75-F110 HydrophobicContact CB-CD1 3.91Å; L75-F110 HydrophobicContact CB-CD2 3.88Å; L75-F110 HydrophobicContact CB-CE1 3.93Å; L75-F110 HydrophobicContact CB-CE2 3.87Å; L75-F110 HydrophobicContact CB-CG 3.89Å; L75-F110 HydrophobicContact CB-CZ 3.9Å; L75-F110 HydrophobicContact CD1-CD1 4.14Å; L75-F110 HydrophobicContact CD1-CE1 3.54Å; L75-F110 HydrophobicContact CD1-CZ 3.77Å; L75-F110 HydrophobicContact CG-CE1 4.4Å; L75-F110 HydrophobicContact CG-CZ 4.46Å; L75-A250 HydrophobicContact CD1-CB 3.18Å
76	I	97.9	Very high	96.4	Very high	36 Å²	36	48.5 Å²	48.5	19%	0.185	27%	0.271	C	S	.	.	H	α-helix	trans	-59.2	-50.4	176	-64.7	173.1	0	0	0	110.4	H72 A73 A79 F80 F110 V111 T114	H72-I76 PolarHBondContact O-N 3.01Å; A73-I76 PolarHBondContact O-N 2.84Å; I76-A79 PolarHBondContact O-N 2.93Å; I76-F80 HydrophobicContact CG2-CD2 3.82Å; I76-F80 HydrophobicContact CG2-CE2 3.67Å; I76-F80 VanDerWaalsContact O-CD2 3.26Å; I76-F80 WeakPolarHBondContact O-CD2 3.3Å; I76-F80 PolarHBondContact O-N 3.37Å; I76-F110 HydrophobicContact CG1-CB 3.88Å; I76-V111 HydrophobicContact CD1-CG2 4.1Å; I76-V111 HydrophobicContact CG1-CG2 4.05Å; I76-V111 HydrophobicContact CG2-CG2 3.83Å; I76-T114 HydrophobicContact CD1-CG2 4.19Å
77	V	97.9	Very high	96.6	Very high	102 Å²	102	50.6 Å²	50.6	62%	0.618	28%	0.277	S	S	*	.	H	α-helix	trans	-63.8	-50.5	-179.3	174.5	0	0	0	0	111.6	A79 F80 V81	V77-A79 VanDerWaalsContact C-N 3.26Å; V77-A79 PolarHBondContact O-N 3.49Å; V77-F80 PolarHBondContact O-N 3.42Å; V77-V81 HydrophobicContact CG1-CG2 4.4Å; V77-V81 WeakPolarHBondContact O-CG2 3.41Å; V77-V81 PolarHBondContact O-N 3.38Å
78	P	97.9	Very high	96.8	Very high	71 Å²	71	53.9 Å²	53.9	46%	0.461	30%	0.297	S	S	.	.	H	α-helix	trans	-52.8	-38.5	171.3	-29.4	34.8	0	0	0	114.4	L74 L75 V81 G82	L74-P78 WeakPolarHBondContact O-CD 3.18Å; L75-P78 WeakPolarHBondContact O-CD 3.17Å; P78-V81 PolarHBondContact O-N 3.11Å; P78-G82 PolarHBondContact O-N 2.91Å
79	A	98	Very high	96.9	Very high	3 Å²	3	56.4 Å²	56.4	3%	0.025	31%	0.311	C	S	.	.	H	α-helix	trans	-66.2	-42.4	178.2	0	0	0	0	0	112.5	L75 I76 V77 G82 M83 L106 F110	L75-A79 VanDerWaalsContact O-CB 3.29Å; L75-A79 WeakPolarHBondContact O-CB 3.5Å; L75-A79 PolarHBondContact O-N 3.06Å; I76-A79 PolarHBondContact O-N 2.93Å; V77-A79 VanDerWaalsContact C-N 3.26Å; V77-A79 PolarHBondContact O-N 3.49Å; A79-G82 PolarHBondContact O-N 3.45Å; A79-M83 WeakPolarHBondContact O-CB 3.49Å; A79-M83 PolarHBondContact O-N 3.28Å; A79-L106 HydrophobicContact CB-CD2 4.09Å; A79-L106 HydrophobicContact CB-CG 3.92Å; A79-F110 HydrophobicContact CB-CD2 3.79Å; A79-F110 HydrophobicContact CB-CE2 4.16Å
80	F	98.3	Very high	97	Very high	94 Å²	94	56.3 Å²	56.3	41%	0.412	31%	0.31	S	S	.	.	H	α-helix	trans	-63.4	-45.8	173.6	-83.5	-72.3	0	0	0	111.7	I76 V77 G82 M83 T84 C107 V111	I76-F80 HydrophobicContact CG2-CD2 3.82Å; I76-F80 HydrophobicContact CG2-CE2 3.67Å; I76-F80 VanDerWaalsContact O-CD2 3.26Å; I76-F80 WeakPolarHBondContact O-CD2 3.3Å; I76-F80 PolarHBondContact O-N 3.37Å; V77-F80 PolarHBondContact O-N 3.42Å; F80-G82 VanDerWaalsContact C-N 3.29Å; F80-G82 PolarHBondContact O-N 3.26Å; F80-M83 HydrophobicContact CD1-CE 3.77Å; F80-M83 HydrophobicContact CE1-CE 4.16Å; F80-M83 PolarHBondContact O-N 3.38Å; F80-T84 PolarHBondContact O-N 3.34Å; F80-T84 PolarHBondContact O-OG1 2.83Å; F80-T84 VanDerWaalsContact O-OG1 3.13Å; F80-C107 HydrophobicContact CE1-CB 4.47Å; F80-C107 HydrophobicContact CZ-CB 4.31Å; F80-V111 HydrophobicContact CE2-CG2 4.47Å
81	V	98.3	Very high	97	Very high	91 Å²	91	55.5 Å²	55.5	55%	0.552	32%	0.316	S	S	*	.	H	α-helix	trans	-59.1	-43.4	175.9	172.3	0	0	0	0	110.7	V77 P78 T84 L85	V77-V81 HydrophobicContact CG1-CG2 4.4Å; V77-V81 WeakPolarHBondContact O-CG2 3.41Å; V77-V81 PolarHBondContact O-N 3.38Å; P78-V81 PolarHBondContact O-N 3.11Å; V81-T84 PolarHBondContact O-N 3.45Å; V81-L85 WeakPolarHBondContact O-CB 3.37Å; V81-L85 PolarHBondContact O-N 2.88Å
82	G	97.8	Very high	96.9	Very high	6 Å²	6	57.1 Å²	57.1	6%	0.062	32%	0.324	C	S	.	.	H	α-helix	trans	-63.2	-45.3	177.7	0	0	0	0	0	112.7	P78 A79 F80 T84 L85 L86 Y257	P78-G82 PolarHBondContact O-N 2.91Å; A79-G82 PolarHBondContact O-N 3.45Å; F80-G82 VanDerWaalsContact C-N 3.29Å; F80-G82 PolarHBondContact O-N 3.26Å; G82-T84 PolarHBondContact O-N 2.91Å; G82-L85 PolarHBondContact O-N 3.4Å; G82-L86 WeakPolarHBondContact O-CG 3.33Å; G82-L86 PolarHBondContact O-N 3.47Å; G82-Y257 VanDerWaalsContact CA-CE2 3.48Å; G82-Y257 VanDerWaalsContact CA-CZ 3.49Å; G82-Y257 WeakPolarHBondContact CA-OH 3.22Å; G82-Y257 PolarHBondContact O-OH 3.39Å
83	M	98.1	Very high	96.9	Very high	14 Å²	14	62.7 Å²	62.7	7%	0.069	35%	0.353	C	S	.	.	H	α-helix	trans	-57.4	-48.6	173.7	177.6	178.2	71.8	0	0	111.6	A79 F80 L85 L86 H87 W100 L104	A79-M83 WeakPolarHBondContact O-CB 3.49Å; A79-M83 PolarHBondContact O-N 3.28Å; F80-M83 HydrophobicContact CD1-CE 3.77Å; F80-M83 HydrophobicContact CE1-CE 4.16Å; F80-M83 PolarHBondContact O-N 3.38Å; M83-L85 VanDerWaalsContact C-N 3.33Å; M83-L85 PolarHBondContact O-N 2.99Å; M83-L86 PolarHBondContact O-N 3.12Å; M83-H87 WeakPolarHBondContact O-CB 3.06Å; M83-H87 PolarHBondContact O-N 3.16Å; M83-W100 HydrophobicContact CE-CZ3 4.01Å; M83-W100 HydrophobicContact SD-CE3 3.91Å; M83-W100 HydrophobicContact SD-CZ3 3.87Å; M83-L104 HydrophobicContact SD-CD2 3.92Å; M83-L104 HydrophobicContact SD-CG 4.06Å
84	T	98	Very high	96.9	Very high	77 Å²	77	68.4 Å²	68.4	47%	0.472	37%	0.368	S	S	.	.	H	α-helix	trans	-62.4	-41.1	178.4	-59.4	0	0	0	0	111.5	F80 V81 G82 H87 C88	F80-T84 PolarHBondContact O-N 3.34Å; F80-T84 PolarHBondContact O-OG1 2.83Å; F80-T84 VanDerWaalsContact O-OG1 3.13Å; V81-T84 PolarHBondContact O-N 3.45Å; G82-T84 PolarHBondContact O-N 2.91Å; T84-H87 PolarHBondContact O-N 2.86Å; T84-C88 WeakPolarHBondContact O-CB 3.31Å; T84-C88 PolarHBondContact O-N 3.23Å; T84-C88 PolarHBondContact O-SG 2.98Å
85	L	98	Very high	96.8	Very high	71 Å²	71	63.8 Å²	63.8	37%	0.372	34%	0.343	S	S	.	.	H	α-helix	trans	-61.6	-49.6	178.1	179.3	61.7	0	0	0	111.9	V81 G82 M83 H87 C88 L89	V81-L85 WeakPolarHBondContact O-CB 3.37Å; V81-L85 PolarHBondContact O-N 2.88Å; G82-L85 PolarHBondContact O-N 3.4Å; M83-L85 VanDerWaalsContact C-N 3.33Å; M83-L85 PolarHBondContact O-N 2.99Å; L85-H87 VanDerWaalsContact C-N 3.28Å; L85-H87 PolarHBondContact O-N 3.4Å; L85-C88 PolarHBondContact O-N 2.91Å; L85-L89 HydrophobicContact CD1-CD1 3.98Å; L85-L89 HydrophobicContact CD1-CG 4.26Å; L85-L89 HydrophobicContact CG-CD1 4.03Å; L85-L89 WeakPolarHBondContact O-CG 3.24Å; L85-L89 PolarHBondContact O-N 2.89Å
86	L	97.8	Very high	96.8	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-60.2	-40.6	176.6	-65.9	-179.3	0	0	0	111.4	G82 M83 L89 S90 A99 Y102 Y257 I260 W261 Y265	G82-L86 WeakPolarHBondContact O-CG 3.33Å; G82-L86 PolarHBondContact O-N 3.47Å; M83-L86 PolarHBondContact O-N 3.12Å; L86-L89 PolarHBondContact O-N 3.27Å; L86-S90 PolarHBondContact O-N 3.2Å; L86-S90 PolarHBondContact O-OG 2.98Å; L86-A99 HydrophobicContact CB-CB 3.73Å; L86-Y102 HydrophobicContact CD1-CD1 3.68Å; L86-Y102 HydrophobicContact CD1-CE1 4.08Å; L86-Y257 HydrophobicContact CD1-CD2 4.49Å; L86-Y257 HydrophobicContact CD1-CE2 3.82Å; L86-Y257 HydrophobicContact CG-CE2 4Å; L86-I260 HydrophobicContact CD1-CG2 4.14Å; L86-I260 HydrophobicContact CD2-CG2 4.36Å; L86-W261 HydrophobicContact CD2-CB 4.03Å; L86-Y265 HydrophobicContact CB-CD1 4.38Å; L86-Y265 HydrophobicContact CB-CE1 4.12Å; L86-Y265 HydrophobicContact CD2-CD1 4.19Å; L86-Y265 HydrophobicContact CD2-CD2 3.74Å; L86-Y265 HydrophobicContact CD2-CE1 4.49Å; L86-Y265 HydrophobicContact CD2-CE2 4.12Å; L86-Y265 HydrophobicContact CD2-CG 3.78Å; L86-Y265 WeakPolarHBondContact O-CD1 3.31Å; L86-Y265 WeakPolarHBondContact O-CE1 3.49Å
87	H	97.1	Very high	96.8	Very high	65 Å²	65	68.7 Å²	68.7	30%	0.301	36%	0.363	S	S	.	.	H	α-helix	trans	-62.2	-45.3	176.7	-178.2	67.2	0	0	0	112.4	M83 T84 L85 L89 S90 W100	M83-H87 WeakPolarHBondContact O-CB 3.06Å; M83-H87 PolarHBondContact O-N 3.16Å; T84-H87 PolarHBondContact O-N 2.86Å; L85-H87 VanDerWaalsContact C-N 3.28Å; L85-H87 PolarHBondContact O-N 3.4Å; H87-L89 VanDerWaalsContact C-N 3.3Å; H87-L89 PolarHBondContact O-N 3.22Å; H87-S90 VanDerWaalsContact O-CB 3.28Å; H87-S90 WeakPolarHBondContact O-CB 3.5Å; H87-S90 PolarHBondContact O-N 2.87Å; H87-S90 VanDerWaalsContact O-N 3.17Å; H87-S90 PolarHBondContact O-OG 3.29Å; H87-W100 AromaticContact CE1-NE1 3.48Å; H87-W100 PolarHBondContact CE1-NE1 3.03Å; H87-W100 AromaticContact ND1-CD1 3.94Å; H87-W100 AromaticContact ND1-CE2 3.98Å; H87-W100 AromaticContact ND1-NE1 3.29Å; H87-W100 PolarHBondContact ND1-NE1 3.45Å
88	C	96.8	Very high	96.8	Very high	95 Å²	95	63.8 Å²	63.8	64%	0.642	33%	0.334	S	S	*	.	H	α-helix	trans	-65.8	-31.7	178.6	-71.2	0	0	0	0	113.1	T84 L85 S90	T84-C88 WeakPolarHBondContact O-CB 3.31Å; T84-C88 PolarHBondContact O-N 3.23Å; T84-C88 PolarHBondContact O-SG 2.98Å; L85-C88 PolarHBondContact O-N 2.91Å; C88-S90 VanDerWaalsContact C-N 3.27Å
89	L	96.1	Very high	96.8	Very high	54 Å²	54	60.4 Å²	60.4	28%	0.283	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-7.3	176.3	-66.9	172.1	0	0	0	113.4	L85 L86 H87 N91 Y265	L85-L89 HydrophobicContact CD1-CD1 3.98Å; L85-L89 HydrophobicContact CD1-CG 4.26Å; L85-L89 HydrophobicContact CG-CD1 4.03Å; L85-L89 WeakPolarHBondContact O-CG 3.24Å; L85-L89 PolarHBondContact O-N 2.89Å; L86-L89 PolarHBondContact O-N 3.27Å; H87-L89 VanDerWaalsContact C-N 3.3Å; H87-L89 PolarHBondContact O-N 3.22Å; L89-N91 PolarHBondContact O-N 3.31Å; L89-N91 PolarHBondContact O-ND2 3.49Å; L89-Y265 HydrophobicContact CB-CD1 4.23Å
90	S	95.6	Very high	96.8	Very high	8 Å²	8	65.8 Å²	65.8	6%	0.056	33%	0.332	C	S	.	.			trans	-76.2	118	-175.2	-57.6	0	0	0	0	112.5	L86 H87 C88 E95 R96 Y265	L86-S90 PolarHBondContact O-N 3.2Å; L86-S90 PolarHBondContact O-OG 2.98Å; H87-S90 VanDerWaalsContact O-CB 3.28Å; H87-S90 WeakPolarHBondContact O-CB 3.5Å; H87-S90 PolarHBondContact O-N 2.87Å; H87-S90 VanDerWaalsContact O-N 3.17Å; H87-S90 PolarHBondContact O-OG 3.29Å; C88-S90 VanDerWaalsContact C-N 3.27Å; S90-E95 WeakPolarHBondContact CA-OE2 3.49Å; S90-R96 PolarHBondContact OG-N 3.35Å; S90-Y265 WeakPolarHBondContact OG-CE1 3.36Å
91	N	93.6	Very high	96.8	Very high	137 Å²	137	63.2 Å²	63.2	73%	0.733	32%	0.323	S	S	*	.			trans	-89.2	-28.8	179.9	-64	-58.5	0	0	0	113.2	L89 E95	L89-N91 PolarHBondContact O-N 3.31Å; L89-N91 PolarHBondContact O-ND2 3.49Å; N91-E95 PolarHBondContact N-OE2 3.19Å
92	N	93.3	Very high	96.8	Very high	64 Å²	64	58.9 Å²	58.9	34%	0.342	30%	0.297	S	S	.	.	S	Bend	trans	-127.1	171.3	-178.1	66.5	59.6	0	0	0	113	W94 E95 R96	N92-W94 VanDerWaalsContact C-N 3.32Å; N92-W94 PolarHBondContact O-N 3.44Å; N92-W94 WeakPolarHBondContact OD1-CA 3.18Å; N92-W94 WeakPolarHBondContact OD1-CB 3.32Å; N92-W94 PolarHBondContact OD1-N 3.25Å; N92-E95 VanDerWaalsContact ND2-CD 3.27Å; N92-E95 PolarHBondContact ND2-OE1 3.42Å; N92-E95 PolarHBondContact O-N 3.5Å; N92-E95 PolarHBondContact OD1-N 3.46Å; N92-R96 WeakPolarHBondContact O-CG 3.43Å; N92-R96 PolarHBondContact O-N 2.88Å; N92-R96 VanDerWaalsContact O-N 3.07Å
93	N	95.3	Very high	96.8	Very high	119 Å²	119	58.6 Å²	58.6	64%	0.636	29%	0.294	S	S	*	.	H	α-helix	trans	-64.2	-34.8	-177.4	-71.2	-23.7	0	0	0	113.1	R96 V97	N93-R96 PolarHBondContact O-N 2.97Å; N93-V97 VanDerWaalsContact O-CG2 3.28Å; N93-V97 WeakPolarHBondContact O-CG2 3.05Å; N93-V97 PolarHBondContact O-N 2.82Å
94	W	94.2	Very high	96.8	Very high	155 Å²	155	62.4 Å²	62.4	59%	0.587	31%	0.314	S	S	*	.	H	α-helix	trans	-69.3	-43	179.5	-73.7	112.8	0	0	0	111.7	N92 V97 T98 L155	N92-W94 VanDerWaalsContact C-N 3.32Å; N92-W94 PolarHBondContact O-N 3.44Å; N92-W94 WeakPolarHBondContact OD1-CA 3.18Å; N92-W94 WeakPolarHBondContact OD1-CB 3.32Å; N92-W94 PolarHBondContact OD1-N 3.25Å; W94-V97 PolarHBondContact O-N 3.29Å; W94-T98 WeakPolarHBondContact O-CB 3.46Å; W94-T98 WeakPolarHBondContact O-CG2 3.44Å; W94-T98 PolarHBondContact O-N 3.43Å; W94-T98 PolarHBondContact O-OG1 3.29Å; W94-T98 VanDerWaalsContact O-OG1 3.11Å; W94-L155 HydrophobicContact CB-CD2 3.98Å
95	E	96	Very high	96.8	Very high	29 Å²	29	59.2 Å²	59.2	14%	0.136	30%	0.297	C	S	.	.	H	α-helix	trans	-57.2	-50.6	171.5	-74.7	168.4	-154.7	0	0	110	S90 N91 N92 V97 T98 A99 L155 Y265	S90-E95 WeakPolarHBondContact CA-OE2 3.49Å; N91-E95 PolarHBondContact N-OE2 3.19Å; N92-E95 VanDerWaalsContact ND2-CD 3.27Å; N92-E95 PolarHBondContact ND2-OE1 3.42Å; N92-E95 PolarHBondContact O-N 3.5Å; N92-E95 PolarHBondContact OD1-N 3.46Å; E95-V97 PolarHBondContact O-N 2.91Å; E95-T98 PolarHBondContact O-N 3.44Å; E95-T98 PolarHBondContact O-OG1 2.89Å; E95-A99 WeakPolarHBondContact O-CB 3.44Å; E95-A99 PolarHBondContact O-N 3.46Å; E95-L155 HydrophobicContact CB-CD2 4.48Å; E95-L155 HydrophobicContact CG-CD1 4.01Å; E95-L155 HydrophobicContact CG-CD2 3.78Å; E95-Y265 HydrophobicContact CB-CE1 3.99Å; E95-Y265 HydrophobicContact CG-CE1 4.42Å; E95-Y265 PolarHBondContact O-OH 3.41Å
96	R	97.1	Very high	96.8	Very high	114 Å²	114	56.3 Å²	56.3	43%	0.43	28%	0.282	S	S	.	.	H	α-helix	trans	-57.1	-47.1	178.5	-69.3	175.9	-172.6	176.1	1.9	112.7	S90 N92 N93 A99 W100	S90-R96 PolarHBondContact OG-N 3.35Å; N92-R96 WeakPolarHBondContact O-CG 3.43Å; N92-R96 PolarHBondContact O-N 2.88Å; N92-R96 VanDerWaalsContact O-N 3.07Å; N93-R96 PolarHBondContact O-N 2.97Å; R96-A99 PolarHBondContact O-N 3.25Å; R96-W100 PolarHBondContact O-N 2.92Å
97	V	97.8	Very high	96.9	Very high	73 Å²	73	56.6 Å²	56.6	44%	0.442	28%	0.283	S	S	.	.	H	α-helix	trans	-62.5	-45.8	179.6	168.4	0	0	0	0	110.7	N93 W94 E95 A99 W100 V101	N93-V97 VanDerWaalsContact O-CG2 3.28Å; N93-V97 WeakPolarHBondContact O-CG2 3.05Å; N93-V97 PolarHBondContact O-N 2.82Å; W94-V97 PolarHBondContact O-N 3.29Å; E95-V97 PolarHBondContact O-N 2.91Å; V97-A99 PolarHBondContact O-N 3.44Å; V97-W100 PolarHBondContact O-N 3.42Å; V97-V101 HydrophobicContact CG1-CG2 4.33Å; V97-V101 WeakPolarHBondContact O-CB 3.1Å; V97-V101 VanDerWaalsContact O-CG2 3.3Å; V97-V101 WeakPolarHBondContact O-CG2 3.23Å; V97-V101 PolarHBondContact O-N 3.43Å
98	T	97.5	Very high	96.9	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-67.9	-35.5	-179.6	62.8	0	0	0	0	112.1	W94 E95 V101 Y102 T150 N154 L155 Y265	W94-T98 WeakPolarHBondContact O-CB 3.46Å; W94-T98 WeakPolarHBondContact O-CG2 3.44Å; W94-T98 PolarHBondContact O-N 3.43Å; W94-T98 PolarHBondContact O-OG1 3.29Å; W94-T98 VanDerWaalsContact O-OG1 3.11Å; E95-T98 PolarHBondContact O-N 3.44Å; E95-T98 PolarHBondContact O-OG1 2.89Å; T98-V101 PolarHBondContact O-N 2.83Å; T98-Y102 VanDerWaalsContact O-CB 3.27Å; T98-Y102 WeakPolarHBondContact O-CB 3.48Å; T98-Y102 PolarHBondContact O-N 3.22Å; T98-T150 HydrophobicContact CG2-CG2 4Å; T98-N154 HydrophobicContact CG2-CB 3.57Å; T98-N154 WeakPolarHBondContact CG2-ND2 3.29Å; T98-L155 HydrophobicContact CG2-CD2 4.3Å; T98-L155 HydrophobicContact CG2-CG 4.24Å; T98-Y265 PolarHBondContact OG1-OH 2.92Å
99	A	97.8	Very high	96.9	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-60.9	-46.2	173.5	0	0	0	0	0	111.4	L86 E95 R96 V97 G103 Y265	L86-A99 HydrophobicContact CB-CB 3.73Å; E95-A99 WeakPolarHBondContact O-CB 3.44Å; E95-A99 PolarHBondContact O-N 3.46Å; R96-A99 PolarHBondContact O-N 3.25Å; V97-A99 PolarHBondContact O-N 3.44Å; A99-G103 WeakPolarHBondContact O-CA 3.27Å; A99-G103 PolarHBondContact O-N 2.95Å; A99-Y265 WeakPolarHBondContact CA-OH 3.43Å; A99-Y265 HydrophobicContact CB-CE1 4.12Å; A99-Y265 WeakPolarHBondContact CB-OH 3.23Å; A99-Y265 PolarHBondContact N-OH 2.94Å
100	W	98.2	Very high	97	Very high	115 Å²	115	48.8 Å²	48.8	44%	0.436	24%	0.242	S	C	.	.	H	α-helix	trans	-64.5	-48.6	175.8	-82.2	112.4	0	0	0	112.2	M83 H87 R96 V97 L104	M83-W100 HydrophobicContact CE-CZ3 4.01Å; M83-W100 HydrophobicContact SD-CE3 3.91Å; M83-W100 HydrophobicContact SD-CZ3 3.87Å; H87-W100 AromaticContact CE1-NE1 3.48Å; H87-W100 PolarHBondContact CE1-NE1 3.03Å; H87-W100 AromaticContact ND1-CD1 3.94Å; H87-W100 AromaticContact ND1-CE2 3.98Å; H87-W100 AromaticContact ND1-NE1 3.29Å; H87-W100 PolarHBondContact ND1-NE1 3.45Å; R96-W100 PolarHBondContact O-N 2.92Å; V97-W100 PolarHBondContact O-N 3.42Å; W100-L104 HydrophobicContact CE3-CD1 4.09Å; W100-L104 HydrophobicContact CE3-CD2 4.35Å; W100-L104 HydrophobicContact CE3-CG 4.06Å; W100-L104 HydrophobicContact CZ3-CD2 4.45Å; W100-L104 WeakPolarHBondContact O-CB 3.25Å; W100-L104 WeakPolarHBondContact O-CG 3.5Å; W100-L104 PolarHBondContact O-N 3.12Å
101	V	98.4	Very high	97.1	Very high	40 Å²	40	50.8 Å²	50.8	24%	0.242	25%	0.254	C	S	.	.	H	α-helix	trans	-60.6	-50.3	-178.7	168.7	0	0	0	0	111	V97 T98 G105 A147 T150 W170	V97-V101 HydrophobicContact CG1-CG2 4.33Å; V97-V101 WeakPolarHBondContact O-CB 3.1Å; V97-V101 VanDerWaalsContact O-CG2 3.3Å; V97-V101 WeakPolarHBondContact O-CG2 3.23Å; V97-V101 PolarHBondContact O-N 3.43Å; T98-V101 PolarHBondContact O-N 2.83Å; V101-G105 PolarHBondContact O-N 3.05Å; V101-G105 VanDerWaalsContact O-N 3.09Å; V101-A147 HydrophobicContact CG1-CB 4.05Å; V101-T150 HydrophobicContact CB-CG2 4.25Å; V101-T150 HydrophobicContact CG1-CG2 3.89Å; V101-W170 HydrophobicContact CG1-CH2 4.12Å; V101-W170 HydrophobicContact CG1-CZ2 3.69Å
102	Y	98.5	Very high	97.2	Very high	1 Å²	1	46 Å²	46	0%	0.004	23%	0.229	C	C	.	.	H	α-helix	trans	-66.8	-47.7	179.3	175.3	-115.2	0	0	0	112.1	L86 T98 G105 L106 F144 P151 Y257 I260	L86-Y102 HydrophobicContact CD1-CD1 3.68Å; L86-Y102 HydrophobicContact CD1-CE1 4.08Å; T98-Y102 VanDerWaalsContact O-CB 3.27Å; T98-Y102 WeakPolarHBondContact O-CB 3.48Å; T98-Y102 PolarHBondContact O-N 3.22Å; Y102-G105 PolarHBondContact O-N 3.09Å; Y102-L106 WeakPolarHBondContact O-CB 3.4Å; Y102-L106 PolarHBondContact O-N 2.88Å; Y102-F144 HydrophobicContact CE2-CE2 4.05Å; Y102-F144 HydrophobicContact CE2-CZ 4.5Å; Y102-P151 HydrophobicContact CG-CG 4.19Å; Y102-Y257 AromaticContact CE1-CD2 3.62Å; Y102-Y257 HydrophobicContact CE1-CD2 3.62Å; Y102-Y257 HydrophobicContact CE1-CE2 4.31Å; Y102-Y257 HydrophobicContact CE1-CG 4.43Å; Y102-Y257 VanDerWaalsContact OH-CA 3.24Å; Y102-Y257 WeakPolarHBondContact OH-CA 3.34Å; Y102-Y257 WeakPolarHBondContact OH-CB 3.45Å; Y102-Y257 PolarHBondContact OH-N 3.14Å; Y102-I260 HydrophobicContact CD1-CD1 3.93Å; Y102-I260 HydrophobicContact CD2-CD1 3.98Å; Y102-I260 HydrophobicContact CE1-CD1 3.63Å; Y102-I260 HydrophobicContact CE2-CD1 3.71Å; Y102-I260 HydrophobicContact CG-CD1 4.09Å
103	G	98.1	Very high	97.2	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.9	-42.1	-178.2	0	0	0	0	0	113.3	A99 L106 C107	A99-G103 WeakPolarHBondContact O-CA 3.27Å; A99-G103 PolarHBondContact O-N 2.95Å; G103-L106 PolarHBondContact O-N 2.96Å; G103-C107 WeakPolarHBondContact O-CB 3.18Å; G103-C107 PolarHBondContact O-N 3.44Å; G103-C107 PolarHBondContact O-SG 3.37Å
