A0A087Y2U5_POEFO Loading...

Exocyst complex component 7

Component of the exocyst complex involved in the docking of exocytic vesicles with fusion sites on the plasma membrane.

AlphaFold DB , UniProt , Accession A0A087Y2U5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 685 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37	Very low	42.1	Very low	253 Å²	253	156.4 Å²	156.4	100%	1.246	84%	0.84	S	S	*	*				0	122.5	0	-57.6	-174.1	-158.9	0	0	105.5
2	G	40.6	Very low	43.1	Very low	59 Å²	59	151.5 Å²	151.5	61%	0.608	81%	0.813	S	S	*	*			cis	148.9	138.6	36.5	0	0	0	0	0	104.2
3	I	40.3	Very low	44	Very low	161 Å²	161	145.4 Å²	145.4	83%	0.826	80%	0.797	S	S	*	*				60.9	115.8	109.3	-58.1	175.8	0	0	0	111.2
4	T	39.2	Very low	45.4	Very low	125 Å²	125	141.9 Å²	141.9	77%	0.767	79%	0.788	S	S	*	*			cis	178.4	153.7	45.4	12.4	0	0	0	0	113.1
5	S	38.4	Very low	46.6	Very low	111 Å²	111	137.1 Å²	137.1	78%	0.776	77%	0.774	S	S	*	*			trans	53.5	128.4	136.4	-131.4	0	0	0	0	120.6
6	R	39.1	Very low	47.7	Very low	242 Å²	242	137.8 Å²	137.8	91%	0.913	76%	0.76	S	S	*	*				-170.8	148.3	62.7	-137.4	176.4	-172.8	177.8	1.2	112
7	M	44.7	Very low	49	Very low	175 Å²	175	137.2 Å²	137.2	86%	0.862	75%	0.748	S	S	*	*			trans	-73.8	156	179.4	-61.5	167.2	84.7	0	0	115.3
8	I	39.7	Very low	50.2	Low	163 Å²	163	140.3 Å²	140.3	84%	0.836	75%	0.747	S	S	*	*			trans	160.5	143.1	133.7	-79	163.1	0	0	0	109.4
9	P	47	Very low	51.4	Low	110 Å²	110	138.2 Å²	138.2	71%	0.714	73%	0.733	S	S	*	*			trans	-95.1	148	-150.9	35.7	-29.3	0	0	0	115.7
10	T	45	Very low	52.5	Low	129 Å²	129	136.8 Å²	136.8	79%	0.791	72%	0.724	S	S	*	*			trans	-132.5	41.9	178.9	45.2	0	0	0	0	113.2	D12	T10-D12 VanDerWaalsContact C-N 3.26Å; T10-D12 PolarHBondContact O-N 3.46Å
11	E	51.7	Low	53.6	Low	192 Å²	192	135.4 Å²	135.4	90%	0.897	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	0.3	177.7	-107.1	176.4	163.4	0	0	115.6
12	D	54.2	Low	55.5	Low	98 Å²	98	130.2 Å²	130.2	52%	0.524	69%	0.686	S	S	.	*	T	Hydrogen-bonded Turn	trans	-115.5	-17.1	-170.6	-161.6	22.1	0	0	0	115.7	T10 R16	T10-D12 VanDerWaalsContact C-N 3.26Å; T10-D12 PolarHBondContact O-N 3.46Å; D12-R16 IonicContact OD2-CZ 3.76Å; D12-R16 IonicContact OD2-NH1 3.99Å; D12-R16 PolarHBondContact OD2-NH1 3.34Å
13	A	55.8	Low	57.2	Low	72 Å²	72	132.9 Å²	132.9	60%	0.595	68%	0.681	S	S	*	*	H	α-helix	trans	-86.1	-32.3	-172.8	0	0	0	0	0	114.3	K17	A13-K17 VanDerWaalsContact O-CB 3.31Å; A13-K17 WeakPolarHBondContact O-CB 3.46Å; A13-K17 PolarHBondContact O-N 3.49Å; A13-K17 VanDerWaalsContact O-N 3.14Å
14	S	62.8	Low	58.9	Low	97 Å²	97	129.8 Å²	129.8	68%	0.678	67%	0.666	S	S	*	*	H	α-helix	trans	-79.1	-30.9	-174.6	-170.1	0	0	0	0	113.5	R18	S14-R18 PolarHBondContact O-N 2.65Å
15	A	63.4	Low	60.9	Low	69 Å²	69	130 Å²	130	57%	0.57	66%	0.656	S	S	*	*	H	α-helix	trans	-75.7	-45.5	177	0	0	0	0	0	111.3	K17 R18 E19	A15-K17 PolarHBondContact O-N 3.2Å; A15-R18 PolarHBondContact O-N 3.31Å; A15-E19 PolarHBondContact O-N 3.04Å
16	R	64.6	Low	62.8	Low	149 Å²	149	130.9 Å²	130.9	56%	0.562	65%	0.648	S	S	*	*	H	α-helix	trans	-60	-41.5	172.9	-88.6	178.9	169.9	159.2	-1	113.1	D12 R18 E19 I20	D12-R16 IonicContact OD2-CZ 3.76Å; D12-R16 IonicContact OD2-NH1 3.99Å; D12-R16 PolarHBondContact OD2-NH1 3.34Å; R16-R18 VanDerWaalsContact C-N 3.32Å; R16-R18 PolarHBondContact O-N 2.99Å; R16-E19 PolarHBondContact O-N 3.23Å; R16-I20 VanDerWaalsContact O-CB 3.32Å; R16-I20 WeakPolarHBondContact O-CB 3.46Å; R16-I20 WeakPolarHBondContact O-CD1 3.25Å; R16-I20 WeakPolarHBondContact O-CG1 3.33Å; R16-I20 PolarHBondContact O-N 3.14Å
17	K	69.5	Low	64.6	Low	128 Å²	128	125.7 Å²	125.7	56%	0.557	63%	0.634	S	S	*	*	H	α-helix	trans	-61	-41.9	177.1	-175.3	-179.3	173.7	-172.9	0	111.7	A13 A15 E21	A13-K17 VanDerWaalsContact O-CB 3.31Å; A13-K17 WeakPolarHBondContact O-CB 3.46Å; A13-K17 PolarHBondContact O-N 3.49Å; A13-K17 VanDerWaalsContact O-N 3.14Å; A15-K17 PolarHBondContact O-N 3.2Å; K17-E21 WeakPolarHBondContact CE-OE1 3.5Å; K17-E21 IonicContact NZ-OE1 3.23Å; K17-E21 WeakPolarHBondContact O-CB 3.28Å; K17-E21 WeakPolarHBondContact O-CG 3.31Å; K17-E21 PolarHBondContact O-N 2.67Å
18	R	70.6	Confident	66.3	Low	192 Å²	192	123.3 Å²	123.3	73%	0.725	62%	0.621	S	S	*	*	H	α-helix	trans	-70.4	-40.7	179.4	-137.4	177.2	-170.7	175.4	0.9	112	S14 A15 R16 E21 E22	S14-R18 PolarHBondContact O-N 2.65Å; A15-R18 PolarHBondContact O-N 3.31Å; R16-R18 VanDerWaalsContact C-N 3.32Å; R16-R18 PolarHBondContact O-N 2.99Å; R18-E21 PolarHBondContact O-N 2.9Å; R18-E22 WeakPolarHBondContact O-CB 3.43Å; R18-E22 PolarHBondContact O-N 3.25Å
19	E	72.5	Confident	68.3	Low	101 Å²	101	120.8 Å²	120.8	47%	0.472	61%	0.606	S	S	.	*	H	α-helix	trans	-66.4	-37.2	175.5	-160.1	-165.7	155.4	0	0	112.2	A15 R16 K23	A15-E19 PolarHBondContact O-N 3.04Å; R16-E19 PolarHBondContact O-N 3.23Å; E19-K23 WeakPolarHBondContact O-CB 3.32Å; E19-K23 WeakPolarHBondContact O-CG 3.49Å; E19-K23 PolarHBondContact O-N 2.96Å; E19-K23 IonicContact OE1-NZ 2.69Å; E19-K23 PolarHBondContact OE1-NZ 3.06Å
20	I	73.4	Confident	69.8	Low	110 Å²	110	119 Å²	119	56%	0.564	59%	0.593	S	S	*	*	H	α-helix	trans	-69.1	-41.4	173.2	-69.1	166.6	0	0	0	110.8	R16 E22 L24	R16-I20 VanDerWaalsContact O-CB 3.32Å; R16-I20 WeakPolarHBondContact O-CB 3.46Å; R16-I20 WeakPolarHBondContact O-CD1 3.25Å; R16-I20 WeakPolarHBondContact O-CG1 3.33Å; R16-I20 PolarHBondContact O-N 3.14Å; I20-E22 VanDerWaalsContact C-N 3.32Å; I20-E22 PolarHBondContact O-N 2.56Å; I20-L24 WeakPolarHBondContact O-CB 3.31Å; I20-L24 PolarHBondContact O-N 3.2Å
21	E	75.8	Confident	71.5	Confident	107 Å²	107	118 Å²	118	50%	0.5	58%	0.582	S	S	.	*	H	α-helix	trans	-63.9	-37.3	175	-82.8	172.4	176.2	0	0	111.9	K17 R18 K25	K17-E21 WeakPolarHBondContact CE-OE1 3.5Å; K17-E21 IonicContact NZ-OE1 3.23Å; K17-E21 WeakPolarHBondContact O-CB 3.28Å; K17-E21 WeakPolarHBondContact O-CG 3.31Å; K17-E21 PolarHBondContact O-N 2.67Å; R18-E21 PolarHBondContact O-N 2.9Å; E21-K25 VanDerWaalsContact O-CB 3.32Å; E21-K25 WeakPolarHBondContact O-CB 3.33Å; E21-K25 PolarHBondContact O-N 3.14Å
22	E	77.3	Confident	73	Confident	144 Å²	144	112.1 Å²	112.1	67%	0.673	56%	0.562	S	S	*	*	H	α-helix	trans	-72.7	-43.5	177.7	-145.3	168.6	-157.5	0	0	111.7	R18 I20 K25 Q26	R18-E22 WeakPolarHBondContact O-CB 3.43Å; R18-E22 PolarHBondContact O-N 3.25Å; I20-E22 VanDerWaalsContact C-N 3.32Å; I20-E22 PolarHBondContact O-N 2.56Å; E22-K25 PolarHBondContact O-N 3.06Å; E22-Q26 WeakPolarHBondContact O-CB 3.22Å; E22-Q26 PolarHBondContact O-N 3.46Å
23	K	75.6	Confident	74.5	Confident	115 Å²	115	113.1 Å²	113.1	50%	0.5	56%	0.562	S	S	.	*	H	α-helix	trans	-63.6	-40.8	171.9	-81.6	174.8	172.8	156.6	0	112.4	E19 K25 Q26 E27	E19-K23 WeakPolarHBondContact O-CB 3.32Å; E19-K23 WeakPolarHBondContact O-CG 3.49Å; E19-K23 PolarHBondContact O-N 2.96Å; E19-K23 IonicContact OE1-NZ 2.69Å; E19-K23 PolarHBondContact OE1-NZ 3.06Å; K23-K25 VanDerWaalsContact C-N 3.34Å; K23-Q26 PolarHBondContact O-N 3.48Å; K23-E27 WeakPolarHBondContact O-CB 3.48Å; K23-E27 WeakPolarHBondContact O-CG 3.43Å; K23-E27 PolarHBondContact O-N 3.33Å
24	L	77.5	Confident	75.7	Confident	97 Å²	97	114.4 Å²	114.4	51%	0.508	56%	0.558	S	S	.	*	H	α-helix	trans	-62.7	-44.2	176.4	-176.3	70.1	0	0	0	110.2	I20 E27 Q28	I20-L24 WeakPolarHBondContact O-CB 3.31Å; I20-L24 PolarHBondContact O-N 3.2Å; L24-E27 PolarHBondContact O-N 2.84Å; L24-Q28 WeakPolarHBondContact O-CB 3.42Å; L24-Q28 PolarHBondContact O-N 3.5Å
25	K	79.7	Confident	76.7	Confident	130 Å²	130	118.6 Å²	118.6	57%	0.565	56%	0.559	S	S	*	*	H	α-helix	trans	-63.5	-42.6	175.9	-170.6	-178	176.5	-169.1	0	111.8	E21 E22 K23 Q28 E29	E21-K25 VanDerWaalsContact O-CB 3.32Å; E21-K25 WeakPolarHBondContact O-CB 3.33Å; E21-K25 PolarHBondContact O-N 3.14Å; E22-K25 PolarHBondContact O-N 3.06Å; K23-K25 VanDerWaalsContact C-N 3.34Å; K25-Q28 PolarHBondContact O-N 2.65Å; K25-E29 WeakPolarHBondContact CE-OE1 3.38Å; K25-E29 PolarHBondContact O-N 2.91Å
26	Q	79.4	Confident	77.8	Confident	129 Å²	129	119.9 Å²	119.9	60%	0.603	55%	0.553	S	S	*	*	H	α-helix	trans	-66.2	-39.9	177.8	-157	174.3	29.9	0	0	111.8	E22 K23 T30	E22-Q26 WeakPolarHBondContact O-CB 3.22Å; E22-Q26 PolarHBondContact O-N 3.46Å; K23-Q26 PolarHBondContact O-N 3.48Å; Q26-T30 WeakPolarHBondContact O-CB 3.48Å; Q26-T30 PolarHBondContact O-N 3.13Å; Q26-T30 PolarHBondContact O-OG1 3.24Å
27	E	77.1	Confident	78.6	Confident	133 Å²	133	115.9 Å²	115.9	62%	0.621	54%	0.543	S	S	*	.	H	α-helix	trans	-65.9	-37.9	171.4	-78.4	-164.2	169.7	0	0	111.7	K23 L24 T30 L31	K23-E27 WeakPolarHBondContact O-CB 3.48Å; K23-E27 WeakPolarHBondContact O-CG 3.43Å; K23-E27 PolarHBondContact O-N 3.33Å; L24-E27 PolarHBondContact O-N 2.84Å; E27-T30 PolarHBondContact O-N 3.44Å; E27-L31 VanDerWaalsContact O-CB 3.32Å; E27-L31 WeakPolarHBondContact O-CB 3.45Å; E27-L31 PolarHBondContact O-N 2.96Å
28	Q	79.6	Confident	79.4	Confident	125 Å²	125	115.7 Å²	115.7	58%	0.584	55%	0.547	S	S	*	.	H	α-helix	trans	-66.4	-40.7	177	-129.5	146.4	-9.3	0	0	112.1	L24 K25 S32	L24-Q28 WeakPolarHBondContact O-CB 3.42Å; L24-Q28 PolarHBondContact O-N 3.5Å; K25-Q28 PolarHBondContact O-N 2.65Å; Q28-S32 WeakPolarHBondContact O-CB 3.43Å; Q28-S32 PolarHBondContact O-N 3.43Å; Q28-S32 PolarHBondContact O-OG 3.32Å
29	E	81.1	Confident	80.1	Confident	110 Å²	110	112.7 Å²	112.7	51%	0.514	54%	0.541	S	S	.	.	H	α-helix	trans	-64.2	-44	172.5	-77.3	175.8	-173.2	0	0	110.8	K25 L31 S32 F33	K25-E29 WeakPolarHBondContact CE-OE1 3.38Å; K25-E29 PolarHBondContact O-N 2.91Å; E29-L31 PolarHBondContact O-N 3.16Å; E29-S32 WeakPolarHBondContact CA-OG 3.49Å; E29-S32 PolarHBondContact O-N 3.43Å; E29-S32 PolarHBondContact O-OG 2.78Å; E29-F33 PolarHBondContact O-N 3.06Å
30	T	78.9	Confident	80.7	Confident	72 Å²	72	112.6 Å²	112.6	44%	0.442	54%	0.539	S	S	.	.	H	α-helix	trans	-65.7	-41	178.1	-48.1	0	0	0	0	112	Q26 E27 S32 F33 I34	Q26-T30 WeakPolarHBondContact O-CB 3.48Å; Q26-T30 PolarHBondContact O-N 3.13Å; Q26-T30 PolarHBondContact O-OG1 3.24Å; E27-T30 PolarHBondContact O-N 3.44Å; T30-S32 VanDerWaalsContact C-N 3.34Å; T30-F33 PolarHBondContact O-N 3.27Å; T30-I34 HydrophobicContact CG2-CD1 4.08Å; T30-I34 WeakPolarHBondContact O-CB 3.48Å; T30-I34 VanDerWaalsContact O-CG1 3.31Å; T30-I34 WeakPolarHBondContact O-CG1 3.41Å; T30-I34 PolarHBondContact O-N 3.48Å
31	L	81	Confident	81.3	Confident	107 Å²	107	110.3 Å²	110.3	56%	0.56	53%	0.533	S	S	*	.	H	α-helix	trans	-64.1	-39.3	174.1	-112	165.2	0	0	0	111.7	E27 E29 R35	E27-L31 VanDerWaalsContact O-CB 3.32Å; E27-L31 WeakPolarHBondContact O-CB 3.45Å; E27-L31 PolarHBondContact O-N 2.96Å; E29-L31 PolarHBondContact O-N 3.16Å; L31-R35 WeakPolarHBondContact O-CB 3.4Å; L31-R35 PolarHBondContact O-N 2.65Å
32	S	82.7	Confident	81.7	Confident	69 Å²	69	108.8 Å²	108.8	48%	0.483	53%	0.529	S	S	.	.	H	α-helix	trans	-64.9	-42	176.1	75.6	0	0	0	0	111.5	Q28 E29 T30 R35 E36	Q28-S32 WeakPolarHBondContact O-CB 3.43Å; Q28-S32 PolarHBondContact O-N 3.43Å; Q28-S32 PolarHBondContact O-OG 3.32Å; E29-S32 WeakPolarHBondContact CA-OG 3.49Å; E29-S32 PolarHBondContact O-N 3.43Å; E29-S32 PolarHBondContact O-OG 2.78Å; T30-S32 VanDerWaalsContact C-N 3.34Å; S32-R35 PolarHBondContact O-N 2.99Å; S32-E36 WeakPolarHBondContact O-CB 3.34Å; S32-E36 PolarHBondContact O-N 3.37Å
33	F	85.7	Confident	82.1	Confident	120 Å²	120	108.2 Å²	108.2	53%	0.526	53%	0.526	S	S	.	.	H	α-helix	trans	-66.8	-42.4	176.5	178.6	-104.4	0	0	0	112.6	E29 T30 E36 N37	E29-F33 PolarHBondContact O-N 3.06Å; T30-F33 PolarHBondContact O-N 3.27Å; F33-E36 PolarHBondContact O-N 2.76Å; F33-N37 WeakPolarHBondContact CE1-ND2 3.25Å; F33-N37 WeakPolarHBondContact CZ-ND2 3.29Å; F33-N37 WeakPolarHBondContact O-CB 3.18Å; F33-N37 PolarHBondContact O-N 3.07Å; F33-N37 PolarHBondContact O-ND2 2.87Å
34	I	81.8	Confident	82.6	Confident	99 Å²	99	109 Å²	109	51%	0.508	54%	0.535	S	S	.	.	H	α-helix	trans	-66	-40.9	175.7	-68.8	170.6	0	0	0	110.5	T30 N37 L38	T30-I34 HydrophobicContact CG2-CD1 4.08Å; T30-I34 WeakPolarHBondContact O-CB 3.48Å; T30-I34 VanDerWaalsContact O-CG1 3.31Å; T30-I34 WeakPolarHBondContact O-CG1 3.41Å; T30-I34 PolarHBondContact O-N 3.48Å; I34-N37 PolarHBondContact O-N 3.03Å; I34-L38 VanDerWaalsContact O-CB 3.27Å; I34-L38 WeakPolarHBondContact O-CB 3.34Å; I34-L38 PolarHBondContact O-N 3.41Å
35	R	83.5	Confident	82.9	Confident	184 Å²	184	108 Å²	108	69%	0.694	53%	0.533	S	S	*	.	H	α-helix	trans	-60.7	-45.8	173.9	-92.1	-170.8	174.3	-170.3	-0.7	111.8	L31 S32 N37 L38 E39	L31-R35 WeakPolarHBondContact O-CB 3.4Å; L31-R35 PolarHBondContact O-N 2.65Å; S32-R35 PolarHBondContact O-N 2.99Å; R35-N37 VanDerWaalsContact C-N 3.35Å; R35-N37 PolarHBondContact O-N 2.74Å; R35-L38 PolarHBondContact O-N 3.08Å; R35-E39 WeakPolarHBondContact O-CB 3.34Å; R35-E39 PolarHBondContact O-N 3.01Å
36	E	85.8	Confident	83.2	Confident	97 Å²	97	107.9 Å²	107.9	45%	0.453	53%	0.532	S	S	.	.	H	α-helix	trans	-63.5	-41.2	178.8	-164.3	-166.9	154.4	0	0	111.5	S32 F33 E39 K40	S32-E36 WeakPolarHBondContact O-CB 3.34Å; S32-E36 PolarHBondContact O-N 3.37Å; F33-E36 PolarHBondContact O-N 2.76Å; E36-E39 PolarHBondContact O-N 3Å; E36-K40 WeakPolarHBondContact O-CB 3.45Å; E36-K40 WeakPolarHBondContact O-CG 3.23Å; E36-K40 PolarHBondContact O-N 3.44Å; E36-K40 VanDerWaalsContact OE1-CE 3.27Å; E36-K40 WeakPolarHBondContact OE1-CE 3.35Å; E36-K40 IonicContact OE1-NZ 3.48Å; E36-K40 PolarHBondContact OE1-NZ 3.31Å
37	N	83.3	Confident	83.6	Confident	65 Å²	65	103.3 Å²	103.3	35%	0.348	52%	0.52	S	S	.	.	H	α-helix	trans	-68.5	-36.1	175.2	-79	-28.5	0	0	0	112.9	F33 I34 R35 E39 K40 S41	F33-N37 WeakPolarHBondContact CE1-ND2 3.25Å; F33-N37 WeakPolarHBondContact CZ-ND2 3.29Å; F33-N37 WeakPolarHBondContact O-CB 3.18Å; F33-N37 PolarHBondContact O-N 3.07Å; F33-N37 PolarHBondContact O-ND2 2.87Å; I34-N37 PolarHBondContact O-N 3.03Å; R35-N37 VanDerWaalsContact C-N 3.35Å; R35-N37 PolarHBondContact O-N 2.74Å; N37-E39 VanDerWaalsContact C-N 3.33Å; N37-K40 PolarHBondContact O-N 3.29Å; N37-S41 WeakPolarHBondContact O-CB 3.43Å; N37-S41 PolarHBondContact O-N 3.31Å
38	L	85.4	Confident	84.2	Confident	123 Å²	123	103 Å²	103	64%	0.644	52%	0.52	S	S	*	.	H	α-helix	trans	-66.3	-39.2	174.6	-168.2	72.7	0	0	0	110.7	I34 R35 S41 D42	I34-L38 VanDerWaalsContact O-CB 3.27Å; I34-L38 WeakPolarHBondContact O-CB 3.34Å; I34-L38 PolarHBondContact O-N 3.41Å; R35-L38 PolarHBondContact O-N 3.08Å; L38-S41 PolarHBondContact O-N 2.92Å; L38-D42 WeakPolarHBondContact O-CB 3.33Å; L38-D42 PolarHBondContact O-N 3.02Å
39	E	84.8	Confident	84.5	Confident	129 Å²	129	101 Å²	101	60%	0.603	52%	0.516	S	S	*	.	H	α-helix	trans	-69.1	-38.8	176.8	-164.9	163.3	-160.6	0	0	111.7	R35 E36 N37 D42 Q43	R35-E39 WeakPolarHBondContact O-CB 3.34Å; R35-E39 PolarHBondContact O-N 3.01Å; E36-E39 PolarHBondContact O-N 3Å; N37-E39 VanDerWaalsContact C-N 3.33Å; E39-D42 PolarHBondContact O-N 3.13Å; E39-Q43 WeakPolarHBondContact O-CB 3.32Å; E39-Q43 PolarHBondContact O-N 3.48Å
40	K	85.9	Confident	84.8	Confident	99 Å²	99	99.5 Å²	99.5	43%	0.43	52%	0.517	S	S	.	.	H	α-helix	trans	-62.3	-41.8	168.7	-75.9	174.4	-173.4	161.9	0	112	E36 N37 Q43 L44	E36-K40 WeakPolarHBondContact O-CB 3.45Å; E36-K40 WeakPolarHBondContact O-CG 3.23Å; E36-K40 PolarHBondContact O-N 3.44Å; E36-K40 VanDerWaalsContact OE1-CE 3.27Å; E36-K40 WeakPolarHBondContact OE1-CE 3.35Å; E36-K40 IonicContact OE1-NZ 3.48Å; E36-K40 PolarHBondContact OE1-NZ 3.31Å; N37-K40 PolarHBondContact O-N 3.29Å; K40-Q43 PolarHBondContact O-N 3.23Å; K40-L44 WeakPolarHBondContact O-CB 3.44Å; K40-L44 WeakPolarHBondContact O-CG 3.43Å; K40-L44 PolarHBondContact O-N 3.2Å