104	L	98.3	Very high	97.2	Very high	93 Å²	93	37.7 Å²	37.7	49%	0.487	19%	0.185	S	C	.	.	H	α-helix	trans	-65.4	-40	173.4	-70.7	172	0	0	0	111.5	M83 W100 C107 A108	M83-L104 HydrophobicContact SD-CD2 3.92Å; M83-L104 HydrophobicContact SD-CG 4.06Å; W100-L104 HydrophobicContact CE3-CD1 4.09Å; W100-L104 HydrophobicContact CE3-CD2 4.35Å; W100-L104 HydrophobicContact CE3-CG 4.06Å; W100-L104 HydrophobicContact CZ3-CD2 4.45Å; W100-L104 WeakPolarHBondContact O-CB 3.25Å; W100-L104 WeakPolarHBondContact O-CG 3.5Å; W100-L104 PolarHBondContact O-N 3.12Å; L104-C107 PolarHBondContact O-N 2.81Å; L104-A108 WeakPolarHBondContact O-CB 3.48Å; L104-A108 PolarHBondContact O-N 2.91Å
105	G	98.2	Very high	97.1	Very high	10 Å²	10	32.7 Å²	32.7	10%	0.103	17%	0.172	C	C	.	.	H	α-helix	trans	-59.6	-45.1	173.9	0	0	0	0	0	112.2	V101 Y102 A108 L109	V101-G105 PolarHBondContact O-N 3.05Å; V101-G105 VanDerWaalsContact O-N 3.09Å; Y102-G105 PolarHBondContact O-N 3.09Å; G105-A108 PolarHBondContact O-N 3.02Å; G105-L109 PolarHBondContact O-N 2.68Å
106	L	98.1	Very high	96.9	Very high	10 Å²	10	31.5 Å²	31.5	5%	0.052	17%	0.167	C	C	.	.	H	α-helix	trans	-66.1	-43.6	178.3	-172.5	66.3	0	0	0	112	A79 Y102 G103 L109 F110 F144 A253 Y257	A79-L106 HydrophobicContact CB-CD2 4.09Å; A79-L106 HydrophobicContact CB-CG 3.92Å; Y102-L106 WeakPolarHBondContact O-CB 3.4Å; Y102-L106 PolarHBondContact O-N 2.88Å; G103-L106 PolarHBondContact O-N 2.96Å; L106-L109 WeakPolarHBondContact O-CB 3.46Å; L106-L109 PolarHBondContact O-N 3.22Å; L106-F110 HydrophobicContact CD1-CD2 4.39Å; L106-F110 HydrophobicContact CD1-CE2 3.56Å; L106-F110 HydrophobicContact CD1-CZ 4.12Å; L106-F110 HydrophobicContact CG-CD2 4.39Å; L106-F110 HydrophobicContact CG-CE2 3.89Å; L106-F110 VanDerWaalsContact O-CD2 3.25Å; L106-F110 WeakPolarHBondContact O-CD2 3.24Å; L106-F110 PolarHBondContact O-N 3.21Å; L106-F144 HydrophobicContact CB-CE2 3.9Å; L106-F144 HydrophobicContact CD1-CE2 3.56Å; L106-F144 HydrophobicContact CD1-CZ 3.61Å; L106-F144 HydrophobicContact CG-CE2 4.35Å; L106-A253 HydrophobicContact CD1-CB 3.96Å; L106-Y257 HydrophobicContact CD2-CD2 4.07Å
107	C	98.3	Very high	96.5	Very high	6 Å²	6	26.3 Å²	26.3	4%	0.041	15%	0.147	C	C	.	.	H	α-helix	trans	-62.8	-45.7	175	-67.1	0	0	0	0	111.1	F80 G103 L104 L109 F110 V111	F80-C107 HydrophobicContact CE1-CB 4.47Å; F80-C107 HydrophobicContact CZ-CB 4.31Å; G103-C107 WeakPolarHBondContact O-CB 3.18Å; G103-C107 PolarHBondContact O-N 3.44Å; G103-C107 PolarHBondContact O-SG 3.37Å; L104-C107 PolarHBondContact O-N 2.81Å; C107-L109 VanDerWaalsContact C-N 3.33Å; C107-L109 PolarHBondContact O-N 3.35Å; C107-F110 PolarHBondContact O-N 3.16Å; C107-V111 WeakPolarHBondContact O-CB 3.33Å; C107-V111 VanDerWaalsContact O-CG2 3.24Å; C107-V111 WeakPolarHBondContact O-CG2 3.17Å; C107-V111 PolarHBondContact O-N 2.93Å
108	A	97.9	Very high	96	Very high	34 Å²	34	26.3 Å²	26.3	28%	0.281	14%	0.144	S	C	.	.	H	α-helix	trans	-60.6	-42.6	179.4	0	0	0	0	0	111.4	L104 G105 F110 V111 V112 V140	L104-A108 WeakPolarHBondContact O-CB 3.48Å; L104-A108 PolarHBondContact O-N 2.91Å; G105-A108 PolarHBondContact O-N 3.02Å; A108-F110 PolarHBondContact O-N 3.3Å; A108-V111 PolarHBondContact O-N 3.15Å; A108-V112 WeakPolarHBondContact O-CB 3.33Å; A108-V112 WeakPolarHBondContact O-CG2 3.43Å; A108-V112 PolarHBondContact O-N 3.21Å; A108-V140 HydrophobicContact CB-CG2 3.62Å
109	L	97.3	Very high	95.5	Very high	7 Å²	7	27.7 Å²	27.7	4%	0.037	15%	0.151	C	C	.	.	H	α-helix	trans	-51.4	-54.9	176.1	177.3	71.1	0	0	0	111.5	G105 L106 C107 S113 V140 I141 F144 V249	G105-L109 PolarHBondContact O-N 2.68Å; L106-L109 WeakPolarHBondContact O-CB 3.46Å; L106-L109 PolarHBondContact O-N 3.22Å; C107-L109 VanDerWaalsContact C-N 3.33Å; C107-L109 PolarHBondContact O-N 3.35Å; L109-S113 WeakPolarHBondContact O-CB 3.27Å; L109-S113 PolarHBondContact O-N 3.17Å; L109-V140 HydrophobicContact CD1-CG1 4.05Å; L109-I141 HydrophobicContact CD1-CG1 4.46Å; L109-F144 HydrophobicContact CB-CD2 4.49Å; L109-F144 HydrophobicContact CB-CG 4.32Å; L109-F144 HydrophobicContact CD1-CD1 4.38Å; L109-F144 HydrophobicContact CD2-CD1 3.69Å; L109-F144 HydrophobicContact CD2-CD2 4.48Å; L109-F144 HydrophobicContact CD2-CE1 3.62Å; L109-F144 HydrophobicContact CD2-CE2 4.45Å; L109-F144 HydrophobicContact CD2-CG 4.12Å; L109-F144 HydrophobicContact CD2-CZ 4.03Å; L109-F144 HydrophobicContact CG-CD1 4.47Å; L109-V249 HydrophobicContact CD2-CG1 4.04Å
110	F	97.5	Very high	94.9	Very high	9 Å²	9	27.9 Å²	27.9	4%	0.039	15%	0.152	C	C	.	.	H	α-helix	trans	-74.8	-38.7	-176.1	-62	-54.2	0	0	0	112.9	H72 L75 I76 A79 L106 C107 A108 T114 A253	H72-F110 HydrophobicContact CB-CD1 4.14Å; H72-F110 AromaticContact CD2-CD1 3.92Å; H72-F110 AromaticContact CG-CD1 3.91Å; L75-F110 HydrophobicContact CB-CD1 3.91Å; L75-F110 HydrophobicContact CB-CD2 3.88Å; L75-F110 HydrophobicContact CB-CE1 3.93Å; L75-F110 HydrophobicContact CB-CE2 3.87Å; L75-F110 HydrophobicContact CB-CG 3.89Å; L75-F110 HydrophobicContact CB-CZ 3.9Å; L75-F110 HydrophobicContact CD1-CD1 4.14Å; L75-F110 HydrophobicContact CD1-CE1 3.54Å; L75-F110 HydrophobicContact CD1-CZ 3.77Å; L75-F110 HydrophobicContact CG-CE1 4.4Å; L75-F110 HydrophobicContact CG-CZ 4.46Å; I76-F110 HydrophobicContact CG1-CB 3.88Å; A79-F110 HydrophobicContact CB-CD2 3.79Å; A79-F110 HydrophobicContact CB-CE2 4.16Å; L106-F110 HydrophobicContact CD1-CD2 4.39Å; L106-F110 HydrophobicContact CD1-CE2 3.56Å; L106-F110 HydrophobicContact CD1-CZ 4.12Å; L106-F110 HydrophobicContact CG-CD2 4.39Å; L106-F110 HydrophobicContact CG-CE2 3.89Å; L106-F110 VanDerWaalsContact O-CD2 3.25Å; L106-F110 WeakPolarHBondContact O-CD2 3.24Å; L106-F110 PolarHBondContact O-N 3.21Å; C107-F110 PolarHBondContact O-N 3.16Å; A108-F110 PolarHBondContact O-N 3.3Å; F110-T114 WeakPolarHBondContact O-CB 3.3Å; F110-T114 PolarHBondContact O-N 3.18Å; F110-T114 PolarHBondContact O-OG1 2.92Å; F110-A253 HydrophobicContact CZ-CB 4.44Å
111	V	97.4	Very high	94.1	Very high	50 Å²	50	27.7 Å²	27.7	30%	0.303	15%	0.151	S	C	.	.	H	α-helix	trans	-67.1	-51.6	-179.8	170.9	0	0	0	0	111	I76 F80 C107 A108 S113 T114 V115	I76-V111 HydrophobicContact CD1-CG2 4.1Å; I76-V111 HydrophobicContact CG1-CG2 4.05Å; I76-V111 HydrophobicContact CG2-CG2 3.83Å; F80-V111 HydrophobicContact CE2-CG2 4.47Å; C107-V111 WeakPolarHBondContact O-CB 3.33Å; C107-V111 VanDerWaalsContact O-CG2 3.24Å; C107-V111 WeakPolarHBondContact O-CG2 3.17Å; C107-V111 PolarHBondContact O-N 2.93Å; A108-V111 PolarHBondContact O-N 3.15Å; V111-S113 VanDerWaalsContact C-N 3.34Å; V111-S113 PolarHBondContact O-N 3.12Å; V111-T114 PolarHBondContact O-N 2.87Å; V111-V115 HydrophobicContact CG1-CG2 4.3Å; V111-V115 WeakPolarHBondContact O-CB 3.27Å; V111-V115 VanDerWaalsContact O-CG2 3.26Å; V111-V115 WeakPolarHBondContact O-CG2 3.39Å; V111-V115 PolarHBondContact O-N 2.94Å
112	V	96	Very high	93.3	Very high	36 Å²	36	34.1 Å²	34.1	22%	0.218	18%	0.176	C	C	.	.	H	α-helix	trans	-62.1	-45	-176.9	174.6	0	0	0	0	110.3	A108 V115 F116 C136 D137 V140	A108-V112 WeakPolarHBondContact O-CB 3.33Å; A108-V112 WeakPolarHBondContact O-CG2 3.43Å; A108-V112 PolarHBondContact O-N 3.21Å; V112-V115 PolarHBondContact O-N 3.5Å; V112-F116 WeakPolarHBondContact O-CB 3.28Å; V112-F116 PolarHBondContact O-N 2.98Å; V112-C136 HydrophobicContact CG1-CB 3.78Å; V112-D137 HydrophobicContact CG1-CB 4.33Å; V112-V140 HydrophobicContact CB-CB 4.5Å; V112-V140 HydrophobicContact CB-CG1 4.41Å; V112-V140 HydrophobicContact CG2-CG2 4.33Å
113	S	94	Very high	92.1	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.007	20%	0.201	C	C	.	.	H	α-helix	trans	-63.5	-43.5	178	-175	0	0	0	0	112.7	H72 L109 V111 V115 F116 H117 D137	H72-S113 PolarHBondContact CE1-OG 2.84Å; H72-S113 WeakPolarHBondContact ND1-CB 3.25Å; H72-S113 PolarHBondContact ND1-OG 2.73Å; L109-S113 WeakPolarHBondContact O-CB 3.27Å; L109-S113 PolarHBondContact O-N 3.17Å; V111-S113 VanDerWaalsContact C-N 3.34Å; V111-S113 PolarHBondContact O-N 3.12Å; S113-V115 PolarHBondContact O-N 3.13Å; S113-F116 WeakPolarHBondContact O-CB 3.5Å; S113-F116 PolarHBondContact O-N 3.05Å; S113-H117 PolarHBondContact O-CD2 3.35Å; S113-H117 PolarHBondContact O-N 3.41Å; S113-D137 WeakPolarHBondContact CA-OD1 3.39Å; S113-D137 WeakPolarHBondContact CB-OD1 3.31Å; S113-D137 PolarHBondContact OG-OD1 3.02Å
114	T	94.3	Very high	90.6	Very high	8 Å²	8	43.6 Å²	43.6	5%	0.049	23%	0.227	C	C	.	.	H	α-helix	trans	-61.4	-47.7	175.5	-61.2	0	0	0	0	111.4	A73 I76 F110 V111 F116 H117 I118	A73-T114 WeakPolarHBondContact CA-OG1 3.18Å; A73-T114 HydrophobicContact CB-CG2 3.69Å; A73-T114 PolarHBondContact N-OG1 3.16Å; I76-T114 HydrophobicContact CD1-CG2 4.19Å; F110-T114 WeakPolarHBondContact O-CB 3.3Å; F110-T114 PolarHBondContact O-N 3.18Å; F110-T114 PolarHBondContact O-OG1 2.92Å; V111-T114 PolarHBondContact O-N 2.87Å; T114-F116 VanDerWaalsContact C-N 3.32Å; T114-F116 PolarHBondContact O-N 3.33Å; T114-H117 PolarHBondContact O-N 3.49Å; T114-I118 HydrophobicContact CG2-CD1 3.7Å; T114-I118 HydrophobicContact CG2-CG1 4.39Å; T114-I118 VanDerWaalsContact O-CG1 3.28Å; T114-I118 WeakPolarHBondContact O-CG1 3.11Å; T114-I118 PolarHBondContact O-N 2.91Å
115	V	93.2	Very high	89.3	Confident	51 Å²	51	47.9 Å²	47.9	31%	0.309	24%	0.244	S	C	.	.	H	α-helix	trans	-61.1	-43.5	179	170.7	0	0	0	0	110.6	V111 V112 S113 I118 I119 F133	V111-V115 HydrophobicContact CG1-CG2 4.3Å; V111-V115 WeakPolarHBondContact O-CB 3.27Å; V111-V115 VanDerWaalsContact O-CG2 3.26Å; V111-V115 WeakPolarHBondContact O-CG2 3.39Å; V111-V115 PolarHBondContact O-N 2.94Å; V112-V115 PolarHBondContact O-N 3.5Å; S113-V115 PolarHBondContact O-N 3.13Å; V115-I118 PolarHBondContact O-N 3.19Å; V115-I119 HydrophobicContact CG1-CD1 3.58Å; V115-I119 HydrophobicContact CG1-CG1 4.28Å; V115-I119 WeakPolarHBondContact O-CB 3.48Å; V115-I119 VanDerWaalsContact O-CG1 3.27Å; V115-I119 WeakPolarHBondContact O-CG1 3.32Å; V115-I119 PolarHBondContact O-N 2.9Å; V115-F133 HydrophobicContact CG1-CD1 3.72Å; V115-F133 HydrophobicContact CG1-CE1 3.39Å; V115-F133 HydrophobicContact CG1-CZ 4.08Å
116	F	90.4	Very high	88.3	Confident	4 Å²	4	51.8 Å²	51.8	2%	0.018	26%	0.261	C	S	.	.	H	α-helix	trans	-57.3	-50.7	175.3	165.5	-116.5	0	0	0	112.1	V112 S113 T114 I118 I119 T120 F133 H134 D137	V112-F116 WeakPolarHBondContact O-CB 3.28Å; V112-F116 PolarHBondContact O-N 2.98Å; S113-F116 WeakPolarHBondContact O-CB 3.5Å; S113-F116 PolarHBondContact O-N 3.05Å; T114-F116 VanDerWaalsContact C-N 3.32Å; T114-F116 PolarHBondContact O-N 3.33Å; F116-I118 VanDerWaalsContact C-N 3.35Å; F116-I118 PolarHBondContact O-N 3.18Å; F116-I119 PolarHBondContact O-N 3.2Å; F116-T120 HydrophobicContact CD2-CG2 3.59Å; F116-T120 HydrophobicContact CE2-CG2 3.29Å; F116-T120 HydrophobicContact CG-CG2 4.39Å; F116-T120 HydrophobicContact CZ-CG2 3.92Å; F116-T120 WeakPolarHBondContact O-CB 3.25Å; F116-T120 WeakPolarHBondContact O-CG2 3.32Å; F116-T120 PolarHBondContact O-N 3.1Å; F116-T120 PolarHBondContact O-OG1 3.29Å; F116-F133 HydrophobicContact CB-CB 4.19Å; F116-F133 HydrophobicContact CD2-CB 3.92Å; F116-H134 HydrophobicContact CD2-CB 4.18Å; F116-H134 VanDerWaalsContact CE2-CA 3.46Å; F116-H134 HydrophobicContact CE2-CB 3.45Å; F116-H134 VanDerWaalsContact CE2-CB 3.45Å; F116-H134 AromaticContact CE2-CD2 3.89Å; F116-H134 AromaticContact CE2-CG 3.93Å; F116-H134 HydrophobicContact CZ-CB 3.92Å; F116-H134 AromaticContact CZ-CD2 3.38Å; F116-H134 WeakPolarHBondContact CZ-CD2 3.06Å; F116-H134 AromaticContact CZ-CG 3.86Å; F116-D137 HydrophobicContact CB-CB 4.27Å; F116-D137 HydrophobicContact CD1-CB 4.1Å; F116-D137 HydrophobicContact CG-CB 4.18Å
117	H	89.1	Confident	87.4	Confident	4 Å²	4	60.9 Å²	60.9	2%	0.019	30%	0.295	C	S	.	.	H	α-helix	trans	-67	-33.4	-179.9	-75.2	-67.1	0	0	0	113.4	N68 C69 S113 T114 T120 W121 H242 H246	N68-H117 HydrophobicContact CB-CB 4.46Å; C69-H117 VanDerWaalsContact SG-C 3.56Å; C69-H117 WeakPolarHBondContact SG-CB 3.5Å; S113-H117 PolarHBondContact O-CD2 3.35Å; S113-H117 PolarHBondContact O-N 3.41Å; T114-H117 PolarHBondContact O-N 3.49Å; H117-T120 VanDerWaalsContact CA-OG1 3.27Å; H117-T120 WeakPolarHBondContact CA-OG1 3.31Å; H117-T120 PolarHBondContact O-OG1 3.07Å; H117-W121 VanDerWaalsContact O-CB 3.29Å; H117-W121 WeakPolarHBondContact O-CB 3.49Å; H117-W121 PolarHBondContact O-N 3.47Å; H117-W121 VanDerWaalsContact O-N 3.11Å; H117-H242 AromaticContact CE1-CD2 3.97Å; H117-H242 AromaticContact CE1-NE2 3.93Å; H117-H242 AromaticContact NE2-NE2 3.88Å; H117-H246 AromaticContact CD2-CE1 3.66Å; H117-H246 AromaticContact NE2-CE1 3.28Å; H117-H246 PolarHBondContact NE2-CE1 2.88Å; H117-H246 VanDerWaalsContact NE2-CE1 3.28Å; H117-H246 AromaticContact NE2-NE2 3.71Å
118	I	88.7	Confident	86.6	Confident	74 Å²	74	65.1 Å²	65.1	38%	0.379	32%	0.324	S	S	.	.	H	α-helix	trans	-67.4	-44.6	174.1	-69.4	170.9	0	0	0	111.2	T114 V115 F116 W121 K122	T114-I118 HydrophobicContact CG2-CD1 3.7Å; T114-I118 HydrophobicContact CG2-CG1 4.39Å; T114-I118 VanDerWaalsContact O-CG1 3.28Å; T114-I118 WeakPolarHBondContact O-CG1 3.11Å; T114-I118 PolarHBondContact O-N 2.91Å; V115-I118 PolarHBondContact O-N 3.19Å; F116-I118 VanDerWaalsContact C-N 3.35Å; F116-I118 PolarHBondContact O-N 3.18Å; I118-W121 PolarHBondContact O-N 3.49Å; I118-K122 HydrophobicContact CG2-CD 4.49Å; I118-K122 WeakPolarHBondContact O-CB 3.35Å; I118-K122 PolarHBondContact O-N 3.41Å
119	I	86.6	Confident	85.9	Confident	29 Å²	29	65.8 Å²	65.8	15%	0.149	33%	0.325	C	S	.	.	H	α-helix	trans	-66.8	-45.3	-178.8	-72.3	174.8	0	0	0	110.7	V115 F116 W121 K122 K123 V129 F133	V115-I119 HydrophobicContact CG1-CD1 3.58Å; V115-I119 HydrophobicContact CG1-CG1 4.28Å; V115-I119 WeakPolarHBondContact O-CB 3.48Å; V115-I119 VanDerWaalsContact O-CG1 3.27Å; V115-I119 WeakPolarHBondContact O-CG1 3.32Å; V115-I119 PolarHBondContact O-N 2.9Å; F116-I119 PolarHBondContact O-N 3.2Å; I119-W121 VanDerWaalsContact C-N 3.26Å; I119-W121 PolarHBondContact O-N 3.24Å; I119-K122 PolarHBondContact O-N 3.49Å; I119-K123 CarbonylContact O-C 3.57Å; I119-K123 WeakPolarHBondContact O-CA 3.49Å; I119-K123 PolarHBondContact O-N 2.84Å; I119-V129 HydrophobicContact CG2-CG1 4.06Å; I119-F133 HydrophobicContact CD1-CD1 4.01Å; I119-F133 HydrophobicContact CD1-CD2 3.4Å; I119-F133 HydrophobicContact CD1-CE1 3.86Å; I119-F133 HydrophobicContact CD1-CE2 3.24Å; I119-F133 HydrophobicContact CD1-CG 3.79Å; I119-F133 HydrophobicContact CD1-CZ 3.48Å; I119-F133 VanDerWaalsContact CD1-CZ 3.48Å; I119-F133 HydrophobicContact CG2-CD2 4.4Å
120	T	83.9	Confident	85.2	Confident	4 Å²	4	67.2 Å²	67.2	3%	0.025	33%	0.331	C	S	.	.	H	α-helix	trans	-61.2	-36.4	177.6	52.6	0	0	0	0	111.8	H65 F116 H117 E130	H65-T120 PolarHBondContact CE1-OG1 2.97Å; H65-T120 VanDerWaalsContact CE1-OG1 3.25Å; F116-T120 HydrophobicContact CD2-CG2 3.59Å; F116-T120 HydrophobicContact CE2-CG2 3.29Å; F116-T120 HydrophobicContact CG-CG2 4.39Å; F116-T120 HydrophobicContact CZ-CG2 3.92Å; F116-T120 WeakPolarHBondContact O-CB 3.25Å; F116-T120 WeakPolarHBondContact O-CG2 3.32Å; F116-T120 PolarHBondContact O-N 3.1Å; F116-T120 PolarHBondContact O-OG1 3.29Å; H117-T120 VanDerWaalsContact CA-OG1 3.27Å; H117-T120 WeakPolarHBondContact CA-OG1 3.31Å; H117-T120 PolarHBondContact O-OG1 3.07Å; T120-E130 HydrophobicContact CG2-CG 3.44Å; T120-E130 VanDerWaalsContact CG2-CG 3.44Å
121	W	82.2	Confident	84.6	Confident	110 Å²	110	71.9 Å²	71.9	42%	0.417	35%	0.353	S	S	.	.	H	α-helix	trans	-72.8	-49.3	175.9	-172	3.7	0	0	0	112.8	V62 H65 A66 H117 I118 I119	V62-W121 HydrophobicContact CG1-CZ2 3.89Å; H65-W121 HydrophobicContact CB-CB 4.48Å; H65-W121 HydrophobicContact CB-CD2 4.13Å; H65-W121 HydrophobicContact CB-CE3 4.24Å; H65-W121 HydrophobicContact CB-CG 4.25Å; A66-W121 HydrophobicContact CB-CH2 3.57Å; A66-W121 HydrophobicContact CB-CZ3 3.74Å; H117-W121 VanDerWaalsContact O-CB 3.29Å; H117-W121 WeakPolarHBondContact O-CB 3.49Å; H117-W121 PolarHBondContact O-N 3.47Å; H117-W121 VanDerWaalsContact O-N 3.11Å; I118-W121 PolarHBondContact O-N 3.49Å; I119-W121 VanDerWaalsContact C-N 3.26Å; I119-W121 PolarHBondContact O-N 3.24Å
122	K	80.6	Confident	84.1	Confident	175 Å²	175	72.3 Å²	72.3	76%	0.761	36%	0.358	S	S	*	.	H	α-helix	trans	-86.5	-27.3	-172.2	-71.9	-165.5	173.8	-172.5	0	115.1	I118 I119	I118-K122 HydrophobicContact CG2-CD 4.49Å; I118-K122 WeakPolarHBondContact O-CB 3.35Å; I118-K122 PolarHBondContact O-N 3.41Å; I119-K122 PolarHBondContact O-N 3.49Å
123	K	74.9	Confident	83.8	Confident	123 Å²	123	73.7 Å²	73.7	54%	0.535	36%	0.361	S	S	.	.			trans	-127.9	39.7	-171.6	-70.2	-170.1	174.7	-175.1	0	112.6	I119 H125 M126	I119-K123 CarbonylContact O-C 3.57Å; I119-K123 WeakPolarHBondContact O-CA 3.49Å; I119-K123 PolarHBondContact O-N 2.84Å; K123-H125 PolarHBondContact O-N 2.94Å; K123-M126 HydrophobicContact CD-SD 4.14Å; K123-M126 PolarHBondContact O-N 3.07Å
124	S	66	Low	83.5	Confident	78 Å²	78	74.3 Å²	74.3	55%	0.545	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-20	179	-179	0	0	0	0	114.6	M126	S124-M126 VanDerWaalsContact C-N 3.31Å; S124-M126 PolarHBondContact O-N 3.14Å
125	H	71.4	Confident	83.3	Confident	183 Å²	183	75.6 Å²	75.6	85%	0.847	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-20	176.2	-167	-82.8	0	0	0	113.8	K123 R127	K123-H125 PolarHBondContact O-N 2.94Å; H125-R127 PolarHBondContact O-N 3.3Å
126	M	77.6	Confident	83.3	Confident	92 Å²	92	75.4 Å²	75.4	45%	0.453	37%	0.37	S	S	.	.			trans	-97.2	74.5	-177.3	-65.2	-177.6	77.2	0	0	111.8	K123 S124 S128 V129 E130	K123-M126 HydrophobicContact CD-SD 4.14Å; K123-M126 PolarHBondContact O-N 3.07Å; S124-M126 VanDerWaalsContact C-N 3.31Å; S124-M126 PolarHBondContact O-N 3.14Å; M126-S128 VanDerWaalsContact C-N 3.3Å; M126-S128 PolarHBondContact O-N 2.95Å; M126-V129 HydrophobicContact CB-CB 4.21Å; M126-V129 HydrophobicContact CB-CG2 4.26Å; M126-V129 HydrophobicContact CE-CG2 3.72Å; M126-V129 PolarHBondContact O-N 2.68Å; M126-V129 VanDerWaalsContact O-N 3.13Å; M126-E130 PolarHBondContact O-N 3.35Å; M126-E130 VanDerWaalsContact O-N 3.11Å
127	R	78.9	Confident	83.4	Confident	201 Å²	201	75.7 Å²	75.7	76%	0.758	37%	0.372	S	S	*	.	H	α-helix	trans	-52.8	-40.8	-174.6	-68.2	-174.1	-179.8	167.6	1.3	114.4	H125 V129 E130 Q131	H125-R127 PolarHBondContact O-N 3.3Å; R127-V129 PolarHBondContact O-N 3Å; R127-E130 WeakPolarHBondContact O-CB 3.22Å; R127-E130 PolarHBondContact O-N 3.5Å; R127-Q131 VanDerWaalsContact O-CG 3.3Å; R127-Q131 WeakPolarHBondContact O-CG 3.3Å; R127-Q131 PolarHBondContact O-N 3.3Å
128	S	81.6	Confident	83.6	Confident	94 Å²	94	76.6 Å²	76.6	66%	0.657	38%	0.375	S	S	*	.	H	α-helix	trans	-66.6	-38.2	-178.6	-48.8	0	0	0	0	113.1	M126 C132	M126-S128 VanDerWaalsContact C-N 3.3Å; M126-S128 PolarHBondContact O-N 2.95Å; S128-C132 PolarHBondContact O-N 3.44Å; S128-C132 VanDerWaalsContact O-N 3.1Å
129	V	82.9	Confident	83.9	Confident	49 Å²	49	73.9 Å²	73.9	30%	0.297	36%	0.362	S	S	.	.	H	α-helix	trans	-69.5	-44.2	177.5	177.5	0	0	0	0	109.4	I119 M126 R127 Q131 C132 F133	I119-V129 HydrophobicContact CG2-CG1 4.06Å; M126-V129 HydrophobicContact CB-CB 4.21Å; M126-V129 HydrophobicContact CB-CG2 4.26Å; M126-V129 HydrophobicContact CE-CG2 3.72Å; M126-V129 PolarHBondContact O-N 2.68Å; M126-V129 VanDerWaalsContact O-N 3.13Å; R127-V129 PolarHBondContact O-N 3Å; V129-Q131 VanDerWaalsContact C-N 3.32Å; V129-Q131 PolarHBondContact O-N 3.44Å; V129-C132 PolarHBondContact O-N 3.31Å; V129-F133 HydrophobicContact CG1-CD2 3.7Å; V129-F133 HydrophobicContact CG1-CE2 3.69Å; V129-F133 VanDerWaalsContact O-CD2 3.32Å; V129-F133 WeakPolarHBondContact O-CD2 3.41Å; V129-F133 PolarHBondContact O-N 3.2Å
130	E	83.1	Confident	84.4	Confident	36 Å²	36	73.1 Å²	73.1	17%	0.168	36%	0.358	C	S	.	.	H	α-helix	trans	-56.1	-45.7	176.1	-162.6	-171.2	151.3	0	0	112.4	R57 T120 M126 R127 F133 H134	R57-E130 IonicContact CZ-OE1 2.94Å; R57-E130 IonicContact NH1-OE1 3.39Å; R57-E130 PolarHBondContact NH1-OE1 2.95Å; R57-E130 IonicContact NH2-OE1 3.9Å; T120-E130 HydrophobicContact CG2-CG 3.44Å; T120-E130 VanDerWaalsContact CG2-CG 3.44Å; M126-E130 PolarHBondContact O-N 3.35Å; M126-E130 VanDerWaalsContact O-N 3.11Å; R127-E130 WeakPolarHBondContact O-CB 3.22Å; R127-E130 PolarHBondContact O-N 3.5Å; E130-F133 PolarHBondContact O-N 2.98Å; E130-H134 WeakPolarHBondContact O-CB 3.21Å; E130-H134 PolarHBondContact O-N 2.96Å
131	Q	84.8	Confident	84.9	Confident	107 Å²	107	74.4 Å²	74.4	50%	0.5	37%	0.365	S	S	.	.	H	α-helix	trans	-63.1	-42.3	176.5	-75.1	174.3	-34.8	0	0	112.4	R127 V129 H134 M135	R127-Q131 VanDerWaalsContact O-CG 3.3Å; R127-Q131 WeakPolarHBondContact O-CG 3.3Å; R127-Q131 PolarHBondContact O-N 3.3Å; V129-Q131 VanDerWaalsContact C-N 3.32Å; V129-Q131 PolarHBondContact O-N 3.44Å; Q131-H134 WeakPolarHBondContact O-CB 3.5Å; Q131-H134 PolarHBondContact O-N 3.46Å; Q131-M135 WeakPolarHBondContact O-CG 3.37Å; Q131-M135 PolarHBondContact O-N 3.41Å
132	C	86.7	Confident	85.6	Confident	59 Å²	59	69.2 Å²	69.2	40%	0.399	35%	0.345	S	S	.	.	H	α-helix	trans	-60.5	-50.5	177.4	-174.5	0	0	0	0	111.5	S128 V129 H134 M135 C136	S128-C132 PolarHBondContact O-N 3.44Å; S128-C132 VanDerWaalsContact O-N 3.1Å; V129-C132 PolarHBondContact O-N 3.31Å; C132-H134 VanDerWaalsContact C-N 3.29Å; C132-H134 PolarHBondContact O-N 3.31Å; C132-M135 WeakPolarHBondContact O-CB 3.28Å; C132-M135 PolarHBondContact O-N 3.31Å; C132-M135 VanDerWaalsContact O-N 3.13Å; C132-C136 PolarHBondContact O-N 2.7Å; C132-C136 PolarHBondContact O-SG 3.33Å
133	F	88.1	Confident	86.5	Confident	65 Å²	65	64.9 Å²	64.9	29%	0.285	33%	0.327	S	S	.	.	H	α-helix	trans	-66.1	-32.4	178.2	-79.9	-79.5	0	0	0	112.7	V115 F116 I119 V129 E130 C136 D137	V115-F133 HydrophobicContact CG1-CD1 3.72Å; V115-F133 HydrophobicContact CG1-CE1 3.39Å; V115-F133 HydrophobicContact CG1-CZ 4.08Å; F116-F133 HydrophobicContact CB-CB 4.19Å; F116-F133 HydrophobicContact CD2-CB 3.92Å; I119-F133 HydrophobicContact CD1-CD1 4.01Å; I119-F133 HydrophobicContact CD1-CD2 3.4Å; I119-F133 HydrophobicContact CD1-CE1 3.86Å; I119-F133 HydrophobicContact CD1-CE2 3.24Å; I119-F133 HydrophobicContact CD1-CG 3.79Å; I119-F133 HydrophobicContact CD1-CZ 3.48Å; I119-F133 VanDerWaalsContact CD1-CZ 3.48Å; I119-F133 HydrophobicContact CG2-CD2 4.4Å; V129-F133 HydrophobicContact CG1-CD2 3.7Å; V129-F133 HydrophobicContact CG1-CE2 3.69Å; V129-F133 VanDerWaalsContact O-CD2 3.32Å; V129-F133 WeakPolarHBondContact O-CD2 3.41Å; V129-F133 PolarHBondContact O-N 3.2Å; E130-F133 PolarHBondContact O-N 2.98Å; F133-C136 PolarHBondContact O-N 3.34Å; F133-D137 WeakPolarHBondContact O-CB 3.07Å; F133-D137 PolarHBondContact O-N 3.43Å
134	H	89.3	Confident	87.6	Confident	14 Å²	14	59.5 Å²	59.5	7%	0.065	30%	0.303	C	S	.	.	H	α-helix	trans	-63.5	-43.4	171.7	-170.9	-144.6	0	0	0	111.6	F116 E130 Q131 C132 D137 R138 H184 E185	F116-H134 HydrophobicContact CD2-CB 4.18Å; F116-H134 VanDerWaalsContact CE2-CA 3.46Å; F116-H134 HydrophobicContact CE2-CB 3.45Å; F116-H134 VanDerWaalsContact CE2-CB 3.45Å; F116-H134 AromaticContact CE2-CD2 3.89Å; F116-H134 AromaticContact CE2-CG 3.93Å; F116-H134 HydrophobicContact CZ-CB 3.92Å; F116-H134 AromaticContact CZ-CD2 3.38Å; F116-H134 WeakPolarHBondContact CZ-CD2 3.06Å; F116-H134 AromaticContact CZ-CG 3.86Å; E130-H134 WeakPolarHBondContact O-CB 3.21Å; E130-H134 PolarHBondContact O-N 2.96Å; Q131-H134 WeakPolarHBondContact O-CB 3.5Å; Q131-H134 PolarHBondContact O-N 3.46Å; C132-H134 VanDerWaalsContact C-N 3.29Å; C132-H134 PolarHBondContact O-N 3.31Å; H134-D137 PolarHBondContact O-N 3.42Å; H134-R138 PolarHBondContact NE2-NH1 3.48Å; H134-R138 VanDerWaalsContact O-CG 3.3Å; H134-R138 WeakPolarHBondContact O-CG 3.31Å; H134-R138 PolarHBondContact O-N 3.33Å; H134-R138 VanDerWaalsContact O-N 3.11Å; H134-H184 AromaticContact CE1-CE1 3.87Å; H134-H184 AromaticContact CE1-NE2 3.98Å; H134-H184 AromaticContact CG-CE1 3.84Å; H134-H184 AromaticContact ND1-CE1 3.14Å; H134-H184 PolarHBondContact ND1-CE1 2.81Å; H134-H184 AromaticContact ND1-NE2 3.15Å; H134-H184 PolarHBondContact ND1-NE2 3.35Å; H134-H184 VanDerWaalsContact ND1-NE2 3.15Å; H134-E185 VanDerWaalsContact CE1-CD 3.43Å; H134-E185 IonicContact CE1-OE1 2.67Å; H134-E185 IonicContact CE1-OE2 2.78Å; H134-E185 IonicContact ND1-OE2 3.18Å
135	M	89.6	Confident	89.1	Confident	35 Å²	35	57 Å²	57	17%	0.172	28%	0.284	C	S	.	.	H	α-helix	trans	-61	-45.6	173.8	-72.9	-172.5	-63.3	0	0	111	Q131 C132 D137 R138 V139 V180 F181 H184	Q131-M135 WeakPolarHBondContact O-CG 3.37Å; Q131-M135 PolarHBondContact O-N 3.41Å; C132-M135 WeakPolarHBondContact O-CB 3.28Å; C132-M135 PolarHBondContact O-N 3.31Å; C132-M135 VanDerWaalsContact O-N 3.13Å; M135-D137 VanDerWaalsContact C-N 3.34Å; M135-D137 PolarHBondContact O-N 2.99Å; M135-R138 PolarHBondContact O-N 2.89Å; M135-V139 WeakPolarHBondContact O-CB 3.27Å; M135-V139 VanDerWaalsContact O-CG2 3.27Å; M135-V139 WeakPolarHBondContact O-CG2 3.22Å; M135-V139 PolarHBondContact O-N 3.38Å; M135-V180 HydrophobicContact CB-CG1 3.92Å; M135-V180 HydrophobicContact CG-CG1 3.94Å; M135-F181 HydrophobicContact CE-CD1 4.22Å; M135-F181 HydrophobicContact CE-CE1 4.16Å; M135-F181 HydrophobicContact SD-CD1 3.83Å; M135-F181 HydrophobicContact SD-CE1 4.2Å; M135-H184 VanDerWaalsContact CG-CE1 3.47Å; M135-H184 WeakPolarHBondContact CG-CE1 3.08Å; M135-H184 VanDerWaalsContact CG-ND1 3.26Å; M135-H184 WeakPolarHBondContact CG-ND1 3.19Å
136	C	92.4	Very high	90.3	Very high	47 Å²	47	48.3 Å²	48.3	32%	0.318	24%	0.243	S	C	.	.	H	α-helix	trans	-58.3	-44.1	176.9	-66.4	0	0	0	0	112.3	V112 C132 F133 R138 V139 V140	V112-C136 HydrophobicContact CG1-CB 3.78Å; C132-C136 PolarHBondContact O-N 2.7Å; C132-C136 PolarHBondContact O-SG 3.33Å; F133-C136 PolarHBondContact O-N 3.34Å; C136-R138 VanDerWaalsContact C-N 3.3Å; C136-R138 PolarHBondContact O-N 3.19Å; C136-V139 PolarHBondContact O-N 3.45Å; C136-V140 PolarHBondContact O-N 3.17Å
137	D	92.7	Very high	91.3	Very high	11 Å²	11	44 Å²	44	6%	0.059	22%	0.223	C	C	.	.	H	α-helix	trans	-62.1	-36.1	177.3	-174.7	63.6	0	0	0	112.3	V112 S113 F116 F133 H134 M135 V140	V112-D137 HydrophobicContact CG1-CB 4.33Å; S113-D137 WeakPolarHBondContact CA-OD1 3.39Å; S113-D137 WeakPolarHBondContact CB-OD1 3.31Å; S113-D137 PolarHBondContact OG-OD1 3.02Å; F116-D137 HydrophobicContact CB-CB 4.27Å; F116-D137 HydrophobicContact CD1-CB 4.1Å; F116-D137 HydrophobicContact CG-CB 4.18Å; F133-D137 WeakPolarHBondContact O-CB 3.07Å; F133-D137 PolarHBondContact O-N 3.43Å; H134-D137 PolarHBondContact O-N 3.42Å; M135-D137 VanDerWaalsContact C-N 3.34Å; M135-D137 PolarHBondContact O-N 2.99Å; D137-V140 WeakPolarHBondContact O-CG1 3.34Å
138	R	92.8	Very high	92.2	Very high	22 Å²	22	35.1 Å²	35.1	8%	0.083	19%	0.191	C	C	.	.	H	α-helix	trans	-75.1	-37.2	175.1	-62.4	176.5	88.3	87.5	17.9	112.8	H134 M135 C136 Y142 V180 E191 Y195	H134-R138 PolarHBondContact NE2-NH1 3.48Å; H134-R138 VanDerWaalsContact O-CG 3.3Å; H134-R138 WeakPolarHBondContact O-CG 3.31Å; H134-R138 PolarHBondContact O-N 3.33Å; H134-R138 VanDerWaalsContact O-N 3.11Å; M135-R138 PolarHBondContact O-N 2.89Å; C136-R138 VanDerWaalsContact C-N 3.3Å; C136-R138 PolarHBondContact O-N 3.19Å; R138-Y142 WeakPolarHBondContact O-CD2 3.25Å; R138-V180 HydrophobicContact CB-CG1 4.21Å; R138-V180 HydrophobicContact CB-CG2 4.13Å; R138-E191 IonicContact CZ-OE1 2.64Å; R138-E191 IonicContact CZ-OE2 3.83Å; R138-E191 VanDerWaalsContact NE-CD 3.32Å; R138-E191 IonicContact NE-OE1 3.21Å; R138-E191 PolarHBondContact NE-OE1 2.92Å; R138-E191 IonicContact NE-OE2 3.5Å; R138-E191 PolarHBondContact NE-OE2 3.35Å; R138-E191 IonicContact NH2-OE1 3.9Å; R138-E191 PolarHBondContact NH2-OE1 2.89Å; R138-E191 IonicContact NH2-OE2 3.79Å; R138-E191 PolarHBondContact NH2-OE2 2.88Å; R138-Y195 PolarHBondContact O-OH 3.06Å
139	V	95.6	Very high	92.9	Very high	18 Å²	18	32.5 Å²	32.5	11%	0.109	17%	0.167	C	C	.	.	H	α-helix	trans	-65.9	-40.5	177	169.5	0	0	0	0	110.9	M135 C136 I141 Y142 F143 T177 V180 F181	M135-V139 WeakPolarHBondContact O-CB 3.27Å; M135-V139 VanDerWaalsContact O-CG2 3.27Å; M135-V139 WeakPolarHBondContact O-CG2 3.22Å; M135-V139 PolarHBondContact O-N 3.38Å; C136-V139 PolarHBondContact O-N 3.45Å; V139-I141 PolarHBondContact O-N 2.82Å; V139-Y142 WeakPolarHBondContact O-CB 3.41Å; V139-Y142 PolarHBondContact O-N 2.9Å; V139-F143 HydrophobicContact CG1-CD2 3.67Å; V139-F143 HydrophobicContact CG1-CE2 3.63Å; V139-F143 PolarHBondContact O-N 2.87Å; V139-T177 HydrophobicContact CG1-CG2 4Å; V139-T177 HydrophobicContact CG2-CG2 4.08Å; V139-V180 HydrophobicContact CG2-CB 3.97Å; V139-V180 HydrophobicContact CG2-CG1 3.92Å; V139-V180 HydrophobicContact CG2-CG2 4.32Å; V139-F181 HydrophobicContact CG2-CE2 4.41Å
140	V	96.9	Very high	93.6	Very high	12 Å²	12	30.5 Å²	30.5	7%	0.073	16%	0.155	C	C	.	.	H	α-helix	trans	-62.5	-30.4	-176.3	89.1	0	0	0	0	112.3	A108 L109 V112 C136 D137 Y142 F143 F144	A108-V140 HydrophobicContact CB-CG2 3.62Å; L109-V140 HydrophobicContact CD1-CG1 4.05Å; V112-V140 HydrophobicContact CB-CB 4.5Å; V112-V140 HydrophobicContact CB-CG1 4.41Å; V112-V140 HydrophobicContact CG2-CG2 4.33Å; C136-V140 PolarHBondContact O-N 3.17Å; D137-V140 WeakPolarHBondContact O-CG1 3.34Å; V140-Y142 VanDerWaalsContact C-N 3.34Å; V140-Y142 PolarHBondContact O-N 3.43Å; V140-F143 PolarHBondContact O-N 2.81Å; V140-F144 VanDerWaalsContact O-CB 3.25Å; V140-F144 WeakPolarHBondContact O-CB 3.33Å; V140-F144 PolarHBondContact O-N 3.34Å
141	I	96	Very high	94.2	Very high	32 Å²	32	28.8 Å²	28.8	16%	0.164	15%	0.147	C	C	.	.	H	α-helix	trans	-60.8	-43.4	174.7	-61.3	169.9	0	0	0	110.7	L109 V139 F144 I145 Y195 W245	L109-I141 HydrophobicContact CD1-CG1 4.46Å; V139-I141 PolarHBondContact O-N 2.82Å; I141-F144 PolarHBondContact O-N 3.45Å; I141-I145 HydrophobicContact CG2-CD1 3.98Å; I141-I145 VanDerWaalsContact O-CG1 3.27Å; I141-I145 WeakPolarHBondContact O-CG1 3.21Å; I141-I145 PolarHBondContact O-N 3.18Å; I141-Y195 HydrophobicContact CB-CE1 3.83Å; I141-Y195 HydrophobicContact CG2-CD1 3.78Å; I141-Y195 HydrophobicContact CG2-CE1 3.5Å; I141-Y195 HydrophobicContact CG2-CG 4.43Å; I141-W245 HydrophobicContact CD1-CH2 4.2Å; I141-W245 HydrophobicContact CD1-CZ2 4.27Å
142	Y	96.9	Very high	94.7	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-62	-47.2	177.7	-71.7	-67.2	0	0	0	112.4	R138 V139 V140 F144 I145 A146 V180 E191 F194 Y195 M198	R138-Y142 WeakPolarHBondContact O-CD2 3.25Å; V139-Y142 WeakPolarHBondContact O-CB 3.41Å; V139-Y142 PolarHBondContact O-N 2.9Å; V140-Y142 VanDerWaalsContact C-N 3.34Å; V140-Y142 PolarHBondContact O-N 3.43Å; Y142-F144 VanDerWaalsContact C-N 3.34Å; Y142-I145 PolarHBondContact O-N 2.87Å; Y142-A146 PolarHBondContact O-N 3.08Å; Y142-V180 HydrophobicContact CD2-CG2 4.46Å; Y142-V180 HydrophobicContact CE2-CG2 3.76Å; Y142-E191 WeakPolarHBondContact OH-CG 3.26Å; Y142-F194 HydrophobicContact CE1-CB 3.73Å; Y142-Y195 AromaticContact CD1-CD1 3.7Å; Y142-Y195 HydrophobicContact CD1-CD1 3.7Å; Y142-Y195 AromaticContact CD1-CE1 3.55Å; Y142-Y195 HydrophobicContact CD1-CE1 3.55Å; Y142-Y195 AromaticContact CD2-CE1 3.64Å; Y142-Y195 HydrophobicContact CD2-CE1 3.64Å; Y142-Y195 AromaticContact CE1-CD1 3.3Å; Y142-Y195 HydrophobicContact CE1-CD1 3.3Å; Y142-Y195 AromaticContact CE1-CE1 3.23Å; Y142-Y195 HydrophobicContact CE1-CE1 3.23Å; Y142-Y195 HydrophobicContact CE1-CG 4.31Å; Y142-Y195 HydrophobicContact CE2-CD1 4.28Å; Y142-Y195 AromaticContact CE2-CE1 3.34Å; Y142-Y195 HydrophobicContact CE2-CE1 3.34Å; Y142-Y195 AromaticContact CE2-CZ 3.68Å; Y142-Y195 HydrophobicContact CG-CD1 4.33Å; Y142-Y195 AromaticContact CG-CE1 3.74Å; Y142-Y195 HydrophobicContact CG-CE1 3.74Å; Y142-Y195 AromaticContact CZ-CD1 3.66Å; Y142-Y195 AromaticContact CZ-CE1 3.14Å; Y142-Y195 AromaticContact CZ-CZ 3.65Å; Y142-M198 HydrophobicContact CD1-SD 3.68Å; Y142-M198 HydrophobicContact CE1-SD 4.37Å
143	F	97.7	Very high	95.1	Very high	85 Å²	85	21.3 Å²	21.3	37%	0.373	11%	0.106	S	C	.	.	H	α-helix	trans	-64.7	-39.9	177.4	-83.4	-90.8	0	0	0	111.8	V139 V140 A146 A147 W170 T177	V139-F143 HydrophobicContact CG1-CD2 3.67Å; V139-F143 HydrophobicContact CG1-CE2 3.63Å; V139-F143 PolarHBondContact O-N 2.87Å; V140-F143 PolarHBondContact O-N 2.81Å; F143-A146 PolarHBondContact O-N 2.9Å; F143-A147 VanDerWaalsContact O-CB 3.24Å; F143-A147 WeakPolarHBondContact O-CB 3.24Å; F143-A147 PolarHBondContact O-N 3.46Å; F143-W170 AromaticContact CD1-CZ3 3.73Å; F143-W170 HydrophobicContact CD1-CZ3 3.73Å; F143-W170 AromaticContact CE1-CZ3 3.98Å; F143-W170 HydrophobicContact CE1-CZ3 3.98Å; F143-T177 WeakPolarHBondContact CE2-OG1 3.44Å
144	F	98.1	Very high	95.4	Very high	9 Å²	9	19.8 Å²	19.8	4%	0.039	10%	0.101	C	C	.	.	H	α-helix	trans	-66.4	-40.5	178.8	179.5	-117.3	0	0	0	112.2	Y102 L106 L109 V140 I141 Y142 A146 A147 S148 Y225 A253	Y102-F144 HydrophobicContact CE2-CE2 4.05Å; Y102-F144 HydrophobicContact CE2-CZ 4.5Å; L106-F144 HydrophobicContact CB-CE2 3.9Å; L106-F144 HydrophobicContact CD1-CE2 3.56Å; L106-F144 HydrophobicContact CD1-CZ 3.61Å; L106-F144 HydrophobicContact CG-CE2 4.35Å; L109-F144 HydrophobicContact CB-CD2 4.49Å; L109-F144 HydrophobicContact CB-CG 4.32Å; L109-F144 HydrophobicContact CD1-CD1 4.38Å; L109-F144 HydrophobicContact CD2-CD1 3.69Å; L109-F144 HydrophobicContact CD2-CD2 4.48Å; L109-F144 HydrophobicContact CD2-CE1 3.62Å; L109-F144 HydrophobicContact CD2-CE2 4.45Å; L109-F144 HydrophobicContact CD2-CG 4.12Å; L109-F144 HydrophobicContact CD2-CZ 4.03Å; L109-F144 HydrophobicContact CG-CD1 4.47Å; V140-F144 VanDerWaalsContact O-CB 3.25Å; V140-F144 WeakPolarHBondContact O-CB 3.33Å; V140-F144 PolarHBondContact O-N 3.34Å; I141-F144 PolarHBondContact O-N 3.45Å; Y142-F144 VanDerWaalsContact C-N 3.34Å; F144-A146 PolarHBondContact O-N 3.16Å; F144-A147 PolarHBondContact O-N 3.39Å; F144-S148 WeakPolarHBondContact O-CB 3.22Å; F144-S148 PolarHBondContact O-N 2.91Å; F144-Y225 WeakPolarHBondContact CE1-OH 3.3Å; F144-A253 HydrophobicContact CE1-CB 4.39Å; F144-A253 HydrophobicContact CZ-CB 4.04Å
145	I	97.2	Very high	95.6	Very high	27 Å²	27	21.1 Å²	21.1	14%	0.138	11%	0.108	C	C	.	.	H	α-helix	trans	-58.9	-49.4	173.4	-65.7	163.4	0	0	0	109.8	I141 Y142 A147 S148 Y149 Y195 M198	I141-I145 HydrophobicContact CG2-CD1 3.98Å; I141-I145 VanDerWaalsContact O-CG1 3.27Å; I141-I145 WeakPolarHBondContact O-CG1 3.21Å; I141-I145 PolarHBondContact O-N 3.18Å; Y142-I145 PolarHBondContact O-N 2.87Å; I145-A147 PolarHBondContact O-N 3.11Å; I145-S148 PolarHBondContact O-N 2.91Å; I145-S148 PolarHBondContact O-OG 3.49Å; I145-Y149 HydrophobicContact CG2-CD2 4.13Å; I145-Y149 HydrophobicContact CG2-CE2 3.9Å; I145-Y149 VanDerWaalsContact O-CD2 3.31Å; I145-Y149 WeakPolarHBondContact O-CD2 3.33Å; I145-Y149 PolarHBondContact O-N 3.16Å; I145-Y195 HydrophobicContact CD1-CD1 4Å; I145-M198 HydrophobicContact CB-CE 4.37Å; I145-M198 HydrophobicContact CG2-CB 3.79Å; I145-M198 HydrophobicContact CG2-CE 4.23Å
146	A	98.1	Very high	95.6	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-61.1	-42.2	177.6	0	0	0	0	0	113	Y142 F143 F144 S148 Y149 T150 V169 W170 A173 M198	Y142-A146 PolarHBondContact O-N 3.08Å; F143-A146 PolarHBondContact O-N 2.9Å; F144-A146 PolarHBondContact O-N 3.16Å; A146-S148 VanDerWaalsContact C-N 3.32Å; A146-S148 PolarHBondContact O-N 3.42Å; A146-Y149 PolarHBondContact O-N 3.45Å; A146-T150 PolarHBondContact O-N 3.46Å; A146-T150 PolarHBondContact O-OG1 3.24Å; A146-V169 HydrophobicContact CB-CB 4.02Å; A146-V169 HydrophobicContact CB-CG2 4.18Å; A146-W170 HydrophobicContact CB-CD2 4.11Å; A146-W170 HydrophobicContact CB-CE3 4.27Å; A146-W170 HydrophobicContact CB-CZ2 4.37Å; A146-A173 HydrophobicContact CB-CB 4.18Å; A146-M198 HydrophobicContact CB-CE 4.23Å
147	A	98.1	Very high	95.2	Very high	2 Å²	2	26.4 Å²	26.4	2%	0.017	13%	0.126	C	C	.	.	H	α-helix	trans	-64.1	-36.1	176.3	0	0	0	0	0	112.2	V101 F143 F144 I145 Y149 T150 P151	V101-A147 HydrophobicContact CG1-CB 4.05Å; F143-A147 VanDerWaalsContact O-CB 3.24Å; F143-A147 WeakPolarHBondContact O-CB 3.24Å; F143-A147 PolarHBondContact O-N 3.46Å; F144-A147 PolarHBondContact O-N 3.39Å; I145-A147 PolarHBondContact O-N 3.11Å; A147-Y149 VanDerWaalsContact C-N 3.33Å; A147-Y149 PolarHBondContact O-N 3.37Å; A147-T150 WeakPolarHBondContact O-CB 3.33Å; A147-T150 PolarHBondContact O-N 3.33Å; A147-P151 WeakPolarHBondContact O-CD 3.29Å
148	S	97.6	Very high	94.7	Very high	14 Å²	14	27.3 Å²	27.3	10%	0.098	13%	0.131	C	C	.	.	H	α-helix	trans	-67.9	-28.9	179	76.7	0	0	0	0	113.8	F144 I145 A146	F144-S148 WeakPolarHBondContact O-CB 3.22Å; F144-S148 PolarHBondContact O-N 2.91Å; I145-S148 PolarHBondContact O-N 2.91Å; I145-S148 PolarHBondContact O-OG 3.49Å; A146-S148 VanDerWaalsContact C-N 3.32Å; A146-S148 PolarHBondContact O-N 3.42Å
149	Y	97.3	Very high	94.3	Very high	38 Å²	38	27.6 Å²	27.6	15%	0.149	14%	0.141	C	C	.	.	H	α-helix	trans	-81.6	-27.2	174	-79.6	-70.2	0	0	0	113.5	I145 A146 A147 W152 L153 V169 M198 G199 P202	I145-Y149 HydrophobicContact CG2-CD2 4.13Å; I145-Y149 HydrophobicContact CG2-CE2 3.9Å; I145-Y149 VanDerWaalsContact O-CD2 3.31Å; I145-Y149 WeakPolarHBondContact O-CD2 3.33Å; I145-Y149 PolarHBondContact O-N 3.16Å; A146-Y149 PolarHBondContact O-N 3.45Å; A147-Y149 VanDerWaalsContact C-N 3.33Å; A147-Y149 PolarHBondContact O-N 3.37Å; Y149-W152 PolarHBondContact O-N 3.41Å; Y149-W152 VanDerWaalsContact O-N 3.12Å; Y149-L153 WeakPolarHBondContact O-CG 3.48Å; Y149-L153 PolarHBondContact O-N 3.38Å; Y149-V169 HydrophobicContact CD2-CG1 4.08Å; Y149-V169 HydrophobicContact CG-CG1 4.39Å; Y149-M198 WeakPolarHBondContact CE2-O 3.24Å; Y149-G199 PolarHBondContact OH-O 3.21Å; Y149-P202 HydrophobicContact CD1-CB 3.94Å; Y149-P202 HydrophobicContact CD2-CB 4.19Å; Y149-P202 HydrophobicContact CD2-CG 4.22Å; Y149-P202 HydrophobicContact CE1-CB 3.82Å; Y149-P202 HydrophobicContact CE2-CB 4.08Å; Y149-P202 HydrophobicContact CE2-CG 3.97Å; Y149-P202 HydrophobicContact CG-CB 4.13Å