41	S	84.7	Confident	85.2	Confident	63 Å²	63	100.9 Å²	100.9	44%	0.441	52%	0.521	S	S	.	.	H	α-helix	trans	-67.2	-37.8	177.2	-166.9	0	0	0	0	111.9	N37 L38 L44 T45	N37-S41 WeakPolarHBondContact O-CB 3.43Å; N37-S41 PolarHBondContact O-N 3.31Å; L38-S41 PolarHBondContact O-N 2.92Å; S41-L44 PolarHBondContact O-N 2.96Å; S41-T45 WeakPolarHBondContact O-CB 3.4Å; S41-T45 PolarHBondContact O-N 3.42Å; S41-T45 PolarHBondContact O-OG1 2.91Å
42	D	85.3	Confident	85.6	Confident	75 Å²	75	100.6 Å²	100.6	40%	0.401	52%	0.52	S	S	.	.	H	α-helix	trans	-67.1	-40.9	174.3	-175.9	61.1	0	0	0	111.3	L38 E39 T45 K46	L38-D42 WeakPolarHBondContact O-CB 3.33Å; L38-D42 PolarHBondContact O-N 3.02Å; E39-D42 PolarHBondContact O-N 3.13Å; D42-T45 PolarHBondContact O-N 3.46Å; D42-K46 WeakPolarHBondContact O-CB 3.49Å; D42-K46 WeakPolarHBondContact O-CG 3.33Å; D42-K46 PolarHBondContact O-N 3.43Å; D42-K46 WeakPolarHBondContact OD2-CE 3.29Å; D42-K46 IonicContact OD2-NZ 3.38Å; D42-K46 PolarHBondContact OD2-NZ 3.47Å
43	Q	85.3	Confident	85.7	Confident	132 Å²	132	99.6 Å²	99.6	62%	0.617	51%	0.513	S	S	*	.	H	α-helix	trans	-62.4	-43.7	172	-83.7	179.9	-5.3	0	0	112.6	E39 K40 T45 K46 G47	E39-Q43 WeakPolarHBondContact O-CB 3.32Å; E39-Q43 PolarHBondContact O-N 3.48Å; K40-Q43 PolarHBondContact O-N 3.23Å; Q43-T45 VanDerWaalsContact C-N 3.34Å; Q43-K46 PolarHBondContact O-N 2.87Å; Q43-G47 PolarHBondContact O-N 3.27Å
44	L	85.4	Confident	85.9	Confident	131 Å²	131	96.4 Å²	96.4	69%	0.686	51%	0.505	S	S	*	.	H	α-helix	trans	-62.5	-41.9	174.5	-78.5	166.4	0	0	0	111.5	K40 S41 G47 M48	K40-L44 WeakPolarHBondContact O-CB 3.44Å; K40-L44 WeakPolarHBondContact O-CG 3.43Å; K40-L44 PolarHBondContact O-N 3.2Å; S41-L44 PolarHBondContact O-N 2.96Å; L44-G47 PolarHBondContact O-N 3.42Å; L44-M48 PolarHBondContact O-N 2.83Å
45	T	85.3	Confident	86.2	Confident	75 Å²	75	97.3 Å²	97.3	46%	0.46	51%	0.506	S	S	.	.	H	α-helix	trans	-64.5	-44.1	177.7	-54.5	0	0	0	0	111	S41 D42 Q43 G47 M48 V49	S41-T45 WeakPolarHBondContact O-CB 3.4Å; S41-T45 PolarHBondContact O-N 3.42Å; S41-T45 PolarHBondContact O-OG1 2.91Å; D42-T45 PolarHBondContact O-N 3.46Å; Q43-T45 VanDerWaalsContact C-N 3.34Å; T45-G47 VanDerWaalsContact C-N 3.33Å; T45-G47 PolarHBondContact O-N 3.07Å; T45-M48 PolarHBondContact O-N 3.38Å; T45-V49 WeakPolarHBondContact O-CG2 3.32Å; T45-V49 PolarHBondContact O-N 3.35Å
46	K	86.3	Confident	86.4	Confident	129 Å²	129	95.2 Å²	95.2	56%	0.561	50%	0.504	S	S	*	.	H	α-helix	trans	-61.5	-39.7	173.2	-76.8	169.7	176.5	161.7	0	112.2	D42 Q43 S50	D42-K46 WeakPolarHBondContact O-CB 3.49Å; D42-K46 WeakPolarHBondContact O-CG 3.33Å; D42-K46 PolarHBondContact O-N 3.43Å; D42-K46 WeakPolarHBondContact OD2-CE 3.29Å; D42-K46 IonicContact OD2-NZ 3.38Å; D42-K46 PolarHBondContact OD2-NZ 3.47Å; Q43-K46 PolarHBondContact O-N 2.87Å; K46-S50 WeakPolarHBondContact O-CB 3.38Å; K46-S50 PolarHBondContact O-N 2.98Å
47	G	87.6	Confident	86.4	Confident	33 Å²	33	98.2 Å²	98.2	34%	0.34	51%	0.511	S	S	.	.	H	α-helix	trans	-60.9	-45	172.2	0	0	0	0	0	112.2	Q43 L44 T45 S50 I51	Q43-G47 PolarHBondContact O-N 3.27Å; L44-G47 PolarHBondContact O-N 3.42Å; T45-G47 VanDerWaalsContact C-N 3.33Å; T45-G47 PolarHBondContact O-N 3.07Å; G47-S50 WeakPolarHBondContact O-CB 3.33Å; G47-S50 PolarHBondContact O-N 3.38Å; G47-I51 WeakPolarHBondContact O-CG1 3.27Å; G47-I51 PolarHBondContact O-N 2.99Å
48	M	88.1	Confident	86.6	Confident	127 Å²	127	102.8 Å²	102.8	63%	0.626	52%	0.523	S	S	*	.	H	α-helix	trans	-65.5	-42.9	178.7	-141.6	175.7	97.6	0	0	111.9	L44 T45 S50 I51 L52	L44-M48 PolarHBondContact O-N 2.83Å; T45-M48 PolarHBondContact O-N 3.38Å; M48-S50 VanDerWaalsContact C-N 3.34Å; M48-I51 PolarHBondContact O-N 2.98Å; M48-L52 HydrophobicContact CE-CD1 4.42Å; M48-L52 WeakPolarHBondContact O-CB 3.39Å; M48-L52 VanDerWaalsContact O-CG 3.32Å; M48-L52 WeakPolarHBondContact O-CG 3.17Å; M48-L52 PolarHBondContact O-N 3.03Å
49	V	86.8	Confident	86.7	Confident	81 Å²	81	102 Å²	102	49%	0.491	52%	0.52	S	S	.	.	H	α-helix	trans	-62.5	-42.1	174.1	172.3	0	0	0	0	110.7	T45 I51 L52 S53	T45-V49 WeakPolarHBondContact O-CG2 3.32Å; T45-V49 PolarHBondContact O-N 3.35Å; V49-I51 PolarHBondContact O-N 2.81Å; V49-L52 PolarHBondContact O-N 3.18Å; V49-S53 WeakPolarHBondContact O-CB 3.31Å; V49-S53 PolarHBondContact O-N 3.27Å; V49-S53 PolarHBondContact O-OG 3.46Å; V49-S53 VanDerWaalsContact O-OG 3.07Å
50	S	87.3	Confident	86.7	Confident	79 Å²	79	101.5 Å²	101.5	55%	0.552	52%	0.518	S	S	*	.	H	α-helix	trans	-62.4	-43.4	176.8	-175	0	0	0	0	112.6	K46 G47 M48 S54	K46-S50 WeakPolarHBondContact O-CB 3.38Å; K46-S50 PolarHBondContact O-N 2.98Å; G47-S50 WeakPolarHBondContact O-CB 3.33Å; G47-S50 PolarHBondContact O-N 3.38Å; M48-S50 VanDerWaalsContact C-N 3.34Å; S50-S54 WeakPolarHBondContact O-CB 3.37Å; S50-S54 PolarHBondContact O-N 3.36Å
51	I	88.3	Confident	86.6	Confident	102 Å²	102	102.7 Å²	102.7	52%	0.523	53%	0.526	S	S	.	.	H	α-helix	trans	-63.1	-46.1	175.5	-68.9	167.4	0	0	0	110.3	G47 M48 V49 S54 F55	G47-I51 WeakPolarHBondContact O-CG1 3.27Å; G47-I51 PolarHBondContact O-N 2.99Å; M48-I51 PolarHBondContact O-N 2.98Å; V49-I51 PolarHBondContact O-N 2.81Å; I51-S54 CarbonylContact O-C 2.91Å; I51-S54 WeakPolarHBondContact O-CB 3.28Å; I51-S54 PolarHBondContact O-N 3.42Å; I51-F55 HydrophobicContact CG2-CD2 3.71Å; I51-F55 HydrophobicContact CG2-CE2 3.92Å; I51-F55 WeakPolarHBondContact O-CD2 3.39Å; I51-F55 PolarHBondContact O-N 2.98Å
52	L	87.5	Confident	86.6	Confident	100 Å²	100	104.2 Å²	104.2	52%	0.524	53%	0.528	S	S	.	.	H	α-helix	trans	-62.7	-45.8	178.7	-74.9	167.8	0	0	0	111.8	M48 V49 S54 F55 E56	M48-L52 HydrophobicContact CE-CD1 4.42Å; M48-L52 WeakPolarHBondContact O-CB 3.39Å; M48-L52 VanDerWaalsContact O-CG 3.32Å; M48-L52 WeakPolarHBondContact O-CG 3.17Å; M48-L52 PolarHBondContact O-N 3.03Å; V49-L52 PolarHBondContact O-N 3.18Å; L52-S54 VanDerWaalsContact C-N 3.28Å; L52-S54 PolarHBondContact O-N 2.95Å; L52-F55 PolarHBondContact O-N 3.43Å; L52-F55 VanDerWaalsContact O-N 3.14Å; L52-E56 WeakPolarHBondContact O-CB 3.39Å; L52-E56 PolarHBondContact O-N 3.22Å
53	S	85.9	Confident	86.5	Confident	48 Å²	48	105.6 Å²	105.6	34%	0.336	53%	0.532	S	S	.	.	H	α-helix	trans	-63.4	-34	174.5	-61.7	0	0	0	0	112.4	V49 R57	V49-S53 WeakPolarHBondContact O-CB 3.31Å; V49-S53 PolarHBondContact O-N 3.27Å; V49-S53 PolarHBondContact O-OG 3.46Å; V49-S53 VanDerWaalsContact O-OG 3.07Å; S53-R57 VanDerWaalsContact O-CB 3.3Å; S53-R57 WeakPolarHBondContact O-CB 3.42Å; S53-R57 PolarHBondContact O-N 3.26Å
54	S	88.9	Confident	86.3	Confident	54 Å²	54	104.2 Å²	104.2	38%	0.378	53%	0.529	S	S	.	.	H	α-helix	trans	-69.2	-38.9	173.1	-178.2	0	0	0	0	112	S50 I51 L52 R58	S50-S54 WeakPolarHBondContact O-CB 3.37Å; S50-S54 PolarHBondContact O-N 3.36Å; I51-S54 CarbonylContact O-C 2.91Å; I51-S54 WeakPolarHBondContact O-CB 3.28Å; I51-S54 PolarHBondContact O-N 3.42Å; L52-S54 VanDerWaalsContact C-N 3.28Å; L52-S54 PolarHBondContact O-N 2.95Å; S54-R58 WeakPolarHBondContact O-CB 3.01Å; S54-R58 VanDerWaalsContact O-CG 3.27Å; S54-R58 WeakPolarHBondContact O-CG 3.4Å; S54-R58 PolarHBondContact O-N 3.32Å
55	F	88.9	Confident	86.3	Confident	117 Å²	117	101 Å²	101	51%	0.513	52%	0.518	S	S	.	.	H	α-helix	trans	-65.9	-49.2	175.4	-99.5	-78.9	0	0	0	110.5	I51 L52 R57 R58 L59	I51-F55 HydrophobicContact CG2-CD2 3.71Å; I51-F55 HydrophobicContact CG2-CE2 3.92Å; I51-F55 WeakPolarHBondContact O-CD2 3.39Å; I51-F55 PolarHBondContact O-N 2.98Å; L52-F55 PolarHBondContact O-N 3.43Å; L52-F55 VanDerWaalsContact O-N 3.14Å; F55-R57 VanDerWaalsContact C-N 3.32Å; F55-R57 PolarHBondContact O-N 3.35Å; F55-R58 CarbonylContact O-C 3.59Å; F55-R58 PolarHBondContact O-N 2.96Å; F55-R58 VanDerWaalsContact O-N 3.09Å; F55-L59 WeakPolarHBondContact O-CB 3.5Å; F55-L59 PolarHBondContact O-N 3.43Å
56	E	87.5	Confident	86.3	Confident	140 Å²	140	101 Å²	101	65%	0.654	51%	0.514	S	S	*	.	H	α-helix	trans	-57.2	-45.1	177.9	-171.5	174.8	-162.5	0	0	111.3	L52 R58 L59 M60	L52-E56 WeakPolarHBondContact O-CB 3.39Å; L52-E56 PolarHBondContact O-N 3.22Å; E56-R58 PolarHBondContact O-N 3.28Å; E56-L59 PolarHBondContact O-N 2.81Å; E56-M60 VanDerWaalsContact O-CB 3.3Å; E56-M60 WeakPolarHBondContact O-CB 3.35Å; E56-M60 PolarHBondContact O-N 3.49Å
57	R	85.1	Confident	86.1	Confident	160 Å²	160	98.2 Å²	98.2	60%	0.604	51%	0.505	S	S	*	.	H	α-helix	trans	-63.7	-40.5	175.9	-165.3	-178.4	-61.8	133.3	1.8	112.5	S53 F55 Q61	S53-R57 VanDerWaalsContact O-CB 3.3Å; S53-R57 WeakPolarHBondContact O-CB 3.42Å; S53-R57 PolarHBondContact O-N 3.26Å; F55-R57 VanDerWaalsContact C-N 3.32Å; F55-R57 PolarHBondContact O-N 3.35Å; R57-Q61 WeakPolarHBondContact O-CB 3.34Å; R57-Q61 WeakPolarHBondContact O-CG 3.39Å; R57-Q61 PolarHBondContact O-N 2.83Å
58	R	88.8	Confident	86.1	Confident	161 Å²	161	99.6 Å²	99.6	61%	0.608	51%	0.508	S	S	*	.	H	α-helix	trans	-69.3	-37.2	176.4	-76	175.2	67.6	-173.9	1	112	S54 F55 E56 Q61 L62	S54-R58 WeakPolarHBondContact O-CB 3.01Å; S54-R58 VanDerWaalsContact O-CG 3.27Å; S54-R58 WeakPolarHBondContact O-CG 3.4Å; S54-R58 PolarHBondContact O-N 3.32Å; F55-R58 CarbonylContact O-C 3.59Å; F55-R58 PolarHBondContact O-N 2.96Å; F55-R58 VanDerWaalsContact O-N 3.09Å; E56-R58 PolarHBondContact O-N 3.28Å; R58-Q61 PolarHBondContact O-N 3.12Å; R58-L62 VanDerWaalsContact O-CB 3.25Å; R58-L62 WeakPolarHBondContact O-CB 3.27Å; R58-L62 PolarHBondContact O-N 2.9Å
59	L	87.1	Confident	85.9	Confident	108 Å²	108	97.5 Å²	97.5	57%	0.565	50%	0.502	S	S	*	.	H	α-helix	trans	-67.7	-43.6	177.6	-133.3	139	0	0	0	110	F55 E56 L62 E63	F55-L59 WeakPolarHBondContact O-CB 3.5Å; F55-L59 PolarHBondContact O-N 3.43Å; E56-L59 PolarHBondContact O-N 2.81Å; L59-L62 PolarHBondContact O-N 3.42Å; L59-E63 WeakPolarHBondContact O-CB 3.13Å; L59-E63 PolarHBondContact O-N 3.36Å
60	M	84.9	Confident	85.8	Confident	117 Å²	117	99.9 Å²	99.9	58%	0.576	51%	0.507	S	S	*	.	H	α-helix	trans	-63.6	-41.5	174	-168.8	-172.8	-173.8	0	0	112	E56 N64	E56-M60 VanDerWaalsContact O-CB 3.3Å; E56-M60 WeakPolarHBondContact O-CB 3.35Å; E56-M60 PolarHBondContact O-N 3.49Å; M60-N64 VanDerWaalsContact O-CB 3.27Å; M60-N64 WeakPolarHBondContact O-CB 3.33Å; M60-N64 PolarHBondContact O-N 3.27Å; M60-N64 PolarHBondContact O-ND2 3.29Å; M60-N64 VanDerWaalsContact O-ND2 3.1Å
61	Q	83.3	Confident	85.7	Confident	125 Å²	125	102.3 Å²	102.3	58%	0.584	51%	0.508	S	S	*	.	H	α-helix	trans	-64.3	-42	173.6	-79.5	178.7	-14.5	0	0	112	R57 R58 S65	R57-Q61 WeakPolarHBondContact O-CB 3.34Å; R57-Q61 WeakPolarHBondContact O-CG 3.39Å; R57-Q61 PolarHBondContact O-N 2.83Å; R58-Q61 PolarHBondContact O-N 3.12Å; Q61-S65 WeakPolarHBondContact O-CB 3.2Å; Q61-S65 PolarHBondContact O-N 3.34Å; Q61-S65 PolarHBondContact O-OG 3.28Å
62	L	84.2	Confident	85.5	Confident	95 Å²	95	104 Å²	104	50%	0.497	51%	0.514	S	S	.	.	H	α-helix	trans	-64.2	-47.3	177.1	-171.5	68.6	0	0	0	110.7	R58 L59 N64 S65 I66	R58-L62 VanDerWaalsContact O-CB 3.25Å; R58-L62 WeakPolarHBondContact O-CB 3.27Å; R58-L62 PolarHBondContact O-N 2.9Å; L59-L62 PolarHBondContact O-N 3.42Å; L62-N64 PolarHBondContact O-N 3.48Å; L62-S65 WeakPolarHBondContact CA-OG 3.21Å; L62-S65 CarbonylContact O-C 3.44Å; L62-S65 PolarHBondContact O-N 3.48Å; L62-S65 VanDerWaalsContact O-N 3.07Å; L62-S65 PolarHBondContact O-OG 3.02Å; L62-I66 HydrophobicContact CD1-CD1 3.51Å; L62-I66 HydrophobicContact CD1-CG1 3.96Å; L62-I66 HydrophobicContact CD2-CD1 4.14Å; L62-I66 HydrophobicContact CG-CD1 3.58Å; L62-I66 HydrophobicContact CG-CG1 4.13Å; L62-I66 WeakPolarHBondContact O-CB 3.48Å; L62-I66 WeakPolarHBondContact O-CG1 3.07Å; L62-I66 PolarHBondContact O-N 3.01Å
63	E	83.3	Confident	85.6	Confident	104 Å²	104	102.3 Å²	102.3	49%	0.486	51%	0.507	S	S	.	.	H	α-helix	trans	-59.5	-47.7	177.7	-173.7	175	-172.3	0	0	111.4	L59 S65 I66 I67	L59-E63 WeakPolarHBondContact O-CB 3.13Å; L59-E63 PolarHBondContact O-N 3.36Å; E63-S65 PolarHBondContact O-N 3.25Å; E63-I66 PolarHBondContact O-N 3.35Å; E63-I67 HydrophobicContact CG-CD1 3.36Å; E63-I67 HydrophobicContact CG-CG1 4Å; E63-I67 WeakPolarHBondContact O-CB 3.35Å; E63-I67 VanDerWaalsContact O-CG1 3.3Å; E63-I67 WeakPolarHBondContact O-CG1 3.32Å; E63-I67 PolarHBondContact O-N 3.28Å
64	N	82.7	Confident	85.7	Confident	102 Å²	102	104.7 Å²	104.7	55%	0.545	51%	0.513	S	S	.	.	H	α-helix	trans	-63.6	-25.8	175.3	-73.7	-30.6	0	0	0	113.2	M60 L62 P68	M60-N64 VanDerWaalsContact O-CB 3.27Å; M60-N64 WeakPolarHBondContact O-CB 3.33Å; M60-N64 PolarHBondContact O-N 3.27Å; M60-N64 PolarHBondContact O-ND2 3.29Å; M60-N64 VanDerWaalsContact O-ND2 3.1Å; L62-N64 PolarHBondContact O-N 3.48Å; N64-P68 WeakPolarHBondContact O-CD 3.32Å; N64-P68 VanDerWaalsContact O-CG 3.22Å; N64-P68 WeakPolarHBondContact O-CG 3.33Å
65	S	83.9	Confident	85.8	Confident	64 Å²	64	106.5 Å²	106.5	45%	0.448	52%	0.518	S	S	.	.	H	α-helix	trans	-87.6	-37.8	176.8	72.3	0	0	0	0	113.5	Q61 L62 E63 V69	Q61-S65 WeakPolarHBondContact O-CB 3.2Å; Q61-S65 PolarHBondContact O-N 3.34Å; Q61-S65 PolarHBondContact O-OG 3.28Å; L62-S65 WeakPolarHBondContact CA-OG 3.21Å; L62-S65 CarbonylContact O-C 3.44Å; L62-S65 PolarHBondContact O-N 3.48Å; L62-S65 VanDerWaalsContact O-N 3.07Å; L62-S65 PolarHBondContact O-OG 3.02Å; E63-S65 PolarHBondContact O-N 3.25Å; S65-V69 WeakPolarHBondContact O-CG2 3.4Å
66	I	84.9	Confident	85.9	Confident	76 Å²	76	106.3 Å²	106.3	39%	0.39	52%	0.522	S	S	.	.	H	α-helix	trans	-84.7	-40.9	-173.4	-70.5	-172.6	0	0	0	111.2	L62 E63 V69 H70	L62-I66 HydrophobicContact CD1-CD1 3.51Å; L62-I66 HydrophobicContact CD1-CG1 3.96Å; L62-I66 HydrophobicContact CD2-CD1 4.14Å; L62-I66 HydrophobicContact CG-CD1 3.58Å; L62-I66 HydrophobicContact CG-CG1 4.13Å; L62-I66 WeakPolarHBondContact O-CB 3.48Å; L62-I66 WeakPolarHBondContact O-CG1 3.07Å; L62-I66 PolarHBondContact O-N 3.01Å; E63-I66 PolarHBondContact O-N 3.35Å; I66-V69 PolarHBondContact O-N 3.39Å; I66-V69 VanDerWaalsContact O-N 3.11Å; I66-H70 PolarHBondContact O-N 2.88Å
67	I	83.9	Confident	86	Confident	70 Å²	70	105 Å²	105	36%	0.359	52%	0.516	S	S	.	.	H	α-helix	trans	-56.8	-45.9	-178.3	-69.8	180	0	0	0	111.8	E63 V69 H70 K71	E63-I67 HydrophobicContact CG-CD1 3.36Å; E63-I67 HydrophobicContact CG-CG1 4Å; E63-I67 WeakPolarHBondContact O-CB 3.35Å; E63-I67 VanDerWaalsContact O-CG1 3.3Å; E63-I67 WeakPolarHBondContact O-CG1 3.32Å; E63-I67 PolarHBondContact O-N 3.28Å; I67-V69 PolarHBondContact O-N 2.88Å; I67-H70 PolarHBondContact O-N 3.46Å; I67-K71 HydrophobicContact CG2-CD 4.16Å; I67-K71 HydrophobicContact CG2-CG 4.46Å; I67-K71 WeakPolarHBondContact O-CB 3.42Å; I67-K71 WeakPolarHBondContact O-CG 3.48Å; I67-K71 PolarHBondContact O-N 3.4Å
68	P	86	Confident	86.3	Confident	62 Å²	62	103.1 Å²	103.1	40%	0.403	51%	0.509	S	S	.	.	H	α-helix	trans	-62.9	-40	176.1	-23.3	34.8	0	0	0	112.9	N64 K71 Q72	N64-P68 WeakPolarHBondContact O-CD 3.32Å; N64-P68 VanDerWaalsContact O-CG 3.22Å; N64-P68 WeakPolarHBondContact O-CG 3.33Å; P68-K71 PolarHBondContact O-N 2.95Å; P68-Q72 WeakPolarHBondContact O-CB 3.47Å; P68-Q72 VanDerWaalsContact O-CG 3.31Å; P68-Q72 WeakPolarHBondContact O-CG 3.45Å; P68-Q72 PolarHBondContact O-N 2.74Å