150	T	97	Very high	94	Very high	7 Å²	7	32 Å²	32	4%	0.043	17%	0.17	C	C	.	.	H	α-helix	trans	-52.8	-46.9	-173.3	-65.7	0	0	0	0	113.8	T98 V101 A146 A147 W152 L153 N154	T98-T150 HydrophobicContact CG2-CG2 4Å; V101-T150 HydrophobicContact CB-CG2 4.25Å; V101-T150 HydrophobicContact CG1-CG2 3.89Å; A146-T150 PolarHBondContact O-N 3.46Å; A146-T150 PolarHBondContact O-OG1 3.24Å; A147-T150 WeakPolarHBondContact O-CB 3.33Å; A147-T150 PolarHBondContact O-N 3.33Å; T150-W152 PolarHBondContact O-N 3.35Å; T150-L153 PolarHBondContact O-N 3.17Å; T150-N154 VanDerWaalsContact O-CB 3.28Å; T150-N154 WeakPolarHBondContact O-CB 3.23Å; T150-N154 PolarHBondContact O-N 3.49Å
151	P	96.1	Very high	93.7	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-58.8	-45.8	176.7	-24.9	34.4	0	0	0	113	Y102 A147 N154 L155 I260 L264	Y102-P151 HydrophobicContact CG-CG 4.19Å; A147-P151 WeakPolarHBondContact O-CD 3.29Å; P151-N154 PolarHBondContact O-N 3.09Å; P151-L155 VanDerWaalsContact O-CB 3.25Å; P151-L155 WeakPolarHBondContact O-CB 3.49Å; P151-L155 WeakPolarHBondContact O-CG 3.45Å; P151-L155 PolarHBondContact O-N 2.79Å; P151-I260 HydrophobicContact CB-CD1 4.46Å; P151-I260 HydrophobicContact CB-CG1 4.3Å; P151-I260 HydrophobicContact CB-CG2 4.08Å; P151-I260 HydrophobicContact CG-CD1 4.08Å; P151-I260 HydrophobicContact CG-CG1 4.45Å; P151-I260 HydrophobicContact CG-CG2 4.31Å; P151-L264 HydrophobicContact CB-CD1 3.69Å
152	W	95	Very high	93.4	Very high	8 Å²	8	32.7 Å²	32.7	3%	0.03	17%	0.174	C	C	.	.	H	α-helix	trans	-65.6	-43.9	-180	-63.8	96.9	0	0	0	112.3	Y149 T150 N154 R156 L158 L218 A259 I260 L264	Y149-W152 PolarHBondContact O-N 3.41Å; Y149-W152 VanDerWaalsContact O-N 3.12Å; T150-W152 PolarHBondContact O-N 3.35Å; W152-N154 VanDerWaalsContact C-N 3.29Å; W152-N154 PolarHBondContact O-N 3.48Å; W152-R156 VanDerWaalsContact CZ3-NH1 3.3Å; W152-R156 WeakPolarHBondContact O-CB 3.38Å; W152-R156 PolarHBondContact O-N 3.33Å; W152-L158 WeakPolarHBondContact O-CD1 3.48Å; W152-L218 HydrophobicContact CD2-CD1 3.86Å; W152-L218 HydrophobicContact CE3-CD1 4.06Å; W152-L218 HydrophobicContact CH2-CD1 3.98Å; W152-L218 HydrophobicContact CH2-CG 4.27Å; W152-L218 HydrophobicContact CZ2-CD1 3.77Å; W152-L218 HydrophobicContact CZ2-CD2 3.73Å; W152-L218 HydrophobicContact CZ2-CG 3.82Å; W152-L218 HydrophobicContact CZ3-CD1 4.13Å; W152-A259 HydrophobicContact CH2-CB 4.25Å; W152-A259 HydrophobicContact CZ2-CB 3.74Å; W152-I260 HydrophobicContact CZ2-CG1 4.21Å; W152-L264 HydrophobicContact CD2-CD1 3.88Å; W152-L264 HydrophobicContact CE3-CD1 4.04Å; W152-L264 HydrophobicContact CE3-CD2 3.99Å; W152-L264 HydrophobicContact CE3-CG 4.32Å; W152-L264 HydrophobicContact CG-CD1 4.26Å; W152-L264 HydrophobicContact CH2-CG 4.4Å; W152-L264 HydrophobicContact CZ2-CD1 4.43Å; W152-L264 HydrophobicContact CZ3-CD1 4.37Å; W152-L264 HydrophobicContact CZ3-CD2 3.92Å; W152-L264 HydrophobicContact CZ3-CG 4.21Å
153	L	95.1	Very high	93.2	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-70.4	-27	-178.1	-67.7	177.2	0	0	0	112.5	Y149 T150 L158 A162 M165 R166 V169 V205	Y149-L153 WeakPolarHBondContact O-CG 3.48Å; Y149-L153 PolarHBondContact O-N 3.38Å; T150-L153 PolarHBondContact O-N 3.17Å; L153-L158 HydrophobicContact CD2-CD1 4.16Å; L153-A162 HydrophobicContact CD2-CB 4.24Å; L153-M165 HydrophobicContact CD1-CB 4.17Å; L153-M165 HydrophobicContact CD2-CB 3.94Å; L153-R166 HydrophobicContact CB-CG 3.7Å; L153-R166 HydrophobicContact CD1-CG 4.02Å; L153-R166 HydrophobicContact CG-CG 4.43Å; L153-R166 PolarHBondContact O-NE 3.48Å; L153-R166 PolarHBondContact O-NH2 3.1Å; L153-V169 HydrophobicContact CD1-CG2 4.38Å; L153-V205 HydrophobicContact CD2-CG1 3.98Å; L153-V205 HydrophobicContact CD2-CG2 4.21Å
154	N	94.3	Very high	93	Very high	33 Å²	33	37 Å²	37	18%	0.176	20%	0.204	C	C	.	.	H	α-helix	trans	-97.8	-38	-176.1	-73.9	-7.9	0	0	0	114.2	T98 T150 P151 W152 R166	T98-N154 HydrophobicContact CG2-CB 3.57Å; T98-N154 WeakPolarHBondContact CG2-ND2 3.29Å; T150-N154 VanDerWaalsContact O-CB 3.28Å; T150-N154 WeakPolarHBondContact O-CB 3.23Å; T150-N154 PolarHBondContact O-N 3.49Å; P151-N154 PolarHBondContact O-N 3.09Å; W152-N154 VanDerWaalsContact C-N 3.29Å; W152-N154 PolarHBondContact O-N 3.48Å; N154-R166 WeakPolarHBondContact OD1-CD 3.35Å; N154-R166 VanDerWaalsContact OD1-CZ 3.27Å; N154-R166 PolarHBondContact OD1-NE 3.38Å
155	L	92.8	Very high	92.9	Very high	43 Å²	43	37.1 Å²	37.1	23%	0.225	21%	0.205	C	C	.	.	H	α-helix	trans	-94.3	-21.8	-172.9	-57.4	-177.5	0	0	0	113.1	W94 E95 T98 P151 L264 Y265	W94-L155 HydrophobicContact CB-CD2 3.98Å; E95-L155 HydrophobicContact CB-CD2 4.48Å; E95-L155 HydrophobicContact CG-CD1 4.01Å; E95-L155 HydrophobicContact CG-CD2 3.78Å; T98-L155 HydrophobicContact CG2-CD2 4.3Å; T98-L155 HydrophobicContact CG2-CG 4.24Å; P151-L155 VanDerWaalsContact O-CB 3.25Å; P151-L155 WeakPolarHBondContact O-CB 3.49Å; P151-L155 WeakPolarHBondContact O-CG 3.45Å; P151-L155 PolarHBondContact O-N 2.79Å; L155-L264 HydrophobicContact CD1-CB 4Å; L155-L264 HydrophobicContact CD1-CD1 4.4Å; L155-Y265 HydrophobicContact CD1-CE2 3.8Å
156	R	90	Very high	92.8	Very high	26 Å²	26	40 Å²	40	10%	0.098	21%	0.214	C	C	.	.	S	Bend	trans	-89.5	139.7	179.1	-153.8	146.1	-165.9	-176.3	23.7	110.6	W152 L158 N211 D213	W152-R156 VanDerWaalsContact CZ3-NH1 3.3Å; W152-R156 WeakPolarHBondContact O-CB 3.38Å; W152-R156 PolarHBondContact O-N 3.33Å; R156-L158 HydrophobicContact CB-CD1 4.3Å; R156-L158 HydrophobicContact CB-CG 4.11Å; R156-L158 PolarHBondContact O-N 3Å; R156-N211 PolarHBondContact NE-O 2.87Å; R156-N211 PolarHBondContact NH2-O 2.98Å; R156-N211 PolarHBondContact NH2-OD1 3.33Å; R156-D213 PolarHBondContact NH1-O 3.46Å; R156-D213 PolarHBondContact NH2-O 2.9Å
157	E	84.9	Confident	92.7	Very high	166 Å²	166	48.9 Å²	48.9	78%	0.776	25%	0.248	S	C	*	.			trans	-69	103.9	170.3	-66.1	-170.8	172.9	0	0	109.1
158	L	82.3	Confident	92.7	Very high	30 Å²	30	51 Å²	51	16%	0.157	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-125.9	143.2	-179.1	-64.3	170	0	0	0	108.2	W152 L153 R156 A162 V205 M209	W152-L158 WeakPolarHBondContact O-CD1 3.48Å; L153-L158 HydrophobicContact CD2-CD1 4.16Å; R156-L158 HydrophobicContact CB-CD1 4.3Å; R156-L158 HydrophobicContact CB-CG 4.11Å; R156-L158 PolarHBondContact O-N 3Å; L158-A162 HydrophobicContact CB-CB 3.35Å; L158-A162 HydrophobicContact CD1-CB 3.67Å; L158-A162 HydrophobicContact CG-CB 4.14Å; L158-V205 HydrophobicContact CD1-CB 4.35Å; L158-V205 HydrophobicContact CD1-CG2 4.2Å; L158-V205 HydrophobicContact CD2-CB 4.38Å; L158-V205 HydrophobicContact CD2-CG2 4.47Å; L158-M209 HydrophobicContact CD2-CB 4.43Å; L158-M209 HydrophobicContact CD2-CE 3.75Å; L158-M209 HydrophobicContact CD2-CG 3.29Å; L158-M209 HydrophobicContact CD2-SD 4.37Å
159	G	84.5	Confident	92.7	Very high	29 Å²	29	50.3 Å²	50.3	30%	0.299	25%	0.252	S	S	.	.			trans	-60.9	-176.9	175.2	0	0	0	0	0	113.7	L161 A162	G159-L161 PolarHBondContact O-N 3.34Å; G159-A162 PolarHBondContact O-N 3.35Å
160	P	88.2	Confident	92.7	Very high	110 Å²	110	53.1 Å²	53.1	71%	0.714	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-22.9	-175.4	-26.5	34.4	0	0	0	115.1	A162 A163 H164	P160-A162 VanDerWaalsContact C-N 3.25Å; P160-A162 PolarHBondContact O-N 3.18Å; P160-A163 PolarHBondContact O-N 2.92Å; P160-H164 PolarHBondContact O-ND1 3.23Å
161	L	89.9	Confident	92.7	Very high	55 Å²	55	58 Å²	58	29%	0.288	29%	0.287	S	S	.	.	H	α-helix	trans	-59	-33.9	176.3	-172.1	60.6	0	0	0	112.8	G159 A163 H164 M165 V205	G159-L161 PolarHBondContact O-N 3.34Å; L161-A163 VanDerWaalsContact C-N 3.34Å; L161-A163 PolarHBondContact O-N 2.9Å; L161-H164 WeakPolarHBondContact O-CB 3.34Å; L161-H164 PolarHBondContact O-N 3.01Å; L161-M165 HydrophobicContact CD1-CE 3.59Å; L161-M165 HydrophobicContact CG-CE 4.24Å; L161-M165 PolarHBondContact O-N 3Å; L161-V205 HydrophobicContact CD2-CG1 4.41Å; L161-V205 HydrophobicContact CG-CG1 4.19Å
162	A	91.1	Very high	92.8	Very high	3 Å²	3	59.6 Å²	59.6	3%	0.025	30%	0.295	C	S	.	.	H	α-helix	trans	-64.7	-36.9	-179.5	0	0	0	0	0	113.1	L153 L158 G159 P160 H164 M165 R166 V205	L153-A162 HydrophobicContact CD2-CB 4.24Å; L158-A162 HydrophobicContact CB-CB 3.35Å; L158-A162 HydrophobicContact CD1-CB 3.67Å; L158-A162 HydrophobicContact CG-CB 4.14Å; G159-A162 PolarHBondContact O-N 3.35Å; P160-A162 VanDerWaalsContact C-N 3.25Å; P160-A162 PolarHBondContact O-N 3.18Å; A162-H164 VanDerWaalsContact C-N 3.28Å; A162-H164 PolarHBondContact O-N 3.36Å; A162-M165 PolarHBondContact O-N 3.28Å; A162-M165 VanDerWaalsContact O-N 3.16Å; A162-R166 WeakPolarHBondContact O-CG 3.29Å; A162-R166 PolarHBondContact O-N 2.73Å; A162-V205 HydrophobicContact CB-CG1 4.49Å
163	A	91.6	Very high	92.9	Very high	52 Å²	52	59.3 Å²	59.3	43%	0.43	29%	0.294	S	S	.	.	H	α-helix	trans	-60.6	-40.4	176	0	0	0	0	0	111.7	P160 L161 R166 W167	P160-A163 PolarHBondContact O-N 2.92Å; L161-A163 VanDerWaalsContact C-N 3.34Å; L161-A163 PolarHBondContact O-N 2.9Å; A163-R166 PolarHBondContact O-N 3.08Å; A163-W167 PolarHBondContact O-N 3.48Å
164	H	94.4	Very high	93	Very high	125 Å²	125	61.5 Å²	61.5	58%	0.579	31%	0.313	S	S	*	.	H	α-helix	trans	-65.1	-43	174.7	-61.8	86.7	0	0	0	111.3	P160 L161 A162 R166 W167 F168	P160-H164 PolarHBondContact O-ND1 3.23Å; L161-H164 WeakPolarHBondContact O-CB 3.34Å; L161-H164 PolarHBondContact O-N 3.01Å; A162-H164 VanDerWaalsContact C-N 3.28Å; A162-H164 PolarHBondContact O-N 3.36Å; H164-R166 VanDerWaalsContact C-N 3.33Å; H164-R166 PolarHBondContact O-N 2.9Å; H164-W167 PolarHBondContact O-N 3.23Å; H164-F168 WeakPolarHBondContact O-CB 3.38Å; H164-F168 PolarHBondContact O-N 3.13Å
165	M	95.8	Very high	93.1	Very high	10 Å²	10	61.7 Å²	61.7	5%	0.049	32%	0.319	C	S	.	.	H	α-helix	trans	-68	-30.3	179.3	-65.3	-51.1	139.4	0	0	113.5	L153 L161 A162 F168 V169 F201 P202 V205	L153-M165 HydrophobicContact CD1-CB 4.17Å; L153-M165 HydrophobicContact CD2-CB 3.94Å; L161-M165 HydrophobicContact CD1-CE 3.59Å; L161-M165 HydrophobicContact CG-CE 4.24Å; L161-M165 PolarHBondContact O-N 3Å; A162-M165 PolarHBondContact O-N 3.28Å; A162-M165 VanDerWaalsContact O-N 3.16Å; M165-F168 PolarHBondContact O-N 3.35Å; M165-F168 HydrophobicContact SD-CB 4.3Å; M165-F168 HydrophobicContact SD-CD1 4.5Å; M165-F168 HydrophobicContact SD-CG 4.42Å; M165-V169 WeakPolarHBondContact O-CG2 3.46Å; M165-V169 PolarHBondContact O-N 3.18Å; M165-F201 HydrophobicContact CE-CD1 4.12Å; M165-F201 HydrophobicContact CE-CE1 3.52Å; M165-F201 HydrophobicContact CE-CZ 4.04Å; M165-F201 HydrophobicContact SD-CD1 3.71Å; M165-F201 HydrophobicContact SD-CE1 3.69Å; M165-P202 HydrophobicContact CB-CB 4.39Å; M165-V205 HydrophobicContact CB-CG1 3.99Å; M165-V205 HydrophobicContact CG-CG1 3.55Å
166	R	94.9	Very high	93.3	Very high	87 Å²	87	59.6 Å²	59.6	33%	0.328	31%	0.308	S	S	.	.	H	α-helix	trans	-59.1	-49.9	172.4	-70.6	172.8	-164.9	-175.7	2.3	110.8	L153 N154 A162 A163 H164 V169 W170	L153-R166 HydrophobicContact CB-CG 3.7Å; L153-R166 HydrophobicContact CD1-CG 4.02Å; L153-R166 HydrophobicContact CG-CG 4.43Å; L153-R166 PolarHBondContact O-NE 3.48Å; L153-R166 PolarHBondContact O-NH2 3.1Å; N154-R166 WeakPolarHBondContact OD1-CD 3.35Å; N154-R166 VanDerWaalsContact OD1-CZ 3.27Å; N154-R166 PolarHBondContact OD1-NE 3.38Å; A162-R166 WeakPolarHBondContact O-CG 3.29Å; A162-R166 PolarHBondContact O-N 2.73Å; A163-R166 PolarHBondContact O-N 3.08Å; H164-R166 VanDerWaalsContact C-N 3.33Å; H164-R166 PolarHBondContact O-N 2.9Å; R166-V169 WeakPolarHBondContact O-CG2 3.48Å; R166-W170 VanDerWaalsContact O-CD1 3.29Å
167	W	96.3	Very high	93.5	Very high	188 Å²	188	59.5 Å²	59.5	71%	0.712	31%	0.31	S	S	*	.	H	α-helix	trans	-66.9	-41.8	176.8	-75.5	109.7	0	0	0	112.1	A163 H164 V169 W170 L171	A163-W167 PolarHBondContact O-N 3.48Å; H164-W167 PolarHBondContact O-N 3.23Å; W167-V169 PolarHBondContact O-N 3.12Å; W167-W170 PolarHBondContact O-N 3.41Å; W167-L171 HydrophobicContact CB-CD1 4.44Å; W167-L171 WeakPolarHBondContact O-CB 3.13Å; W167-L171 VanDerWaalsContact O-CG 3.26Å; W167-L171 WeakPolarHBondContact O-CG 3.37Å; W167-L171 PolarHBondContact O-N 3.11Å
168	F	97.3	Very high	94	Very high	46 Å²	46	56.5 Å²	56.5	20%	0.202	30%	0.298	C	S	.	.	H	α-helix	trans	-54.9	-50.6	-179.7	178.9	-92.5	0	0	0	112.4	H164 M165 W170 L171 M172 T197 F201 P202	H164-F168 WeakPolarHBondContact O-CB 3.38Å; H164-F168 PolarHBondContact O-N 3.13Å; M165-F168 PolarHBondContact O-N 3.35Å; M165-F168 HydrophobicContact SD-CB 4.3Å; M165-F168 HydrophobicContact SD-CD1 4.5Å; M165-F168 HydrophobicContact SD-CG 4.42Å; F168-W170 VanDerWaalsContact C-N 3.35Å; F168-W170 PolarHBondContact O-N 3.4Å; F168-L171 PolarHBondContact O-N 2.7Å; F168-M172 HydrophobicContact CD1-CG 4.2Å; F168-M172 HydrophobicContact CD2-CG 4.2Å; F168-M172 HydrophobicContact CE1-CG 3.83Å; F168-M172 HydrophobicContact CE2-CG 3.84Å; F168-M172 HydrophobicContact CE2-SD 4.4Å; F168-M172 HydrophobicContact CG-CG 4.38Å; F168-M172 HydrophobicContact CZ-CG 3.65Å; F168-M172 HydrophobicContact CZ-SD 4.33Å; F168-M172 VanDerWaalsContact O-CB 3.26Å; F168-M172 WeakPolarHBondContact O-CB 3.44Å; F168-M172 VanDerWaalsContact O-CG 3.27Å; F168-M172 WeakPolarHBondContact O-CG 3.49Å; F168-M172 PolarHBondContact O-N 2.74Å; F168-T197 HydrophobicContact CZ-CG2 3.99Å; F168-F201 AromaticContact CD1-CD1 3.81Å; F168-F201 HydrophobicContact CD1-CD1 3.81Å; F168-F201 HydrophobicContact CD1-CE1 4.47Å; F168-F201 AromaticContact CD2-CD1 3.95Å; F168-F201 HydrophobicContact CD2-CD1 3.95Å; F168-F201 AromaticContact CD2-CE1 3.89Å; F168-F201 HydrophobicContact CD2-CE1 3.89Å; F168-F201 HydrophobicContact CE1-CB 3.99Å; F168-F201 AromaticContact CE1-CD1 3.47Å; F168-F201 HydrophobicContact CE1-CD1 3.47Å; F168-F201 VanDerWaalsContact CE1-CD1 3.47Å; F168-F201 HydrophobicContact CE1-CE1 4.37Å; F168-F201 HydrophobicContact CE1-CG 4.15Å; F168-F201 AromaticContact CE2-CD1 3.61Å; F168-F201 HydrophobicContact CE2-CD1 3.61Å; F168-F201 AromaticContact CE2-CE1 3.77Å; F168-F201 HydrophobicContact CE2-CE1 3.77Å; F168-F201 HydrophobicContact CG-CD1 4.03Å; F168-F201 HydrophobicContact CG-CE1 4.24Å; F168-F201 HydrophobicContact CZ-CB 4.09Å; F168-F201 AromaticContact CZ-CD1 3.35Å; F168-F201 HydrophobicContact CZ-CD1 3.35Å; F168-F201 HydrophobicContact CZ-CE1 4.01Å; F168-F201 AromaticContact CZ-CG 3.98Å; F168-F201 HydrophobicContact CZ-CG 3.98Å; F168-P202 HydrophobicContact CD1-CG 4.03Å; F168-P202 HydrophobicContact CE1-CG 4.18Å
169	V	97.6	Very high	94.6	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-64.2	-38.7	-176	-65.4	0	0	0	0	112.6	A146 Y149 L153 M165 R166 W167 A173 M198 P202	A146-V169 HydrophobicContact CB-CB 4.02Å; A146-V169 HydrophobicContact CB-CG2 4.18Å; Y149-V169 HydrophobicContact CD2-CG1 4.08Å; Y149-V169 HydrophobicContact CG-CG1 4.39Å; L153-V169 HydrophobicContact CD1-CG2 4.38Å; M165-V169 WeakPolarHBondContact O-CG2 3.46Å; M165-V169 PolarHBondContact O-N 3.18Å; R166-V169 WeakPolarHBondContact O-CG2 3.48Å; W167-V169 PolarHBondContact O-N 3.12Å; V169-A173 WeakPolarHBondContact O-CB 3.48Å; V169-A173 PolarHBondContact O-N 2.9Å; V169-M198 WeakPolarHBondContact O-CE 3.46Å; V169-P202 HydrophobicContact CG1-CB 3.81Å; V169-P202 HydrophobicContact CG1-CG 3.31Å
170	W	97.9	Very high	94.9	Very high	96 Å²	96	54.6 Å²	54.6	36%	0.364	28%	0.28	S	S	.	.	H	α-helix	trans	-77.3	-37.7	-179.6	-73.8	104.9	0	0	0	112.7	V101 F143 A146 R166 W167 F168 A173 A174	V101-W170 HydrophobicContact CG1-CH2 4.12Å; V101-W170 HydrophobicContact CG1-CZ2 3.69Å; F143-W170 AromaticContact CD1-CZ3 3.73Å; F143-W170 HydrophobicContact CD1-CZ3 3.73Å; F143-W170 AromaticContact CE1-CZ3 3.98Å; F143-W170 HydrophobicContact CE1-CZ3 3.98Å; A146-W170 HydrophobicContact CB-CD2 4.11Å; A146-W170 HydrophobicContact CB-CE3 4.27Å; A146-W170 HydrophobicContact CB-CZ2 4.37Å; R166-W170 VanDerWaalsContact O-CD1 3.29Å; W167-W170 PolarHBondContact O-N 3.41Å; F168-W170 VanDerWaalsContact C-N 3.35Å; F168-W170 PolarHBondContact O-N 3.4Å; W170-A173 PolarHBondContact O-N 2.89Å; W170-A174 PolarHBondContact O-N 3.36Å
171	L	97.7	Very high	95	Very high	110 Å²	110	55 Å²	55	58%	0.576	27%	0.271	S	S	*	.	H	α-helix	trans	-64.6	-41.1	172.8	-70.9	175.1	0	0	0	111.4	W167 F168 A174 A175	W167-L171 HydrophobicContact CB-CD1 4.44Å; W167-L171 WeakPolarHBondContact O-CB 3.13Å; W167-L171 VanDerWaalsContact O-CG 3.26Å; W167-L171 WeakPolarHBondContact O-CG 3.37Å; W167-L171 PolarHBondContact O-N 3.11Å; F168-L171 PolarHBondContact O-N 2.7Å; L171-A174 PolarHBondContact O-N 3.25Å; L171-A175 WeakPolarHBondContact O-CB 3.42Å; L171-A175 PolarHBondContact O-N 3.43Å
172	M	97.4	Very high	95.1	Very high	34 Å²	34	57.5 Å²	57.5	17%	0.167	29%	0.285	C	S	.	.	H	α-helix	trans	-67.2	-35.8	174.9	-75	-66.5	-71	0	0	112.2	F168 A175 G176 F194 T197 M198	F168-M172 HydrophobicContact CD1-CG 4.2Å; F168-M172 HydrophobicContact CD2-CG 4.2Å; F168-M172 HydrophobicContact CE1-CG 3.83Å; F168-M172 HydrophobicContact CE2-CG 3.84Å; F168-M172 HydrophobicContact CE2-SD 4.4Å; F168-M172 HydrophobicContact CG-CG 4.38Å; F168-M172 HydrophobicContact CZ-CG 3.65Å; F168-M172 HydrophobicContact CZ-SD 4.33Å; F168-M172 VanDerWaalsContact O-CB 3.26Å; F168-M172 WeakPolarHBondContact O-CB 3.44Å; F168-M172 VanDerWaalsContact O-CG 3.27Å; F168-M172 WeakPolarHBondContact O-CG 3.49Å; F168-M172 PolarHBondContact O-N 2.74Å; M172-A175 PolarHBondContact O-N 2.93Å; M172-G176 PolarHBondContact O-N 3.36Å; M172-F194 HydrophobicContact CE-CD1 3.45Å; M172-F194 VanDerWaalsContact CE-CD1 3.45Å; M172-F194 HydrophobicContact CE-CE1 3.8Å; M172-F194 HydrophobicContact CE-CG 4.38Å; M172-F194 HydrophobicContact SD-CD1 4.45Å; M172-F194 HydrophobicContact SD-CE1 4.32Å; M172-T197 HydrophobicContact CE-CG2 4.2Å; M172-M198 HydrophobicContact CB-CE 4.05Å; M172-M198 HydrophobicContact CB-CG 3.59Å; M172-M198 HydrophobicContact CB-SD 3.58Å; M172-M198 VanDerWaalsContact CB-SD 3.58Å; M172-M198 HydrophobicContact CE-CG 4.2Å; M172-M198 HydrophobicContact CG-CG 4.3Å
173	A	97.4	Very high	94.9	Very high	1 Å²	1	62.6 Å²	62.6	1%	0.008	30%	0.304	C	S	.	.	H	α-helix	trans	-63.2	-42.2	172.7	0	0	0	0	0	111.9	A146 V169 W170 G176 T177 M198	A146-A173 HydrophobicContact CB-CB 4.18Å; V169-A173 WeakPolarHBondContact O-CB 3.48Å; V169-A173 PolarHBondContact O-N 2.9Å; W170-A173 PolarHBondContact O-N 2.89Å; A173-G176 PolarHBondContact O-N 2.93Å; A173-T177 WeakPolarHBondContact O-CB 3.47Å; A173-T177 PolarHBondContact O-N 3.2Å; A173-T177 PolarHBondContact O-OG1 3.21Å; A173-M198 HydrophobicContact CB-CE 4.06Å
174	A	97.4	Very high	94.5	Very high	48 Å²	48	62.5 Å²	62.5	40%	0.397	29%	0.294	S	S	.	.	H	α-helix	trans	-64	-44.6	174.2	0	0	0	0	0	111.7	W170 L171 T177 I178	W170-A174 PolarHBondContact O-N 3.36Å; L171-A174 PolarHBondContact O-N 3.25Å; A174-T177 WeakPolarHBondContact O-CB 3.29Å; A174-T177 PolarHBondContact O-N 3.46Å; A174-I178 WeakPolarHBondContact O-CG1 3.27Å; A174-I178 PolarHBondContact O-N 3.41Å
175	A	96.6	Very high	93.8	Very high	36 Å²	36	57.8 Å²	57.8	30%	0.298	27%	0.273	S	S	.	.	H	α-helix	trans	-61.9	-44.3	176.5	0	0	0	0	0	112.2	L171 M172 T177 I178 Y179 F194	L171-A175 WeakPolarHBondContact O-CB 3.42Å; L171-A175 PolarHBondContact O-N 3.43Å; M172-A175 PolarHBondContact O-N 2.93Å; A175-T177 VanDerWaalsContact C-N 3.3Å; A175-T177 PolarHBondContact O-N 3.02Å; A175-I178 PolarHBondContact O-N 2.81Å; A175-Y179 WeakPolarHBondContact O-CB 3.27Å; A175-Y179 PolarHBondContact O-N 2.9Å; A175-F194 HydrophobicContact CB-CE1 4.15Å
176	G	95.3	Very high	93.1	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-61.1	-38.6	174.2	0	0	0	0	0	112.3	M172 A173 Y179 V180	M172-G176 PolarHBondContact O-N 3.36Å; A173-G176 PolarHBondContact O-N 2.93Å; G176-Y179 WeakPolarHBondContact O-CB 3.29Å; G176-Y179 PolarHBondContact O-N 3.32Å; G176-V180 WeakPolarHBondContact O-CG2 3.13Å; G176-V180 PolarHBondContact O-N 3.3Å
177	T	95.3	Very high	92.7	Very high	23 Å²	23	63.3 Å²	63.3	14%	0.141	30%	0.297	C	S	.	.	H	α-helix	trans	-62.3	-50.9	174.4	-58.6	0	0	0	0	111.5	V139 F143 A173 A174 A175 Y179 V180 F181	V139-T177 HydrophobicContact CG1-CG2 4Å; V139-T177 HydrophobicContact CG2-CG2 4.08Å; F143-T177 WeakPolarHBondContact CE2-OG1 3.44Å; A173-T177 WeakPolarHBondContact O-CB 3.47Å; A173-T177 PolarHBondContact O-N 3.2Å; A173-T177 PolarHBondContact O-OG1 3.21Å; A174-T177 WeakPolarHBondContact O-CB 3.29Å; A174-T177 PolarHBondContact O-N 3.46Å; A175-T177 VanDerWaalsContact C-N 3.3Å; A175-T177 PolarHBondContact O-N 3.02Å; T177-Y179 PolarHBondContact O-N 3.35Å; T177-V180 PolarHBondContact O-N 3.26Å; T177-V180 VanDerWaalsContact O-N 3.15Å; T177-F181 HydrophobicContact CG2-CD2 3.8Å; T177-F181 HydrophobicContact CG2-CE2 3.56Å; T177-F181 WeakPolarHBondContact O-CD2 3.42Å; T177-F181 PolarHBondContact O-N 3.04Å; T177-F181 VanDerWaalsContact O-N 3.12Å
178	I	95.4	Very high	92.1	Very high	103 Å²	103	57.3 Å²	57.3	53%	0.528	28%	0.275	S	S	.	.	H	α-helix	trans	-57.2	-40.5	175.7	-67.5	165.3	0	0	0	110.6	A174 A175 F181 N182	A174-I178 WeakPolarHBondContact O-CG1 3.27Å; A174-I178 PolarHBondContact O-N 3.41Å; A175-I178 PolarHBondContact O-N 2.81Å; I178-F181 PolarHBondContact O-N 2.87Å; I178-N182 VanDerWaalsContact CG2-ND2 3.31Å; I178-N182 WeakPolarHBondContact CG2-ND2 3.38Å; I178-N182 WeakPolarHBondContact O-CB 3.48Å; I178-N182 PolarHBondContact O-N 3.37Å; I178-N182 VanDerWaalsContact O-N 3.1Å; I178-N182 PolarHBondContact O-ND2 3.34Å
179	Y	94.1	Very high	91.6	Very high	19 Å²	19	61.6 Å²	61.6	8%	0.075	30%	0.3	C	S	.	.	H	α-helix	trans	-62.1	-47.4	176.5	174.5	-90.1	0	0	0	112	A175 G176 T177 F181 N182 Y183 Y187 V190 E191	A175-Y179 WeakPolarHBondContact O-CB 3.27Å; A175-Y179 PolarHBondContact O-N 2.9Å; G176-Y179 WeakPolarHBondContact O-CB 3.29Å; G176-Y179 PolarHBondContact O-N 3.32Å; T177-Y179 PolarHBondContact O-N 3.35Å; Y179-F181 VanDerWaalsContact C-N 3.32Å; Y179-F181 PolarHBondContact O-N 3.42Å; Y179-N182 PolarHBondContact O-N 3.39Å; Y179-Y183 AromaticContact CD2-CD2 3.7Å; Y179-Y183 HydrophobicContact CD2-CD2 3.7Å; Y179-Y183 HydrophobicContact CD2-CG 4.25Å; Y179-Y183 AromaticContact CE2-CD2 3.93Å; Y179-Y183 HydrophobicContact CE2-CD2 3.93Å; Y179-Y183 HydrophobicContact CE2-CG 4.03Å; Y179-Y183 HydrophobicContact CG-CD2 4.5Å; Y179-Y183 PolarHBondContact O-N 3.42Å; Y179-Y187 WeakPolarHBondContact OH-CA 3.38Å; Y179-Y187 VanDerWaalsContact OH-CB 3.23Å; Y179-Y187 WeakPolarHBondContact OH-CB 3.45Å; Y179-Y187 PolarHBondContact OH-N 3.4Å; Y179-Y187 PolarHBondContact OH-O 2.88Å; Y179-V190 HydrophobicContact CD2-CG1 4.36Å; Y179-V190 HydrophobicContact CE2-CB 4.27Å; Y179-V190 HydrophobicContact CE2-CG1 3.76Å; Y179-E191 HydrophobicContact CD1-CG 4.36Å; Y179-E191 HydrophobicContact CE1-CB 3.87Å; Y179-E191 HydrophobicContact CE1-CG 4.02Å
180	V	92	Very high	91.2	Very high	1 Å²	1	64.4 Å²	64.4	1%	0.006	32%	0.317	C	S	.	.	H	α-helix	trans	-60.6	-40.9	180	170.9	0	0	0	0	111.6	M135 R138 V139 Y142 G176 T177 H184	M135-V180 HydrophobicContact CB-CG1 3.92Å; M135-V180 HydrophobicContact CG-CG1 3.94Å; R138-V180 HydrophobicContact CB-CG1 4.21Å; R138-V180 HydrophobicContact CB-CG2 4.13Å; V139-V180 HydrophobicContact CG2-CB 3.97Å; V139-V180 HydrophobicContact CG2-CG1 3.92Å; V139-V180 HydrophobicContact CG2-CG2 4.32Å; Y142-V180 HydrophobicContact CD2-CG2 4.46Å; Y142-V180 HydrophobicContact CE2-CG2 3.76Å; G176-V180 WeakPolarHBondContact O-CG2 3.13Å; G176-V180 PolarHBondContact O-N 3.3Å; T177-V180 PolarHBondContact O-N 3.26Å; T177-V180 VanDerWaalsContact O-N 3.15Å; V180-H184 WeakPolarHBondContact O-CA 3.41Å; V180-H184 WeakPolarHBondContact O-CB 3.27Å; V180-H184 PolarHBondContact O-N 3.3Å
181	F	90.4	Very high	90.8	Very high	117 Å²	117	59.9 Å²	59.9	51%	0.513	30%	0.3	S	S	.	.	H	α-helix	trans	-70	-35.7	178.8	-77.6	-68.2	0	0	0	113.4	M135 V139 T177 I178 Y179	M135-F181 HydrophobicContact CE-CD1 4.22Å; M135-F181 HydrophobicContact CE-CE1 4.16Å; M135-F181 HydrophobicContact SD-CD1 3.83Å; M135-F181 HydrophobicContact SD-CE1 4.2Å; V139-F181 HydrophobicContact CG2-CE2 4.41Å; T177-F181 HydrophobicContact CG2-CD2 3.8Å; T177-F181 HydrophobicContact CG2-CE2 3.56Å; T177-F181 WeakPolarHBondContact O-CD2 3.42Å; T177-F181 PolarHBondContact O-N 3.04Å; T177-F181 VanDerWaalsContact O-N 3.12Å; I178-F181 PolarHBondContact O-N 2.87Å; Y179-F181 VanDerWaalsContact C-N 3.32Å; Y179-F181 PolarHBondContact O-N 3.42Å
182	N	91.1	Very high	90.5	Very high	109 Å²	109	56 Å²	56	58%	0.583	28%	0.279	S	S	*	.	H	α-helix	trans	-88.7	-31.6	-176.9	-72.3	-47	0	0	0	114.1	I178 Y179	I178-N182 VanDerWaalsContact CG2-ND2 3.31Å; I178-N182 WeakPolarHBondContact CG2-ND2 3.38Å; I178-N182 WeakPolarHBondContact O-CB 3.48Å; I178-N182 PolarHBondContact O-N 3.37Å; I178-N182 VanDerWaalsContact O-N 3.1Å; I178-N182 PolarHBondContact O-ND2 3.34Å; Y179-N182 PolarHBondContact O-N 3.39Å
183	Y	87.7	Confident	90.3	Very high	110 Å²	110	56.7 Å²	56.7	43%	0.431	29%	0.291	S	S	.	.	H	α-helix	trans	-127.4	28.6	-169	-60.4	-75.9	0	0	0	113.1	Y179 E185 K186 Y187	Y179-Y183 AromaticContact CD2-CD2 3.7Å; Y179-Y183 HydrophobicContact CD2-CD2 3.7Å; Y179-Y183 HydrophobicContact CD2-CG 4.25Å; Y179-Y183 AromaticContact CE2-CD2 3.93Å; Y179-Y183 HydrophobicContact CE2-CD2 3.93Å; Y179-Y183 HydrophobicContact CE2-CG 4.03Å; Y179-Y183 HydrophobicContact CG-CD2 4.5Å; Y179-Y183 PolarHBondContact O-N 3.42Å; Y183-E185 PolarHBondContact O-N 3.39Å; Y183-K186 HydrophobicContact CD1-CD 4.4Å; Y183-K186 WeakPolarHBondContact O-CB 3.39Å; Y183-K186 PolarHBondContact O-N 2.96Å; Y183-Y187 HydrophobicContact CD1-CD2 4.36Å; Y183-Y187 AromaticContact CD1-CE2 3.92Å; Y183-Y187 HydrophobicContact CD1-CE2 3.92Å; Y183-Y187 HydrophobicContact CE1-CE2 4.38Å
184	H	82.9	Confident	90.1	Very high	49 Å²	49	59.1 Å²	59.1	23%	0.227	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-40.4	119.5	-178	-170.1	66.6	0	0	0	113.1	H134 M135 V180 K186	H134-H184 AromaticContact CE1-CE1 3.87Å; H134-H184 AromaticContact CE1-NE2 3.98Å; H134-H184 AromaticContact CG-CE1 3.84Å; H134-H184 AromaticContact ND1-CE1 3.14Å; H134-H184 PolarHBondContact ND1-CE1 2.81Å; H134-H184 AromaticContact ND1-NE2 3.15Å; H134-H184 PolarHBondContact ND1-NE2 3.35Å; H134-H184 VanDerWaalsContact ND1-NE2 3.15Å; M135-H184 VanDerWaalsContact CG-CE1 3.47Å; M135-H184 WeakPolarHBondContact CG-CE1 3.08Å; M135-H184 VanDerWaalsContact CG-ND1 3.26Å; M135-H184 WeakPolarHBondContact CG-ND1 3.19Å; V180-H184 WeakPolarHBondContact O-CA 3.41Å; V180-H184 WeakPolarHBondContact O-CB 3.27Å; V180-H184 PolarHBondContact O-N 3.3Å; H184-K186 PolarHBondContact O-N 3.05Å
185	E	78.4	Confident	89.9	Confident	26 Å²	26	58.2 Å²	58.2	12%	0.121	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	3.1	-179.1	-61.7	-163.6	95.5	0	0	117.5	R57 H134 Y183	R57-E185 WeakPolarHBondContact CA-OE1 3.26Å; R57-E185 WeakPolarHBondContact CB-OE1 3.46Å; H134-E185 VanDerWaalsContact CE1-CD 3.43Å; H134-E185 IonicContact CE1-OE1 2.67Å; H134-E185 IonicContact CE1-OE2 2.78Å; H134-E185 IonicContact ND1-OE2 3.18Å; Y183-E185 PolarHBondContact O-N 3.39Å
186	K	81.4	Confident	89.8	Confident	102 Å²	102	59.6 Å²	59.6	44%	0.443	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-43	-173.2	-166	178.1	-177.8	-179.2	0	113.1	N55 Y183 H184	N55-K186 PolarHBondContact OD1-O 3.43Å; Y183-K186 HydrophobicContact CD1-CD 4.4Å; Y183-K186 WeakPolarHBondContact O-CB 3.39Å; Y183-K186 PolarHBondContact O-N 2.96Å; H184-K186 PolarHBondContact O-N 3.05Å
187	Y	86.4	Confident	89.9	Confident	112 Å²	112	62.5 Å²	62.5	44%	0.439	31%	0.308	S	S	.	.			trans	-127.5	72.8	-179.9	-43.4	-71.9	0	0	0	112.2	Y179 Y183 L189 V190 E191	Y179-Y187 WeakPolarHBondContact OH-CA 3.38Å; Y179-Y187 VanDerWaalsContact OH-CB 3.23Å; Y179-Y187 WeakPolarHBondContact OH-CB 3.45Å; Y179-Y187 PolarHBondContact OH-N 3.4Å; Y179-Y187 PolarHBondContact OH-O 2.88Å; Y183-Y187 HydrophobicContact CD1-CD2 4.36Å; Y183-Y187 AromaticContact CD1-CE2 3.92Å; Y183-Y187 HydrophobicContact CD1-CE2 3.92Å; Y183-Y187 HydrophobicContact CE1-CE2 4.38Å; Y187-L189 PolarHBondContact O-N 2.92Å; Y187-V190 HydrophobicContact CG-CG2 4.49Å; Y187-V190 WeakPolarHBondContact O-CB 3.14Å; Y187-V190 PolarHBondContact O-N 3.46Å; Y187-E191 PolarHBondContact O-N 3.32Å
188	K	84.3	Confident	89.9	Confident	61 Å²	61	61.4 Å²	61.4	27%	0.265	30%	0.301	S	S	.	.	H	α-helix	trans	-56.5	-18	-178.4	-58.9	-174.4	-178.8	-176.1	0	115.4	C56 L192 K233	C56-K188 PolarHBondContact O-NZ 2.84Å; K188-L192 PolarHBondContact O-N 3.36Å; K188-K233 PolarHBondContact O-NZ 3.45Å; K188-K233 VanDerWaalsContact O-NZ 3.13Å
189	L	87.4	Confident	89.8	Confident	136 Å²	136	58 Å²	58	71%	0.712	29%	0.291	S	S	*	.	H	α-helix	trans	-81.6	-39.1	173.2	-74.8	176.9	0	0	0	112.2	Y187 E191 L192 A193	Y187-L189 PolarHBondContact O-N 2.92Å; L189-E191 VanDerWaalsContact C-N 3.31Å; L189-L192 PolarHBondContact O-N 3.31Å; L189-A193 PolarHBondContact O-N 2.88Å
190	V	89.8	Confident	89.8	Confident	59 Å²	59	63 Å²	63	36%	0.358	31%	0.313	S	S	.	.	H	α-helix	trans	-61.8	-46.6	176.1	175.5	0	0	0	0	109.1	Y179 Y187 L192 A193 F194	Y179-V190 HydrophobicContact CD2-CG1 4.36Å; Y179-V190 HydrophobicContact CE2-CB 4.27Å; Y179-V190 HydrophobicContact CE2-CG1 3.76Å; Y187-V190 HydrophobicContact CG-CG2 4.49Å; Y187-V190 WeakPolarHBondContact O-CB 3.14Å; Y187-V190 PolarHBondContact O-N 3.46Å; V190-L192 VanDerWaalsContact C-N 3.34Å; V190-L192 PolarHBondContact O-N 2.92Å; V190-A193 WeakPolarHBondContact O-CA 3.41Å; V190-A193 WeakPolarHBondContact O-CB 3.27Å; V190-A193 PolarHBondContact O-N 2.99Å; V190-F194 HydrophobicContact CG1-CD2 3.86Å; V190-F194 HydrophobicContact CG1-CE2 3.72Å; V190-F194 WeakPolarHBondContact O-CD2 3.38Å; V190-F194 PolarHBondContact O-N 3.32Å
191	E	88.7	Confident	89.9	Confident	2 Å²	2	67.8 Å²	67.8	1%	0.009	33%	0.334	C	S	.	.	H	α-helix	trans	-59.8	-43	177.6	-157.5	-178.6	156	0	0	113.1	R138 Y142 Y179 Y187 L189 A193 F194 Y195	R138-E191 IonicContact CZ-OE1 2.64Å; R138-E191 IonicContact CZ-OE2 3.83Å; R138-E191 VanDerWaalsContact NE-CD 3.32Å; R138-E191 IonicContact NE-OE1 3.21Å; R138-E191 PolarHBondContact NE-OE1 2.92Å; R138-E191 IonicContact NE-OE2 3.5Å; R138-E191 PolarHBondContact NE-OE2 3.35Å; R138-E191 IonicContact NH2-OE1 3.9Å; R138-E191 PolarHBondContact NH2-OE1 2.89Å; R138-E191 IonicContact NH2-OE2 3.79Å; R138-E191 PolarHBondContact NH2-OE2 2.88Å; Y142-E191 WeakPolarHBondContact OH-CG 3.26Å; Y179-E191 HydrophobicContact CD1-CG 4.36Å; Y179-E191 HydrophobicContact CE1-CB 3.87Å; Y179-E191 HydrophobicContact CE1-CG 4.02Å; Y187-E191 PolarHBondContact O-N 3.32Å; L189-E191 VanDerWaalsContact C-N 3.31Å; E191-A193 VanDerWaalsContact C-N 3.3Å; E191-A193 PolarHBondContact O-N 3Å; E191-F194 PolarHBondContact O-N 3.16Å; E191-Y195 HydrophobicContact CG-CE2 3.85Å; E191-Y195 WeakPolarHBondContact O-CD2 3.32Å; E191-Y195 PolarHBondContact O-N 3.43Å; E191-Y195 PolarHBondContact OE1-OH 3.22Å; E191-Y195 VanDerWaalsContact OE1-OH 3.05Å
192	L	91	Very high	90	Very high	28 Å²	28	62.2 Å²	62.2	15%	0.147	31%	0.31	C	S	.	.	H	α-helix	trans	-61	-41	173	177.3	62.9	0	0	0	111.3	K188 L189 V190 F194 Y195 L196 V229 K233	K188-L192 PolarHBondContact O-N 3.36Å; L189-L192 PolarHBondContact O-N 3.31Å; V190-L192 VanDerWaalsContact C-N 3.34Å; V190-L192 PolarHBondContact O-N 2.92Å; L192-F194 VanDerWaalsContact C-N 3.34Å; L192-F194 PolarHBondContact O-N 2.98Å; L192-Y195 PolarHBondContact O-N 3.32Å; L192-L196 HydrophobicContact CD1-CD1 4.15Å; L192-L196 HydrophobicContact CD1-CD2 4.42Å; L192-L196 HydrophobicContact CD1-CG 4Å; L192-L196 HydrophobicContact CD2-CD1 4.43Å; L192-L196 HydrophobicContact CG-CD1 3.95Å; L192-L196 HydrophobicContact CG-CG 4.23Å; L192-L196 WeakPolarHBondContact O-CG 3.26Å; L192-L196 PolarHBondContact O-N 3.32Å; L192-V229 HydrophobicContact CD1-CG1 3.76Å; L192-V229 HydrophobicContact CD1-CG2 4.41Å; L192-V229 HydrophobicContact CD2-CG1 4.24Å; L192-K233 VanDerWaalsContact CD2-CE 3.46Å
193	A	93.6	Very high	90	Very high	49 Å²	49	59 Å²	59	41%	0.405	30%	0.298	S	S	.	.	H	α-helix	trans	-62.8	-39.1	177.2	0	0	0	0	0	112.1	L189 V190 E191 T197	L189-A193 PolarHBondContact O-N 2.88Å; V190-A193 WeakPolarHBondContact O-CA 3.41Å; V190-A193 WeakPolarHBondContact O-CB 3.27Å; V190-A193 PolarHBondContact O-N 2.99Å; E191-A193 VanDerWaalsContact C-N 3.3Å; E191-A193 PolarHBondContact O-N 3Å; A193-T197 VanDerWaalsContact O-CB 3.24Å; A193-T197 WeakPolarHBondContact O-CB 3.26Å; A193-T197 PolarHBondContact O-N 3.38Å; A193-T197 PolarHBondContact O-OG1 3.25Å
194	F	93.6	Very high	90.1	Very high	51 Å²	51	55.7 Å²	55.7	22%	0.224	29%	0.291	C	S	.	.	H	α-helix	trans	-60.7	-48.7	172	-87.4	-94.2	0	0	0	111.3	Y142 M172 A175 V190 E191 L192 L196 T197 M198	Y142-F194 HydrophobicContact CE1-CB 3.73Å; M172-F194 HydrophobicContact CE-CD1 3.45Å; M172-F194 VanDerWaalsContact CE-CD1 3.45Å; M172-F194 HydrophobicContact CE-CE1 3.8Å; M172-F194 HydrophobicContact CE-CG 4.38Å; M172-F194 HydrophobicContact SD-CD1 4.45Å; M172-F194 HydrophobicContact SD-CE1 4.32Å; A175-F194 HydrophobicContact CB-CE1 4.15Å; V190-F194 HydrophobicContact CG1-CD2 3.86Å; V190-F194 HydrophobicContact CG1-CE2 3.72Å; V190-F194 WeakPolarHBondContact O-CD2 3.38Å; V190-F194 PolarHBondContact O-N 3.32Å; E191-F194 PolarHBondContact O-N 3.16Å; L192-F194 VanDerWaalsContact C-N 3.34Å; L192-F194 PolarHBondContact O-N 2.98Å; F194-L196 PolarHBondContact O-N 3.19Å; F194-T197 PolarHBondContact O-N 2.73Å; F194-M198 WeakPolarHBondContact O-CB 3.31Å; F194-M198 WeakPolarHBondContact O-CG 3.42Å; F194-M198 PolarHBondContact O-N 3.18Å
195	Y	93.4	Very high	90.5	Very high	29 Å²	29	53.7 Å²	53.7	11%	0.114	28%	0.282	C	S	.	.	H	α-helix	trans	-58.9	-46.6	177.9	-65.4	-41.1	0	0	0	112.7	R138 I141 Y142 I145 E191 L192 M198 G199	R138-Y195 PolarHBondContact O-OH 3.06Å; I141-Y195 HydrophobicContact CB-CE1 3.83Å; I141-Y195 HydrophobicContact CG2-CD1 3.78Å; I141-Y195 HydrophobicContact CG2-CE1 3.5Å; I141-Y195 HydrophobicContact CG2-CG 4.43Å; Y142-Y195 AromaticContact CD1-CD1 3.7Å; Y142-Y195 HydrophobicContact CD1-CD1 3.7Å; Y142-Y195 AromaticContact CD1-CE1 3.55Å; Y142-Y195 HydrophobicContact CD1-CE1 3.55Å; Y142-Y195 AromaticContact CD2-CE1 3.64Å; Y142-Y195 HydrophobicContact CD2-CE1 3.64Å; Y142-Y195 AromaticContact CE1-CD1 3.3Å; Y142-Y195 HydrophobicContact CE1-CD1 3.3Å; Y142-Y195 AromaticContact CE1-CE1 3.23Å; Y142-Y195 HydrophobicContact CE1-CE1 3.23Å; Y142-Y195 HydrophobicContact CE1-CG 4.31Å; Y142-Y195 HydrophobicContact CE2-CD1 4.28Å; Y142-Y195 AromaticContact CE2-CE1 3.34Å; Y142-Y195 HydrophobicContact CE2-CE1 3.34Å; Y142-Y195 AromaticContact CE2-CZ 3.68Å; Y142-Y195 HydrophobicContact CG-CD1 4.33Å; Y142-Y195 AromaticContact CG-CE1 3.74Å; Y142-Y195 HydrophobicContact CG-CE1 3.74Å; Y142-Y195 AromaticContact CZ-CD1 3.66Å; Y142-Y195 AromaticContact CZ-CE1 3.14Å; Y142-Y195 AromaticContact CZ-CZ 3.65Å; I145-Y195 HydrophobicContact CD1-CD1 4Å; E191-Y195 HydrophobicContact CG-CE2 3.85Å; E191-Y195 WeakPolarHBondContact O-CD2 3.32Å; E191-Y195 PolarHBondContact O-N 3.43Å; E191-Y195 PolarHBondContact OE1-OH 3.22Å; E191-Y195 VanDerWaalsContact OE1-OH 3.05Å; L192-Y195 PolarHBondContact O-N 3.32Å; Y195-M198 PolarHBondContact O-N 3.12Å; Y195-G199 PolarHBondContact O-N 3.38Å
196	L	94.4	Very high	90.9	Very high	65 Å²	65	54.8 Å²	54.8	34%	0.34	29%	0.291	S	S	.	.	H	α-helix	trans	-65.7	-43.2	178.5	-66.1	176.6	0	0	0	111.3	L192 F194 M198 G199 F200	L192-L196 HydrophobicContact CD1-CD1 4.15Å; L192-L196 HydrophobicContact CD1-CD2 4.42Å; L192-L196 HydrophobicContact CD1-CG 4Å; L192-L196 HydrophobicContact CD2-CD1 4.43Å; L192-L196 HydrophobicContact CG-CD1 3.95Å; L192-L196 HydrophobicContact CG-CG 4.23Å; L192-L196 WeakPolarHBondContact O-CG 3.26Å; L192-L196 PolarHBondContact O-N 3.32Å; F194-L196 PolarHBondContact O-N 3.19Å; L196-M198 VanDerWaalsContact C-N 3.3Å; L196-M198 PolarHBondContact O-N 3.31Å; L196-G199 CarbonylContact O-C 3.55Å; L196-G199 PolarHBondContact O-N 3.5Å; L196-G199 VanDerWaalsContact O-N 3.08Å; L196-F200 HydrophobicContact CB-CD2 4.39Å; L196-F200 HydrophobicContact CD2-CE2 4.05Å; L196-F200 WeakPolarHBondContact O-CB 3.37Å; L196-F200 VanDerWaalsContact O-CD2 3.28Å; L196-F200 WeakPolarHBondContact O-CD2 3.36Å; L196-F200 PolarHBondContact O-N 3.22Å
197	T	95.8	Very high	91.2	Very high	62 Å²	62	55.6 Å²	55.6	38%	0.38	30%	0.304	S	S	.	.	H	α-helix	trans	-59.6	-44.8	177.8	-58.7	0	0	0	0	110.7	F168 M172 A193 F194 G199 F200 F201	F168-T197 HydrophobicContact CZ-CG2 3.99Å; M172-T197 HydrophobicContact CE-CG2 4.2Å; A193-T197 VanDerWaalsContact O-CB 3.24Å; A193-T197 WeakPolarHBondContact O-CB 3.26Å; A193-T197 PolarHBondContact O-N 3.38Å; A193-T197 PolarHBondContact O-OG1 3.25Å; F194-T197 PolarHBondContact O-N 2.73Å; T197-G199 VanDerWaalsContact C-N 3.33Å; T197-G199 PolarHBondContact O-N 3.02Å; T197-F200 PolarHBondContact O-N 3.39Å; T197-F201 HydrophobicContact CG2-CB 4.38Å; T197-F201 WeakPolarHBondContact O-CB 3.34Å; T197-F201 PolarHBondContact O-N 3.29Å