69	V	84.4	Confident	86.5	Confident	82 Å²	82	100.3 Å²	100.3	50%	0.497	51%	0.506	S	S	.	.	H	α-helix	trans	-66	-42.7	177.6	174.3	0	0	0	0	110.9	S65 I66 I67 Q72 T73	S65-V69 WeakPolarHBondContact O-CG2 3.4Å; I66-V69 PolarHBondContact O-N 3.39Å; I66-V69 VanDerWaalsContact O-N 3.11Å; I67-V69 PolarHBondContact O-N 2.88Å; V69-Q72 PolarHBondContact O-N 3.22Å; V69-T73 WeakPolarHBondContact O-CB 3.28Å; V69-T73 PolarHBondContact O-N 2.86Å; V69-T73 PolarHBondContact O-OG1 3.03Å
70	H	85.8	Confident	86.7	Confident	132 Å²	132	100.7 Å²	100.7	61%	0.611	51%	0.505	S	S	*	.	H	α-helix	trans	-63.2	-44.9	175.1	-113.3	-63.6	0	0	0	111.4	I66 I67 Q72 T73 E74	I66-H70 PolarHBondContact O-N 2.88Å; I67-H70 PolarHBondContact O-N 3.46Å; H70-Q72 PolarHBondContact O-N 3.42Å; H70-T73 PolarHBondContact O-N 3.23Å; H70-E74 WeakPolarHBondContact O-CB 3.46Å; H70-E74 PolarHBondContact O-N 2.98Å
71	K	83.9	Confident	87.1	Confident	130 Å²	130	100 Å²	100	57%	0.565	50%	0.5	S	S	*	.	H	α-helix	trans	-62.2	-41.1	174.8	-77.7	-177.6	177.2	-179.5	0	112.3	I67 P68 N75	I67-K71 HydrophobicContact CG2-CD 4.16Å; I67-K71 HydrophobicContact CG2-CG 4.46Å; I67-K71 WeakPolarHBondContact O-CB 3.42Å; I67-K71 WeakPolarHBondContact O-CG 3.48Å; I67-K71 PolarHBondContact O-N 3.4Å; P68-K71 PolarHBondContact O-N 2.95Å; K71-N75 WeakPolarHBondContact O-CB 3.3Å; K71-N75 VanDerWaalsContact O-CG 3.29Å; K71-N75 PolarHBondContact O-N 3.26Å; K71-N75 PolarHBondContact O-ND2 3.28Å
72	Q	85.3	Confident	87.6	Confident	138 Å²	138	97.9 Å²	97.9	65%	0.645	49%	0.492	S	S	*	.	H	α-helix	trans	-66	-39.8	175	-78.4	-177.7	-22.9	0	0	111.6	P68 V69 H70 N75 L76	P68-Q72 WeakPolarHBondContact O-CB 3.47Å; P68-Q72 VanDerWaalsContact O-CG 3.31Å; P68-Q72 WeakPolarHBondContact O-CG 3.45Å; P68-Q72 PolarHBondContact O-N 2.74Å; V69-Q72 PolarHBondContact O-N 3.22Å; H70-Q72 PolarHBondContact O-N 3.42Å; Q72-N75 PolarHBondContact O-N 3.19Å; Q72-L76 WeakPolarHBondContact O-CB 3.44Å; Q72-L76 PolarHBondContact O-N 2.68Å
73	T	88.3	Confident	88	Confident	63 Å²	63	96.7 Å²	96.7	39%	0.387	49%	0.489	S	S	.	.	H	α-helix	trans	-66.3	-42.6	177.2	-55.2	0	0	0	0	111.3	V69 H70 L76 Q77	V69-T73 WeakPolarHBondContact O-CB 3.28Å; V69-T73 PolarHBondContact O-N 2.86Å; V69-T73 PolarHBondContact O-OG1 3.03Å; H70-T73 PolarHBondContact O-N 3.23Å; T73-L76 PolarHBondContact O-N 2.98Å; T73-Q77 WeakPolarHBondContact O-CG 3.36Å; T73-Q77 PolarHBondContact O-N 3.25Å
74	E	88.6	Confident	88.4	Confident	98 Å²	98	95.8 Å²	95.8	46%	0.458	49%	0.488	S	S	.	.	H	α-helix	trans	-62.8	-44.1	175.1	-169.6	-164.8	150.1	0	0	111.3	H70 L76 Q77 R78	H70-E74 WeakPolarHBondContact O-CB 3.46Å; H70-E74 PolarHBondContact O-N 2.98Å; E74-L76 VanDerWaalsContact C-N 3.31Å; E74-L76 PolarHBondContact O-N 2.85Å; E74-Q77 PolarHBondContact O-N 2.86Å; E74-R78 WeakPolarHBondContact O-CB 3.37Å; E74-R78 PolarHBondContact O-N 2.55Å; E74-R78 IonicContact OE1-CZ 2.69Å; E74-R78 IonicContact OE1-NH2 3.64Å; E74-R78 PolarHBondContact OE1-NH2 3.5Å
75	N	90.3	Very high	88.8	Confident	92 Å²	92	96.8 Å²	96.8	49%	0.492	49%	0.487	S	S	.	.	H	α-helix	trans	-63.2	-38.1	174.8	-76.5	-23.9	0	0	0	112	K71 Q72 R78 L79	K71-N75 WeakPolarHBondContact O-CB 3.3Å; K71-N75 VanDerWaalsContact O-CG 3.29Å; K71-N75 PolarHBondContact O-N 3.26Å; K71-N75 PolarHBondContact O-ND2 3.28Å; Q72-N75 PolarHBondContact O-N 3.19Å; N75-R78 PolarHBondContact O-N 3Å; N75-L79 WeakPolarHBondContact O-CB 3.47Å; N75-L79 PolarHBondContact O-N 3.2Å
76	L	91.3	Very high	89.2	Confident	114 Å²	114	98.1 Å²	98.1	60%	0.597	49%	0.492	S	S	*	.	H	α-helix	trans	-68.3	-41.3	176.9	-167.8	72.1	0	0	0	111.6	Q72 T73 E74 L79 Q80	Q72-L76 WeakPolarHBondContact O-CB 3.44Å; Q72-L76 PolarHBondContact O-N 2.68Å; T73-L76 PolarHBondContact O-N 2.98Å; E74-L76 VanDerWaalsContact C-N 3.31Å; E74-L76 PolarHBondContact O-N 2.85Å; L76-L79 WeakPolarHBondContact O-CB 3.34Å; L76-L79 PolarHBondContact O-N 3.06Å; L76-Q80 WeakPolarHBondContact O-CB 3.44Å; L76-Q80 PolarHBondContact O-N 3.24Å
77	Q	89.6	Confident	89.5	Confident	111 Å²	111	98.7 Å²	98.7	52%	0.519	50%	0.496	S	S	.	.	H	α-helix	trans	-62	-44.7	173.5	-77.1	178.7	-15.1	0	0	111.3	T73 E74 L79 Q80 E81	T73-Q77 WeakPolarHBondContact O-CG 3.36Å; T73-Q77 PolarHBondContact O-N 3.25Å; E74-Q77 PolarHBondContact O-N 2.86Å; Q77-L79 VanDerWaalsContact C-N 3.3Å; Q77-L79 PolarHBondContact O-N 3.22Å; Q77-Q80 PolarHBondContact O-N 3.44Å; Q77-E81 WeakPolarHBondContact O-CG 3.38Å; Q77-E81 PolarHBondContact O-N 3.06Å
78	R	91.7	Very high	89.8	Confident	122 Å²	122	99.2 Å²	99.2	46%	0.46	51%	0.506	S	S	.	.	H	α-helix	trans	-61.7	-39.3	175.1	-169.8	179	-66.1	141.1	6.6	111.8	E74 N75 N82	E74-R78 WeakPolarHBondContact O-CB 3.37Å; E74-R78 PolarHBondContact O-N 2.55Å; E74-R78 IonicContact OE1-CZ 2.69Å; E74-R78 IonicContact OE1-NH2 3.64Å; E74-R78 PolarHBondContact OE1-NH2 3.5Å; N75-R78 PolarHBondContact O-N 3Å; R78-N82 WeakPolarHBondContact O-CB 3.43Å; R78-N82 PolarHBondContact O-N 2.7Å; R78-N82 PolarHBondContact O-ND2 3.17Å; R78-N82 PolarHBondContact O-OD1 3.37Å
79	L	92.6	Very high	89.9	Confident	102 Å²	102	100.2 Å²	100.2	53%	0.534	51%	0.513	S	S	.	.	H	α-helix	trans	-64.1	-46.2	174.6	-179.2	65.4	0	0	0	111.1	N75 L76 Q77 N82 V83	N75-L79 WeakPolarHBondContact O-CB 3.47Å; N75-L79 PolarHBondContact O-N 3.2Å; L76-L79 WeakPolarHBondContact O-CB 3.34Å; L76-L79 PolarHBondContact O-N 3.06Å; Q77-L79 VanDerWaalsContact C-N 3.3Å; Q77-L79 PolarHBondContact O-N 3.22Å; L79-N82 PolarHBondContact O-N 2.93Å; L79-V83 WeakPolarHBondContact O-CG2 3.24Å; L79-V83 PolarHBondContact O-N 2.97Å
80	Q	92.2	Very high	90.1	Very high	116 Å²	116	100.6 Å²	100.6	54%	0.542	51%	0.512	S	S	.	.	H	α-helix	trans	-59.4	-49	177	-178	-179.8	-6.5	0	0	111.2	L76 Q77 N82 V83 D84	L76-Q80 WeakPolarHBondContact O-CB 3.44Å; L76-Q80 PolarHBondContact O-N 3.24Å; Q77-Q80 PolarHBondContact O-N 3.44Å; Q80-N82 VanDerWaalsContact C-N 3.27Å; Q80-N82 PolarHBondContact O-N 3.48Å; Q80-V83 WeakPolarHBondContact O-CB 3.46Å; Q80-V83 PolarHBondContact O-N 3.04Å; Q80-V83 VanDerWaalsContact O-N 3.09Å; Q80-D84 PolarHBondContact O-N 3.49Å
81	E	93.4	Very high	90.2	Very high	102 Å²	102	99.2 Å²	99.2	48%	0.477	51%	0.509	S	S	.	.	H	α-helix	trans	-58.5	-39.4	176.1	-74.9	-179.5	-163.6	0	0	112.4	Q77 K85	Q77-E81 WeakPolarHBondContact O-CG 3.38Å; Q77-E81 PolarHBondContact O-N 3.06Å; E81-K85 WeakPolarHBondContact O-CB 3.31Å; E81-K85 WeakPolarHBondContact O-CD 3.27Å; E81-K85 WeakPolarHBondContact O-CG 3.29Å; E81-K85 PolarHBondContact O-N 2.71Å; E81-K85 IonicContact OE2-NZ 3.93Å
82	N	93.4	Very high	90.4	Very high	80 Å²	80	97.8 Å²	97.8	43%	0.428	50%	0.504	S	S	.	.	H	α-helix	trans	-67.2	-39.3	176.7	-71.8	-15	0	0	0	111.6	R78 L79 Q80 T86	R78-N82 WeakPolarHBondContact O-CB 3.43Å; R78-N82 PolarHBondContact O-N 2.7Å; R78-N82 PolarHBondContact O-ND2 3.17Å; R78-N82 PolarHBondContact O-OD1 3.37Å; L79-N82 PolarHBondContact O-N 2.93Å; Q80-N82 VanDerWaalsContact C-N 3.27Å; Q80-N82 PolarHBondContact O-N 3.48Å; N82-T86 WeakPolarHBondContact O-CB 3.38Å; N82-T86 PolarHBondContact O-N 2.88Å; N82-T86 PolarHBondContact O-OG1 3.44Å
83	V	92.5	Very high	90.5	Very high	71 Å²	71	93.5 Å²	93.5	43%	0.43	49%	0.487	S	S	.	.	H	α-helix	trans	-64.2	-47.7	174.8	170.2	0	0	0	0	110.3	L79 Q80 K85 T86 L87	L79-V83 WeakPolarHBondContact O-CG2 3.24Å; L79-V83 PolarHBondContact O-N 2.97Å; Q80-V83 WeakPolarHBondContact O-CB 3.46Å; Q80-V83 PolarHBondContact O-N 3.04Å; Q80-V83 VanDerWaalsContact O-N 3.09Å; V83-K85 PolarHBondContact O-N 3.16Å; V83-T86 PolarHBondContact O-N 3.47Å; V83-T86 VanDerWaalsContact O-N 3.12Å; V83-L87 HydrophobicContact CG1-CD1 3.94Å; V83-L87 HydrophobicContact CG1-CG 4.35Å; V83-L87 WeakPolarHBondContact O-CG 3.34Å; V83-L87 PolarHBondContact O-N 2.98Å
84	D	92.4	Very high	90.5	Very high	85 Å²	85	93.8 Å²	93.8	46%	0.455	49%	0.486	S	S	.	.	H	α-helix	trans	-62.8	-41.8	179.7	-68.7	-22.4	0	0	0	111.6	Q80 T86 L87 S88	Q80-D84 PolarHBondContact O-N 3.49Å; D84-T86 VanDerWaalsContact C-N 3.35Å; D84-L87 PolarHBondContact O-N 2.64Å; D84-S88 WeakPolarHBondContact O-CB 3.19Å; D84-S88 PolarHBondContact O-N 3.3Å
85	K	91.4	Very high	90.6	Very high	123 Å²	123	91.5 Å²	91.5	54%	0.535	48%	0.481	S	S	.	.	H	α-helix	trans	-62.4	-42.1	173	-74.7	168.5	-173.4	162.8	0	111.6	E81 V83 S88 C89	E81-K85 WeakPolarHBondContact O-CB 3.31Å; E81-K85 WeakPolarHBondContact O-CD 3.27Å; E81-K85 WeakPolarHBondContact O-CG 3.29Å; E81-K85 PolarHBondContact O-N 2.71Å; E81-K85 IonicContact OE2-NZ 3.93Å; V83-K85 PolarHBondContact O-N 3.16Å; K85-S88 PolarHBondContact O-N 2.87Å; K85-C89 WeakPolarHBondContact O-CB 3.46Å; K85-C89 PolarHBondContact O-N 3.1Å; K85-C89 PolarHBondContact O-SG 3.12Å
86	T	91.1	Very high	90.6	Very high	91 Å²	91	88.8 Å²	88.8	56%	0.558	46%	0.464	S	S	*	.	H	α-helix	trans	-67	-42	179.3	-56.1	0	0	0	0	111.4	N82 V83 D84 C89 L90	N82-T86 WeakPolarHBondContact O-CB 3.38Å; N82-T86 PolarHBondContact O-N 2.88Å; N82-T86 PolarHBondContact O-OG1 3.44Å; V83-T86 PolarHBondContact O-N 3.47Å; V83-T86 VanDerWaalsContact O-N 3.12Å; D84-T86 VanDerWaalsContact C-N 3.35Å; T86-C89 PolarHBondContact O-N 2.59Å; T86-L90 WeakPolarHBondContact O-CB 3.33Å; T86-L90 PolarHBondContact O-N 3.14Å
87	L	91.4	Very high	90.5	Very high	89 Å²	89	88.2 Å²	88.2	47%	0.466	45%	0.454	S	S	.	.	H	α-helix	trans	-61.5	-46.4	174.5	-74.8	172.3	0	0	0	111	V83 D84 C89 L90 D91	V83-L87 HydrophobicContact CG1-CD1 3.94Å; V83-L87 HydrophobicContact CG1-CG 4.35Å; V83-L87 WeakPolarHBondContact O-CG 3.34Å; V83-L87 PolarHBondContact O-N 2.98Å; D84-L87 PolarHBondContact O-N 2.64Å; L87-C89 VanDerWaalsContact C-N 3.34Å; L87-C89 PolarHBondContact O-N 2.88Å; L87-L90 PolarHBondContact O-N 3.05Å; L87-L90 VanDerWaalsContact O-N 3.12Å; L87-D91 WeakPolarHBondContact O-CB 3.28Å; L87-D91 PolarHBondContact O-N 3.3Å
88	S	91.1	Very high	90.5	Very high	81 Å²	81	87.3 Å²	87.3	57%	0.566	45%	0.45	S	S	*	.	H	α-helix	trans	-59.4	-43.1	175.9	-176.9	0	0	0	0	112.5	D84 K85 H92	D84-S88 WeakPolarHBondContact O-CB 3.19Å; D84-S88 PolarHBondContact O-N 3.3Å; K85-S88 PolarHBondContact O-N 2.87Å; S88-H92 WeakPolarHBondContact O-CB 3.35Å; S88-H92 PolarHBondContact O-N 3.47Å
89	C	86.5	Confident	90.6	Very high	83 Å²	83	81.6 Å²	81.6	56%	0.561	43%	0.429	S	S	*	.	H	α-helix	trans	-62.6	-42.1	173.8	-71	0	0	0	0	112.1	K85 T86 L87 H92 V93	K85-C89 WeakPolarHBondContact O-CB 3.46Å; K85-C89 PolarHBondContact O-N 3.1Å; K85-C89 PolarHBondContact O-SG 3.12Å; T86-C89 PolarHBondContact O-N 2.59Å; L87-C89 VanDerWaalsContact C-N 3.34Å; L87-C89 PolarHBondContact O-N 2.88Å; C89-H92 WeakPolarHBondContact O-CB 3.48Å; C89-H92 PolarHBondContact O-N 2.72Å; C89-V93 WeakPolarHBondContact O-CG2 3.46Å; C89-V93 PolarHBondContact O-N 3.17Å
90	L	88.8	Confident	90.4	Very high	90 Å²	90	77.9 Å²	77.9	47%	0.471	41%	0.413	S	S	.	.	H	α-helix	trans	-67.7	-43.4	-179.9	-173.6	131.7	0	0	0	111.6	T86 L87 H92 V93 I94	T86-L90 WeakPolarHBondContact O-CB 3.33Å; T86-L90 PolarHBondContact O-N 3.14Å; L87-L90 PolarHBondContact O-N 3.05Å; L87-L90 VanDerWaalsContact O-N 3.12Å; L90-H92 VanDerWaalsContact C-N 3.3Å; L90-H92 PolarHBondContact O-N 2.89Å; L90-V93 PolarHBondContact O-N 3.35Å; L90-I94 HydrophobicContact CD2-CD1 3.44Å; L90-I94 VanDerWaalsContact CD2-CD1 3.44Å; L90-I94 HydrophobicContact CD2-CG1 4.4Å; L90-I94 HydrophobicContact CG-CD1 4.11Å; L90-I94 WeakPolarHBondContact O-CB 3.39Å; L90-I94 WeakPolarHBondContact O-CG1 3.42Å; L90-I94 PolarHBondContact O-N 3.14Å
91	D	88.8	Confident	90.2	Very high	102 Å²	102	80.2 Å²	80.2	55%	0.545	42%	0.421	S	S	.	.	H	α-helix	trans	-61.4	-39.8	173.6	-76	-23.6	0	0	0	111.3	L87 I94 S95	L87-D91 WeakPolarHBondContact O-CB 3.28Å; L87-D91 PolarHBondContact O-N 3.3Å; D91-I94 PolarHBondContact O-N 3.27Å; D91-S95 WeakPolarHBondContact O-CB 3.38Å; D91-S95 PolarHBondContact O-N 3.15Å
92	H	86.9	Confident	90.1	Very high	100 Å²	100	79.3 Å²	79.3	46%	0.463	42%	0.419	S	S	.	.	H	α-helix	trans	-61	-45.3	174.8	-173.5	62.2	0	0	0	111.7	S88 C89 L90 S95 Y96	S88-H92 WeakPolarHBondContact O-CB 3.35Å; S88-H92 PolarHBondContact O-N 3.47Å; C89-H92 WeakPolarHBondContact O-CB 3.48Å; C89-H92 PolarHBondContact O-N 2.72Å; L90-H92 VanDerWaalsContact C-N 3.3Å; L90-H92 PolarHBondContact O-N 2.89Å; H92-S95 WeakPolarHBondContact O-CB 3.34Å; H92-S95 PolarHBondContact O-N 3.21Å; H92-S95 PolarHBondContact O-OG 2.82Å; H92-Y96 AromaticContact CD2-CE2 3.81Å; H92-Y96 AromaticContact CE1-CE2 3.8Å; H92-Y96 AromaticContact CE1-CZ 3.73Å; H92-Y96 PolarHBondContact CE1-OH 2.85Å; H92-Y96 AromaticContact NE2-CE2 3.44Å; H92-Y96 WeakPolarHBondContact NE2-CE2 3.48Å; H92-Y96 AromaticContact NE2-CZ 3.63Å; H92-Y96 PolarHBondContact NE2-OH 3.33Å; H92-Y96 VanDerWaalsContact O-CD2 3.28Å; H92-Y96 WeakPolarHBondContact O-CD2 3.27Å
93	V	87.5	Confident	90	Very high	48 Å²	48	75.6 Å²	75.6	29%	0.291	40%	0.4	S	S	.	.	H	α-helix	trans	-64.7	-48.4	176.6	172.4	0	0	0	0	111.5	C89 L90 S95 Y96 Y97 Y131	C89-V93 WeakPolarHBondContact O-CG2 3.46Å; C89-V93 PolarHBondContact O-N 3.17Å; L90-V93 PolarHBondContact O-N 3.35Å; V93-S95 PolarHBondContact O-N 2.65Å; V93-Y96 PolarHBondContact O-N 3.06Å; V93-Y96 VanDerWaalsContact O-N 3.11Å; V93-Y97 HydrophobicContact CG1-CD2 4.41Å; V93-Y97 HydrophobicContact CG1-CE2 3.94Å; V93-Y97 WeakPolarHBondContact O-CD2 3.31Å; V93-Y131 WeakPolarHBondContact CG1-OH 3.38Å; V93-Y131 WeakPolarHBondContact CG2-OH 3.45Å
94	I	88.7	Confident	89.9	Confident	70 Å²	70	74.7 Å²	74.7	36%	0.359	39%	0.393	S	S	.	.	H	α-helix	trans	-58.4	-35.4	178.7	-71.9	175	0	0	0	111.1	L90 D91 Y96 Y97 H98	L90-I94 HydrophobicContact CD2-CD1 3.44Å; L90-I94 VanDerWaalsContact CD2-CD1 3.44Å; L90-I94 HydrophobicContact CD2-CG1 4.4Å; L90-I94 HydrophobicContact CG-CD1 4.11Å; L90-I94 WeakPolarHBondContact O-CB 3.39Å; L90-I94 WeakPolarHBondContact O-CG1 3.42Å; L90-I94 PolarHBondContact O-N 3.14Å; D91-I94 PolarHBondContact O-N 3.27Å; I94-Y96 PolarHBondContact O-N 3.22Å; I94-Y97 PolarHBondContact O-N 3.14Å; I94-H98 WeakPolarHBondContact CG2-NE2 3.33Å; I94-H98 PolarHBondContact O-N 3.24Å
95	S	91.5	Very high	89.9	Confident	50 Å²	50	78.9 Å²	78.9	35%	0.35	40%	0.402	S	S	.	.	H	α-helix	trans	-55.8	-37.2	178.7	82.4	0	0	0	0	112.5	D91 H92 V93 H98 V99	D91-S95 WeakPolarHBondContact O-CB 3.38Å; D91-S95 PolarHBondContact O-N 3.15Å; H92-S95 WeakPolarHBondContact O-CB 3.34Å; H92-S95 PolarHBondContact O-N 3.21Å; H92-S95 PolarHBondContact O-OG 2.82Å; V93-S95 PolarHBondContact O-N 2.65Å; S95-H98 PolarHBondContact O-N 3.46Å; S95-V99 VanDerWaalsContact O-CG2 3.3Å; S95-V99 WeakPolarHBondContact O-CG2 3.46Å; S95-V99 PolarHBondContact O-N 3.11Å
96	Y	90.6	Very high	89.9	Confident	35 Å²	35	74.6 Å²	74.6	14%	0.137	38%	0.384	C	S	.	.	H	α-helix	trans	-66.4	-36.5	177.4	-65.8	-65	0	0	0	112.9	H92 V93 I94 H98 V99 K127 A128 Y131	H92-Y96 AromaticContact CD2-CE2 3.81Å; H92-Y96 AromaticContact CE1-CE2 3.8Å; H92-Y96 AromaticContact CE1-CZ 3.73Å; H92-Y96 PolarHBondContact CE1-OH 2.85Å; H92-Y96 AromaticContact NE2-CE2 3.44Å; H92-Y96 WeakPolarHBondContact NE2-CE2 3.48Å; H92-Y96 AromaticContact NE2-CZ 3.63Å; H92-Y96 PolarHBondContact NE2-OH 3.33Å; H92-Y96 VanDerWaalsContact O-CD2 3.28Å; H92-Y96 WeakPolarHBondContact O-CD2 3.27Å; V93-Y96 PolarHBondContact O-N 3.06Å; V93-Y96 VanDerWaalsContact O-N 3.11Å; I94-Y96 PolarHBondContact O-N 3.22Å; Y96-H98 VanDerWaalsContact C-N 3.27Å; Y96-H98 PolarHBondContact O-N 2.79Å; Y96-V99 WeakPolarHBondContact O-CB 3.38Å; Y96-V99 PolarHBondContact O-N 3.18Å; Y96-K127 HydrophobicContact CE1-CB 4.46Å; Y96-A128 HydrophobicContact CD1-CB 3.86Å; Y96-Y131 HydrophobicContact CD1-CD1 4.37Å; Y96-Y131 HydrophobicContact CD1-CG 4.25Å; Y96-Y131 AromaticContact CD2-CD1 3.54Å; Y96-Y131 HydrophobicContact CD2-CD1 3.54Å; Y96-Y131 AromaticContact CD2-CD2 3.79Å; Y96-Y131 HydrophobicContact CD2-CD2 3.79Å; Y96-Y131 AromaticContact CD2-CE1 3.8Å; Y96-Y131 HydrophobicContact CD2-CE1 3.8Å; Y96-Y131 HydrophobicContact CD2-CE2 4.04Å; Y96-Y131 AromaticContact CD2-CG 3.54Å; Y96-Y131 HydrophobicContact CD2-CG 3.54Å; Y96-Y131 HydrophobicContact CE1-CG 4.36Å; Y96-Y131 HydrophobicContact CE2-CD1 4.18Å; Y96-Y131 AromaticContact CE2-CD2 3.59Å; Y96-Y131 HydrophobicContact CE2-CD2 3.59Å; Y96-Y131 HydrophobicContact CE2-CE2 4.03Å; Y96-Y131 AromaticContact CE2-CG 3.69Å; Y96-Y131 HydrophobicContact CE2-CG 3.69Å; Y96-Y131 AromaticContact CG-CD1 3.65Å; Y96-Y131 HydrophobicContact CG-CD1 3.65Å; Y96-Y131 HydrophobicContact CG-CE1 4.21Å; Y96-Y131 AromaticContact CG-CG 3.85Å; Y96-Y131 HydrophobicContact CG-CG 3.85Å
97	Y	88.1	Confident	90	Very high	101 Å²	101	70.3 Å²	70.3	40%	0.396	36%	0.358	S	S	.	.	H	α-helix	trans	-68.8	-25.7	176.5	-73.4	-95.6	0	0	0	112.7	V93 I94 F132 E141	V93-Y97 HydrophobicContact CG1-CD2 4.41Å; V93-Y97 HydrophobicContact CG1-CE2 3.94Å; V93-Y97 WeakPolarHBondContact O-CD2 3.31Å; I94-Y97 PolarHBondContact O-N 3.14Å; Y97-F132 HydrophobicContact CD1-CE1 4.43Å; Y97-F132 HydrophobicContact CD1-CZ 4.2Å; Y97-F132 HydrophobicContact CD2-CE1 4.2Å; Y97-F132 HydrophobicContact CD2-CZ 4.02Å; Y97-F132 HydrophobicContact CE1-CE1 4Å; Y97-F132 HydrophobicContact CE1-CZ 4.23Å; Y97-F132 AromaticContact CE2-CE1 3.75Å; Y97-F132 HydrophobicContact CE2-CE1 3.75Å; Y97-F132 HydrophobicContact CE2-CZ 4.06Å; Y97-F132 HydrophobicContact CG-CZ 4.09Å; Y97-F132 AromaticContact CZ-CE1 3.63Å; Y97-E141 HydrophobicContact CD1-CG 3.79Å; Y97-E141 HydrophobicContact CE1-CG 3.81Å
98	H	90.6	Very high	90	Very high	92 Å²	92	75.7 Å²	75.7	43%	0.426	37%	0.372	S	S	.	.	H	α-helix	trans	-86.2	-15.4	175.9	-69	-42.7	0	0	0	114.2	I94 S95 Y96 A100 K101 D102	I94-H98 WeakPolarHBondContact CG2-NE2 3.33Å; I94-H98 PolarHBondContact O-N 3.24Å; S95-H98 PolarHBondContact O-N 3.46Å; Y96-H98 VanDerWaalsContact C-N 3.27Å; Y96-H98 PolarHBondContact O-N 2.79Å; H98-A100 VanDerWaalsContact C-N 3.32Å; H98-A100 PolarHBondContact O-N 3.13Å; H98-K101 PolarHBondContact O-N 2.88Å; H98-D102 PolarHBondContact O-N 3.49Å
99	V	92.3	Very high	90	Very high	3 Å²	3	76.1 Å²	76.1	2%	0.018	37%	0.365	C	S	.	.	H	α-helix	trans	-53	-46.5	-177.1	177.1	0	0	0	0	112.5	S95 Y96 K101 D102 T103 R124 I125 A128	S95-V99 VanDerWaalsContact O-CG2 3.3Å; S95-V99 WeakPolarHBondContact O-CG2 3.46Å; S95-V99 PolarHBondContact O-N 3.11Å; Y96-V99 WeakPolarHBondContact O-CB 3.38Å; Y96-V99 PolarHBondContact O-N 3.18Å; V99-K101 VanDerWaalsContact C-N 3.26Å; V99-K101 PolarHBondContact O-N 3.41Å; V99-D102 PolarHBondContact O-N 3.05Å; V99-T103 HydrophobicContact CG1-CG2 3.97Å; V99-T103 WeakPolarHBondContact O-CB 3.37Å; V99-T103 VanDerWaalsContact O-CG2 3.26Å; V99-T103 WeakPolarHBondContact O-CG2 3.27Å; V99-T103 PolarHBondContact O-N 3.38Å; V99-T103 PolarHBondContact O-OG1 2.89Å; V99-R124 HydrophobicContact CG1-CG 4.23Å; V99-R124 HydrophobicContact CG2-CG 4.28Å; V99-I125 HydrophobicContact CG1-CB 4.42Å; V99-I125 HydrophobicContact CG1-CG1 3.97Å; V99-A128 HydrophobicContact CB-CB 4.1Å; V99-A128 HydrophobicContact CG1-CB 4.09Å; V99-A128 HydrophobicContact CG2-CB 4.04Å
100	A	88.2	Confident	90.3	Very high	23 Å²	23	72.4 Å²	72.4	19%	0.19	34%	0.342	C	S	.	.	H	α-helix	trans	-61.3	-33.8	-178.8	0	0	0	0	0	113.3	H98 T144 V145	H98-A100 VanDerWaalsContact C-N 3.32Å; H98-A100 PolarHBondContact O-N 3.13Å; A100-T144 HydrophobicContact CB-CG2 4.04Å; A100-V145 HydrophobicContact CB-CG1 4.13Å
101	K	89.8	Confident	90.5	Very high	165 Å²	165	68.3 Å²	68.3	72%	0.717	32%	0.32	S	S	*	.	H	α-helix	trans	-79.6	-44.9	179.7	-176	-177.9	176.7	-174.6	0	111.5	H98 V99 T103 D104	H98-K101 PolarHBondContact O-N 2.88Å; V99-K101 VanDerWaalsContact C-N 3.26Å; V99-K101 PolarHBondContact O-N 3.41Å; K101-T103 VanDerWaalsContact C-N 3.3Å; K101-T103 PolarHBondContact O-N 2.94Å; K101-D104 PolarHBondContact O-N 3.45Å
102	D	90.6	Very high	90.6	Very high	83 Å²	83	66.9 Å²	66.9	44%	0.444	32%	0.318	S	S	.	.	H	α-helix	trans	-69.6	-31.1	-175.7	-65.8	-9.1	0	0	0	112.2	H98 V99 R124	H98-D102 PolarHBondContact O-N 3.49Å; V99-D102 PolarHBondContact O-N 3.05Å; D102-R124 VanDerWaalsContact CB-NH2 3.32Å; D102-R124 IonicContact OD2-CZ 3.9Å; D102-R124 IonicContact OD2-NH1 2.82Å; D102-R124 IonicContact OD2-NH2 3.99Å; D102-R124 PolarHBondContact OD2-NH2 3.4Å
103	T	92.2	Very high	90.7	Very high	3 Å²	3	66 Å²	66	2%	0.018	34%	0.337	C	S	.	.	H	α-helix	trans	-88.8	-14.6	-178.1	60.1	0	0	0	0	113.6	V99 K101 R105 I106 I107 C121 I125	V99-T103 HydrophobicContact CG1-CG2 3.97Å; V99-T103 WeakPolarHBondContact O-CB 3.37Å; V99-T103 VanDerWaalsContact O-CG2 3.26Å; V99-T103 WeakPolarHBondContact O-CG2 3.27Å; V99-T103 PolarHBondContact O-N 3.38Å; V99-T103 PolarHBondContact O-OG1 2.89Å; K101-T103 VanDerWaalsContact C-N 3.3Å; K101-T103 PolarHBondContact O-N 2.94Å; T103-R105 VanDerWaalsContact C-N 3.3Å; T103-R105 PolarHBondContact O-N 3.39Å; T103-I106 PolarHBondContact O-N 2.98Å; T103-I106 VanDerWaalsContact O-N 3.16Å; T103-I107 WeakPolarHBondContact O-CG1 3.49Å; T103-I107 PolarHBondContact O-N 3.38Å; T103-C121 WeakPolarHBondContact CB-SG 3.33Å; T103-C121 VanDerWaalsContact CG2-SG 3.52Å; T103-I125 HydrophobicContact CG2-CD1 4.28Å; T103-I125 HydrophobicContact CG2-CG1 3.87Å
104	D	89	Confident	90.9	Very high	52 Å²	52	66.9 Å²	66.9	28%	0.278	33%	0.334	S	S	.	.	H	α-helix	trans	-54.2	-43.7	-175.2	178.2	63.9	0	0	0	112.9	K101 R108 R148	K101-D104 PolarHBondContact O-N 3.45Å; D104-R108 VanDerWaalsContact O-CB 3.24Å; D104-R108 WeakPolarHBondContact O-CB 3.31Å; D104-R108 PolarHBondContact O-N 2.93Å; D104-R148 IonicContact OD1-CZ 2.75Å; D104-R148 IonicContact OD1-NH1 3.54Å; D104-R148 PolarHBondContact OD1-NH1 2.74Å; D104-R148 IonicContact OD1-NH2 2.79Å; D104-R148 PolarHBondContact OD1-NH2 2.9Å
105	R	91.9	Very high	91.2	Very high	172 Å²	172	64 Å²	64	65%	0.649	32%	0.32	S	S	*	.	H	α-helix	trans	-61.4	-49.6	-179.9	-179.1	-179	171.3	-162.9	-6.9	111.5	T103 R108 E109	T103-R105 VanDerWaalsContact C-N 3.3Å; T103-R105 PolarHBondContact O-N 3.39Å; R105-R108 PolarHBondContact O-N 3.42Å; R105-E109 HydrophobicContact CG-CG 4.46Å; R105-E109 VanDerWaalsContact CG-OE1 3.28Å; R105-E109 WeakPolarHBondContact CG-OE1 3.2Å; R105-E109 IonicContact CZ-OE1 3.96Å; R105-E109 IonicContact NE-OE1 2.7Å; R105-E109 PolarHBondContact NE-OE1 2.95Å; R105-E109 IonicContact NH2-OE1 2.64Å; R105-E109 VanDerWaalsContact O-CG 3.28Å; R105-E109 WeakPolarHBondContact O-CG 3.34Å; R105-E109 PolarHBondContact O-N 2.8Å
106	I	92.6	Very high	91.2	Very high	33 Å²	33	67.5 Å²	67.5	17%	0.169	34%	0.335	C	S	.	.	H	α-helix	trans	-65.7	-44.9	-177.1	-63.1	173.5	0	0	0	110	T103 R108 E109 G110 E117 Y118 C121	T103-I106 PolarHBondContact O-N 2.98Å; T103-I106 VanDerWaalsContact O-N 3.16Å; I106-R108 VanDerWaalsContact C-N 3.34Å; I106-R108 PolarHBondContact O-N 3.39Å; I106-E109 PolarHBondContact O-N 3.33Å; I106-G110 PolarHBondContact O-N 3.31Å; I106-G110 VanDerWaalsContact O-N 3.08Å; I106-E117 HydrophobicContact CD1-CG 4.39Å; I106-Y118 HydrophobicContact CG2-CD2 3.76Å; I106-Y118 HydrophobicContact CG2-CE2 4.45Å; I106-Y118 WeakPolarHBondContact O-CE2 3.47Å; I106-C121 HydrophobicContact CB-CB 4.37Å; I106-C121 HydrophobicContact CD1-CB 4.19Å; I106-C121 HydrophobicContact CG2-CB 3.8Å
107	I	93.3	Very high	91.4	Very high	2 Å²	2	70.7 Å²	70.7	1%	0.01	35%	0.351	C	S	.	.	H	α-helix	trans	-61.7	-41.9	177.6	-63.5	-60.9	0	0	0	111.2	T103 Y118 I122 I125 K151 L155	T103-I107 WeakPolarHBondContact O-CG1 3.49Å; T103-I107 PolarHBondContact O-N 3.38Å; I107-Y118 HydrophobicContact CD1-CE2 4.09Å; I107-I122 HydrophobicContact CD1-CD1 4.41Å; I107-I122 HydrophobicContact CD1-CG1 3.84Å; I107-I125 HydrophobicContact CD1-CD1 3.78Å; I107-I125 HydrophobicContact CG1-CD1 3.78Å; I107-K151 HydrophobicContact CG2-CG 4.31Å; I107-L155 HydrophobicContact CG2-CD1 4.42Å; I107-L155 WeakPolarHBondContact O-CD1 3.48Å
108	R	91.5	Very high	91.8	Very high	202 Å²	202	65.9 Å²	65.9	76%	0.762	33%	0.332	S	S	*	.	H	α-helix	trans	-67.2	-37.9	179.8	178	177.4	147	-139.1	-7.6	113.1	D104 R105 I106	D104-R108 VanDerWaalsContact O-CB 3.24Å; D104-R108 WeakPolarHBondContact O-CB 3.31Å; D104-R108 PolarHBondContact O-N 2.93Å; R105-R108 PolarHBondContact O-N 3.42Å; I106-R108 VanDerWaalsContact C-N 3.34Å; I106-R108 PolarHBondContact O-N 3.39Å
109	E	91.4	Very high	91.9	Very high	89 Å²	89	63 Å²	63	42%	0.416	32%	0.32	S	S	.	.	H	α-helix	trans	-83	-15.1	-177.6	-62.1	173.4	-174.4	0	0	113	R105 I106 R114	R105-E109 HydrophobicContact CG-CG 4.46Å; R105-E109 VanDerWaalsContact CG-OE1 3.28Å; R105-E109 WeakPolarHBondContact CG-OE1 3.2Å; R105-E109 IonicContact CZ-OE1 3.96Å; R105-E109 IonicContact NE-OE1 2.7Å; R105-E109 PolarHBondContact NE-OE1 2.95Å; R105-E109 IonicContact NH2-OE1 2.64Å; R105-E109 VanDerWaalsContact O-CG 3.28Å; R105-E109 WeakPolarHBondContact O-CG 3.34Å; R105-E109 PolarHBondContact O-N 2.8Å; I106-E109 PolarHBondContact O-N 3.33Å; E109-R114 PolarHBondContact O-NH2 3.01Å; E109-R114 IonicContact OE2-CZ 3.24Å; E109-R114 VanDerWaalsContact OE2-CZ 3.22Å; E109-R114 IonicContact OE2-NH1 2.72Å; E109-R114 PolarHBondContact OE2-NH1 3.28Å; E109-R114 IonicContact OE2-NH2 2.92Å; E109-R114 PolarHBondContact OE2-NH2 3.12Å
110	G	92.4	Very high	92	Very high	6 Å²	6	65.9 Å²	65.9	6%	0.062	34%	0.344	C	S	.	.			trans	82.6	171.1	170.8	0	0	0	0	0	116.1	I106 R114	I106-G110 PolarHBondContact O-N 3.31Å; I106-G110 VanDerWaalsContact O-N 3.08Å; G110-R114 PolarHBondContact O-NE 3.32Å; G110-R114 PolarHBondContact O-NH2 3.11Å
111	P	93.3	Very high	92.3	Very high	4 Å²	4	65.2 Å²	65.2	3%	0.026	34%	0.337	C	S	.	.	S	Bend	trans	-78.8	-15	-173.3	30.6	-37.1	0	0	0	115.3	G113 R114 L115 Y118 L156 E159	P111-G113 PolarHBondContact O-N 2.99Å; P111-R114 CarbonylContact O-C 3.5Å; P111-R114 PolarHBondContact O-N 2.8Å; P111-L115 HydrophobicContact CB-CD1 4.34Å; P111-L115 PolarHBondContact O-N 3.12Å; P111-Y118 HydrophobicContact CB-CD1 3.66Å; P111-Y118 HydrophobicContact CB-CD2 4.09Å; P111-Y118 HydrophobicContact CB-CE1 4.02Å; P111-Y118 HydrophobicContact CB-CE2 4.46Å; P111-Y118 HydrophobicContact CB-CG 3.67Å; P111-Y118 HydrophobicContact CG-CD1 4.44Å; P111-Y118 HydrophobicContact CG-CE1 4.32Å; P111-L156 HydrophobicContact CB-CD2 4.02Å; P111-L156 HydrophobicContact CG-CD2 4.23Å; P111-E159 HydrophobicContact CB-CG 4.35Å; P111-E159 HydrophobicContact CG-CB 3.51Å; P111-E159 HydrophobicContact CG-CG 3.74Å
112	S	91.2	Very high	92.5	Very high	72 Å²	72	57.3 Å²	57.3	50%	0.503	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	120.9	-169	-42.2	0	0	0	0	112.6	R114 E159	S112-R114 VanDerWaalsContact C-N 3.28Å; S112-R114 PolarHBondContact O-N 3.35Å; S112-E159 WeakPolarHBondContact CA-OE1 3.35Å; S112-E159 VanDerWaalsContact OG-CD 3.3Å; S112-E159 PolarHBondContact OG-OE1 2.76Å; S112-E159 PolarHBondContact OG-OE2 3.45Å
113	G	87.7	Confident	92.7	Very high	82 Å²	82	55.4 Å²	55.4	85%	0.845	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.9	6.9	178.4	0	0	0	0	0	115.9	P111	P111-G113 PolarHBondContact O-N 2.99Å
114	R	92.4	Very high	92.8	Very high	65 Å²	65	60 Å²	60	25%	0.245	32%	0.316	C	S	.	.			trans	-153.1	48.2	179.4	54.6	155.7	171.2	-138.7	-23	112	E109 G110 P111 S112 D116 E117 Y118	E109-R114 PolarHBondContact O-NH2 3.01Å; E109-R114 IonicContact OE2-CZ 3.24Å; E109-R114 VanDerWaalsContact OE2-CZ 3.22Å; E109-R114 IonicContact OE2-NH1 2.72Å; E109-R114 PolarHBondContact OE2-NH1 3.28Å; E109-R114 IonicContact OE2-NH2 2.92Å; E109-R114 PolarHBondContact OE2-NH2 3.12Å; G110-R114 PolarHBondContact O-NE 3.32Å; G110-R114 PolarHBondContact O-NH2 3.11Å; P111-R114 CarbonylContact O-C 3.5Å; P111-R114 PolarHBondContact O-N 2.8Å; S112-R114 VanDerWaalsContact C-N 3.28Å; S112-R114 PolarHBondContact O-N 3.35Å; R114-D116 VanDerWaalsContact C-N 3.34Å; R114-D116 PolarHBondContact O-N 3.49Å; R114-E117 HydrophobicContact CB-CB 4.42Å; R114-E117 WeakPolarHBondContact CD-OE2 3.3Å; R114-E117 PolarHBondContact O-N 3.07Å; R114-Y118 WeakPolarHBondContact O-CB 3.27Å; R114-Y118 PolarHBondContact O-N 2.96Å; R114-Y118 VanDerWaalsContact O-N 3.1Å
115	L	93.8	Very high	93	Very high	9 Å²	9	57.6 Å²	57.6	5%	0.047	30%	0.303	C	S	.	.	H	α-helix	trans	-57.4	-45.3	-173.4	-179.6	61.7	0	0	0	112.2	P111 E117 Y118 L119 L156 D204 C207 I208	P111-L115 HydrophobicContact CB-CD1 4.34Å; P111-L115 PolarHBondContact O-N 3.12Å; L115-E117 PolarHBondContact O-N 3.45Å; L115-Y118 CarbonylContact O-C 3.43Å; L115-Y118 WeakPolarHBondContact O-CB 3.36Å; L115-Y118 PolarHBondContact O-N 3.38Å; L115-Y118 VanDerWaalsContact O-N 3.12Å; L115-L119 HydrophobicContact CD1-CD1 4.03Å; L115-L119 HydrophobicContact CD1-CD2 4.26Å; L115-L119 HydrophobicContact CD1-CG 3.87Å; L115-L119 HydrophobicContact CD2-CD1 4.41Å; L115-L119 HydrophobicContact CG-CD1 3.86Å; L115-L119 HydrophobicContact CG-CG 4.13Å; L115-L119 WeakPolarHBondContact O-CG 3.33Å; L115-L119 PolarHBondContact O-N 2.85Å; L115-L156 HydrophobicContact CD1-CD2 3.87Å; L115-D204 HydrophobicContact CD2-CB 3.89Å; L115-D204 WeakPolarHBondContact CD2-O 3.36Å; L115-C207 HydrophobicContact CD2-CB 3.81Å; L115-I208 HydrophobicContact CD1-CD1 4.05Å; L115-I208 HydrophobicContact CD1-CG1 3.61Å; L115-I208 HydrophobicContact CD2-CD1 4.19Å; L115-I208 HydrophobicContact CD2-CG1 3.8Å; L115-I208 HydrophobicContact CG-CG1 4.37Å
116	D	93.1	Very high	93.1	Very high	125 Å²	125	50.9 Å²	50.9	67%	0.668	28%	0.279	S	S	*	.	H	α-helix	trans	-59.8	-46.1	-178.9	-65.4	-31.8	0	0	0	113.1	R114 Y118 L119 A120	R114-D116 VanDerWaalsContact C-N 3.34Å; R114-D116 PolarHBondContact O-N 3.49Å; D116-Y118 VanDerWaalsContact C-N 3.27Å; D116-Y118 PolarHBondContact O-N 3Å; D116-L119 PolarHBondContact O-N 3.37Å; D116-A120 WeakPolarHBondContact O-CB 3.34Å; D116-A120 PolarHBondContact O-N 3.11Å
117	E	94.1	Very high	93.1	Very high	102 Å²	102	55.6 Å²	55.6	48%	0.477	30%	0.298	S	S	.	.	H	α-helix	trans	-61.7	-40.4	176.8	-174.2	-174.6	-169.3	0	0	110.5	I106 R114 L115 C121	I106-E117 HydrophobicContact CD1-CG 4.39Å; R114-E117 HydrophobicContact CB-CB 4.42Å; R114-E117 WeakPolarHBondContact CD-OE2 3.3Å; R114-E117 PolarHBondContact O-N 3.07Å; L115-E117 PolarHBondContact O-N 3.45Å; E117-C121 WeakPolarHBondContact O-CB 3.43Å; E117-C121 PolarHBondContact O-N 3.08Å