198	M	95.6	Very high	91.1	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-66.1	-32.7	175.1	-72.4	-170.8	68	0	0	113.5	Y142 I145 A146 Y149 V169 M172 A173 F194 Y195 L196 P202	Y142-M198 HydrophobicContact CD1-SD 3.68Å; Y142-M198 HydrophobicContact CE1-SD 4.37Å; I145-M198 HydrophobicContact CB-CE 4.37Å; I145-M198 HydrophobicContact CG2-CB 3.79Å; I145-M198 HydrophobicContact CG2-CE 4.23Å; A146-M198 HydrophobicContact CB-CE 4.23Å; Y149-M198 WeakPolarHBondContact CE2-O 3.24Å; V169-M198 WeakPolarHBondContact O-CE 3.46Å; M172-M198 HydrophobicContact CB-CE 4.05Å; M172-M198 HydrophobicContact CB-CG 3.59Å; M172-M198 HydrophobicContact CB-SD 3.58Å; M172-M198 VanDerWaalsContact CB-SD 3.58Å; M172-M198 HydrophobicContact CE-CG 4.2Å; M172-M198 HydrophobicContact CG-CG 4.3Å; A173-M198 HydrophobicContact CB-CE 4.06Å; F194-M198 WeakPolarHBondContact O-CB 3.31Å; F194-M198 WeakPolarHBondContact O-CG 3.42Å; F194-M198 PolarHBondContact O-N 3.18Å; Y195-M198 PolarHBondContact O-N 3.12Å; L196-M198 VanDerWaalsContact C-N 3.3Å; L196-M198 PolarHBondContact O-N 3.31Å; M198-P202 WeakPolarHBondContact O-CD 3.48Å; M198-P202 VanDerWaalsContact O-CG 3.26Å; M198-P202 WeakPolarHBondContact O-CG 3.3Å
199	G	93.1	Very high	91.1	Very high	30 Å²	30	51 Å²	51	31%	0.309	29%	0.294	S	S	.	.	H	α-helix	trans	-82	-14.6	179.1	0	0	0	0	0	115.4	Y149 Y195 L196 T197	Y149-G199 PolarHBondContact OH-O 3.21Å; Y195-G199 PolarHBondContact O-N 3.38Å; L196-G199 CarbonylContact O-C 3.55Å; L196-G199 PolarHBondContact O-N 3.5Å; L196-G199 VanDerWaalsContact O-N 3.08Å; T197-G199 VanDerWaalsContact C-N 3.33Å; T197-G199 PolarHBondContact O-N 3.02Å
200	F	94.4	Very high	90.9	Very high	126 Å²	126	49.7 Å²	49.7	55%	0.553	30%	0.296	S	S	*	.	H	α-helix	trans	-116.2	-42.6	-178.5	-78.4	-80	0	0	0	113.1	L196 T197 A203 C226	L196-F200 HydrophobicContact CB-CD2 4.39Å; L196-F200 HydrophobicContact CD2-CE2 4.05Å; L196-F200 WeakPolarHBondContact O-CB 3.37Å; L196-F200 VanDerWaalsContact O-CD2 3.28Å; L196-F200 WeakPolarHBondContact O-CD2 3.36Å; L196-F200 PolarHBondContact O-N 3.22Å; T197-F200 PolarHBondContact O-N 3.39Å; F200-A203 VanDerWaalsContact O-CB 3.27Å; F200-A203 WeakPolarHBondContact O-CB 3.42Å; F200-A203 PolarHBondContact O-N 3.1Å; F200-A203 VanDerWaalsContact O-N 3.1Å; F200-C226 VanDerWaalsContact CZ-SG 3.57Å
201	F	94	Very high	90.6	Very high	101 Å²	101	50.4 Å²	50.4	44%	0.443	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-63	-44.4	-172.3	-171.2	-105.6	0	0	0	113.6	M165 F168 T197 A203 S204	M165-F201 HydrophobicContact CE-CD1 4.12Å; M165-F201 HydrophobicContact CE-CE1 3.52Å; M165-F201 HydrophobicContact CE-CZ 4.04Å; M165-F201 HydrophobicContact SD-CD1 3.71Å; M165-F201 HydrophobicContact SD-CE1 3.69Å; F168-F201 AromaticContact CD1-CD1 3.81Å; F168-F201 HydrophobicContact CD1-CD1 3.81Å; F168-F201 HydrophobicContact CD1-CE1 4.47Å; F168-F201 AromaticContact CD2-CD1 3.95Å; F168-F201 HydrophobicContact CD2-CD1 3.95Å; F168-F201 AromaticContact CD2-CE1 3.89Å; F168-F201 HydrophobicContact CD2-CE1 3.89Å; F168-F201 HydrophobicContact CE1-CB 3.99Å; F168-F201 AromaticContact CE1-CD1 3.47Å; F168-F201 HydrophobicContact CE1-CD1 3.47Å; F168-F201 VanDerWaalsContact CE1-CD1 3.47Å; F168-F201 HydrophobicContact CE1-CE1 4.37Å; F168-F201 HydrophobicContact CE1-CG 4.15Å; F168-F201 AromaticContact CE2-CD1 3.61Å; F168-F201 HydrophobicContact CE2-CD1 3.61Å; F168-F201 AromaticContact CE2-CE1 3.77Å; F168-F201 HydrophobicContact CE2-CE1 3.77Å; F168-F201 HydrophobicContact CG-CD1 4.03Å; F168-F201 HydrophobicContact CG-CE1 4.24Å; F168-F201 HydrophobicContact CZ-CB 4.09Å; F168-F201 AromaticContact CZ-CD1 3.35Å; F168-F201 HydrophobicContact CZ-CD1 3.35Å; F168-F201 HydrophobicContact CZ-CE1 4.01Å; F168-F201 AromaticContact CZ-CG 3.98Å; F168-F201 HydrophobicContact CZ-CG 3.98Å; T197-F201 HydrophobicContact CG2-CB 4.38Å; T197-F201 WeakPolarHBondContact O-CB 3.34Å; T197-F201 PolarHBondContact O-N 3.29Å; F201-A203 PolarHBondContact O-N 2.86Å; F201-S204 VanDerWaalsContact O-CB 3.29Å; F201-S204 WeakPolarHBondContact O-CB 3.36Å; F201-S204 PolarHBondContact O-N 2.72Å; F201-S204 VanDerWaalsContact O-N 3.12Å; F201-S204 PolarHBondContact O-OG 2.66Å
202	P	92.2	Very high	90.6	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-65.2	-22.3	176.2	-18.7	32.7	0	0	0	113.3	Y149 M165 F168 V169 M198 S204 V205	Y149-P202 HydrophobicContact CD1-CB 3.94Å; Y149-P202 HydrophobicContact CD2-CB 4.19Å; Y149-P202 HydrophobicContact CD2-CG 4.22Å; Y149-P202 HydrophobicContact CE1-CB 3.82Å; Y149-P202 HydrophobicContact CE2-CB 4.08Å; Y149-P202 HydrophobicContact CE2-CG 3.97Å; Y149-P202 HydrophobicContact CG-CB 4.13Å; M165-P202 HydrophobicContact CB-CB 4.39Å; F168-P202 HydrophobicContact CD1-CG 4.03Å; F168-P202 HydrophobicContact CE1-CG 4.18Å; V169-P202 HydrophobicContact CG1-CB 3.81Å; V169-P202 HydrophobicContact CG1-CG 3.31Å; M198-P202 WeakPolarHBondContact O-CD 3.48Å; M198-P202 VanDerWaalsContact O-CG 3.26Å; M198-P202 WeakPolarHBondContact O-CG 3.3Å; P202-S204 PolarHBondContact O-N 2.57Å; P202-V205 WeakPolarHBondContact O-CG1 3.42Å; P202-V205 VanDerWaalsContact O-CG2 3.3Å; P202-V205 WeakPolarHBondContact O-CG2 3.43Å; P202-V205 PolarHBondContact O-N 2.64Å
203	A	90.9	Very high	90.6	Very high	40 Å²	40	57.1 Å²	57.1	33%	0.331	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-67.1	-12.2	176	0	0	0	0	0	112.9	F200 F201 V205 V206	F200-A203 VanDerWaalsContact O-CB 3.27Å; F200-A203 WeakPolarHBondContact O-CB 3.42Å; F200-A203 PolarHBondContact O-N 3.1Å; F200-A203 VanDerWaalsContact O-N 3.1Å; F201-A203 PolarHBondContact O-N 2.86Å; A203-V205 PolarHBondContact O-N 3.11Å; A203-V205 VanDerWaalsContact O-N 3.13Å; A203-V206 VanDerWaalsContact O-CB 3.31Å; A203-V206 WeakPolarHBondContact O-CB 3.33Å; A203-V206 WeakPolarHBondContact O-CG2 3.14Å; A203-V206 PolarHBondContact O-N 3.27Å; A203-V206 VanDerWaalsContact O-N 3.14Å
204	S	91	Very high	90.4	Very high	41 Å²	41	55 Å²	55	29%	0.287	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-59	-21.5	173.3	61.1	0	0	0	0	113.9	F201 P202 V206 T207	F201-S204 VanDerWaalsContact O-CB 3.29Å; F201-S204 WeakPolarHBondContact O-CB 3.36Å; F201-S204 PolarHBondContact O-N 2.72Å; F201-S204 VanDerWaalsContact O-N 3.12Å; F201-S204 PolarHBondContact O-OG 2.66Å; P202-S204 PolarHBondContact O-N 2.57Å; S204-V206 PolarHBondContact O-N 3.14Å; S204-V206 VanDerWaalsContact O-N 3.07Å; S204-T207 WeakPolarHBondContact O-CB 3.4Å; S204-T207 WeakPolarHBondContact O-CG2 3.32Å; S204-T207 PolarHBondContact O-N 2.9Å; S204-T207 VanDerWaalsContact O-N 3.1Å; S204-T207 PolarHBondContact O-OG1 3.04Å
205	V	90.4	Very high	90.4	Very high	7 Å²	7	54.7 Å²	54.7	4%	0.042	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-59.9	-18.7	175.2	-59.4	0	0	0	0	113.6	L153 L158 L161 A162 M165 P202 A203 T207 S208 M209	L153-V205 HydrophobicContact CD2-CG1 3.98Å; L153-V205 HydrophobicContact CD2-CG2 4.21Å; L158-V205 HydrophobicContact CD1-CB 4.35Å; L158-V205 HydrophobicContact CD1-CG2 4.2Å; L158-V205 HydrophobicContact CD2-CB 4.38Å; L158-V205 HydrophobicContact CD2-CG2 4.47Å; L161-V205 HydrophobicContact CD2-CG1 4.41Å; L161-V205 HydrophobicContact CG-CG1 4.19Å; A162-V205 HydrophobicContact CB-CG1 4.49Å; M165-V205 HydrophobicContact CB-CG1 3.99Å; M165-V205 HydrophobicContact CG-CG1 3.55Å; P202-V205 WeakPolarHBondContact O-CG1 3.42Å; P202-V205 VanDerWaalsContact O-CG2 3.3Å; P202-V205 WeakPolarHBondContact O-CG2 3.43Å; P202-V205 PolarHBondContact O-N 2.64Å; A203-V205 PolarHBondContact O-N 3.11Å; A203-V205 VanDerWaalsContact O-N 3.13Å; V205-T207 PolarHBondContact O-N 3.29Å; V205-S208 PolarHBondContact O-N 3Å; V205-M209 HydrophobicContact CG2-CE 4.31Å; V205-M209 PolarHBondContact O-N 2.94Å
206	V	88	Confident	90.5	Very high	50 Å²	50	61.1 Å²	61.1	30%	0.303	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-57.2	-29.9	174.9	172.1	0	0	0	0	111.8	A203 S204 S208 M209 L215	A203-V206 VanDerWaalsContact O-CB 3.31Å; A203-V206 WeakPolarHBondContact O-CB 3.33Å; A203-V206 WeakPolarHBondContact O-CG2 3.14Å; A203-V206 PolarHBondContact O-N 3.27Å; A203-V206 VanDerWaalsContact O-N 3.14Å; S204-V206 PolarHBondContact O-N 3.14Å; S204-V206 VanDerWaalsContact O-N 3.07Å; V206-S208 PolarHBondContact O-N 3.38Å; V206-M209 HydrophobicContact CG2-SD 4.17Å; V206-M209 WeakPolarHBondContact O-CB 3.47Å; V206-M209 PolarHBondContact O-N 3Å; V206-L215 HydrophobicContact CB-CD1 4.22Å; V206-L215 HydrophobicContact CG1-CD1 3.72Å; V206-L215 HydrophobicContact CG1-CD2 3.53Å; V206-L215 HydrophobicContact CG1-CG 4.27Å; V206-L215 HydrophobicContact CG2-CD1 3.39Å
207	T	86.6	Confident	90.6	Very high	119 Å²	119	59.7 Å²	59.7	73%	0.73	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-64.1	-18.8	175	60.4	0	0	0	0	113.9	S204 V205	S204-T207 WeakPolarHBondContact O-CB 3.4Å; S204-T207 WeakPolarHBondContact O-CG2 3.32Å; S204-T207 PolarHBondContact O-N 2.9Å; S204-T207 VanDerWaalsContact O-N 3.1Å; S204-T207 PolarHBondContact O-OG1 3.04Å; V205-T207 PolarHBondContact O-N 3.29Å
208	S	85.7	Confident	90.5	Very high	53 Å²	53	58.3 Å²	58.3	37%	0.371	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-109.4	8.8	179.8	-55	0	0	0	0	112.6	V205 V206	V205-S208 PolarHBondContact O-N 3Å; V206-S208 PolarHBondContact O-N 3.38Å
209	M	83.9	Confident	90.6	Very high	24 Å²	24	60.9 Å²	60.9	12%	0.118	35%	0.354	C	S	.	.	B	Isolated β-bridge	trans	-84.2	125	179.4	-79.9	-175.7	174.6	0	0	111	L158 V205 V206	L158-M209 HydrophobicContact CD2-CB 4.43Å; L158-M209 HydrophobicContact CD2-CE 3.75Å; L158-M209 HydrophobicContact CD2-CG 3.29Å; L158-M209 HydrophobicContact CD2-SD 4.37Å; V205-M209 HydrophobicContact CG2-CE 4.31Å; V205-M209 PolarHBondContact O-N 2.94Å; V206-M209 HydrophobicContact CG2-SD 4.17Å; V206-M209 WeakPolarHBondContact O-CB 3.47Å; V206-M209 PolarHBondContact O-N 3Å
210	S	82.4	Confident	90.8	Very high	108 Å²	108	62.4 Å²	62.4	76%	0.755	36%	0.359	S	S	*	.	S	Bend	trans	-79.8	-40.7	169.9	53.4	0	0	0	0	112.1
211	N	84.6	Confident	90.9	Very high	73 Å²	73	56.4 Å²	56.4	39%	0.39	33%	0.333	S	S	.	.			trans	-98.7	125.3	173.8	179.2	-31.1	0	0	0	109.3	R156 D213	R156-N211 PolarHBondContact NE-O 2.87Å; R156-N211 PolarHBondContact NH2-O 2.98Å; R156-N211 PolarHBondContact NH2-OD1 3.33Å; N211-D213 PolarHBondContact ND2-OD2 2.93Å; N211-D213 WeakPolarHBondContact OD1-CB 3.29Å; N211-D213 PolarHBondContact OD1-N 3.37Å; N211-D213 PolarHBondContact OD1-OD2 2.64Å; N211-D213 VanDerWaalsContact OD1-OD2 3.04Å
212	T	87.6	Confident	91	Very high	87 Å²	87	52.9 Å²	52.9	53%	0.534	33%	0.325	S	S	.	.			trans	-101.6	6.2	-178.2	54.9	0	0	0	0	114.4	L215	T212-L215 WeakPolarHBondContact O-CB 3.02Å; T212-L215 PolarHBondContact O-N 3.38Å; T212-L215 VanDerWaalsContact O-N 3.16Å
213	D	90.9	Very high	91.2	Very high	85 Å²	85	58.4 Å²	58.4	46%	0.455	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	143.1	176.9	-61.3	-25.6	0	0	0	111.2	R156 N211 L215 Y263	R156-D213 PolarHBondContact NH1-O 3.46Å; R156-D213 PolarHBondContact NH2-O 2.9Å; N211-D213 PolarHBondContact ND2-OD2 2.93Å; N211-D213 WeakPolarHBondContact OD1-CB 3.29Å; N211-D213 PolarHBondContact OD1-N 3.37Å; N211-D213 PolarHBondContact OD1-OD2 2.64Å; N211-D213 VanDerWaalsContact OD1-OD2 3.04Å; D213-L215 PolarHBondContact O-N 3.41Å; D213-L215 VanDerWaalsContact O-N 3.12Å; D213-Y263 HydrophobicContact CB-CD1 3.57Å; D213-Y263 HydrophobicContact CB-CE1 3.9Å; D213-Y263 HydrophobicContact CB-CG 4.29Å
214	G	90.8	Very high	91.6	Very high	3 Å²	3	57.6 Å²	57.6	3%	0.031	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.9	-8.7	-177.8	0	0	0	0	0	115.5	Q216 E217 L218	G214-Q216 VanDerWaalsContact C-N 3.31Å; G214-Q216 PolarHBondContact O-N 3.05Å; G214-E217 VanDerWaalsContact C-OE2 3.28Å; G214-E217 WeakPolarHBondContact CA-OE2 3.41Å; G214-E217 PolarHBondContact O-N 3Å; G214-L218 WeakPolarHBondContact O-CG 3.47Å; G214-L218 PolarHBondContact O-N 2.94Å
215	L	92.5	Very high	91.9	Very high	46 Å²	46	58.7 Å²	58.7	24%	0.241	34%	0.342	C	S	.	.	H	α-helix	trans	-68.8	-32.6	-177.9	-167.7	66.9	0	0	0	112.1	V206 T212 D213 L218 A219	V206-L215 HydrophobicContact CB-CD1 4.22Å; V206-L215 HydrophobicContact CG1-CD1 3.72Å; V206-L215 HydrophobicContact CG1-CD2 3.53Å; V206-L215 HydrophobicContact CG1-CG 4.27Å; V206-L215 HydrophobicContact CG2-CD1 3.39Å; T212-L215 WeakPolarHBondContact O-CB 3.02Å; T212-L215 PolarHBondContact O-N 3.38Å; T212-L215 VanDerWaalsContact O-N 3.16Å; D213-L215 PolarHBondContact O-N 3.41Å; D213-L215 VanDerWaalsContact O-N 3.12Å; L215-L218 PolarHBondContact O-N 3.05Å; L215-A219 WeakPolarHBondContact O-CB 3.48Å; L215-A219 PolarHBondContact O-N 2.88Å
216	Q	94.8	Very high	92.1	Very high	164 Å²	164	60.6 Å²	60.6	77%	0.766	36%	0.356	S	S	*	.	H	α-helix	trans	-65.2	-41.9	175.6	-69.5	-173.4	-14.3	0	0	111.2	G214 A219 C220	G214-Q216 VanDerWaalsContact C-N 3.31Å; G214-Q216 PolarHBondContact O-N 3.05Å; Q216-A219 PolarHBondContact O-N 2.95Å; Q216-C220 VanDerWaalsContact O-CB 3.24Å; Q216-C220 WeakPolarHBondContact O-CB 3.44Å; Q216-C220 PolarHBondContact O-N 2.97Å
217	E	96.8	Very high	92.5	Very high	35 Å²	35	63.1 Å²	63.1	16%	0.164	37%	0.367	C	S	.	.	H	α-helix	trans	-67.9	-41.2	177.1	-66.1	83.4	164.6	0	0	111	G214 C220 G221 V255 Y258 A259 Y263	G214-E217 VanDerWaalsContact C-OE2 3.28Å; G214-E217 WeakPolarHBondContact CA-OE2 3.41Å; G214-E217 PolarHBondContact O-N 3Å; E217-C220 PolarHBondContact O-N 2.97Å; E217-G221 PolarHBondContact O-N 3.18Å; E217-V255 HydrophobicContact CB-CG1 4.12Å; E217-V255 WeakPolarHBondContact O-CG1 3.41Å; E217-Y258 HydrophobicContact CG-CD1 4.19Å; E217-Y258 HydrophobicContact CG-CE1 4.27Å; E217-A259 HydrophobicContact CB-CB 3.69Å; E217-A259 HydrophobicContact CG-CB 4.49Å; E217-Y263 VanDerWaalsContact CD-CE2 3.47Å; E217-Y263 HydrophobicContact CG-CE2 4.27Å; E217-Y263 VanDerWaalsContact OE1-CE2 3.28Å; E217-Y263 WeakPolarHBondContact OE1-CE2 3.41Å; E217-Y263 VanDerWaalsContact OE1-CZ 3.32Å; E217-Y263 PolarHBondContact OE1-OH 3.33Å
218	L	95.5	Very high	92.9	Very high	32 Å²	32	57.5 Å²	57.5	17%	0.168	33%	0.333	C	S	.	.	H	α-helix	trans	-61.8	-43.2	173	-70.3	177.5	0	0	0	112.2	W152 G214 L215 G222 H256	W152-L218 HydrophobicContact CD2-CD1 3.86Å; W152-L218 HydrophobicContact CE3-CD1 4.06Å; W152-L218 HydrophobicContact CH2-CD1 3.98Å; W152-L218 HydrophobicContact CH2-CG 4.27Å; W152-L218 HydrophobicContact CZ2-CD1 3.77Å; W152-L218 HydrophobicContact CZ2-CD2 3.73Å; W152-L218 HydrophobicContact CZ2-CG 3.82Å; W152-L218 HydrophobicContact CZ3-CD1 4.13Å; G214-L218 WeakPolarHBondContact O-CG 3.47Å; G214-L218 PolarHBondContact O-N 2.94Å; L215-L218 PolarHBondContact O-N 3.05Å; L218-G222 PolarHBondContact O-N 2.92Å; L218-H256 WeakPolarHBondContact CD2-ND1 3.28Å
219	A	95.8	Very high	93.3	Very high	55 Å²	55	56.8 Å²	56.8	46%	0.455	33%	0.326	S	S	.	.	H	α-helix	trans	-65	-44.5	176.2	0	0	0	0	0	111.2	L215 Q216 G222 L223	L215-A219 WeakPolarHBondContact O-CB 3.48Å; L215-A219 PolarHBondContact O-N 2.88Å; Q216-A219 PolarHBondContact O-N 2.95Å; A219-G222 PolarHBondContact O-N 3.38Å; A219-L223 VanDerWaalsContact O-CG 3.31Å; A219-L223 WeakPolarHBondContact O-CG 3.4Å; A219-L223 PolarHBondContact O-N 2.91Å
220	C	97.7	Very high	93.8	Very high	61 Å²	61	61.5 Å²	61.5	41%	0.412	35%	0.346	S	S	.	.	H	α-helix	trans	-59.8	-50	176.2	-176.2	0	0	0	0	111.4	Q216 E217 G222 L223 I224 V255	Q216-C220 VanDerWaalsContact O-CB 3.24Å; Q216-C220 WeakPolarHBondContact O-CB 3.44Å; Q216-C220 PolarHBondContact O-N 2.97Å; E217-C220 PolarHBondContact O-N 2.97Å; C220-G222 PolarHBondContact O-N 3.39Å; C220-L223 PolarHBondContact O-N 3.49Å; C220-I224 VanDerWaalsContact O-CG1 3.27Å; C220-I224 WeakPolarHBondContact O-CG1 3.33Å; C220-I224 PolarHBondContact O-N 3.49Å; C220-V255 HydrophobicContact CB-CG1 4.5Å
221	G	97.3	Very high	94.3	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-59.4	-43.5	175.9	0	0	0	0	0	112.7	E217 L223 I224 Y225	E217-G221 PolarHBondContact O-N 3.18Å; G221-L223 PolarHBondContact O-N 3.13Å; G221-I224 PolarHBondContact O-N 2.81Å; G221-Y225 WeakPolarHBondContact O-CD2 3.38Å; G221-Y225 PolarHBondContact O-N 3.11Å
222	G	96.2	Very high	94.6	Very high	27 Å²	27	57 Å²	57	28%	0.278	31%	0.309	S	S	.	.	H	α-helix	trans	-60	-41.7	174.4	0	0	0	0	0	113.3	L218 A219 C220 Y225 C226 H256	L218-G222 PolarHBondContact O-N 2.92Å; A219-G222 PolarHBondContact O-N 3.38Å; C220-G222 PolarHBondContact O-N 3.39Å; G222-Y225 PolarHBondContact O-N 3.36Å; G222-C226 PolarHBondContact O-N 3.39Å; G222-C226 PolarHBondContact O-SG 2.87Å; G222-H256 PolarHBondContact N-NE2 3.15Å
223	L	97	Very high	94.7	Very high	117 Å²	117	57 Å²	57	61%	0.613	30%	0.302	S	S	*	.	H	α-helix	trans	-65.2	-41.6	174.6	-71.3	173	0	0	0	111.7	A219 C220 G221 Y225 C226 L227	A219-L223 VanDerWaalsContact O-CG 3.31Å; A219-L223 WeakPolarHBondContact O-CG 3.4Å; A219-L223 PolarHBondContact O-N 2.91Å; C220-L223 PolarHBondContact O-N 3.49Å; G221-L223 PolarHBondContact O-N 3.13Å; L223-Y225 VanDerWaalsContact C-N 3.32Å; L223-Y225 PolarHBondContact O-N 3.29Å; L223-C226 WeakPolarHBondContact O-CB 3.34Å; L223-C226 PolarHBondContact O-N 2.92Å; L223-C226 VanDerWaalsContact O-N 3.16Å; L223-L227 WeakPolarHBondContact O-CG 3.42Å; L223-L227 PolarHBondContact O-N 3.19Å
224	I	98.1	Very high	94.6	Very high	23 Å²	23	53.7 Å²	53.7	12%	0.118	29%	0.285	C	S	.	.	H	α-helix	trans	-61	-41.8	175.5	-64.1	164.7	0	0	0	110.3	C220 G221 C226 L227 G228 F248 L251 A252 V255	C220-I224 VanDerWaalsContact O-CG1 3.27Å; C220-I224 WeakPolarHBondContact O-CG1 3.33Å; C220-I224 PolarHBondContact O-N 3.49Å; G221-I224 PolarHBondContact O-N 2.81Å; I224-C226 PolarHBondContact O-N 3.31Å; I224-L227 PolarHBondContact O-N 3.13Å; I224-G228 PolarHBondContact O-N 3.18Å; I224-F248 HydrophobicContact CG2-CB 4.43Å; I224-F248 HydrophobicContact CG2-CD1 3.79Å; I224-F248 WeakPolarHBondContact CG2-O 3.5Å; I224-F248 WeakPolarHBondContact O-CD1 3.3Å; I224-L251 HydrophobicContact CD1-CD2 4.17Å; I224-L251 HydrophobicContact CD1-CG 4.16Å; I224-L251 HydrophobicContact CG2-CB 4.26Å; I224-L251 HydrophobicContact CG2-CD2 4.19Å; I224-L251 HydrophobicContact CG2-CG 4.3Å; I224-A252 HydrophobicContact CB-CB 4.01Å; I224-A252 HydrophobicContact CG2-CB 3.79Å; I224-V255 HydrophobicContact CD1-CG2 4.12Å
225	Y	96.6	Very high	94.5	Very high	63 Å²	63	54.8 Å²	54.8	25%	0.247	29%	0.291	C	S	.	.	H	α-helix	trans	-59.8	-45.8	172.4	-81.4	-56.8	0	0	0	112.4	F144 G221 G222 L223 L227 G228 V229 V249 A252 A253 H256	F144-Y225 WeakPolarHBondContact CE1-OH 3.3Å; G221-Y225 WeakPolarHBondContact O-CD2 3.38Å; G221-Y225 PolarHBondContact O-N 3.11Å; G222-Y225 PolarHBondContact O-N 3.36Å; L223-Y225 VanDerWaalsContact C-N 3.32Å; L223-Y225 PolarHBondContact O-N 3.29Å; Y225-L227 VanDerWaalsContact C-N 3.32Å; Y225-L227 PolarHBondContact O-N 3.49Å; Y225-G228 WeakPolarHBondContact O-CA 3.5Å; Y225-G228 PolarHBondContact O-N 3.12Å; Y225-G228 VanDerWaalsContact O-N 3.08Å; Y225-V229 WeakPolarHBondContact O-CG2 3.14Å; Y225-V229 PolarHBondContact O-N 3.11Å; Y225-V249 HydrophobicContact CE1-CB 4.41Å; Y225-V249 HydrophobicContact CE1-CG1 4.24Å; Y225-V249 HydrophobicContact CE1-CG2 4.44Å; Y225-A252 HydrophobicContact CD1-CB 3.72Å; Y225-A252 HydrophobicContact CD2-CB 3.6Å; Y225-A252 HydrophobicContact CE1-CB 3.6Å; Y225-A252 HydrophobicContact CE2-CB 3.49Å; Y225-A252 VanDerWaalsContact CE2-CB 3.49Å; Y225-A252 HydrophobicContact CG-CB 3.7Å; Y225-A252 VanDerWaalsContact CZ-CB 3.46Å; Y225-A253 PolarHBondContact OH-N 3.4Å; Y225-H256 AromaticContact CD2-NE2 3.95Å; Y225-H256 AromaticContact CE2-CD2 3.71Å; Y225-H256 AromaticContact CE2-NE2 3.68Å