118	Y	95.7	Very high	93.1	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-70.1	-41.5	-179.7	-168.1	-88.9	0	0	0	112.6	I106 I107 P111 R114 L115 D116 C121 I122 G152 L155 L156	I106-Y118 HydrophobicContact CG2-CD2 3.76Å; I106-Y118 HydrophobicContact CG2-CE2 4.45Å; I106-Y118 WeakPolarHBondContact O-CE2 3.47Å; I107-Y118 HydrophobicContact CD1-CE2 4.09Å; P111-Y118 HydrophobicContact CB-CD1 3.66Å; P111-Y118 HydrophobicContact CB-CD2 4.09Å; P111-Y118 HydrophobicContact CB-CE1 4.02Å; P111-Y118 HydrophobicContact CB-CE2 4.46Å; P111-Y118 HydrophobicContact CB-CG 3.67Å; P111-Y118 HydrophobicContact CG-CD1 4.44Å; P111-Y118 HydrophobicContact CG-CE1 4.32Å; R114-Y118 WeakPolarHBondContact O-CB 3.27Å; R114-Y118 PolarHBondContact O-N 2.96Å; R114-Y118 VanDerWaalsContact O-N 3.1Å; L115-Y118 CarbonylContact O-C 3.43Å; L115-Y118 WeakPolarHBondContact O-CB 3.36Å; L115-Y118 PolarHBondContact O-N 3.38Å; L115-Y118 VanDerWaalsContact O-N 3.12Å; D116-Y118 VanDerWaalsContact C-N 3.27Å; D116-Y118 PolarHBondContact O-N 3Å; Y118-C121 WeakPolarHBondContact O-CB 3.47Å; Y118-C121 PolarHBondContact O-N 3.4Å; Y118-I122 HydrophobicContact CD1-CD1 3.75Å; Y118-I122 HydrophobicContact CD1-CG1 4.29Å; Y118-I122 HydrophobicContact CE1-CD1 3.2Å; Y118-I122 HydrophobicContact CE1-CG1 4.01Å; Y118-I122 PolarHBondContact O-N 3.19Å; Y118-G152 VanDerWaalsContact OH-CA 3.25Å; Y118-G152 WeakPolarHBondContact OH-CA 3.42Å; Y118-G152 PolarHBondContact OH-O 2.67Å; Y118-L155 WeakPolarHBondContact OH-CB 3.44Å; Y118-L155 WeakPolarHBondContact OH-CD1 3.42Å; Y118-L156 HydrophobicContact CD1-CD2 3.82Å; Y118-L156 HydrophobicContact CD1-CG 4.26Å; Y118-L156 HydrophobicContact CE1-CD1 4.38Å; Y118-L156 HydrophobicContact CE1-CD2 3.82Å; Y118-L156 HydrophobicContact CE1-CG 3.81Å
119	L	94.5	Very high	93.1	Very high	32 Å²	32	46.8 Å²	46.8	17%	0.168	27%	0.267	C	S	.	.	H	α-helix	trans	-65.3	-41	175	-69.8	178.8	0	0	0	111.3	L115 D116 C121 I122 A123 L156 C207 W211	L115-L119 HydrophobicContact CD1-CD1 4.03Å; L115-L119 HydrophobicContact CD1-CD2 4.26Å; L115-L119 HydrophobicContact CD1-CG 3.87Å; L115-L119 HydrophobicContact CD2-CD1 4.41Å; L115-L119 HydrophobicContact CG-CD1 3.86Å; L115-L119 HydrophobicContact CG-CG 4.13Å; L115-L119 WeakPolarHBondContact O-CG 3.33Å; L115-L119 PolarHBondContact O-N 2.85Å; D116-L119 PolarHBondContact O-N 3.37Å; L119-C121 VanDerWaalsContact C-N 3.31Å; L119-C121 PolarHBondContact O-N 3.16Å; L119-I122 PolarHBondContact O-N 3.09Å; L119-A123 WeakPolarHBondContact O-CB 3.46Å; L119-A123 PolarHBondContact O-N 3.48Å; L119-L156 HydrophobicContact CD2-CD1 3.96Å; L119-L156 HydrophobicContact CD2-CD2 4.19Å; L119-C207 HydrophobicContact CD1-CB 4.49Å; L119-W211 HydrophobicContact CD2-CB 4.37Å; L119-W211 HydrophobicContact CD2-CD2 4.43Å; L119-W211 HydrophobicContact CD2-CG 3.93Å
120	A	94	Very high	93.2	Very high	63 Å²	63	47.1 Å²	47.1	52%	0.521	27%	0.268	S	S	.	.	H	α-helix	trans	-62	-39.7	173.8	0	0	0	0	0	112	D116 A123 R124	D116-A120 WeakPolarHBondContact O-CB 3.34Å; D116-A120 PolarHBondContact O-N 3.11Å; A120-A123 PolarHBondContact O-N 2.94Å; A120-R124 PolarHBondContact O-N 3.42Å
121	C	94.3	Very high	93.2	Very high	8 Å²	8	48.7 Å²	48.7	5%	0.054	27%	0.273	C	S	.	.	H	α-helix	trans	-61.3	-48	174.2	-178.7	0	0	0	0	111.6	T103 I106 E117 Y118 L119 R124 I125	T103-C121 WeakPolarHBondContact CB-SG 3.33Å; T103-C121 VanDerWaalsContact CG2-SG 3.52Å; I106-C121 HydrophobicContact CB-CB 4.37Å; I106-C121 HydrophobicContact CD1-CB 4.19Å; I106-C121 HydrophobicContact CG2-CB 3.8Å; E117-C121 WeakPolarHBondContact O-CB 3.43Å; E117-C121 PolarHBondContact O-N 3.08Å; Y118-C121 WeakPolarHBondContact O-CB 3.47Å; Y118-C121 PolarHBondContact O-N 3.4Å; L119-C121 VanDerWaalsContact C-N 3.31Å; L119-C121 PolarHBondContact O-N 3.16Å; C121-R124 WeakPolarHBondContact O-CB 3.32Å; C121-R124 PolarHBondContact O-N 3.42Å; C121-I125 WeakPolarHBondContact O-CG1 3.29Å; C121-I125 PolarHBondContact O-N 2.96Å; C121-I125 VanDerWaalsContact O-N 3.09Å
122	I	94.1	Very high	93.2	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-64.6	-41.5	177.6	-74.7	-176	0	0	0	112	I107 Y118 L119 R124 I125 Q126 F149 L156 W211	I107-I122 HydrophobicContact CD1-CD1 4.41Å; I107-I122 HydrophobicContact CD1-CG1 3.84Å; Y118-I122 HydrophobicContact CD1-CD1 3.75Å; Y118-I122 HydrophobicContact CD1-CG1 4.29Å; Y118-I122 HydrophobicContact CE1-CD1 3.2Å; Y118-I122 HydrophobicContact CE1-CG1 4.01Å; Y118-I122 PolarHBondContact O-N 3.19Å; L119-I122 PolarHBondContact O-N 3.09Å; I122-R124 PolarHBondContact O-N 3.37Å; I122-I125 WeakPolarHBondContact O-CA 3.27Å; I122-I125 WeakPolarHBondContact O-CB 3.49Å; I122-I125 PolarHBondContact O-N 3.25Å; I122-Q126 PolarHBondContact O-N 2.95Å; I122-F149 HydrophobicContact CG2-CD2 3.86Å; I122-F149 HydrophobicContact CG2-CE2 3.52Å; I122-L156 HydrophobicContact CD1-CD1 3.73Å; I122-L156 HydrophobicContact CD1-CG 4.25Å; I122-W211 HydrophobicContact CG2-CH2 4.15Å; I122-W211 HydrophobicContact CG2-CZ2 3.38Å
123	A	93.4	Very high	93.3	Very high	43 Å²	43	49.9 Å²	49.9	36%	0.355	27%	0.27	S	S	.	.	H	α-helix	trans	-60.3	-36	175.8	0	0	0	0	0	111.9	L119 A120 Q126 K127	L119-A123 WeakPolarHBondContact O-CB 3.46Å; L119-A123 PolarHBondContact O-N 3.48Å; A120-A123 PolarHBondContact O-N 2.94Å; A123-Q126 PolarHBondContact O-N 2.92Å; A123-K127 WeakPolarHBondContact O-CG 3.46Å; A123-K127 PolarHBondContact O-N 3.37Å
124	R	94.1	Very high	93.5	Very high	100 Å²	100	52.2 Å²	52.2	38%	0.377	26%	0.263	S	S	.	.	H	α-helix	trans	-66.5	-39.7	173.4	-175.6	-175.6	147.5	173.4	0	112	V99 D102 A120 C121 I122 Q126 A128	V99-R124 HydrophobicContact CG1-CG 4.23Å; V99-R124 HydrophobicContact CG2-CG 4.28Å; D102-R124 VanDerWaalsContact CB-NH2 3.32Å; D102-R124 IonicContact OD2-CZ 3.9Å; D102-R124 IonicContact OD2-NH1 2.82Å; D102-R124 IonicContact OD2-NH2 3.99Å; D102-R124 PolarHBondContact OD2-NH2 3.4Å; A120-R124 PolarHBondContact O-N 3.42Å; C121-R124 WeakPolarHBondContact O-CB 3.32Å; C121-R124 PolarHBondContact O-N 3.42Å; I122-R124 PolarHBondContact O-N 3.37Å; R124-Q126 VanDerWaalsContact C-N 3.35Å; R124-A128 PolarHBondContact O-N 3.47Å
125	I	93.8	Very high	93.4	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-63.3	-43.3	173	-60.9	170.1	0	0	0	110.3	V99 T103 I107 C121 I122 A128 V129 V145 R148 F149	V99-I125 HydrophobicContact CG1-CB 4.42Å; V99-I125 HydrophobicContact CG1-CG1 3.97Å; T103-I125 HydrophobicContact CG2-CD1 4.28Å; T103-I125 HydrophobicContact CG2-CG1 3.87Å; I107-I125 HydrophobicContact CD1-CD1 3.78Å; I107-I125 HydrophobicContact CG1-CD1 3.78Å; C121-I125 WeakPolarHBondContact O-CG1 3.29Å; C121-I125 PolarHBondContact O-N 2.96Å; C121-I125 VanDerWaalsContact O-N 3.09Å; I122-I125 WeakPolarHBondContact O-CA 3.27Å; I122-I125 WeakPolarHBondContact O-CB 3.49Å; I122-I125 PolarHBondContact O-N 3.25Å; I125-A128 WeakPolarHBondContact O-CA 3.42Å; I125-A128 WeakPolarHBondContact O-CB 3.45Å; I125-A128 PolarHBondContact O-N 3.2Å; I125-A128 VanDerWaalsContact O-N 3.09Å; I125-V129 HydrophobicContact CG2-CG2 4.49Å; I125-V129 WeakPolarHBondContact O-CG2 3.17Å; I125-V129 PolarHBondContact O-N 2.94Å; I125-V145 HydrophobicContact CG2-CB 4.26Å; I125-V145 WeakPolarHBondContact CG2-O 3.34Å; I125-R148 HydrophobicContact CD1-CB 4.37Å; I125-R148 HydrophobicContact CG2-CB 4.48Å; I125-F149 HydrophobicContact CG2-CB 3.88Å; I125-F149 HydrophobicContact CG2-CD2 4.39Å
126	Q	93.9	Very high	93.1	Very high	31 Å²	31	56.3 Å²	56.3	15%	0.145	29%	0.29	C	S	.	.	H	α-helix	trans	-61.5	-45.6	179.7	-178.7	154.8	-2.7	0	0	112.9	I122 A123 R124 A128 V129 E130 F149	I122-Q126 PolarHBondContact O-N 2.95Å; A123-Q126 PolarHBondContact O-N 2.92Å; R124-Q126 VanDerWaalsContact C-N 3.35Å; Q126-A128 PolarHBondContact O-N 2.93Å; Q126-V129 WeakPolarHBondContact O-CA 3.44Å; Q126-V129 WeakPolarHBondContact O-CB 3.24Å; Q126-V129 PolarHBondContact O-N 3.26Å; Q126-E130 WeakPolarHBondContact CG-OE1 3.45Å; Q126-E130 PolarHBondContact NE2-OE1 3.42Å; Q126-E130 PolarHBondContact O-N 2.94Å; Q126-F149 HydrophobicContact CB-CD2 4.17Å; Q126-F149 HydrophobicContact CB-CE2 3.77Å; Q126-F149 HydrophobicContact CG-CE2 4.26Å
127	K	92.7	Very high	92.9	Very high	132 Å²	132	54.1 Å²	54.1	57%	0.574	28%	0.282	S	S	*	.	H	α-helix	trans	-57.2	-36.1	173	-72.8	178.4	-179.7	-178.8	0	112.4	Y96 A123 Y131	Y96-K127 HydrophobicContact CE1-CB 4.46Å; A123-K127 WeakPolarHBondContact O-CG 3.46Å; A123-K127 PolarHBondContact O-N 3.37Å; K127-Y131 WeakPolarHBondContact O-CB 3.32Å; K127-Y131 PolarHBondContact O-N 2.9Å
128	A	93.1	Very high	92.6	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-69.5	-38.1	174.6	0	0	0	0	0	112.3	Y96 V99 R124 I125 Q126 Y131 F132 V145	Y96-A128 HydrophobicContact CD1-CB 3.86Å; V99-A128 HydrophobicContact CB-CB 4.1Å; V99-A128 HydrophobicContact CG1-CB 4.09Å; V99-A128 HydrophobicContact CG2-CB 4.04Å; R124-A128 PolarHBondContact O-N 3.47Å; I125-A128 WeakPolarHBondContact O-CA 3.42Å; I125-A128 WeakPolarHBondContact O-CB 3.45Å; I125-A128 PolarHBondContact O-N 3.2Å; I125-A128 VanDerWaalsContact O-N 3.09Å; Q126-A128 PolarHBondContact O-N 2.93Å; A128-Y131 PolarHBondContact O-N 3.15Å; A128-F132 HydrophobicContact CB-CE2 4.46Å; A128-F132 WeakPolarHBondContact O-CB 3.43Å; A128-F132 WeakPolarHBondContact O-CD2 3.31Å; A128-F132 PolarHBondContact O-N 3.39Å; A128-V145 HydrophobicContact CB-CG1 4.38Å
129	V	92.9	Very high	92.2	Very high	19 Å²	19	57.5 Å²	57.5	12%	0.115	31%	0.305	C	S	.	.	H	α-helix	trans	-60.6	-48.6	173.8	173.6	0	0	0	0	110.5	I125 Q126 F132 Q133 L142 V145 K146	I125-V129 HydrophobicContact CG2-CG2 4.49Å; I125-V129 WeakPolarHBondContact O-CG2 3.17Å; I125-V129 PolarHBondContact O-N 2.94Å; Q126-V129 WeakPolarHBondContact O-CA 3.44Å; Q126-V129 WeakPolarHBondContact O-CB 3.24Å; Q126-V129 PolarHBondContact O-N 3.26Å; V129-F132 PolarHBondContact O-N 3.36Å; V129-Q133 WeakPolarHBondContact O-CB 3.38Å; V129-Q133 PolarHBondContact O-N 3.41Å; V129-L142 HydrophobicContact CG1-CD1 4.2Å; V129-L142 WeakPolarHBondContact O-CD1 3.49Å; V129-V145 HydrophobicContact CB-CG2 4.49Å; V129-V145 HydrophobicContact CG2-CB 4.04Å; V129-V145 HydrophobicContact CG2-CG2 3.68Å; V129-K146 HydrophobicContact CG1-CG 3.89Å; V129-K146 HydrophobicContact CG2-CG 4.14Å
130	E	93.1	Very high	92	Very high	96 Å²	96	59.9 Å²	59.9	45%	0.449	32%	0.322	S	S	.	.	H	α-helix	trans	-59.3	-49.6	177.1	-70.3	166.1	-169.6	0	0	110.9	Q126 F132 Q133 D134	Q126-E130 WeakPolarHBondContact CG-OE1 3.45Å; Q126-E130 PolarHBondContact NE2-OE1 3.42Å; Q126-E130 PolarHBondContact O-N 2.94Å; E130-F132 PolarHBondContact O-N 2.91Å; E130-Q133 PolarHBondContact O-N 2.81Å; E130-D134 PolarHBondContact O-N 2.83Å
131	Y	92.8	Very high	91.8	Very high	39 Å²	39	60.2 Å²	60.2	15%	0.153	31%	0.313	C	S	.	.	H	α-helix	trans	-55.3	-51.6	177.1	173.5	-97.5	0	0	0	112.7	V93 Y96 K127 A128 Q133 D134 N135	V93-Y131 WeakPolarHBondContact CG1-OH 3.38Å; V93-Y131 WeakPolarHBondContact CG2-OH 3.45Å; Y96-Y131 HydrophobicContact CD1-CD1 4.37Å; Y96-Y131 HydrophobicContact CD1-CG 4.25Å; Y96-Y131 AromaticContact CD2-CD1 3.54Å; Y96-Y131 HydrophobicContact CD2-CD1 3.54Å; Y96-Y131 AromaticContact CD2-CD2 3.79Å; Y96-Y131 HydrophobicContact CD2-CD2 3.79Å; Y96-Y131 AromaticContact CD2-CE1 3.8Å; Y96-Y131 HydrophobicContact CD2-CE1 3.8Å; Y96-Y131 HydrophobicContact CD2-CE2 4.04Å; Y96-Y131 AromaticContact CD2-CG 3.54Å; Y96-Y131 HydrophobicContact CD2-CG 3.54Å; Y96-Y131 HydrophobicContact CE1-CG 4.36Å; Y96-Y131 HydrophobicContact CE2-CD1 4.18Å; Y96-Y131 AromaticContact CE2-CD2 3.59Å; Y96-Y131 HydrophobicContact CE2-CD2 3.59Å; Y96-Y131 HydrophobicContact CE2-CE2 4.03Å; Y96-Y131 AromaticContact CE2-CG 3.69Å; Y96-Y131 HydrophobicContact CE2-CG 3.69Å; Y96-Y131 AromaticContact CG-CD1 3.65Å; Y96-Y131 HydrophobicContact CG-CD1 3.65Å; Y96-Y131 HydrophobicContact CG-CE1 4.21Å; Y96-Y131 AromaticContact CG-CG 3.85Å; Y96-Y131 HydrophobicContact CG-CG 3.85Å; K127-Y131 WeakPolarHBondContact O-CB 3.32Å; K127-Y131 PolarHBondContact O-N 2.9Å; A128-Y131 PolarHBondContact O-N 3.15Å; Y131-Q133 VanDerWaalsContact C-N 3.33Å; Y131-Q133 PolarHBondContact O-N 3.14Å; Y131-D134 PolarHBondContact O-N 2.67Å; Y131-N135 WeakPolarHBondContact CD2-ND2 3.16Å; Y131-N135 HydrophobicContact CE2-CB 4.49Å; Y131-N135 WeakPolarHBondContact CE2-ND2 3.5Å; Y131-N135 WeakPolarHBondContact O-CB 3.38Å; Y131-N135 PolarHBondContact O-N 3.37Å; Y131-N135 PolarHBondContact O-ND2 3.49Å
132	F	93.3	Very high	91.7	Very high	0 Å²	0	60 Å²	60	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-69.9	-31.3	-179.2	-74.1	-56.5	0	0	0	112.2	Y97 A128 V129 E130 N136 E141 L142 V145	Y97-F132 HydrophobicContact CD1-CE1 4.43Å; Y97-F132 HydrophobicContact CD1-CZ 4.2Å; Y97-F132 HydrophobicContact CD2-CE1 4.2Å; Y97-F132 HydrophobicContact CD2-CZ 4.02Å; Y97-F132 HydrophobicContact CE1-CE1 4Å; Y97-F132 HydrophobicContact CE1-CZ 4.23Å; Y97-F132 AromaticContact CE2-CE1 3.75Å; Y97-F132 HydrophobicContact CE2-CE1 3.75Å; Y97-F132 HydrophobicContact CE2-CZ 4.06Å; Y97-F132 HydrophobicContact CG-CZ 4.09Å; Y97-F132 AromaticContact CZ-CE1 3.63Å; A128-F132 HydrophobicContact CB-CE2 4.46Å; A128-F132 WeakPolarHBondContact O-CB 3.43Å; A128-F132 WeakPolarHBondContact O-CD2 3.31Å; A128-F132 PolarHBondContact O-N 3.39Å; V129-F132 PolarHBondContact O-N 3.36Å; E130-F132 PolarHBondContact O-N 2.91Å; F132-N136 CarbonylContact O-C 3.48Å; F132-N136 VanDerWaalsContact O-CA 3.31Å; F132-N136 WeakPolarHBondContact O-CA 3.26Å; F132-N136 PolarHBondContact O-N 3.3Å; F132-E141 HydrophobicContact CE1-CB 4.22Å; F132-E141 HydrophobicContact CE2-CB 4.16Å; F132-E141 HydrophobicContact CZ-CB 4Å; F132-L142 HydrophobicContact CB-CB 3.98Å; F132-L142 HydrophobicContact CB-CD1 3.67Å; F132-L142 HydrophobicContact CB-CG 4.34Å; F132-V145 HydrophobicContact CD2-CG2 4.04Å
133	Q	93.1	Very high	91.5	Very high	101 Å²	101	65.2 Å²	65.2	47%	0.472	34%	0.339	S	S	.	.	H	α-helix	trans	-67.1	-39.4	176.4	-177	162	-40.6	0	0	112.1	V129 E130 Y131 L142	V129-Q133 WeakPolarHBondContact O-CB 3.38Å; V129-Q133 PolarHBondContact O-N 3.41Å; E130-Q133 PolarHBondContact O-N 2.81Å; Y131-Q133 VanDerWaalsContact C-N 3.33Å; Y131-Q133 PolarHBondContact O-N 3.14Å; Q133-L142 HydrophobicContact CB-CD1 4.36Å
134	D	92.4	Very high	91.5	Very high	132 Å²	132	66.5 Å²	66.5	71%	0.706	34%	0.343	S	S	*	.	H	α-helix	trans	-78.6	-33.4	-179.3	-68.7	-15.1	0	0	0	112.8	E130 Y131	E130-D134 PolarHBondContact O-N 2.83Å; Y131-D134 PolarHBondContact O-N 2.67Å
135	N	89.6	Confident	91.4	Very high	91 Å²	91	61.9 Å²	61.9	49%	0.487	33%	0.326	S	S	.	.	H	α-helix	trans	-103.1	-35.5	-172.7	-64.9	-88.7	0	0	0	113.9	Y131	Y131-N135 WeakPolarHBondContact CD2-ND2 3.16Å; Y131-N135 HydrophobicContact CE2-CB 4.49Å; Y131-N135 WeakPolarHBondContact CE2-ND2 3.5Å; Y131-N135 WeakPolarHBondContact O-CB 3.38Å; Y131-N135 PolarHBondContact O-N 3.37Å; Y131-N135 PolarHBondContact O-ND2 3.49Å
136	N	87.9	Confident	91.3	Very high	69 Å²	69	65.6 Å²	65.6	37%	0.369	34%	0.342	S	S	.	.			trans	-146.8	70.4	-172.1	-68.7	-55.9	0	0	0	112.5	F132 D138 S139	F132-N136 CarbonylContact O-C 3.48Å; F132-N136 VanDerWaalsContact O-CA 3.31Å; F132-N136 WeakPolarHBondContact O-CA 3.26Å; F132-N136 PolarHBondContact O-N 3.3Å; N136-D138 VanDerWaalsContact C-N 3.32Å; N136-D138 PolarHBondContact O-N 3.28Å; N136-S139 WeakPolarHBondContact O-CB 3.24Å; N136-S139 PolarHBondContact O-N 3.48Å; N136-S139 PolarHBondContact O-OG 2.87Å
137	P	87.4	Confident	91.2	Very high	78 Å²	78	67 Å²	67	51%	0.506	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-25.5	-168.2	23.9	-34.4	0	0	0	115.2	L142	P137-L142 WeakPolarHBondContact O-CD2 3.17Å
138	D	87.9	Confident	91.2	Very high	160 Å²	160	64.6 Å²	64.6	86%	0.856	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	14.8	-178.3	-63.7	-46.4	0	0	0	113.5	N136	N136-D138 VanDerWaalsContact C-N 3.32Å; N136-D138 PolarHBondContact O-N 3.28Å
139	S	88.8	Confident	91.2	Very high	13 Å²	13	65.9 Å²	65.9	9%	0.091	35%	0.352	C	S	.	.			trans	-77.2	142.6	-175.6	61.9	0	0	0	0	113.5	N136 E141 L142	N136-S139 WeakPolarHBondContact O-CB 3.24Å; N136-S139 PolarHBondContact O-N 3.48Å; N136-S139 PolarHBondContact O-OG 2.87Å; S139-E141 WeakPolarHBondContact CB-OE2 3.44Å; S139-E141 PolarHBondContact O-N 3.34Å; S139-L142 WeakPolarHBondContact O-CB 3.35Å; S139-L142 PolarHBondContact O-N 3.39Å; S139-L142 WeakPolarHBondContact OG-CB 3.29Å; S139-L142 PolarHBondContact OG-N 3.06Å
140	P	89.7	Confident	91.2	Very high	82 Å²	82	67.3 Å²	67.3	53%	0.532	36%	0.357	S	S	.	.	H	α-helix	trans	-65.1	-25.3	172.7	26.5	-33.2	0	0	0	112.6	N143 T144	P140-N143 PolarHBondContact O-N 3.47Å; P140-T144 PolarHBondContact O-N 3.48Å; P140-T144 VanDerWaalsContact O-N 3.1Å; P140-T144 PolarHBondContact O-OG1 3.22Å
141	E	88.8	Confident	91.2	Very high	71 Å²	71	67.3 Å²	67.3	33%	0.332	36%	0.356	S	S	.	.	H	α-helix	trans	-63.4	-43.8	174.2	-66.1	74.7	-161.3	0	0	111.2	Y97 F132 S139 N143 T144 V145	Y97-E141 HydrophobicContact CD1-CG 3.79Å; Y97-E141 HydrophobicContact CE1-CG 3.81Å; F132-E141 HydrophobicContact CE1-CB 4.22Å; F132-E141 HydrophobicContact CE2-CB 4.16Å; F132-E141 HydrophobicContact CZ-CB 4Å; S139-E141 WeakPolarHBondContact CB-OE2 3.44Å; S139-E141 PolarHBondContact O-N 3.34Å; E141-N143 VanDerWaalsContact C-N 3.33Å; E141-N143 PolarHBondContact O-N 2.86Å; E141-T144 WeakPolarHBondContact O-CB 3.38Å; E141-T144 PolarHBondContact O-N 3.43Å; E141-T144 VanDerWaalsContact O-N 3.11Å; E141-V145 WeakPolarHBondContact O-CG2 3.27Å; E141-V145 PolarHBondContact O-N 2.93Å
142	L	92	Very high	91.2	Very high	4 Å²	4	65.4 Å²	65.4	2%	0.021	35%	0.348	C	S	.	.	H	α-helix	trans	-57.1	-46.2	175.4	-178.5	62.9	0	0	0	111.6	V129 F132 Q133 P137 S139 T144 V145 K146	V129-L142 HydrophobicContact CG1-CD1 4.2Å; V129-L142 WeakPolarHBondContact O-CD1 3.49Å; F132-L142 HydrophobicContact CB-CB 3.98Å; F132-L142 HydrophobicContact CB-CD1 3.67Å; F132-L142 HydrophobicContact CB-CG 4.34Å; Q133-L142 HydrophobicContact CB-CD1 4.36Å; P137-L142 WeakPolarHBondContact O-CD2 3.17Å; S139-L142 WeakPolarHBondContact O-CB 3.35Å; S139-L142 PolarHBondContact O-N 3.39Å; S139-L142 WeakPolarHBondContact OG-CB 3.29Å; S139-L142 PolarHBondContact OG-N 3.06Å; L142-T144 VanDerWaalsContact C-N 3.27Å; L142-T144 PolarHBondContact O-N 2.88Å; L142-V145 HydrophobicContact CD1-CG2 4.44Å; L142-V145 WeakPolarHBondContact O-CG2 3.26Å; L142-V145 PolarHBondContact O-N 3.28Å; L142-K146 HydrophobicContact CD1-CD 4.14Å; L142-K146 HydrophobicContact CD1-CG 4.21Å; L142-K146 HydrophobicContact CG-CD 4.04Å; L142-K146 HydrophobicContact CG-CG 4.44Å; L142-K146 VanDerWaalsContact O-CB 3.32Å; L142-K146 WeakPolarHBondContact O-CB 3.27Å; L142-K146 WeakPolarHBondContact O-CG 3.25Å; L142-K146 PolarHBondContact O-N 3.02Å
143	N	91.9	Very high	91.1	Very high	108 Å²	108	65.8 Å²	65.8	58%	0.578	35%	0.35	S	S	*	.	H	α-helix	trans	-61.4	-38.7	178.1	-69.2	-37.7	0	0	0	111.6	P140 E141 A147	P140-N143 PolarHBondContact O-N 3.47Å; E141-N143 VanDerWaalsContact C-N 3.33Å; E141-N143 PolarHBondContact O-N 2.86Å; N143-A147 WeakPolarHBondContact O-CB 3.28Å; N143-A147 PolarHBondContact O-N 3.05Å
144	T	91.6	Very high	91	Very high	71 Å²	71	65 Å²	65	44%	0.436	35%	0.347	S	S	.	.	H	α-helix	trans	-66.2	-50.1	178.2	-56.2	0	0	0	0	111.4	A100 P140 E141 L142 K146 A147 R148	A100-T144 HydrophobicContact CB-CG2 4.04Å; P140-T144 PolarHBondContact O-N 3.48Å; P140-T144 VanDerWaalsContact O-N 3.1Å; P140-T144 PolarHBondContact O-OG1 3.22Å; E141-T144 WeakPolarHBondContact O-CB 3.38Å; E141-T144 PolarHBondContact O-N 3.43Å; E141-T144 VanDerWaalsContact O-N 3.11Å; L142-T144 VanDerWaalsContact C-N 3.27Å; L142-T144 PolarHBondContact O-N 2.88Å; T144-K146 PolarHBondContact O-N 3.37Å; T144-A147 PolarHBondContact O-N 3.04Å; T144-R148 WeakPolarHBondContact O-CG 3.35Å; T144-R148 PolarHBondContact O-N 3.21Å
145	V	92.8	Very high	91.1	Very high	3 Å²	3	61 Å²	61	2%	0.018	33%	0.325	C	S	.	.	H	α-helix	trans	-67.6	-35.3	179.6	-66.3	0	0	0	0	112.3	A100 I125 A128 V129 F132 E141 L142 R148 F149	A100-V145 HydrophobicContact CB-CG1 4.13Å; I125-V145 HydrophobicContact CG2-CB 4.26Å; I125-V145 WeakPolarHBondContact CG2-O 3.34Å; A128-V145 HydrophobicContact CB-CG1 4.38Å; V129-V145 HydrophobicContact CB-CG2 4.49Å; V129-V145 HydrophobicContact CG2-CB 4.04Å; V129-V145 HydrophobicContact CG2-CG2 3.68Å; F132-V145 HydrophobicContact CD2-CG2 4.04Å; E141-V145 WeakPolarHBondContact O-CG2 3.27Å; E141-V145 PolarHBondContact O-N 2.93Å; L142-V145 HydrophobicContact CD1-CG2 4.44Å; L142-V145 WeakPolarHBondContact O-CG2 3.26Å; L142-V145 PolarHBondContact O-N 3.28Å; V145-R148 PolarHBondContact O-N 2.65Å; V145-F149 WeakPolarHBondContact O-CB 3.45Å; V145-F149 PolarHBondContact O-N 3.49Å
146	K	92.1	Very high	91.3	Very high	77 Å²	77	56.7 Å²	56.7	34%	0.335	30%	0.301	S	S	.	.	H	α-helix	trans	-61.8	-46.3	172.3	-79.6	-177.8	170.5	170.8	0	111.9	V129 L142 T144 R148 F149 E150	V129-K146 HydrophobicContact CG1-CG 3.89Å; V129-K146 HydrophobicContact CG2-CG 4.14Å; L142-K146 HydrophobicContact CD1-CD 4.14Å; L142-K146 HydrophobicContact CD1-CG 4.21Å; L142-K146 HydrophobicContact CG-CD 4.04Å; L142-K146 HydrophobicContact CG-CG 4.44Å; L142-K146 VanDerWaalsContact O-CB 3.32Å; L142-K146 WeakPolarHBondContact O-CB 3.27Å; L142-K146 WeakPolarHBondContact O-CG 3.25Å; L142-K146 PolarHBondContact O-N 3.02Å; T144-K146 PolarHBondContact O-N 3.37Å; K146-R148 VanDerWaalsContact C-N 3.28Å; K146-R148 PolarHBondContact O-N 2.66Å; K146-F149 PolarHBondContact O-N 2.97Å; K146-E150 WeakPolarHBondContact O-CG 3.36Å; K146-E150 PolarHBondContact O-N 3.31Å
147	A	92.4	Very high	91.5	Very high	62 Å²	62	56.1 Å²	56.1	51%	0.512	30%	0.297	S	S	.	.	H	α-helix	trans	-61.5	-36.9	176.5	0	0	0	0	0	112.2	N143 T144 K151	N143-A147 WeakPolarHBondContact O-CB 3.28Å; N143-A147 PolarHBondContact O-N 3.05Å; T144-A147 PolarHBondContact O-N 3.04Å; A147-K151 WeakPolarHBondContact O-CB 3.29Å; A147-K151 PolarHBondContact O-N 3.39Å
148	R	92.4	Very high	91.8	Very high	80 Å²	80	55 Å²	55	30%	0.302	29%	0.294	S	S	.	.	H	α-helix	trans	-69.3	-41.3	175.3	-67	-61.2	-178.4	157.7	8.9	113	D104 I125 T144 V145 K146 E150 K151 G152	D104-R148 IonicContact OD1-CZ 2.75Å; D104-R148 IonicContact OD1-NH1 3.54Å; D104-R148 PolarHBondContact OD1-NH1 2.74Å; D104-R148 IonicContact OD1-NH2 2.79Å; D104-R148 PolarHBondContact OD1-NH2 2.9Å; I125-R148 HydrophobicContact CD1-CB 4.37Å; I125-R148 HydrophobicContact CG2-CB 4.48Å; T144-R148 WeakPolarHBondContact O-CG 3.35Å; T144-R148 PolarHBondContact O-N 3.21Å; V145-R148 PolarHBondContact O-N 2.65Å; K146-R148 VanDerWaalsContact C-N 3.28Å; K146-R148 PolarHBondContact O-N 2.66Å; R148-E150 VanDerWaalsContact C-N 3.34Å; R148-K151 PolarHBondContact O-N 2.9Å; R148-G152 PolarHBondContact O-N 3.2Å
149	F	93.1	Very high	92.2	Very high	27 Å²	27	48.2 Å²	48.2	12%	0.118	26%	0.257	C	S	.	.	H	α-helix	trans	-59.9	-47.2	175.1	-175.2	-102.1	0	0	0	111	I122 I125 Q126 V145 K146 K151 G152 K153 W211 Y215	I122-F149 HydrophobicContact CG2-CD2 3.86Å; I122-F149 HydrophobicContact CG2-CE2 3.52Å; I125-F149 HydrophobicContact CG2-CB 3.88Å; I125-F149 HydrophobicContact CG2-CD2 4.39Å; Q126-F149 HydrophobicContact CB-CD2 4.17Å; Q126-F149 HydrophobicContact CB-CE2 3.77Å; Q126-F149 HydrophobicContact CG-CE2 4.26Å; V145-F149 WeakPolarHBondContact O-CB 3.45Å; V145-F149 PolarHBondContact O-N 3.49Å; K146-F149 PolarHBondContact O-N 2.97Å; F149-K151 VanDerWaalsContact C-N 3.35Å; F149-K151 PolarHBondContact O-N 3.08Å; F149-G152 PolarHBondContact O-N 3Å; F149-G152 VanDerWaalsContact O-N 3.13Å; F149-K153 PolarHBondContact O-N 3.39Å; F149-W211 HydrophobicContact CE2-CH2 4.29Å; F149-W211 AromaticContact CE2-CZ2 3.86Å; F149-W211 HydrophobicContact CE2-CZ2 3.86Å; F149-W211 AromaticContact CZ-CH2 3.92Å; F149-W211 HydrophobicContact CZ-CH2 3.92Å; F149-W211 AromaticContact CZ-CZ2 3.75Å; F149-W211 HydrophobicContact CZ-CZ2 3.75Å; F149-Y215 HydrophobicContact CZ-CG 4.43Å
150	E	92.3	Very high	92.5	Very high	50 Å²	50	47.6 Å²	47.6	23%	0.234	25%	0.253	C	S	.	.	H	α-helix	trans	-64.6	-39.4	177.5	-68.2	-71.4	-156.1	0	0	112.2	K146 R148 G152 K153 E154 R217	K146-E150 WeakPolarHBondContact O-CG 3.36Å; K146-E150 PolarHBondContact O-N 3.31Å; R148-E150 VanDerWaalsContact C-N 3.34Å; E150-G152 VanDerWaalsContact C-N 3.29Å; E150-G152 PolarHBondContact O-N 2.74Å; E150-K153 PolarHBondContact O-N 2.85Å; E150-K153 IonicContact OE2-NZ 2.63Å; E150-E154 WeakPolarHBondContact O-CG 3.4Å; E150-E154 PolarHBondContact O-N 3.13Å; E150-R217 VanDerWaalsContact CG-NH2 3.27Å; E150-R217 IonicContact OE1-CZ 3.21Å; E150-R217 VanDerWaalsContact OE1-CZ 3.28Å; E150-R217 IonicContact OE1-NE 3.25Å; E150-R217 PolarHBondContact OE1-NE 3.19Å; E150-R217 IonicContact OE1-NH2 2.59Å; E150-R217 PolarHBondContact OE1-NH2 3.41Å; E150-R217 IonicContact OE2-CZ 2.66Å; E150-R217 IonicContact OE2-NE 2.61Å; E150-R217 PolarHBondContact OE2-NE 3.47Å; E150-R217 IonicContact OE2-NH2 2.71Å; E150-R217 PolarHBondContact OE2-NH2 3.5Å; E150-R217 VanDerWaalsContact OE2-NH2 3.15Å
151	K	92.6	Very high	92.8	Very high	95 Å²	95	49.6 Å²	49.6	41%	0.413	25%	0.25	S	C	.	.	H	α-helix	trans	-63.4	-39.6	173.2	-172.3	57.1	-178	174.3	0	112.1	I107 A147 R148 F149 K153 E154 L155	I107-K151 HydrophobicContact CG2-CG 4.31Å; A147-K151 WeakPolarHBondContact O-CB 3.29Å; A147-K151 PolarHBondContact O-N 3.39Å; R148-K151 PolarHBondContact O-N 2.9Å; F149-K151 VanDerWaalsContact C-N 3.35Å; F149-K151 PolarHBondContact O-N 3.08Å; K151-K153 VanDerWaalsContact C-N 3.31Å; K151-K153 PolarHBondContact O-N 2.71Å; K151-E154 WeakPolarHBondContact CD-OE2 3.45Å; K151-E154 IonicContact NZ-OE2 2.77Å; K151-E154 PolarHBondContact NZ-OE2 3.49Å; K151-E154 PolarHBondContact O-N 3.45Å; K151-L155 HydrophobicContact CG-CD1 4.5Å; K151-L155 WeakPolarHBondContact O-CG 3.44Å; K151-L155 PolarHBondContact O-N 2.96Å
152	G	92.5	Very high	93.1	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60.5	-42.9	178.3	0	0	0	0	0	112.1	Y118 R148 F149 E150 L155 L156	Y118-G152 VanDerWaalsContact OH-CA 3.25Å; Y118-G152 WeakPolarHBondContact OH-CA 3.42Å; Y118-G152 PolarHBondContact OH-O 2.67Å; R148-G152 PolarHBondContact O-N 3.2Å; F149-G152 PolarHBondContact O-N 3Å; F149-G152 VanDerWaalsContact O-N 3.13Å; E150-G152 VanDerWaalsContact C-N 3.29Å; E150-G152 PolarHBondContact O-N 2.74Å; G152-L155 PolarHBondContact O-N 3.28Å; G152-L156 PolarHBondContact O-N 3.43Å; G152-L156 VanDerWaalsContact O-N 3.15Å
153	K	91.3	Very high	93.3	Very high	8 Å²	8	48.6 Å²	48.6	4%	0.035	25%	0.25	C	C	.	.	H	α-helix	trans	-65	-46.8	175.2	169.6	170.9	161.7	179.5	0	113.9	F149 E150 K151 L155 L156 E157 W211 L212 Y215 R217	F149-K153 PolarHBondContact O-N 3.39Å; E150-K153 PolarHBondContact O-N 2.85Å; E150-K153 IonicContact OE2-NZ 2.63Å; K151-K153 VanDerWaalsContact C-N 3.31Å; K151-K153 PolarHBondContact O-N 2.71Å; K153-L155 PolarHBondContact O-N 2.88Å; K153-L156 WeakPolarHBondContact O-CB 3.49Å; K153-L156 PolarHBondContact O-N 3.5Å; K153-E157 PolarHBondContact O-N 2.87Å; K153-W211 HydrophobicContact CB-CH2 3.94Å; K153-W211 HydrophobicContact CB-CZ3 3.98Å; K153-W211 HydrophobicContact CD-CH2 4.42Å; K153-W211 HydrophobicContact CD-CZ3 4.33Å; K153-W211 HydrophobicContact CG-CH2 4.32Å; K153-W211 HydrophobicContact CG-CZ3 3.98Å; K153-L212 HydrophobicContact CG-CD2 4.47Å; K153-Y215 WeakPolarHBondContact CD-O 3.15Å; K153-Y215 WeakPolarHBondContact CE-O 3.22Å; K153-Y215 PolarHBondContact NZ-O 3.46Å; K153-R217 VanDerWaalsContact NZ-CA 3.34Å; K153-R217 VanDerWaalsContact NZ-CB 3.34Å
154	E	92.1	Very high	93.5	Very high	85 Å²	85	43.4 Å²	43.4	40%	0.397	22%	0.222	S	C	.	.	H	α-helix	trans	-54.3	-38.1	174.7	-74.4	174.8	-175.6	0	0	111.6	E150 K151 A158	E150-E154 WeakPolarHBondContact O-CG 3.4Å; E150-E154 PolarHBondContact O-N 3.13Å; K151-E154 WeakPolarHBondContact CD-OE2 3.45Å; K151-E154 IonicContact NZ-OE2 2.77Å; K151-E154 PolarHBondContact NZ-OE2 3.49Å; K151-E154 PolarHBondContact O-N 3.45Å; E154-A158 WeakPolarHBondContact O-CB 3.32Å; E154-A158 PolarHBondContact O-N 3.36Å
155	L	94.4	Very high	93.8	Very high	47 Å²	47	43.8 Å²	43.8	25%	0.246	22%	0.224	C	C	.	.	H	α-helix	trans	-72.5	-31.7	177.7	-69.4	170.4	0	0	0	112.8	I107 Y118 K151 G152 K153 A158 E159	I107-L155 HydrophobicContact CG2-CD1 4.42Å; I107-L155 WeakPolarHBondContact O-CD1 3.48Å; Y118-L155 WeakPolarHBondContact OH-CB 3.44Å; Y118-L155 WeakPolarHBondContact OH-CD1 3.42Å; K151-L155 HydrophobicContact CG-CD1 4.5Å; K151-L155 WeakPolarHBondContact O-CG 3.44Å; K151-L155 PolarHBondContact O-N 2.96Å; G152-L155 PolarHBondContact O-N 3.28Å; K153-L155 PolarHBondContact O-N 2.88Å; L155-A158 PolarHBondContact O-N 3.16Å; L155-E159 WeakPolarHBondContact O-CB 3.47Å; L155-E159 PolarHBondContact O-N 3.26Å
156	L	93.6	Very high	93.9	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-67.8	-43.4	171.1	-73.2	173.2	0	0	0	111.6	P111 L115 Y118 L119 I122 G152 K153 A158 E159 F160 I208 W211 L212	P111-L156 HydrophobicContact CB-CD2 4.02Å; P111-L156 HydrophobicContact CG-CD2 4.23Å; L115-L156 HydrophobicContact CD1-CD2 3.87Å; Y118-L156 HydrophobicContact CD1-CD2 3.82Å; Y118-L156 HydrophobicContact CD1-CG 4.26Å; Y118-L156 HydrophobicContact CE1-CD1 4.38Å; Y118-L156 HydrophobicContact CE1-CD2 3.82Å; Y118-L156 HydrophobicContact CE1-CG 3.81Å; L119-L156 HydrophobicContact CD2-CD1 3.96Å; L119-L156 HydrophobicContact CD2-CD2 4.19Å; I122-L156 HydrophobicContact CD1-CD1 3.73Å; I122-L156 HydrophobicContact CD1-CG 4.25Å; G152-L156 PolarHBondContact O-N 3.43Å; G152-L156 VanDerWaalsContact O-N 3.15Å; K153-L156 WeakPolarHBondContact O-CB 3.49Å; K153-L156 PolarHBondContact O-N 3.5Å; L156-A158 VanDerWaalsContact C-N 3.29Å; L156-A158 PolarHBondContact O-N 2.94Å; L156-E159 PolarHBondContact O-N 3.49Å; L156-F160 WeakPolarHBondContact O-CB 3.5Å; L156-F160 PolarHBondContact O-N 3.42Å; L156-I208 HydrophobicContact CB-CG2 4.28Å; L156-I208 HydrophobicContact CD2-CG1 4.32Å; L156-W211 HydrophobicContact CD1-CD2 3.69Å; L156-W211 HydrophobicContact CD1-CE3 3.35Å; L156-W211 HydrophobicContact CD1-CG 4.45Å; L156-W211 HydrophobicContact CD1-CH2 4.06Å; L156-W211 HydrophobicContact CD1-CZ2 4.35Å; L156-W211 HydrophobicContact CD1-CZ3 3.55Å; L156-L212 HydrophobicContact CB-CD2 4.48Å
157	E	92.8	Very high	94.1	Very high	57 Å²	57	51.8 Å²	51.8	27%	0.266	25%	0.253	S	S	.	.	H	α-helix	trans	-60.9	-41	174.3	-69	176.4	177.4	0	0	111.1	K153 R161 L212	K153-E157 PolarHBondContact O-N 2.87Å; E157-R161 PolarHBondContact O-N 3.01Å; E157-R161 VanDerWaalsContact O-N 3.13Å; E157-L212 HydrophobicContact CG-CD1 4.03Å; E157-L212 HydrophobicContact CG-CD2 3.55Å; E157-L212 HydrophobicContact CG-CG 4.47Å
158	A	93.6	Very high	94.2	Very high	54 Å²	54	49.1 Å²	49.1	45%	0.446	23%	0.23	S	C	.	.	H	α-helix	trans	-65.8	-39.5	174.9	0	0	0	0	0	112.6	E154 L155 L156 R161 S162	E154-A158 WeakPolarHBondContact O-CB 3.32Å; E154-A158 PolarHBondContact O-N 3.36Å; L155-A158 PolarHBondContact O-N 3.16Å; L156-A158 VanDerWaalsContact C-N 3.29Å; L156-A158 PolarHBondContact O-N 2.94Å; A158-R161 PolarHBondContact O-N 3.05Å; A158-S162 VanDerWaalsContact O-CB 3.3Å; A158-S162 WeakPolarHBondContact O-CB 3.43Å; A158-S162 PolarHBondContact O-N 3.34Å