226	C	95.1	Very high	94.1	Very high	48 Å²	48	53 Å²	53	32%	0.324	28%	0.283	S	S	.	.	H	α-helix	trans	-60.9	-41.6	179	-66.9	0	0	0	0	112	F200 G222 L223 I224 G228 V229	F200-C226 VanDerWaalsContact CZ-SG 3.57Å; G222-C226 PolarHBondContact O-N 3.39Å; G222-C226 PolarHBondContact O-SG 2.87Å; L223-C226 WeakPolarHBondContact O-CB 3.34Å; L223-C226 PolarHBondContact O-N 2.92Å; L223-C226 VanDerWaalsContact O-N 3.16Å; I224-C226 PolarHBondContact O-N 3.31Å; C226-G228 VanDerWaalsContact C-N 3.33Å; C226-V229 WeakPolarHBondContact O-CB 3.1Å; C226-V229 PolarHBondContact O-N 3.03Å
227	L	96.3	Very high	93.7	Very high	102 Å²	102	48.8 Å²	48.8	53%	0.534	27%	0.269	S	S	.	.	H	α-helix	trans	-64.3	-38.6	173.1	-67.9	174.4	0	0	0	111.5	L223 I224 Y225 V229 F230 F231 F248	L223-L227 WeakPolarHBondContact O-CG 3.42Å; L223-L227 PolarHBondContact O-N 3.19Å; I224-L227 PolarHBondContact O-N 3.13Å; Y225-L227 VanDerWaalsContact C-N 3.32Å; Y225-L227 PolarHBondContact O-N 3.49Å; L227-V229 VanDerWaalsContact C-N 3.31Å; L227-V229 PolarHBondContact O-N 3.1Å; L227-F230 WeakPolarHBondContact O-CB 3.46Å; L227-F230 PolarHBondContact O-N 2.95Å; L227-F231 WeakPolarHBondContact O-CD2 3.37Å; L227-F248 HydrophobicContact CB-CD1 4.03Å; L227-F248 HydrophobicContact CB-CE1 3.76Å; L227-F248 HydrophobicContact CD1-CE1 4.38Å
228	G	95.8	Very high	93.3	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-58.6	-39.8	173.5	0	0	0	0	0	113	I224 Y225 C226 F230 F231 F232 W245	I224-G228 PolarHBondContact O-N 3.18Å; Y225-G228 WeakPolarHBondContact O-CA 3.5Å; Y225-G228 PolarHBondContact O-N 3.12Å; Y225-G228 VanDerWaalsContact O-N 3.08Å; C226-G228 VanDerWaalsContact C-N 3.33Å; G228-F230 PolarHBondContact O-N 3.32Å; G228-F231 PolarHBondContact O-N 3.43Å; G228-F232 PolarHBondContact O-N 2.88Å; G228-W245 VanDerWaalsContact O-CD1 3.27Å
229	V	93.4	Very high	93	Very high	38 Å²	38	48.8 Å²	48.8	23%	0.23	27%	0.27	C	S	.	.	H	α-helix	trans	-58.7	-33	178.5	171.9	0	0	0	0	112	L192 Y225 C226 L227 F231 F232 K233	L192-V229 HydrophobicContact CD1-CG1 3.76Å; L192-V229 HydrophobicContact CD1-CG2 4.41Å; L192-V229 HydrophobicContact CD2-CG1 4.24Å; Y225-V229 WeakPolarHBondContact O-CG2 3.14Å; Y225-V229 PolarHBondContact O-N 3.11Å; C226-V229 WeakPolarHBondContact O-CB 3.1Å; C226-V229 PolarHBondContact O-N 3.03Å; L227-V229 VanDerWaalsContact C-N 3.31Å; L227-V229 PolarHBondContact O-N 3.1Å; V229-F231 PolarHBondContact O-N 2.85Å; V229-F232 PolarHBondContact O-N 2.92Å; V229-K233 PolarHBondContact O-N 3.3Å
230	F	94.3	Very high	92.8	Very high	123 Å²	123	48.9 Å²	48.9	54%	0.539	26%	0.26	S	S	.	.	H	α-helix	trans	-60	-45.1	174.3	171.9	-95.9	0	0	0	111.6	L227 G228 K233 S234 I238	L227-F230 WeakPolarHBondContact O-CB 3.46Å; L227-F230 PolarHBondContact O-N 2.95Å; G228-F230 PolarHBondContact O-N 3.32Å; F230-K233 PolarHBondContact O-N 2.76Å; F230-S234 WeakPolarHBondContact O-CB 3.5Å; F230-S234 PolarHBondContact O-N 3.22Å; F230-S234 PolarHBondContact O-OG 2.94Å; F230-I238 HydrophobicContact CE1-CD1 4.26Å
231	F	93.7	Very high	92.6	Very high	45 Å²	45	46 Å²	46	20%	0.197	24%	0.241	C	C	.	.	H	α-helix	trans	-69.2	-39.8	177.2	-68.2	-75.1	0	0	0	112.1	L227 G228 V229 K233 S234 I238 I244 W245 F248	L227-F231 WeakPolarHBondContact O-CD2 3.37Å; G228-F231 PolarHBondContact O-N 3.43Å; V229-F231 PolarHBondContact O-N 2.85Å; F231-K233 VanDerWaalsContact C-N 3.27Å; F231-K233 PolarHBondContact O-N 3.32Å; F231-S234 WeakPolarHBondContact O-CA 3.42Å; F231-S234 WeakPolarHBondContact O-CB 3.27Å; F231-S234 PolarHBondContact O-N 2.92Å; F231-I238 HydrophobicContact CD1-CD1 4.39Å; F231-I238 HydrophobicContact CE1-CD1 4.4Å; F231-I244 HydrophobicContact CB-CG2 4.27Å; F231-I244 HydrophobicContact CD1-CB 4.29Å; F231-I244 HydrophobicContact CD1-CD1 4.49Å; F231-I244 HydrophobicContact CD1-CG2 3.71Å; F231-I244 HydrophobicContact CD2-CG2 3.85Å; F231-I244 HydrophobicContact CE1-CG2 3.95Å; F231-I244 HydrophobicContact CE2-CG2 4.08Å; F231-I244 HydrophobicContact CG-CB 4.36Å; F231-I244 HydrophobicContact CG-CG2 3.66Å; F231-I244 HydrophobicContact CZ-CG2 4.13Å; F231-W245 HydrophobicContact CB-CB 4.17Å; F231-F248 AromaticContact CD2-CD2 3.89Å; F231-F248 HydrophobicContact CD2-CD2 3.89Å; F231-F248 AromaticContact CD2-CE2 3.62Å; F231-F248 HydrophobicContact CD2-CE2 3.62Å; F231-F248 HydrophobicContact CD2-CZ 4.2Å; F231-F248 HydrophobicContact CE2-CD2 4.12Å; F231-F248 AromaticContact CE2-CE2 3.36Å; F231-F248 HydrophobicContact CE2-CE2 3.36Å; F231-F248 AromaticContact CE2-CZ 3.64Å; F231-F248 HydrophobicContact CE2-CZ 3.64Å; F231-F248 HydrophobicContact CZ-CE2 4.23Å
232	F	90.5	Very high	92.4	Very high	41 Å²	41	47 Å²	47	18%	0.18	25%	0.245	C	C	.	.	H	α-helix	trans	-56.8	-39.1	173.5	177	-108.5	0	0	0	112.8	G228 V229 S234 W245	G228-F232 PolarHBondContact O-N 2.88Å; V229-F232 PolarHBondContact O-N 2.92Å; F232-S234 VanDerWaalsContact C-N 3.26Å; F232-S234 PolarHBondContact O-N 2.87Å; F232-W245 HydrophobicContact CB-CB 4.34Å; F232-W245 HydrophobicContact CB-CD2 4.14Å; F232-W245 HydrophobicContact CB-CG 3.79Å; F232-W245 AromaticContact CD2-CD2 3.85Å; F232-W245 HydrophobicContact CD2-CD2 3.85Å; F232-W245 AromaticContact CD2-CE2 3.93Å; F232-W245 HydrophobicContact CD2-CE3 4.01Å; F232-W245 HydrophobicContact CD2-CG 4.37Å; F232-W245 HydrophobicContact CD2-CH2 4.4Å; F232-W245 HydrophobicContact CD2-CZ2 4.22Å; F232-W245 HydrophobicContact CD2-CZ3 4.29Å; F232-W245 HydrophobicContact CE2-CH2 4.5Å; F232-W245 HydrophobicContact CG-CD2 4.4Å
233	K	89.6	Confident	92.4	Very high	89 Å²	89	46 Å²	46	39%	0.387	24%	0.235	S	C	.	.	H	α-helix	trans	-79	-9.1	175.5	-70.5	-63.9	-174.5	-176.5	0	113.9	K188 L192 V229 F230 F231	K188-K233 PolarHBondContact O-NZ 3.45Å; K188-K233 VanDerWaalsContact O-NZ 3.13Å; L192-K233 VanDerWaalsContact CD2-CE 3.46Å; V229-K233 PolarHBondContact O-N 3.3Å; F230-K233 PolarHBondContact O-N 2.76Å; F231-K233 VanDerWaalsContact C-N 3.27Å; F231-K233 PolarHBondContact O-N 3.32Å
234	S	89.8	Confident	92.3	Very high	14 Å²	14	43.1 Å²	43.1	10%	0.098	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	9.7	-179.8	-59.4	0	0	0	0	113.4	F230 F231 F232 G236 V237 I238	F230-S234 WeakPolarHBondContact O-CB 3.5Å; F230-S234 PolarHBondContact O-N 3.22Å; F230-S234 PolarHBondContact O-OG 2.94Å; F231-S234 WeakPolarHBondContact O-CA 3.42Å; F231-S234 WeakPolarHBondContact O-CB 3.27Å; F231-S234 PolarHBondContact O-N 2.92Å; F232-S234 VanDerWaalsContact C-N 3.26Å; F232-S234 PolarHBondContact O-N 2.87Å; S234-G236 PolarHBondContact O-N 3.44Å; S234-V237 WeakPolarHBondContact O-CA 3.38Å; S234-V237 WeakPolarHBondContact O-CB 3.39Å; S234-V237 PolarHBondContact O-N 2.86Å; S234-I238 PolarHBondContact O-N 2.85Å; S234-I238 VanDerWaalsContact O-N 3.12Å
235	D	87.6	Confident	92.2	Very high	27 Å²	27	43.3 Å²	43.3	14%	0.144	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-52.4	120.9	174.1	-78.8	-5.2	0	0	0	111.5	Y58 V237 H242	Y58-D235 HydrophobicContact CD1-CB 4.29Å; Y58-D235 HydrophobicContact CD2-CB 3.92Å; Y58-D235 HydrophobicContact CE1-CB 4.46Å; Y58-D235 HydrophobicContact CE2-CB 4.09Å; Y58-D235 HydrophobicContact CG-CB 3.94Å; D235-V237 VanDerWaalsContact C-N 3.27Å; D235-V237 PolarHBondContact O-N 3.4Å; D235-H242 WeakPolarHBondContact OD1-CA 3.37Å; D235-H242 WeakPolarHBondContact OD1-CB 3.34Å; D235-H242 IonicContact OD1-CG 2.6Å; D235-H242 PolarHBondContact OD1-N 3.47Å; D235-H242 IonicContact OD1-ND1 3.11Å; D235-H242 IonicContact OD2-CE1 3.52Å; D235-H242 IonicContact OD2-CG 3.83Å; D235-H242 IonicContact OD2-ND1 3.89Å; D235-H242 PolarHBondContact OD2-ND1 2.83Å
236	G	84.1	Confident	92.2	Very high	8 Å²	8	40.3 Å²	40.3	8%	0.082	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.1	6.5	-177.3	0	0	0	0	0	115.3	S234	S234-G236 PolarHBondContact O-N 3.44Å
237	V	87	Confident	92.4	Very high	76 Å²	76	41.8 Å²	41.8	46%	0.461	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-39.3	168.5	-177.9	0	0	0	0	110.5	S234 D235	S234-V237 WeakPolarHBondContact O-CA 3.38Å; S234-V237 WeakPolarHBondContact O-CB 3.39Å; S234-V237 PolarHBondContact O-N 2.86Å; D235-V237 VanDerWaalsContact C-N 3.27Å; D235-V237 PolarHBondContact O-N 3.4Å
238	I	88.5	Confident	92.5	Very high	52 Å²	52	39.2 Å²	39.2	27%	0.267	20%	0.199	S	C	.	.	B	Isolated β-bridge	trans	-115.1	134.5	177.4	-56.4	174.4	0	0	0	108.1	F230 F231 S234 A241	F230-I238 HydrophobicContact CE1-CD1 4.26Å; F231-I238 HydrophobicContact CD1-CD1 4.39Å; F231-I238 HydrophobicContact CE1-CD1 4.4Å; S234-I238 PolarHBondContact O-N 2.85Å; S234-I238 VanDerWaalsContact O-N 3.12Å; I238-A241 HydrophobicContact CB-CB 4.13Å; I238-A241 WeakPolarHBondContact O-CB 3.21Å; I238-A241 PolarHBondContact O-N 3.34Å
239	P	88.9	Confident	92.5	Very high	15 Å²	15	39.7 Å²	39.7	10%	0.097	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	140.3	174.4	28.7	-35.2	0	0	0	110.1	F44 F47 A241	F44-P239 HydrophobicContact CD1-CG 4.34Å; F44-P239 HydrophobicContact CD2-CG 4.5Å; F44-P239 HydrophobicContact CE1-CG 3.58Å; F44-P239 HydrophobicContact CE2-CG 3.76Å; F44-P239 VanDerWaalsContact CZ-CD 3.48Å; F44-P239 HydrophobicContact CZ-CG 3.26Å; F47-P239 HydrophobicContact CB-CB 4.05Å; F47-P239 WeakPolarHBondContact O-CB 3.42Å; P239-A241 PolarHBondContact O-N 3.45Å
240	F	91.8	Very high	92.7	Very high	57 Å²	57	38.7 Å²	38.7	25%	0.25	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	18.9	-176.2	-58.5	-84.1	0	0	0	115.2	F47 E64 A67 H242 A243 I244	F47-F240 HydrophobicContact CB-CD2 4.4Å; F47-F240 HydrophobicContact CB-CE2 3.71Å; F47-F240 HydrophobicContact CB-CZ 4.37Å; F47-F240 AromaticContact CD1-CE2 3.79Å; F47-F240 HydrophobicContact CD1-CE2 3.79Å; F47-F240 AromaticContact CD1-CZ 3.76Å; F47-F240 HydrophobicContact CD1-CZ 3.76Å; F47-F240 HydrophobicContact CE1-CZ 4.39Å; F47-F240 AromaticContact CG-CE2 3.85Å; F47-F240 HydrophobicContact CG-CE2 3.85Å; F47-F240 HydrophobicContact CG-CZ 4.3Å; E64-F240 HydrophobicContact CB-CD1 3.89Å; E64-F240 HydrophobicContact CB-CE1 4.16Å; E64-F240 HydrophobicContact CG-CD1 4.09Å; E64-F240 VanDerWaalsContact OE1-C 3.27Å; E64-F240 VanDerWaalsContact OE1-CA 3.23Å; E64-F240 WeakPolarHBondContact OE1-CA 3.43Å; A67-F240 HydrophobicContact CB-CD1 3.98Å; A67-F240 HydrophobicContact CB-CE1 4.16Å; F240-H242 PolarHBondContact O-N 2.86Å; F240-A243 HydrophobicContact CB-CB 4.31Å; F240-A243 PolarHBondContact O-N 3.45Å; F240-A243 VanDerWaalsContact O-N 3.11Å; F240-I244 VanDerWaalsContact O-CG1 3.29Å; F240-I244 WeakPolarHBondContact O-CG1 3.22Å; F240-I244 PolarHBondContact O-N 2.86Å
241	A	93.3	Very high	92.9	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-50.2	-42.7	178.8	0	0	0	0	0	112.9	E64 I238 P239 I244 W245	E64-A241 PolarHBondContact OE1-N 2.84Å; I238-A241 HydrophobicContact CB-CB 4.13Å; I238-A241 WeakPolarHBondContact O-CB 3.21Å; I238-A241 PolarHBondContact O-N 3.34Å; P239-A241 PolarHBondContact O-N 3.45Å; A241-I244 PolarHBondContact O-N 2.8Å; A241-W245 PolarHBondContact O-N 2.88Å
242	H	93.8	Very high	93.1	Very high	20 Å²	20	35.1 Å²	35.1	9%	0.093	19%	0.185	C	C	.	.	H	α-helix	trans	-70.1	-40.5	-178.1	-156.1	82.6	0	0	0	111.8	Y58 E64 H117 D235 F240 I244 W245 H246	Y58-H242 HydrophobicContact CE1-CB 4.32Å; E64-H242 WeakPolarHBondContact OE1-CB 3.43Å; E64-H242 PolarHBondContact OE1-N 2.75Å; E64-H242 VanDerWaalsContact OE1-N 3.14Å; H117-H242 AromaticContact CE1-CD2 3.97Å; H117-H242 AromaticContact CE1-NE2 3.93Å; H117-H242 AromaticContact NE2-NE2 3.88Å; D235-H242 WeakPolarHBondContact OD1-CA 3.37Å; D235-H242 WeakPolarHBondContact OD1-CB 3.34Å; D235-H242 IonicContact OD1-CG 2.6Å; D235-H242 PolarHBondContact OD1-N 3.47Å; D235-H242 IonicContact OD1-ND1 3.11Å; D235-H242 IonicContact OD2-CE1 3.52Å; D235-H242 IonicContact OD2-CG 3.83Å; D235-H242 IonicContact OD2-ND1 3.89Å; D235-H242 PolarHBondContact OD2-ND1 2.83Å; F240-H242 PolarHBondContact O-N 2.86Å; H242-I244 VanDerWaalsContact C-N 3.33Å; H242-I244 PolarHBondContact O-N 3.32Å; H242-W245 AromaticContact CD2-CE3 3.99Å; H242-W245 AromaticContact CE1-CE3 3.56Å; H242-W245 AromaticContact CE1-CZ3 3.48Å; H242-W245 VanDerWaalsContact CE1-CZ3 3.48Å; H242-W245 WeakPolarHBondContact CE1-CZ3 3.3Å; H242-W245 AromaticContact ND1-CE3 3.91Å; H242-W245 AromaticContact NE2-CE3 3.66Å; H242-W245 AromaticContact NE2-CZ3 3.42Å; H242-W245 WeakPolarHBondContact NE2-CZ3 3.33Å; H242-W245 WeakPolarHBondContact O-CB 3.39Å; H242-W245 PolarHBondContact O-N 3.27Å; H242-H246 AromaticContact CD2-CE1 3.97Å; H242-H246 AromaticContact CD2-NE2 3.6Å; H242-H246 AromaticContact NE2-NE2 3.57Å; H242-H246 PolarHBondContact O-N 3.42Å
243	A	94.9	Very high	93.5	Very high	7 Å²	7	33.2 Å²	33.2	6%	0.058	18%	0.177	C	C	.	.	H	α-helix	trans	-67	-37.1	176.5	0	0	0	0	0	111.4	E64 A67 N68 F240 H246 V247	E64-A243 HydrophobicContact CG-CB 4.43Å; A67-A243 HydrophobicContact CB-CB 3.64Å; N68-A243 WeakPolarHBondContact OD1-CA 3.34Å; N68-A243 VanDerWaalsContact OD1-CB 3.29Å; N68-A243 WeakPolarHBondContact OD1-CB 3.17Å; N68-A243 PolarHBondContact OD1-N 3.04Å; F240-A243 HydrophobicContact CB-CB 4.31Å; F240-A243 PolarHBondContact O-N 3.45Å; F240-A243 VanDerWaalsContact O-N 3.11Å; A243-H246 WeakPolarHBondContact O-CB 3.23Å; A243-H246 PolarHBondContact O-N 2.86Å; A243-V247 WeakPolarHBondContact O-CG2 3.34Å; A243-V247 PolarHBondContact O-N 3.43Å
244	I	96.1	Very high	93.9	Very high	56 Å²	56	31.6 Å²	31.6	29%	0.287	18%	0.18	S	C	.	.	H	α-helix	trans	-64.1	-44.9	173.3	-66	164	0	0	0	109.4	F231 F240 A241 H242 H246 V247 F248	F231-I244 HydrophobicContact CB-CG2 4.27Å; F231-I244 HydrophobicContact CD1-CB 4.29Å; F231-I244 HydrophobicContact CD1-CD1 4.49Å; F231-I244 HydrophobicContact CD1-CG2 3.71Å; F231-I244 HydrophobicContact CD2-CG2 3.85Å; F231-I244 HydrophobicContact CE1-CG2 3.95Å; F231-I244 HydrophobicContact CE2-CG2 4.08Å; F231-I244 HydrophobicContact CG-CB 4.36Å; F231-I244 HydrophobicContact CG-CG2 3.66Å; F231-I244 HydrophobicContact CZ-CG2 4.13Å; F240-I244 VanDerWaalsContact O-CG1 3.29Å; F240-I244 WeakPolarHBondContact O-CG1 3.22Å; F240-I244 PolarHBondContact O-N 2.86Å; A241-I244 PolarHBondContact O-N 2.8Å; H242-I244 VanDerWaalsContact C-N 3.33Å; H242-I244 PolarHBondContact O-N 3.32Å; I244-H246 VanDerWaalsContact C-N 3.3Å; I244-H246 PolarHBondContact O-N 3.44Å; I244-V247 WeakPolarHBondContact O-CB 3.36Å; I244-V247 PolarHBondContact O-N 3.22Å; I244-F248 HydrophobicContact CG2-CD2 3.82Å; I244-F248 HydrophobicContact CG2-CE2 3.66Å; I244-F248 WeakPolarHBondContact O-CD2 3.35Å; I244-F248 PolarHBondContact O-N 3.47Å
245	W	96.3	Very high	94.3	Very high	28 Å²	28	32.4 Å²	32.4	11%	0.106	18%	0.184	C	C	.	.	H	α-helix	trans	-54.8	-44.1	174	167	62.8	0	0	0	112.3	I141 G228 F231 F232 A241 H242 V247 F248 V249	I141-W245 HydrophobicContact CD1-CH2 4.2Å; I141-W245 HydrophobicContact CD1-CZ2 4.27Å; G228-W245 VanDerWaalsContact O-CD1 3.27Å; F231-W245 HydrophobicContact CB-CB 4.17Å; F232-W245 HydrophobicContact CB-CB 4.34Å; F232-W245 HydrophobicContact CB-CD2 4.14Å; F232-W245 HydrophobicContact CB-CG 3.79Å; F232-W245 AromaticContact CD2-CD2 3.85Å; F232-W245 HydrophobicContact CD2-CD2 3.85Å; F232-W245 AromaticContact CD2-CE2 3.93Å; F232-W245 HydrophobicContact CD2-CE3 4.01Å; F232-W245 HydrophobicContact CD2-CG 4.37Å; F232-W245 HydrophobicContact CD2-CH2 4.4Å; F232-W245 HydrophobicContact CD2-CZ2 4.22Å; F232-W245 HydrophobicContact CD2-CZ3 4.29Å; F232-W245 HydrophobicContact CE2-CH2 4.5Å; F232-W245 HydrophobicContact CG-CD2 4.4Å; A241-W245 PolarHBondContact O-N 2.88Å; H242-W245 AromaticContact CD2-CE3 3.99Å; H242-W245 AromaticContact CE1-CE3 3.56Å; H242-W245 AromaticContact CE1-CZ3 3.48Å; H242-W245 VanDerWaalsContact CE1-CZ3 3.48Å; H242-W245 WeakPolarHBondContact CE1-CZ3 3.3Å; H242-W245 AromaticContact ND1-CE3 3.91Å; H242-W245 AromaticContact NE2-CE3 3.66Å; H242-W245 AromaticContact NE2-CZ3 3.42Å; H242-W245 WeakPolarHBondContact NE2-CZ3 3.33Å; H242-W245 WeakPolarHBondContact O-CB 3.39Å; H242-W245 PolarHBondContact O-N 3.27Å; W245-V247 VanDerWaalsContact C-N 3.3Å; W245-V247 PolarHBondContact O-N 3.25Å; W245-F248 PolarHBondContact O-N 3.13Å; W245-F248 VanDerWaalsContact O-N 3.13Å; W245-V249 HydrophobicContact CD2-CG2 4.31Å; W245-V249 HydrophobicContact CG-CG2 4.44Å; W245-V249 HydrophobicContact CZ2-CG2 4Å; W245-V249 WeakPolarHBondContact O-CG2 3.37Å; W245-V249 PolarHBondContact O-N 3.47Å
246	H	96.5	Very high	94.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-55.7	-42.3	173.1	-74.6	-173.8	0	0	0	112.9	N68 T71 H72 H117 H242 A243 I244 V249 A250	N68-H246 PolarHBondContact O-ND1 2.96Å; T71-H246 VanDerWaalsContact OG1-CB 3.27Å; T71-H246 WeakPolarHBondContact OG1-CB 3.37Å; T71-H246 PolarHBondContact OG1-ND1 3.07Å; T71-H246 VanDerWaalsContact OG1-ND1 3.17Å; H72-H246 AromaticContact CD2-CG 3.79Å; H72-H246 AromaticContact CD2-ND1 3.91Å; H72-H246 AromaticContact CE1-CD2 3.41Å; H72-H246 PolarHBondContact CE1-CD2 3.42Å; H72-H246 VanDerWaalsContact CE1-CD2 3.41Å; H72-H246 AromaticContact CE1-CE1 3.81Å; H72-H246 AromaticContact CE1-CG 3.54Å; H72-H246 AromaticContact CE1-ND1 3.8Å; H72-H246 AromaticContact CE1-NE2 3.6Å; H72-H246 AromaticContact CG-ND1 3.98Å; H72-H246 AromaticContact ND1-CE1 3.84Å; H72-H246 AromaticContact ND1-ND1 3.9Å; H72-H246 VanDerWaalsContact NE2-CB 3.32Å; H72-H246 WeakPolarHBondContact NE2-CB 3.38Å; H72-H246 AromaticContact NE2-CD2 3.56Å; H72-H246 AromaticContact NE2-CG 3.31Å; H72-H246 VanDerWaalsContact NE2-CG 3.31Å; H72-H246 AromaticContact NE2-ND1 3.81Å; H117-H246 AromaticContact CD2-CE1 3.66Å; H117-H246 AromaticContact NE2-CE1 3.28Å; H117-H246 PolarHBondContact NE2-CE1 2.88Å; H117-H246 VanDerWaalsContact NE2-CE1 3.28Å; H117-H246 AromaticContact NE2-NE2 3.71Å; H242-H246 AromaticContact CD2-CE1 3.97Å; H242-H246 AromaticContact CD2-NE2 3.6Å; H242-H246 AromaticContact NE2-NE2 3.57Å; H242-H246 PolarHBondContact O-N 3.42Å; A243-H246 WeakPolarHBondContact O-CB 3.23Å; A243-H246 PolarHBondContact O-N 2.86Å; I244-H246 VanDerWaalsContact C-N 3.3Å; I244-H246 PolarHBondContact O-N 3.44Å; H246-V249 PolarHBondContact O-N 2.99Å; H246-A250 VanDerWaalsContact O-CB 3.31Å; H246-A250 WeakPolarHBondContact O-CB 2.92Å; H246-A250 PolarHBondContact O-N 3.12Å