159	E	95.1	Very high	94.3	Very high	18 Å²	18	52.4 Å²	52.4	8%	0.084	25%	0.247	C	C	.	.	H	α-helix	trans	-67.9	-43.8	177.1	-172.6	63.9	-166.6	0	0	111.7	P111 S112 L155 L156 R161 S162 L163 I208	P111-E159 HydrophobicContact CB-CG 4.35Å; P111-E159 HydrophobicContact CG-CB 3.51Å; P111-E159 HydrophobicContact CG-CG 3.74Å; S112-E159 WeakPolarHBondContact CA-OE1 3.35Å; S112-E159 VanDerWaalsContact OG-CD 3.3Å; S112-E159 PolarHBondContact OG-OE1 2.76Å; S112-E159 PolarHBondContact OG-OE2 3.45Å; L155-E159 WeakPolarHBondContact O-CB 3.47Å; L155-E159 PolarHBondContact O-N 3.26Å; L156-E159 PolarHBondContact O-N 3.49Å; E159-R161 VanDerWaalsContact C-N 3.29Å; E159-R161 PolarHBondContact O-N 3.14Å; E159-S162 WeakPolarHBondContact O-CA 3.49Å; E159-S162 WeakPolarHBondContact O-CB 3.19Å; E159-S162 PolarHBondContact O-N 2.86Å; E159-L163 HydrophobicContact CG-CD1 4.11Å; E159-L163 HydrophobicContact CG-CG 4.23Å; E159-L163 WeakPolarHBondContact O-CG 3.32Å; E159-L163 PolarHBondContact O-N 3.1Å; E159-I208 HydrophobicContact CB-CD1 4.43Å; E159-I208 HydrophobicContact CG-CD1 4.12Å
160	F	95.6	Very high	94.5	Very high	1 Å²	1	53.8 Å²	53.8	0%	0.004	26%	0.258	C	S	.	.	H	α-helix	trans	-52.5	-49.3	172.8	-178.8	-93.9	0	0	0	111.1	L156 S162 L164 I205 I208 L212 F221 Y225 I336	L156-F160 WeakPolarHBondContact O-CB 3.5Å; L156-F160 PolarHBondContact O-N 3.42Å; F160-S162 PolarHBondContact O-N 2.9Å; F160-L164 HydrophobicContact CD1-CD1 3.69Å; F160-L164 HydrophobicContact CE1-CD1 3.2Å; F160-L164 HydrophobicContact CE1-CG 4.46Å; F160-L164 HydrophobicContact CE2-CD1 4.25Å; F160-L164 HydrophobicContact CG-CD1 4.37Å; F160-L164 HydrophobicContact CZ-CD1 3.53Å; F160-L164 WeakPolarHBondContact O-CB 3.36Å; F160-L164 WeakPolarHBondContact O-CG 3.44Å; F160-L164 PolarHBondContact O-N 2.92Å; F160-L164 VanDerWaalsContact O-N 3.12Å; F160-I205 HydrophobicContact CD2-CG2 4.09Å; F160-I205 HydrophobicContact CE2-CG2 3.59Å; F160-I205 HydrophobicContact CZ-CG2 4.4Å; F160-I208 HydrophobicContact CB-CG2 3.85Å; F160-I208 HydrophobicContact CD2-CB 4.36Å; F160-I208 HydrophobicContact CD2-CG2 4.1Å; F160-I208 HydrophobicContact CG-CG2 4.41Å; F160-L212 HydrophobicContact CB-CD1 4.5Å; F160-F221 HydrophobicContact CD1-CB 4.17Å; F160-F221 HydrophobicContact CD1-CD2 4.46Å; F160-F221 HydrophobicContact CE1-CB 4.16Å; F160-F221 AromaticContact CE1-CD2 3.88Å; F160-F221 HydrophobicContact CE1-CD2 3.88Å; F160-F221 WeakPolarHBondContact CE1-O 3.47Å; F160-F221 HydrophobicContact CE2-CD2 4.12Å; F160-F221 AromaticContact CZ-CD2 3.7Å; F160-F221 HydrophobicContact CZ-CD2 3.7Å; F160-F221 HydrophobicContact CZ-CE2 4.36Å; F160-Y225 HydrophobicContact CZ-CD2 4.27Å; F160-I336 HydrophobicContact CE2-CG2 4.19Å; F160-I336 HydrophobicContact CZ-CG2 4.33Å
161	R	96	Very high	94.7	Very high	123 Å²	123	52.2 Å²	52.2	46%	0.464	25%	0.252	S	S	.	.	H	α-helix	trans	-61.6	-42.8	175.6	-174.3	176.2	-133.9	-76	-1.5	112.1	E157 A158 E159 T165 V224 I228	E157-R161 PolarHBondContact O-N 3.01Å; E157-R161 VanDerWaalsContact O-N 3.13Å; A158-R161 PolarHBondContact O-N 3.05Å; E159-R161 VanDerWaalsContact C-N 3.29Å; E159-R161 PolarHBondContact O-N 3.14Å; R161-T165 VanDerWaalsContact O-CB 3.25Å; R161-T165 WeakPolarHBondContact O-CB 3.4Å; R161-T165 PolarHBondContact O-N 3.1Å; R161-T165 PolarHBondContact O-OG1 2.91Å; R161-V224 HydrophobicContact CB-CG1 3.92Å; R161-V224 HydrophobicContact CG-CG1 3.7Å; R161-I228 HydrophobicContact CG-CD1 4.4Å
162	S	96.1	Very high	94.8	Very high	41 Å²	41	50.9 Å²	50.9	29%	0.287	25%	0.253	S	S	.	.	H	α-helix	trans	-63.1	-48.9	-179.1	179.8	0	0	0	0	111.7	A158 E159 F160 T165 R166	A158-S162 VanDerWaalsContact O-CB 3.3Å; A158-S162 WeakPolarHBondContact O-CB 3.43Å; A158-S162 PolarHBondContact O-N 3.34Å; E159-S162 WeakPolarHBondContact O-CA 3.49Å; E159-S162 WeakPolarHBondContact O-CB 3.19Å; E159-S162 PolarHBondContact O-N 2.86Å; F160-S162 PolarHBondContact O-N 2.9Å; S162-T165 PolarHBondContact O-N 3.42Å; S162-R166 WeakPolarHBondContact O-CB 3.44Å; S162-R166 PolarHBondContact O-N 3.48Å
163	L	96	Very high	94.8	Very high	13 Å²	13	52.2 Å²	52.2	7%	0.068	26%	0.262	C	S	.	.	H	α-helix	trans	-60.7	-50.5	178.3	-68.5	175.3	0	0	0	110.8	E159 T165 R166 Y167 V201 D204 I205 I208	E159-L163 HydrophobicContact CG-CD1 4.11Å; E159-L163 HydrophobicContact CG-CG 4.23Å; E159-L163 WeakPolarHBondContact O-CG 3.32Å; E159-L163 PolarHBondContact O-N 3.1Å; L163-T165 PolarHBondContact O-N 3.11Å; L163-R166 PolarHBondContact O-N 3.34Å; L163-Y167 HydrophobicContact CD2-CD2 4.46Å; L163-Y167 HydrophobicContact CD2-CE2 4.12Å; L163-Y167 WeakPolarHBondContact O-CD2 3.25Å; L163-Y167 PolarHBondContact O-N 3.28Å; L163-V201 HydrophobicContact CB-CG1 4.19Å; L163-V201 HydrophobicContact CD2-CG1 4.3Å; L163-D204 HydrophobicContact CD1-CB 3.98Å; L163-I205 HydrophobicContact CB-CD1 4.04Å; L163-I205 HydrophobicContact CB-CG1 4.01Å; L163-I205 HydrophobicContact CD1-CG1 4.06Å; L163-I208 HydrophobicContact CD1-CD1 3.98Å
164	L	96.2	Very high	94.8	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-60.1	-46.2	177.7	-75.3	171.1	0	0	0	112.3	F160 R166 S168 L197 I205 Y225 I228	F160-L164 HydrophobicContact CD1-CD1 3.69Å; F160-L164 HydrophobicContact CE1-CD1 3.2Å; F160-L164 HydrophobicContact CE1-CG 4.46Å; F160-L164 HydrophobicContact CE2-CD1 4.25Å; F160-L164 HydrophobicContact CG-CD1 4.37Å; F160-L164 HydrophobicContact CZ-CD1 3.53Å; F160-L164 WeakPolarHBondContact O-CB 3.36Å; F160-L164 WeakPolarHBondContact O-CG 3.44Å; F160-L164 PolarHBondContact O-N 2.92Å; F160-L164 VanDerWaalsContact O-N 3.12Å; L164-R166 VanDerWaalsContact C-N 3.31Å; L164-R166 PolarHBondContact O-N 3.03Å; L164-S168 WeakPolarHBondContact O-CB 3.14Å; L164-S168 PolarHBondContact O-N 2.94Å; L164-S168 PolarHBondContact O-OG 3.48Å; L164-L197 HydrophobicContact CD2-CD1 4.38Å; L164-I205 HydrophobicContact CD2-CD1 3.79Å; L164-I205 HydrophobicContact CG-CD1 4.03Å; L164-Y225 HydrophobicContact CD1-CD2 3.83Å; L164-Y225 HydrophobicContact CD2-CD2 3.93Å; L164-Y225 HydrophobicContact CD2-CE2 4.12Å; L164-I228 HydrophobicContact CB-CD1 3.75Å; L164-I228 HydrophobicContact CB-CG2 4.34Å; L164-I228 HydrophobicContact CD1-CD1 4.49Å
165	T	96.2	Very high	94.8	Very high	78 Å²	78	56.8 Å²	56.8	48%	0.479	29%	0.288	S	S	.	.	H	α-helix	trans	-65.3	-36.4	-178.7	-56.3	0	0	0	0	111.7	R161 S162 L163 I228	R161-T165 VanDerWaalsContact O-CB 3.25Å; R161-T165 WeakPolarHBondContact O-CB 3.4Å; R161-T165 PolarHBondContact O-N 3.1Å; R161-T165 PolarHBondContact O-OG1 2.91Å; S162-T165 PolarHBondContact O-N 3.42Å; L163-T165 PolarHBondContact O-N 3.11Å; T165-I228 WeakPolarHBondContact OG1-CD1 3.35Å
166	R	95.6	Very high	94.7	Very high	162 Å²	162	54.6 Å²	54.6	61%	0.611	28%	0.277	S	S	*	.	H	α-helix	trans	-75.5	-40	-176.7	-178.4	175.7	-68.2	177	2.3	112.6	S162 L163 L164	S162-R166 WeakPolarHBondContact O-CB 3.44Å; S162-R166 PolarHBondContact O-N 3.48Å; L163-R166 PolarHBondContact O-N 3.34Å; L164-R166 VanDerWaalsContact C-N 3.31Å; L164-R166 PolarHBondContact O-N 3.03Å
167	Y	95.8	Very high	94.6	Very high	86 Å²	86	56.6 Å²	56.6	34%	0.337	29%	0.287	S	S	.	.	H	α-helix	trans	-102.6	-21.4	-170.4	-68.1	-76.6	0	0	0	114	L163 K169 P198 V201	L163-Y167 HydrophobicContact CD2-CD2 4.46Å; L163-Y167 HydrophobicContact CD2-CE2 4.12Å; L163-Y167 WeakPolarHBondContact O-CD2 3.25Å; L163-Y167 PolarHBondContact O-N 3.28Å; Y167-K169 PolarHBondContact O-N 2.88Å; Y167-K169 VanDerWaalsContact O-N 3.11Å; Y167-P198 HydrophobicContact CD1-CG 3.93Å; Y167-P198 HydrophobicContact CE1-CG 4.31Å; Y167-V201 HydrophobicContact CD1-CG2 4.33Å; Y167-V201 HydrophobicContact CD2-CB 4.34Å; Y167-V201 HydrophobicContact CD2-CG1 3.62Å; Y167-V201 HydrophobicContact CD2-CG2 3.83Å; Y167-V201 HydrophobicContact CE1-CG2 4.17Å; Y167-V201 HydrophobicContact CE2-CG1 4.12Å; Y167-V201 HydrophobicContact CE2-CG2 3.62Å; Y167-V201 HydrophobicContact CG-CG1 4.1Å; Y167-V201 HydrophobicContact CG-CG2 4.17Å
168	S	95.6	Very high	94.4	Very high	6 Å²	6	57.4 Å²	57.4	4%	0.042	29%	0.293	C	S	.	.			trans	-71.9	107.6	174.8	-56.1	0	0	0	0	110.3	L164 R229 Q232	L164-S168 WeakPolarHBondContact O-CB 3.14Å; L164-S168 PolarHBondContact O-N 2.94Å; L164-S168 PolarHBondContact O-OG 3.48Å; S168-R229 VanDerWaalsContact CB-NH1 3.28Å; S168-R229 PolarHBondContact OG-NH1 2.67Å; S168-Q232 PolarHBondContact O-NE2 3.14Å
169	K	95	Very high	94.1	Very high	149 Å²	149	55.4 Å²	55.4	65%	0.648	28%	0.277	S	S	*	.			trans	-116.4	152.4	178.3	-66.4	-178	-176.7	174.6	0	110.5	Y167 Q232	Y167-K169 PolarHBondContact O-N 2.88Å; Y167-K169 VanDerWaalsContact O-N 3.11Å; K169-Q232 VanDerWaalsContact C-NE2 3.32Å
170	P	96.1	Very high	93.7	Very high	56 Å²	56	56 Å²	56	36%	0.364	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-65.7	141.8	174.7	-12.5	29.4	0	0	0	109.1	Q232 R235 S236	P170-Q232 VanDerWaalsContact N-NE2 3.12Å; P170-R235 HydrophobicContact CB-CB 4.03Å; P170-R235 HydrophobicContact CG-CB 3.91Å; P170-S236 VanDerWaalsContact CA-OG 3.28Å; P170-S236 WeakPolarHBondContact CA-OG 3.13Å
171	V	95.9	Very high	92.7	Very high	17 Å²	17	59.4 Å²	59.4	10%	0.103	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-68.8	128.5	176.9	-173.7	0	0	0	0	108.8	L175 I176 L194 S236 L325	V171-L175 HydrophobicContact CG1-CB 4.14Å; V171-I176 HydrophobicContact CB-CD1 4.23Å; V171-I176 HydrophobicContact CB-CG1 4.07Å; V171-I176 HydrophobicContact CG1-CD1 4.36Å; V171-I176 HydrophobicContact CG1-CG1 3.68Å; V171-L194 HydrophobicContact CG1-CD2 4.05Å; V171-S236 PolarHBondContact N-OG 3.48Å; V171-L325 HydrophobicContact CB-CD2 4.05Å; V171-L325 HydrophobicContact CG1-CD2 4.39Å; V171-L325 HydrophobicContact CG2-CD2 3.73Å
172	P	94.9	Very high	90.9	Very high	67 Å²	67	55.1 Å²	55.1	44%	0.435	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-60.2	142.2	176.7	-24.9	33.6	0	0	0	112.8	I174 L175 I176	P172-I174 VanDerWaalsContact C-N 3.26Å; P172-I174 PolarHBondContact O-N 3.32Å; P172-I174 VanDerWaalsContact O-N 3.13Å; P172-L175 HydrophobicContact CG-CD1 4.27Å; P172-L175 PolarHBondContact O-N 2.96Å; P172-L175 VanDerWaalsContact O-N 3.12Å; P172-I176 PolarHBondContact O-N 2.86Å
173	P	93.9	Very high	88.9	Confident	29 Å²	29	58.2 Å²	58.2	19%	0.188	31%	0.305	C	S	.	.	H	α-helix	trans	-52.1	-38.3	-179.2	-31.4	37.4	0	0	0	115.1	I176 L177 L240 H243	P173-I176 PolarHBondContact O-N 3.3Å; P173-L177 WeakPolarHBondContact O-CG 3.5Å; P173-L177 PolarHBondContact O-N 2.98Å; P173-L240 HydrophobicContact CB-CD1 3.91Å; P173-H243 HydrophobicContact CB-CB 3.73Å; P173-H243 HydrophobicContact CG-CB 3.8Å
174	I	91.3	Very high	86.6	Confident	106 Å²	106	65.6 Å²	65.6	54%	0.544	34%	0.339	S	S	.	.	H	α-helix	trans	-64.7	-44.1	-178.1	-60.2	170	0	0	0	110.9	P172 I176 L177 D178	P172-I174 VanDerWaalsContact C-N 3.26Å; P172-I174 PolarHBondContact O-N 3.32Å; P172-I174 VanDerWaalsContact O-N 3.13Å; I174-I176 VanDerWaalsContact C-N 3.27Å; I174-I176 PolarHBondContact O-N 2.99Å; I174-L177 PolarHBondContact O-N 3.33Å; I174-D178 VanDerWaalsContact O-CG 3.29Å; I174-D178 PolarHBondContact O-N 3.26Å
175	L	91.5	Very high	84	Confident	82 Å²	82	72.9 Å²	72.9	43%	0.429	38%	0.378	S	S	.	.	H	α-helix	trans	-66.4	-32.3	178.1	-64.1	-176.7	0	0	0	112.1	V171 P172 A179 L194	V171-L175 HydrophobicContact CG1-CB 4.14Å; P172-L175 HydrophobicContact CG-CD1 4.27Å; P172-L175 PolarHBondContact O-N 2.96Å; P172-L175 VanDerWaalsContact O-N 3.12Å; L175-A179 WeakPolarHBondContact O-CB 3.27Å; L175-A179 PolarHBondContact O-N 3.45Å; L175-L194 HydrophobicContact CB-CD2 4.33Å
176	I	93	Very high	81.4	Confident	2 Å²	2	74 Å²	74	1%	0.01	38%	0.38	C	S	.	.	H	α-helix	trans	-66.4	-44.9	174.2	-58.8	169.1	0	0	0	110.2	V171 P172 P173 I174 A179 I180 L240 A321 L325	V171-I176 HydrophobicContact CB-CD1 4.23Å; V171-I176 HydrophobicContact CB-CG1 4.07Å; V171-I176 HydrophobicContact CG1-CD1 4.36Å; V171-I176 HydrophobicContact CG1-CG1 3.68Å; P172-I176 PolarHBondContact O-N 2.86Å; P173-I176 PolarHBondContact O-N 3.3Å; I174-I176 VanDerWaalsContact C-N 3.27Å; I174-I176 PolarHBondContact O-N 2.99Å; I176-A179 PolarHBondContact O-N 3.12Å; I176-I180 HydrophobicContact CG2-CD1 3.86Å; I176-I180 HydrophobicContact CG2-CG1 4.5Å; I176-I180 VanDerWaalsContact O-CG1 3.28Å; I176-I180 WeakPolarHBondContact O-CG1 3.33Å; I176-I180 PolarHBondContact O-N 3.38Å; I176-L240 HydrophobicContact CD1-CB 4.41Å; I176-L240 HydrophobicContact CG2-CD2 3.96Å; I176-A321 HydrophobicContact CG2-CB 3.49Å; I176-A321 VanDerWaalsContact CG2-CB 3.49Å; I176-L325 HydrophobicContact CD1-CD1 4.08Å; I176-L325 HydrophobicContact CG1-CD1 4.46Å; I176-L325 HydrophobicContact CG1-CD2 4.35Å
177	L	91.1	Very high	78.9	Confident	41 Å²	41	76.1 Å²	76.1	22%	0.215	40%	0.397	C	S	.	.	H	α-helix	trans	-64.1	-41.6	177.9	-69	173.1	0	0	0	111.7	P173 I174 A179 I180 S181 L240 F244	P173-L177 WeakPolarHBondContact O-CG 3.5Å; P173-L177 PolarHBondContact O-N 2.98Å; I174-L177 PolarHBondContact O-N 3.33Å; L177-A179 VanDerWaalsContact C-N 3.33Å; L177-A179 PolarHBondContact O-N 3.1Å; L177-I180 PolarHBondContact O-N 3.38Å; L177-S181 WeakPolarHBondContact O-CB 3.47Å; L177-S181 PolarHBondContact O-N 3.38Å; L177-S181 PolarHBondContact O-OG 3.4Å; L177-L240 HydrophobicContact CD1-CD1 4.35Å; L177-L240 HydrophobicContact CD2-CD1 4.01Å; L177-L240 HydrophobicContact CG-CD1 3.94Å; L177-F244 HydrophobicContact CD2-CE2 4.14Å; L177-F244 HydrophobicContact CD2-CZ 3.93Å
178	D	88.9	Confident	76.5	Confident	74 Å²	74	79.8 Å²	79.8	40%	0.396	42%	0.421	S	S	.	.	H	α-helix	trans	-58.3	-46.8	174.1	-67.4	-22.6	0	0	0	110.2	I174 I180 S181 V182	I174-D178 VanDerWaalsContact O-CG 3.29Å; I174-D178 PolarHBondContact O-N 3.26Å; D178-I180 VanDerWaalsContact C-N 3.32Å; D178-I180 PolarHBondContact O-N 2.96Å; D178-S181 WeakPolarHBondContact CA-OG 3.24Å; D178-S181 PolarHBondContact O-N 3.48Å; D178-S181 PolarHBondContact O-OG 3.44Å; D178-V182 WeakPolarHBondContact O-CG2 3.37Å; D178-V182 PolarHBondContact O-N 3.13Å
179	A	87.1	Confident	74.2	Confident	13 Å²	13	84.9 Å²	84.9	11%	0.107	45%	0.445	C	S	.	.	H	α-helix	trans	-65.1	-28	178.4	0	0	0	0	0	114.6	L175 I176 L177 V192	L175-A179 WeakPolarHBondContact O-CB 3.27Å; L175-A179 PolarHBondContact O-N 3.45Å; I176-A179 PolarHBondContact O-N 3.12Å; L177-A179 VanDerWaalsContact C-N 3.33Å; L177-A179 PolarHBondContact O-N 3.1Å; A179-V192 HydrophobicContact CB-CB 4.49Å; A179-V192 HydrophobicContact CB-CG1 4.38Å
180	I	86.7	Confident	72.1	Confident	29 Å²	29	86.5 Å²	86.5	15%	0.149	45%	0.454	C	S	.	.	H	α-helix	trans	-78.4	-38	174.3	-64.5	162.6	0	0	0	110.7	I176 L177 D178 V182 A321 K324	I176-I180 HydrophobicContact CG2-CD1 3.86Å; I176-I180 HydrophobicContact CG2-CG1 4.5Å; I176-I180 VanDerWaalsContact O-CG1 3.28Å; I176-I180 WeakPolarHBondContact O-CG1 3.33Å; I176-I180 PolarHBondContact O-N 3.38Å; L177-I180 PolarHBondContact O-N 3.38Å; D178-I180 VanDerWaalsContact C-N 3.32Å; D178-I180 PolarHBondContact O-N 2.96Å; I180-V182 VanDerWaalsContact C-N 3.31Å; I180-V182 PolarHBondContact O-N 2.92Å; I180-A321 HydrophobicContact CD1-CB 4.03Å; I180-K324 HydrophobicContact CG1-CG 4.37Å