247	V	97.8	Very high	95.5	Very high	78 Å²	78	33.4 Å²	33.4	47%	0.473	19%	0.185	S	C	.	.	H	α-helix	trans	-64.4	-40.7	177.3	176.5	0	0	0	0	111.4	T71 A243 I244 W245 A250 L251	T71-V247 HydrophobicContact CG2-CG2 3.8Å; A243-V247 WeakPolarHBondContact O-CG2 3.34Å; A243-V247 PolarHBondContact O-N 3.43Å; I244-V247 WeakPolarHBondContact O-CB 3.36Å; I244-V247 PolarHBondContact O-N 3.22Å; W245-V247 VanDerWaalsContact C-N 3.3Å; W245-V247 PolarHBondContact O-N 3.25Å; V247-A250 PolarHBondContact O-N 3.4Å; V247-L251 WeakPolarHBondContact O-CB 3.4Å; V247-L251 PolarHBondContact O-N 2.92Å
248	F	98.2	Very high	96	Very high	49 Å²	49	34.9 Å²	34.9	22%	0.215	18%	0.183	C	C	.	.	H	α-helix	trans	-64.1	-43.1	174.7	-84.2	-92.3	0	0	0	111.9	I224 L227 F231 I244 W245 A250 L251 A252	I224-F248 HydrophobicContact CG2-CB 4.43Å; I224-F248 HydrophobicContact CG2-CD1 3.79Å; I224-F248 WeakPolarHBondContact CG2-O 3.5Å; I224-F248 WeakPolarHBondContact O-CD1 3.3Å; L227-F248 HydrophobicContact CB-CD1 4.03Å; L227-F248 HydrophobicContact CB-CE1 3.76Å; L227-F248 HydrophobicContact CD1-CE1 4.38Å; F231-F248 AromaticContact CD2-CD2 3.89Å; F231-F248 HydrophobicContact CD2-CD2 3.89Å; F231-F248 AromaticContact CD2-CE2 3.62Å; F231-F248 HydrophobicContact CD2-CE2 3.62Å; F231-F248 HydrophobicContact CD2-CZ 4.2Å; F231-F248 HydrophobicContact CE2-CD2 4.12Å; F231-F248 AromaticContact CE2-CE2 3.36Å; F231-F248 HydrophobicContact CE2-CE2 3.36Å; F231-F248 AromaticContact CE2-CZ 3.64Å; F231-F248 HydrophobicContact CE2-CZ 3.64Å; F231-F248 HydrophobicContact CZ-CE2 4.23Å; I244-F248 HydrophobicContact CG2-CD2 3.82Å; I244-F248 HydrophobicContact CG2-CE2 3.66Å; I244-F248 WeakPolarHBondContact O-CD2 3.35Å; I244-F248 PolarHBondContact O-N 3.47Å; W245-F248 PolarHBondContact O-N 3.13Å; W245-F248 VanDerWaalsContact O-N 3.13Å; F248-A250 VanDerWaalsContact C-N 3.35Å; F248-L251 PolarHBondContact O-N 3.43Å; F248-A252 WeakPolarHBondContact O-CB 3.3Å; F248-A252 PolarHBondContact O-N 3.47Å
249	V	97.1	Very high	96.4	Very high	10 Å²	10	32.4 Å²	32.4	6%	0.061	17%	0.17	C	C	.	.	H	α-helix	trans	-60.2	-45.9	175.2	169.8	0	0	0	0	110.9	L109 Y225 W245 H246 A252 A253	L109-V249 HydrophobicContact CD2-CG1 4.04Å; Y225-V249 HydrophobicContact CE1-CB 4.41Å; Y225-V249 HydrophobicContact CE1-CG1 4.24Å; Y225-V249 HydrophobicContact CE1-CG2 4.44Å; W245-V249 HydrophobicContact CD2-CG2 4.31Å; W245-V249 HydrophobicContact CG-CG2 4.44Å; W245-V249 HydrophobicContact CZ2-CG2 4Å; W245-V249 WeakPolarHBondContact O-CG2 3.37Å; W245-V249 PolarHBondContact O-N 3.47Å; H246-V249 PolarHBondContact O-N 2.99Å; V249-A252 PolarHBondContact O-N 3.24Å; V249-A253 VanDerWaalsContact O-CB 3.25Å; V249-A253 WeakPolarHBondContact O-CB 3.38Å; V249-A253 PolarHBondContact O-N 2.69Å
250	A	97.9	Very high	96.8	Very high	17 Å²	17	31.7 Å²	31.7	14%	0.14	17%	0.166	C	C	.	.	H	α-helix	trans	-60	-48	176.8	0	0	0	0	0	112.9	L75 H246 V247 F248 A253 A254	L75-A250 HydrophobicContact CD1-CB 3.18Å; H246-A250 VanDerWaalsContact O-CB 3.31Å; H246-A250 WeakPolarHBondContact O-CB 2.92Å; H246-A250 PolarHBondContact O-N 3.12Å; V247-A250 PolarHBondContact O-N 3.4Å; F248-A250 VanDerWaalsContact C-N 3.35Å; A250-A253 PolarHBondContact O-N 2.6Å; A250-A254 WeakPolarHBondContact O-CB 3.48Å; A250-A254 PolarHBondContact O-N 2.78Å
251	L	98.2	Very high	97.1	Very high	93 Å²	93	32.4 Å²	32.4	49%	0.487	17%	0.167	S	C	.	.	H	α-helix	trans	-64.6	-44.9	-179.9	-178.3	63.6	0	0	0	111.2	I224 V247 F248 A254 V255	I224-L251 HydrophobicContact CD1-CD2 4.17Å; I224-L251 HydrophobicContact CD1-CG 4.16Å; I224-L251 HydrophobicContact CG2-CB 4.26Å; I224-L251 HydrophobicContact CG2-CD2 4.19Å; I224-L251 HydrophobicContact CG2-CG 4.3Å; V247-L251 WeakPolarHBondContact O-CB 3.4Å; V247-L251 PolarHBondContact O-N 2.92Å; F248-L251 PolarHBondContact O-N 3.43Å; L251-A254 WeakPolarHBondContact O-CB 3.42Å; L251-A254 PolarHBondContact O-N 3.18Å; L251-V255 WeakPolarHBondContact O-CG2 3.24Å; L251-V255 PolarHBondContact O-N 3.03Å
252	A	98.1	Very high	97.2	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.1	-47.7	175.3	0	0	0	0	0	110.9	I224 Y225 F248 V249 A254 V255 H256	I224-A252 HydrophobicContact CB-CB 4.01Å; I224-A252 HydrophobicContact CG2-CB 3.79Å; Y225-A252 HydrophobicContact CD1-CB 3.72Å; Y225-A252 HydrophobicContact CD2-CB 3.6Å; Y225-A252 HydrophobicContact CE1-CB 3.6Å; Y225-A252 HydrophobicContact CE2-CB 3.49Å; Y225-A252 VanDerWaalsContact CE2-CB 3.49Å; Y225-A252 HydrophobicContact CG-CB 3.7Å; Y225-A252 VanDerWaalsContact CZ-CB 3.46Å; F248-A252 WeakPolarHBondContact O-CB 3.3Å; F248-A252 PolarHBondContact O-N 3.47Å; V249-A252 PolarHBondContact O-N 3.24Å; A252-A254 VanDerWaalsContact C-N 3.26Å; A252-A254 PolarHBondContact O-N 2.67Å; A252-V255 PolarHBondContact O-N 2.93Å; A252-V255 VanDerWaalsContact O-N 3.12Å; A252-H256 PolarHBondContact O-CD2 3.33Å; A252-H256 PolarHBondContact O-N 3.22Å
253	A	97.9	Very high	97.3	Very high	2 Å²	2	38 Å²	38	2%	0.017	19%	0.19	C	C	.	.	H	α-helix	trans	-57.5	-38.5	176.3	0	0	0	0	0	112.3	L106 F110 F144 Y225 V249 A250 H256 Y257	L106-A253 HydrophobicContact CD1-CB 3.96Å; F110-A253 HydrophobicContact CZ-CB 4.44Å; F144-A253 HydrophobicContact CE1-CB 4.39Å; F144-A253 HydrophobicContact CZ-CB 4.04Å; Y225-A253 PolarHBondContact OH-N 3.4Å; V249-A253 VanDerWaalsContact O-CB 3.25Å; V249-A253 WeakPolarHBondContact O-CB 3.38Å; V249-A253 PolarHBondContact O-N 2.69Å; A250-A253 PolarHBondContact O-N 2.6Å; A253-H256 PolarHBondContact O-N 3.42Å; A253-Y257 VanDerWaalsContact O-CB 3.28Å; A253-Y257 WeakPolarHBondContact O-CB 3.42Å; A253-Y257 PolarHBondContact O-N 3.15Å
254	A	98.2	Very high	97.2	Very high	55 Å²	55	38.7 Å²	38.7	46%	0.455	19%	0.192	S	C	.	.	H	α-helix	trans	-65.9	-42.3	175.2	0	0	0	0	0	112.7	A250 L251 A252 Y257 Y258	A250-A254 WeakPolarHBondContact O-CB 3.48Å; A250-A254 PolarHBondContact O-N 2.78Å; L251-A254 WeakPolarHBondContact O-CB 3.42Å; L251-A254 PolarHBondContact O-N 3.18Å; A252-A254 VanDerWaalsContact C-N 3.26Å; A252-A254 PolarHBondContact O-N 2.67Å; A254-Y257 PolarHBondContact O-N 3.25Å; A254-Y258 WeakPolarHBondContact O-CB 3.36Å; A254-Y258 PolarHBondContact O-N 3.36Å
255	V	98.4	Very high	97.1	Very high	30 Å²	30	36.9 Å²	36.9	18%	0.182	18%	0.182	C	C	.	.	H	α-helix	trans	-63.7	-44.2	175	173.9	0	0	0	0	110.9	E217 C220 I224 L251 A252 Y258 A259	E217-V255 HydrophobicContact CB-CG1 4.12Å; E217-V255 WeakPolarHBondContact O-CG1 3.41Å; C220-V255 HydrophobicContact CB-CG1 4.5Å; I224-V255 HydrophobicContact CD1-CG2 4.12Å; L251-V255 WeakPolarHBondContact O-CG2 3.24Å; L251-V255 PolarHBondContact O-N 3.03Å; A252-V255 PolarHBondContact O-N 2.93Å; A252-V255 VanDerWaalsContact O-N 3.12Å; V255-Y258 PolarHBondContact O-N 3.1Å; V255-A259 PolarHBondContact O-N 3.42Å
256	H	98	Very high	96.6	Very high	22 Å²	22	38.9 Å²	38.9	10%	0.102	20%	0.195	C	C	.	.	H	α-helix	trans	-63.8	-41.6	175.5	-82.5	-97.3	0	0	0	112.1	L218 G222 Y225 A252 A253 A259 I260	L218-H256 WeakPolarHBondContact CD2-ND1 3.28Å; G222-H256 PolarHBondContact N-NE2 3.15Å; Y225-H256 AromaticContact CD2-NE2 3.95Å; Y225-H256 AromaticContact CE2-CD2 3.71Å; Y225-H256 AromaticContact CE2-NE2 3.68Å; A252-H256 PolarHBondContact O-CD2 3.33Å; A252-H256 PolarHBondContact O-N 3.22Å; A253-H256 PolarHBondContact O-N 3.42Å; H256-A259 PolarHBondContact O-N 3.44Å; H256-I260 WeakPolarHBondContact O-CG1 3.47Å; H256-I260 PolarHBondContact O-N 3.41Å
257	Y	98.4	Very high	95.4	Very high	35 Å²	35	41.6 Å²	41.6	14%	0.137	22%	0.217	C	C	.	.	H	α-helix	trans	-59.4	-48.5	174.4	179.1	-82.6	0	0	0	110.7	G82 L86 Y102 L106 A253 A254 A259 I260 W261	G82-Y257 VanDerWaalsContact CA-CE2 3.48Å; G82-Y257 VanDerWaalsContact CA-CZ 3.49Å; G82-Y257 WeakPolarHBondContact CA-OH 3.22Å; G82-Y257 PolarHBondContact O-OH 3.39Å; L86-Y257 HydrophobicContact CD1-CD2 4.49Å; L86-Y257 HydrophobicContact CD1-CE2 3.82Å; L86-Y257 HydrophobicContact CG-CE2 4Å; Y102-Y257 AromaticContact CE1-CD2 3.62Å; Y102-Y257 HydrophobicContact CE1-CD2 3.62Å; Y102-Y257 HydrophobicContact CE1-CE2 4.31Å; Y102-Y257 HydrophobicContact CE1-CG 4.43Å; Y102-Y257 VanDerWaalsContact OH-CA 3.24Å; Y102-Y257 WeakPolarHBondContact OH-CA 3.34Å; Y102-Y257 WeakPolarHBondContact OH-CB 3.45Å; Y102-Y257 PolarHBondContact OH-N 3.14Å; L106-Y257 HydrophobicContact CD2-CD2 4.07Å; A253-Y257 VanDerWaalsContact O-CB 3.28Å; A253-Y257 WeakPolarHBondContact O-CB 3.42Å; A253-Y257 PolarHBondContact O-N 3.15Å; A254-Y257 PolarHBondContact O-N 3.25Å; Y257-A259 VanDerWaalsContact C-N 3.31Å; Y257-A259 PolarHBondContact O-N 3.23Å; Y257-I260 PolarHBondContact O-N 2.84Å; Y257-W261 HydrophobicContact CE1-CB 4.05Å; Y257-W261 WeakPolarHBondContact O-CB 3.26Å; Y257-W261 PolarHBondContact O-N 3.28Å
258	Y	98	Very high	93.4	Very high	107 Å²	107	42 Å²	42	42%	0.42	22%	0.221	S	C	.	.	H	α-helix	trans	-57.4	-45.1	178	172.8	-96.2	0	0	0	111.4	E217 A254 V255 I260 W261 K262	E217-Y258 HydrophobicContact CG-CD1 4.19Å; E217-Y258 HydrophobicContact CG-CE1 4.27Å; A254-Y258 WeakPolarHBondContact O-CB 3.36Å; A254-Y258 PolarHBondContact O-N 3.36Å; V255-Y258 PolarHBondContact O-N 3.1Å; Y258-I260 PolarHBondContact O-N 3.5Å; Y258-W261 AromaticContact CD2-CE3 3.99Å; Y258-W261 HydrophobicContact CD2-CE3 3.99Å; Y258-W261 HydrophobicContact CD2-CZ3 4.08Å; Y258-W261 HydrophobicContact CE2-CE3 4.17Å; Y258-W261 AromaticContact CE2-CZ3 3.86Å; Y258-W261 HydrophobicContact CE2-CZ3 3.86Å; Y258-W261 PolarHBondContact O-N 2.98Å; Y258-K262 HydrophobicContact CE1-CB 4.42Å; Y258-K262 VanDerWaalsContact O-CB 3.24Å; Y258-K262 WeakPolarHBondContact O-CB 3.45Å; Y258-K262 PolarHBondContact O-N 2.88Å
259	A	97.2	Very high	91.3	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61.2	-45.4	177.7	0	0	0	0	0	112	W152 E217 V255 H256 Y257 Y263	W152-A259 HydrophobicContact CH2-CB 4.25Å; W152-A259 HydrophobicContact CZ2-CB 3.74Å; E217-A259 HydrophobicContact CB-CB 3.69Å; E217-A259 HydrophobicContact CG-CB 4.49Å; V255-A259 PolarHBondContact O-N 3.42Å; H256-A259 PolarHBondContact O-N 3.44Å; Y257-A259 VanDerWaalsContact C-N 3.31Å; Y257-A259 PolarHBondContact O-N 3.23Å; A259-Y263 HydrophobicContact CB-CD2 4.36Å; A259-Y263 WeakPolarHBondContact O-CB 3.42Å; A259-Y263 VanDerWaalsContact O-CD2 3.26Å; A259-Y263 WeakPolarHBondContact O-CD2 3.43Å; A259-Y263 PolarHBondContact O-N 3.25Å
260	I	97.2	Very high	89.1	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.9	-51.6	176.7	-69.9	161.4	0	0	0	110.3	L86 Y102 P151 W152 H256 Y257 Y258 K262 L264 Y265	L86-I260 HydrophobicContact CD1-CG2 4.14Å; L86-I260 HydrophobicContact CD2-CG2 4.36Å; Y102-I260 HydrophobicContact CD1-CD1 3.93Å; Y102-I260 HydrophobicContact CD2-CD1 3.98Å; Y102-I260 HydrophobicContact CE1-CD1 3.63Å; Y102-I260 HydrophobicContact CE2-CD1 3.71Å; Y102-I260 HydrophobicContact CG-CD1 4.09Å; P151-I260 HydrophobicContact CB-CD1 4.46Å; P151-I260 HydrophobicContact CB-CG1 4.3Å; P151-I260 HydrophobicContact CB-CG2 4.08Å; P151-I260 HydrophobicContact CG-CD1 4.08Å; P151-I260 HydrophobicContact CG-CG1 4.45Å; P151-I260 HydrophobicContact CG-CG2 4.31Å; W152-I260 HydrophobicContact CZ2-CG1 4.21Å; H256-I260 WeakPolarHBondContact O-CG1 3.47Å; H256-I260 PolarHBondContact O-N 3.41Å; Y257-I260 PolarHBondContact O-N 2.84Å; Y258-I260 PolarHBondContact O-N 3.5Å; I260-K262 PolarHBondContact O-N 3.21Å; I260-L264 HydrophobicContact CG1-CD1 4.42Å; I260-L264 HydrophobicContact CG2-CD1 4.37Å; I260-L264 WeakPolarHBondContact O-CA 3.44Å; I260-L264 VanDerWaalsContact O-CB 3.28Å; I260-L264 WeakPolarHBondContact O-CB 3.3Å; I260-L264 PolarHBondContact O-N 2.97Å; I260-Y265 HydrophobicContact CG2-CD2 3.87Å; I260-Y265 HydrophobicContact CG2-CE2 3.67Å; I260-Y265 PolarHBondContact O-N 2.92Å
261	W	97.3	Very high	86.7	Confident	71 Å²	71	53.2 Å²	53.2	27%	0.269	29%	0.289	S	S	.	.	I	π-helix	trans	-59.3	-49.6	-179.4	169.1	69.2	0	0	0	111.9	L86 Y257 Y258 Y265 N266	L86-W261 HydrophobicContact CD2-CB 4.03Å; Y257-W261 HydrophobicContact CE1-CB 4.05Å; Y257-W261 WeakPolarHBondContact O-CB 3.26Å; Y257-W261 PolarHBondContact O-N 3.28Å; Y258-W261 AromaticContact CD2-CE3 3.99Å; Y258-W261 HydrophobicContact CD2-CE3 3.99Å; Y258-W261 HydrophobicContact CD2-CZ3 4.08Å; Y258-W261 HydrophobicContact CE2-CE3 4.17Å; Y258-W261 AromaticContact CE2-CZ3 3.86Å; Y258-W261 HydrophobicContact CE2-CZ3 3.86Å; Y258-W261 PolarHBondContact O-N 2.98Å; W261-Y265 CarbonylContact O-C 3.6Å; W261-Y265 PolarHBondContact O-N 2.75Å; W261-N266 VanDerWaalsContact O-CB 3.29Å; W261-N266 WeakPolarHBondContact O-CB 3.43Å; W261-N266 PolarHBondContact O-N 2.99Å
262	K	96	Very high	84.3	Confident	74 Å²	74	51.2 Å²	51.2	32%	0.322	28%	0.283	S	S	.	.	I	π-helix	trans	-70.5	-43.4	-173.8	-179.7	58	-175.6	169.6	0	112.8	Y258 I260 N266 A267	Y258-K262 HydrophobicContact CE1-CB 4.42Å; Y258-K262 VanDerWaalsContact O-CB 3.24Å; Y258-K262 WeakPolarHBondContact O-CB 3.45Å; Y258-K262 PolarHBondContact O-N 2.88Å; I260-K262 PolarHBondContact O-N 3.21Å; K262-N266 CarbonylContact O-C 3.28Å; K262-N266 VanDerWaalsContact O-C 3.28Å; K262-A267 PolarHBondContact O-N 2.96Å
263	Y	94.6	Very high	82.2	Confident	64 Å²	64	56.8 Å²	56.8	25%	0.251	31%	0.312	S	S	.	.	I	π-helix	trans	-102.9	-16.7	-168.3	-59.9	-70.8	0	0	0	114.4	D213 E217 A259	D213-Y263 HydrophobicContact CB-CD1 3.57Å; D213-Y263 HydrophobicContact CB-CE1 3.9Å; D213-Y263 HydrophobicContact CB-CG 4.29Å; E217-Y263 VanDerWaalsContact CD-CE2 3.47Å; E217-Y263 HydrophobicContact CG-CE2 4.27Å; E217-Y263 VanDerWaalsContact OE1-CE2 3.28Å; E217-Y263 WeakPolarHBondContact OE1-CE2 3.41Å; E217-Y263 VanDerWaalsContact OE1-CZ 3.32Å; E217-Y263 PolarHBondContact OE1-OH 3.33Å; A259-Y263 HydrophobicContact CB-CD2 4.36Å; A259-Y263 WeakPolarHBondContact O-CB 3.42Å; A259-Y263 VanDerWaalsContact O-CD2 3.26Å; A259-Y263 WeakPolarHBondContact O-CD2 3.43Å; A259-Y263 PolarHBondContact O-N 3.25Å
264	L	94.1	Very high	80	Confident	22 Å²	22	63.9 Å²	63.9	12%	0.115	35%	0.349	C	S	.	.	I	π-helix	trans	-112	-27.5	178.9	-53.1	-179.4	0	0	0	113.5	P151 W152 L155 I260	P151-L264 HydrophobicContact CB-CD1 3.69Å; W152-L264 HydrophobicContact CD2-CD1 3.88Å; W152-L264 HydrophobicContact CE3-CD1 4.04Å; W152-L264 HydrophobicContact CE3-CD2 3.99Å; W152-L264 HydrophobicContact CE3-CG 4.32Å; W152-L264 HydrophobicContact CG-CD1 4.26Å; W152-L264 HydrophobicContact CH2-CG 4.4Å; W152-L264 HydrophobicContact CZ2-CD1 4.43Å; W152-L264 HydrophobicContact CZ3-CD1 4.37Å; W152-L264 HydrophobicContact CZ3-CD2 3.92Å; W152-L264 HydrophobicContact CZ3-CG 4.21Å; L155-L264 HydrophobicContact CD1-CB 4Å; L155-L264 HydrophobicContact CD1-CD1 4.4Å; I260-L264 HydrophobicContact CG1-CD1 4.42Å; I260-L264 HydrophobicContact CG2-CD1 4.37Å; I260-L264 WeakPolarHBondContact O-CA 3.44Å; I260-L264 VanDerWaalsContact O-CB 3.28Å; I260-L264 WeakPolarHBondContact O-CB 3.3Å; I260-L264 PolarHBondContact O-N 2.97Å
265	Y	93.4	Very high	77.6	Confident	17 Å²	17	69.7 Å²	69.7	7%	0.067	37%	0.366	C	S	.	.	I	π-helix	trans	-114.6	-23.3	-176.2	-73.3	-101.1	0	0	0	114.1	L86 L89 S90 E95 T98 A99 L155 I260 W261	L86-Y265 HydrophobicContact CB-CD1 4.38Å; L86-Y265 HydrophobicContact CB-CE1 4.12Å; L86-Y265 HydrophobicContact CD2-CD1 4.19Å; L86-Y265 HydrophobicContact CD2-CD2 3.74Å; L86-Y265 HydrophobicContact CD2-CE1 4.49Å; L86-Y265 HydrophobicContact CD2-CE2 4.12Å; L86-Y265 HydrophobicContact CD2-CG 3.78Å; L86-Y265 WeakPolarHBondContact O-CD1 3.31Å; L86-Y265 WeakPolarHBondContact O-CE1 3.49Å; L89-Y265 HydrophobicContact CB-CD1 4.23Å; S90-Y265 WeakPolarHBondContact OG-CE1 3.36Å; E95-Y265 HydrophobicContact CB-CE1 3.99Å; E95-Y265 HydrophobicContact CG-CE1 4.42Å; E95-Y265 PolarHBondContact O-OH 3.41Å; T98-Y265 PolarHBondContact OG1-OH 2.92Å; A99-Y265 WeakPolarHBondContact CA-OH 3.43Å; A99-Y265 HydrophobicContact CB-CE1 4.12Å; A99-Y265 WeakPolarHBondContact CB-OH 3.23Å; A99-Y265 PolarHBondContact N-OH 2.94Å; L155-Y265 HydrophobicContact CD1-CE2 3.8Å; I260-Y265 HydrophobicContact CG2-CD2 3.87Å; I260-Y265 HydrophobicContact CG2-CE2 3.67Å; I260-Y265 PolarHBondContact O-N 2.92Å; W261-Y265 CarbonylContact O-C 3.6Å; W261-Y265 PolarHBondContact O-N 2.75Å
266	N	86.8	Confident	75	Confident	71 Å²	71	75.3 Å²	75.3	38%	0.38	41%	0.407	S	S	.	.	S	Bend	trans	-123	26.7	-179.4	-163.3	20	0	0	0	111.6	W261 K262	W261-N266 VanDerWaalsContact O-CB 3.29Å; W261-N266 WeakPolarHBondContact O-CB 3.43Å; W261-N266 PolarHBondContact O-N 2.99Å; K262-N266 CarbonylContact O-C 3.28Å; K262-N266 VanDerWaalsContact O-C 3.28Å
267	A	70.8	Confident	73.8	Confident	56 Å²	56	78 Å²	78	46%	0.463	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-68.8	129.6	171.3	0	0	0	0	0	108.3	K262 S269	K262-A267 PolarHBondContact O-N 2.96Å; A267-S269 PolarHBondContact O-N 3.17Å; A267-S269 VanDerWaalsContact O-N 3.14Å
268	P	56.6	Low	72.5	Confident	86 Å²	86	80.2 Å²	80.2	56%	0.558	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-58.1	123.1	174.5	21.5	-28.8	0	0	0	108.5	S272	P268-S272 WeakPolarHBondContact CB-OG 3.14Å
269	S	53.8	Low	71.1	Confident	70 Å²	70	78.7 Å²	78.7	49%	0.49	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-58.2	141.8	169.3	51.1	0	0	0	0	108	A267 E271 S272	A267-S269 PolarHBondContact O-N 3.17Å; A267-S269 VanDerWaalsContact O-N 3.14Å; S269-E271 PolarHBondContact O-N 3.27Å; S269-S272 WeakPolarHBondContact O-CB 3.34Å; S269-S272 PolarHBondContact O-N 3.06Å; S269-S272 PolarHBondContact O-OG 3.17Å
270	S	50.5	Low	69.6	Low	94 Å²	94	83.4 Å²	83.4	66%	0.657	46%	0.464	S	S	*	.	H	α-helix	trans	-52.5	-21.6	176	30	0	0	0	0	113.2
271	E	47.3	Very low	67.8	Low	148 Å²	148	88.6 Å²	88.6	69%	0.692	49%	0.493	S	S	*	.	H	α-helix	trans	-65	-33.4	171.4	-69.3	-176.6	160.5	0	0	113.9	S269 L274	S269-E271 PolarHBondContact O-N 3.27Å; E271-L274 PolarHBondContact O-N 3.25Å
272	S	48.6	Very low	65.9	Low	52 Å²	52	89.7 Å²	89.7	36%	0.364	51%	0.508	S	S	.	.	H	α-helix	trans	-74.2	-26.1	-179.6	64.1	0	0	0	0	113.7	P268 S269	P268-S272 WeakPolarHBondContact CB-OG 3.14Å; S269-S272 WeakPolarHBondContact O-CB 3.34Å; S269-S272 PolarHBondContact O-N 3.06Å; S269-S272 PolarHBondContact O-OG 3.17Å
273	L	52.8	Low	63.7	Low	116 Å²	116	90.9 Å²	90.9	61%	0.607	52%	0.521	S	S	*	.	H	α-helix	trans	-82.8	-17	176.2	-70.5	170.7	0	0	0	113
274	L	51.7	Low	61.3	Low	151 Å²	151	92.9 Å²	92.9	79%	0.791	54%	0.542	S	S	*	.	S	Bend	trans	-88.4	-5	175.6	-71.9	167.8	0	0	0	112.9	E271	E271-L274 PolarHBondContact O-N 3.25Å
275	Q	48	Very low	58.6	Low	177 Å²	177	98.8 Å²	98.8	83%	0.827	58%	0.577	S	S	*	*			trans	-108.1	2.1	177.6	-77.9	-180	-21.7	0	0	114
276	S	42.9	Very low	55.4	Low	148 Å²	148	106.3 Å²	106.3	100%	1.035	62%	0.624	S	S	*	*			trans	-114.3	0	174.8	65.6	0	0	0	0	111.5

Retrieved 276 of 276 residues in 87 ms (Link to these results)

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