181	S	73.6	Confident	70.3	Confident	73 Å²	73	91.9 Å²	91.9	51%	0.51	48%	0.475	S	S	.	.	H	α-helix	trans	-71.9	-17.9	-172.8	66.6	0	0	0	0	115.4	L177 D178 D183	L177-S181 WeakPolarHBondContact O-CB 3.47Å; L177-S181 PolarHBondContact O-N 3.38Å; L177-S181 PolarHBondContact O-OG 3.4Å; D178-S181 WeakPolarHBondContact CA-OG 3.24Å; D178-S181 PolarHBondContact O-N 3.48Å; D178-S181 PolarHBondContact O-OG 3.44Å; S181-D183 PolarHBondContact O-N 2.93Å
182	V	58.4	Low	68.9	Low	34 Å²	34	94 Å²	94	21%	0.206	49%	0.488	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-18.8	-178.4	173.3	0	0	0	0	112.4	D178 I180 E184 Q189 V192	D178-V182 WeakPolarHBondContact O-CG2 3.37Å; D178-V182 PolarHBondContact O-N 3.13Å; I180-V182 VanDerWaalsContact C-N 3.31Å; I180-V182 PolarHBondContact O-N 2.92Å; V182-E184 PolarHBondContact O-N 2.9Å; V182-Q189 HydrophobicContact CG1-CB 4.32Å; V182-V192 HydrophobicContact CG2-CG2 3.91Å
183	D	53.8	Low	68	Low	106 Å²	106	96.3 Å²	96.3	57%	0.567	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-15.3	-178.2	-89.2	-23.6	0	0	0	114.7	S181 K324	S181-D183 PolarHBondContact O-N 2.93Å; D183-K324 IonicContact OD1-NZ 2.71Å; D183-K324 WeakPolarHBondContact OD2-CE 3.48Å; D183-K324 IonicContact OD2-NZ 3.41Å; D183-K324 PolarHBondContact OD2-NZ 2.82Å
184	E	47.5	Very low	67.6	Low	167 Å²	167	95.9 Å²	95.9	78%	0.78	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-18.8	-167.5	-74.4	-165.9	162	0	0	116.7	V182	V182-E184 PolarHBondContact O-N 2.9Å
185	D	42.9	Very low	67.3	Low	154 Å²	154	99.3 Å²	99.3	82%	0.824	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-159.2	6.1	-172.8	-96.8	-38.4	0	0	0	121.6
186	I	41.8	Very low	67.3	Low	101 Å²	101	96.5 Å²	96.5	52%	0.518	50%	0.495	S	S	.	.			trans	-143.5	105.8	-174.9	-49.5	178.2	0	0	0	113.8	L188	I186-L188 HydrophobicContact CG2-CB 4.29Å; I186-L188 PolarHBondContact O-N 2.97Å
187	E	42.3	Very low	67.3	Low	206 Å²	206	97 Å²	97	96%	0.963	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	10.3	174.7	-67.7	-178.5	152.6	0	0	115.5
188	L	44.5	Very low	67.4	Low	163 Å²	163	98.1 Å²	98.1	85%	0.853	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.1	11.8	-171.2	-75.5	171.5	0	0	0	115.2	I186	I186-L188 HydrophobicContact CG2-CB 4.29Å; I186-L188 PolarHBondContact O-N 2.97Å
189	Q	47.1	Very low	67.6	Low	113 Å²	113	100.2 Å²	100.2	53%	0.528	51%	0.514	S	S	.	.	S	Bend	trans	-88.9	132.5	171.6	-93.5	175.1	-23.7	0	0	111.5	V182 E191	V182-Q189 HydrophobicContact CG1-CB 4.32Å; Q189-E191 PolarHBondContact O-N 2.98Å
190	E	52.6	Low	67.8	Low	183 Å²	183	103 Å²	103	86%	0.855	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-52.7	127.1	168.2	-72.6	174.1	163.7	0	0	108.8	V192	E190-V192 PolarHBondContact O-N 3.33Å; E190-V192 VanDerWaalsContact O-N 3.16Å
191	E	57	Low	68.2	Low	170 Å²	170	102.2 Å²	102.2	79%	0.794	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-51.2	120.9	173.6	-170.6	174.4	-177.3	0	0	108.6	Q189 V193	Q189-E191 PolarHBondContact O-N 2.98Å; E191-V193 PolarHBondContact O-N 3.17Å
192	V	66.9	Low	69.2	Low	61 Å²	61	99.3 Å²	99.3	37%	0.37	51%	0.513	S	S	.	.			trans	-69.6	97.1	-178.3	175.7	0	0	0	0	108.2	A179 V182 E190 L194	A179-V192 HydrophobicContact CB-CB 4.49Å; A179-V192 HydrophobicContact CB-CG1 4.38Å; V182-V192 HydrophobicContact CG2-CG2 3.91Å; E190-V192 PolarHBondContact O-N 3.33Å; E190-V192 VanDerWaalsContact O-N 3.16Å; V192-L194 PolarHBondContact O-N 3.08Å
193	V	75.3	Confident	71	Confident	116 Å²	116	101.6 Å²	101.6	70%	0.703	52%	0.521	S	S	*	.			trans	-75.1	116.8	176.6	-176.6	0	0	0	0	109.1	E191 E195	E191-V193 PolarHBondContact O-N 3.17Å; V193-E195 PolarHBondContact O-N 3.3Å
194	L	86	Confident	73	Confident	19 Å²	19	99 Å²	99	10%	0.099	51%	0.507	C	S	.	.			trans	-78.6	102.1	174.5	-64.9	175.4	0	0	0	110	V171 L175 V192 H196 L325	V171-L194 HydrophobicContact CG1-CD2 4.05Å; L175-L194 HydrophobicContact CB-CD2 4.33Å; V192-L194 PolarHBondContact O-N 3.08Å; L194-H196 PolarHBondContact O-CD2 3.36Å; L194-H196 PolarHBondContact O-N 2.97Å; L194-L325 HydrophobicContact CD1-CD2 3.72Å
195	E	85.9	Confident	75.3	Confident	179 Å²	179	91 Å²	91	84%	0.836	47%	0.47	S	S	*	.			trans	-74.1	108.7	175.1	-67.8	-177.2	-176.9	0	0	111.2	V193	V193-E195 PolarHBondContact O-N 3.3Å
196	H	90.3	Very high	77.8	Confident	22 Å²	22	85.9 Å²	85.9	10%	0.102	44%	0.442	C	S	.	.			trans	-85.8	-29.1	-178	-73.2	-62.2	0	0	0	114.6	L194 R229 S328 E329 L332	L194-H196 PolarHBondContact O-CD2 3.36Å; L194-H196 PolarHBondContact O-N 2.97Å; H196-R229 PolarHBondContact ND1-NH2 3.12Å; H196-S328 PolarHBondContact CD2-OG 3.01Å; H196-S328 PolarHBondContact NE2-OG 3.35Å; H196-E329 IonicContact CE1-OE1 3.8Å; H196-E329 IonicContact ND1-OE1 3.87Å; H196-L332 HydrophobicContact CB-CD2 3.71Å
197	L	92.6	Very high	80.3	Confident	14 Å²	14	83.7 Å²	83.7	7%	0.073	44%	0.435	C	S	.	.	S	Bend	trans	-143	144.5	-173.7	-64.4	174.5	0	0	0	108.9	L164 L202 I205 L332	L164-L197 HydrophobicContact CD2-CD1 4.38Å; L197-L202 HydrophobicContact CB-CB 4.48Å; L197-L202 HydrophobicContact CD1-CD1 4.4Å; L197-I205 HydrophobicContact CD1-CD1 3.85Å; L197-L332 HydrophobicContact CD1-CD1 4.24Å; L197-L332 HydrophobicContact CD1-CD2 4.32Å
198	P	94.4	Very high	82.8	Confident	63 Å²	63	73.9 Å²	73.9	41%	0.409	39%	0.389	S	S	.	.			trans	-61.6	140.1	170.1	-20.2	32.1	0	0	0	111.2	Y167 A200 V201 L202	Y167-P198 HydrophobicContact CD1-CG 3.93Å; Y167-P198 HydrophobicContact CE1-CG 4.31Å; P198-A200 VanDerWaalsContact C-N 3.32Å; P198-A200 PolarHBondContact O-N 2.98Å; P198-V201 HydrophobicContact CB-CB 4.49Å; P198-V201 HydrophobicContact CB-CG2 4.2Å; P198-V201 HydrophobicContact CG-CG2 4.27Å; P198-V201 WeakPolarHBondContact O-CA 3.38Å; P198-V201 WeakPolarHBondContact O-CB 3.47Å; P198-V201 PolarHBondContact O-N 3.34Å; P198-L202 PolarHBondContact O-N 3.47Å
199	E	92.1	Very high	85.2	Confident	119 Å²	119	66.2 Å²	66.2	56%	0.556	35%	0.349	S	S	*	.	H	α-helix	trans	-49.8	-47.2	-175.7	-175.6	56.7	-146.7	0	0	113.6	V201 L202 Q203	E199-V201 VanDerWaalsContact C-N 3.27Å; E199-V201 PolarHBondContact O-N 3.33Å; E199-L202 WeakPolarHBondContact O-CB 3.42Å; E199-L202 PolarHBondContact O-N 3.29Å; E199-L202 VanDerWaalsContact O-N 3.15Å; E199-Q203 WeakPolarHBondContact O-CG 3.44Å; E199-Q203 PolarHBondContact O-N 3.27Å; E199-Q203 PolarHBondContact OE1-NE2 3.15Å
200	A	92.3	Very high	87.3	Confident	72 Å²	72	62.8 Å²	62.8	60%	0.595	34%	0.344	S	S	*	.	H	α-helix	trans	-60.1	-36.8	178.8	0	0	0	0	0	112.9	P198 D204	P198-A200 VanDerWaalsContact C-N 3.32Å; P198-A200 PolarHBondContact O-N 2.98Å; A200-D204 PolarHBondContact O-N 3.15Å
201	V	95.1	Very high	89.3	Confident	12 Å²	12	55.4 Å²	55.4	7%	0.073	31%	0.308	C	S	.	.	H	α-helix	trans	-74.5	-36.6	178.5	177.1	0	0	0	0	110.8	L163 Y167 P198 E199 D204 I205	L163-V201 HydrophobicContact CB-CG1 4.19Å; L163-V201 HydrophobicContact CD2-CG1 4.3Å; Y167-V201 HydrophobicContact CD1-CG2 4.33Å; Y167-V201 HydrophobicContact CD2-CB 4.34Å; Y167-V201 HydrophobicContact CD2-CG1 3.62Å; Y167-V201 HydrophobicContact CD2-CG2 3.83Å; Y167-V201 HydrophobicContact CE1-CG2 4.17Å; Y167-V201 HydrophobicContact CE2-CG1 4.12Å; Y167-V201 HydrophobicContact CE2-CG2 3.62Å; Y167-V201 HydrophobicContact CG-CG1 4.1Å; Y167-V201 HydrophobicContact CG-CG2 4.17Å; P198-V201 HydrophobicContact CB-CB 4.49Å; P198-V201 HydrophobicContact CB-CG2 4.2Å; P198-V201 HydrophobicContact CG-CG2 4.27Å; P198-V201 WeakPolarHBondContact O-CA 3.38Å; P198-V201 WeakPolarHBondContact O-CB 3.47Å; P198-V201 PolarHBondContact O-N 3.34Å; E199-V201 VanDerWaalsContact C-N 3.27Å; E199-V201 PolarHBondContact O-N 3.33Å; V201-D204 PolarHBondContact O-N 2.94Å; V201-I205 HydrophobicContact CG1-CD1 3.79Å; V201-I205 HydrophobicContact CG1-CG1 4.42Å; V201-I205 WeakPolarHBondContact O-CB 3.41Å; V201-I205 VanDerWaalsContact O-CG1 3.26Å; V201-I205 WeakPolarHBondContact O-CG1 3.44Å; V201-I205 PolarHBondContact O-N 3.37Å
202	L	95.3	Very high	91	Very high	11 Å²	11	47.4 Å²	47.4	6%	0.058	27%	0.271	C	S	.	.	H	α-helix	trans	-61.5	-46.8	175.4	177.7	56.3	0	0	0	110.8	L197 P198 E199 D204 I205 I206 L332 E335 I336	L197-L202 HydrophobicContact CB-CB 4.48Å; L197-L202 HydrophobicContact CD1-CD1 4.4Å; P198-L202 PolarHBondContact O-N 3.47Å; E199-L202 WeakPolarHBondContact O-CB 3.42Å; E199-L202 PolarHBondContact O-N 3.29Å; E199-L202 VanDerWaalsContact O-N 3.15Å; L202-D204 PolarHBondContact O-N 2.89Å; L202-I205 PolarHBondContact O-N 2.7Å; L202-I205 VanDerWaalsContact O-N 3.16Å; L202-I206 HydrophobicContact CD1-CD1 3.98Å; L202-I206 HydrophobicContact CD1-CG1 4.16Å; L202-I206 HydrophobicContact CG-CD1 3.89Å; L202-I206 HydrophobicContact CG-CG1 4.5Å; L202-I206 VanDerWaalsContact O-CG1 3.29Å; L202-I206 WeakPolarHBondContact O-CG1 3.5Å; L202-I206 PolarHBondContact O-N 3.24Å; L202-L332 HydrophobicContact CD1-CD1 3.71Å; L202-L332 HydrophobicContact CD2-CD1 4.42Å; L202-E335 WeakPolarHBondContact CD2-OE2 3.48Å; L202-I336 HydrophobicContact CD1-CD1 3.84Å; L202-I336 HydrophobicContact CD1-CG1 3.93Å
203	Q	94.9	Very high	92.1	Very high	83 Å²	83	48 Å²	48	39%	0.388	28%	0.275	S	S	.	.	H	α-helix	trans	-59.2	-45.3	175.7	-65.5	-55.9	-36.3	0	0	112.1	E199 I205 I206 C207	E199-Q203 WeakPolarHBondContact O-CG 3.44Å; E199-Q203 PolarHBondContact O-N 3.27Å; E199-Q203 PolarHBondContact OE1-NE2 3.15Å; Q203-I205 VanDerWaalsContact C-N 3.31Å; Q203-I205 PolarHBondContact O-N 2.74Å; Q203-I206 PolarHBondContact O-N 2.98Å; Q203-C207 WeakPolarHBondContact O-CB 3.3Å; Q203-C207 PolarHBondContact O-N 2.94Å; Q203-C207 PolarHBondContact O-SG 3.35Å; Q203-C207 VanDerWaalsContact O-SG 3.38Å
204	D	95.2	Very high	92.8	Very high	50 Å²	50	48.9 Å²	48.9	27%	0.267	27%	0.271	S	S	.	.	H	α-helix	trans	-58.1	-43.9	175.2	-77.1	-13.7	0	0	0	111.7	L115 L163 A200 V201 L202 C207 I208	L115-D204 HydrophobicContact CD2-CB 3.89Å; L115-D204 WeakPolarHBondContact CD2-O 3.36Å; L163-D204 HydrophobicContact CD1-CB 3.98Å; A200-D204 PolarHBondContact O-N 3.15Å; V201-D204 PolarHBondContact O-N 2.94Å; L202-D204 PolarHBondContact O-N 2.89Å; D204-C207 PolarHBondContact O-N 3.3Å; D204-I208 WeakPolarHBondContact O-CD1 3.3Å; D204-I208 WeakPolarHBondContact O-CG1 3.28Å; D204-I208 PolarHBondContact O-N 3.21Å
205	I	96.1	Very high	92.8	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-65.8	-41	178.9	-72.7	168.1	0	0	0	111.5	F160 L163 L164 L197 V201 L202 Q203 I208 S209 I336	F160-I205 HydrophobicContact CD2-CG2 4.09Å; F160-I205 HydrophobicContact CE2-CG2 3.59Å; F160-I205 HydrophobicContact CZ-CG2 4.4Å; L163-I205 HydrophobicContact CB-CD1 4.04Å; L163-I205 HydrophobicContact CB-CG1 4.01Å; L163-I205 HydrophobicContact CD1-CG1 4.06Å; L164-I205 HydrophobicContact CD2-CD1 3.79Å; L164-I205 HydrophobicContact CG-CD1 4.03Å; L197-I205 HydrophobicContact CD1-CD1 3.85Å; V201-I205 HydrophobicContact CG1-CD1 3.79Å; V201-I205 HydrophobicContact CG1-CG1 4.42Å; V201-I205 WeakPolarHBondContact O-CB 3.41Å; V201-I205 VanDerWaalsContact O-CG1 3.26Å; V201-I205 WeakPolarHBondContact O-CG1 3.44Å; V201-I205 PolarHBondContact O-N 3.37Å; L202-I205 PolarHBondContact O-N 2.7Å; L202-I205 VanDerWaalsContact O-N 3.16Å; Q203-I205 VanDerWaalsContact C-N 3.31Å; Q203-I205 PolarHBondContact O-N 2.74Å; I205-I208 PolarHBondContact O-N 3.43Å; I205-S209 WeakPolarHBondContact O-CB 3.43Å; I205-S209 PolarHBondContact O-N 2.98Å; I205-I336 HydrophobicContact CG2-CD1 3.82Å; I205-I336 HydrophobicContact CG2-CG1 4.01Å; I205-I336 HydrophobicContact CG2-CG2 3.78Å
206	I	95.4	Very high	92.4	Very high	46 Å²	46	44 Å²	44	24%	0.236	25%	0.252	C	S	.	.	H	α-helix	trans	-62.4	-47.3	176.3	-69.3	167.5	0	0	0	109.8	L202 Q203 I208 S209 G210 E335 I336	L202-I206 HydrophobicContact CD1-CD1 3.98Å; L202-I206 HydrophobicContact CD1-CG1 4.16Å; L202-I206 HydrophobicContact CG-CD1 3.89Å; L202-I206 HydrophobicContact CG-CG1 4.5Å; L202-I206 VanDerWaalsContact O-CG1 3.29Å; L202-I206 WeakPolarHBondContact O-CG1 3.5Å; L202-I206 PolarHBondContact O-N 3.24Å; Q203-I206 PolarHBondContact O-N 2.98Å; I206-I208 PolarHBondContact O-N 2.92Å; I206-S209 PolarHBondContact O-N 3.4Å; I206-G210 PolarHBondContact O-N 3.2Å; I206-E335 HydrophobicContact CD1-CB 4.16Å; I206-I336 HydrophobicContact CG1-CG1 4.16Å
207	C	94.8	Very high	91.5	Very high	55 Å²	55	50.2 Å²	50.2	37%	0.372	28%	0.275	S	S	.	.	H	α-helix	trans	-60.3	-46.4	177.3	-72.5	0	0	0	0	112	L115 L119 Q203 D204 W211	L115-C207 HydrophobicContact CD2-CB 3.81Å; L119-C207 HydrophobicContact CD1-CB 4.49Å; Q203-C207 WeakPolarHBondContact O-CB 3.3Å; Q203-C207 PolarHBondContact O-N 2.94Å; Q203-C207 PolarHBondContact O-SG 3.35Å; Q203-C207 VanDerWaalsContact O-SG 3.38Å; D204-C207 PolarHBondContact O-N 3.3Å; C207-W211 WeakPolarHBondContact O-CB 3.19Å; C207-W211 PolarHBondContact O-N 2.92Å
208	I	94.7	Very high	90.7	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-64.9	-43.3	177.4	-63.6	163.1	0	0	0	110.7	L115 L156 E159 F160 L163 D204 I205 I206 W211 L212	L115-I208 HydrophobicContact CD1-CD1 4.05Å; L115-I208 HydrophobicContact CD1-CG1 3.61Å; L115-I208 HydrophobicContact CD2-CD1 4.19Å; L115-I208 HydrophobicContact CD2-CG1 3.8Å; L115-I208 HydrophobicContact CG-CG1 4.37Å; L156-I208 HydrophobicContact CB-CG2 4.28Å; L156-I208 HydrophobicContact CD2-CG1 4.32Å; E159-I208 HydrophobicContact CB-CD1 4.43Å; E159-I208 HydrophobicContact CG-CD1 4.12Å; F160-I208 HydrophobicContact CB-CG2 3.85Å; F160-I208 HydrophobicContact CD2-CB 4.36Å; F160-I208 HydrophobicContact CD2-CG2 4.1Å; F160-I208 HydrophobicContact CG-CG2 4.41Å; L163-I208 HydrophobicContact CD1-CD1 3.98Å; D204-I208 WeakPolarHBondContact O-CD1 3.3Å; D204-I208 WeakPolarHBondContact O-CG1 3.28Å; D204-I208 PolarHBondContact O-N 3.21Å; I205-I208 PolarHBondContact O-N 3.43Å; I206-I208 PolarHBondContact O-N 2.92Å; I208-W211 PolarHBondContact O-N 2.99Å; I208-L212 HydrophobicContact CG2-CD1 3.68Å; I208-L212 HydrophobicContact CG2-CG 4.07Å; I208-L212 WeakPolarHBondContact O-CB 3.39Å; I208-L212 VanDerWaalsContact O-CG 3.27Å; I208-L212 WeakPolarHBondContact O-CG 3.37Å; I208-L212 PolarHBondContact O-N 3.42Å
209	S	94.3	Very high	90.1	Very high	2 Å²	2	54.7 Å²	54.7	1%	0.014	29%	0.292	C	S	.	.	H	α-helix	trans	-59.3	-51.2	177.9	-175.9	0	0	0	0	111.2	I205 I206 W211 L212 V213 F221 I336	I205-S209 WeakPolarHBondContact O-CB 3.43Å; I205-S209 PolarHBondContact O-N 2.98Å; I206-S209 PolarHBondContact O-N 3.4Å; S209-W211 VanDerWaalsContact C-N 3.29Å; S209-W211 PolarHBondContact O-N 2.69Å; S209-L212 PolarHBondContact O-N 3.44Å; S209-L212 VanDerWaalsContact O-N 3.15Å; S209-V213 WeakPolarHBondContact O-CG2 3.39Å; S209-V213 PolarHBondContact O-N 3.18Å; S209-F221 VanDerWaalsContact OG-CE2 3.31Å; S209-F221 WeakPolarHBondContact OG-CE2 3.4Å; S209-I336 WeakPolarHBondContact CB-O 3.37Å; S209-I336 PolarHBondContact OG-O 3.34Å
210	G	92.9	Very high	89.9	Confident	41 Å²	41	52.9 Å²	52.9	42%	0.423	29%	0.287	S	S	.	.	H	α-helix	trans	-56.5	-43	176.8	0	0	0	0	0	112.3	I206 V213 E214	I206-G210 PolarHBondContact O-N 3.2Å; G210-V213 PolarHBondContact O-N 2.98Å; G210-E214 PolarHBondContact O-N 3.01Å
211	W	93.8	Very high	89.8	Confident	27 Å²	27	49.9 Å²	49.9	10%	0.102	26%	0.26	C	S	.	.	H	α-helix	trans	-65	-43.1	176.5	-168.8	89.9	0	0	0	112.7	L119 I122 F149 K153 L156 C207 I208 S209 V213 E214 Y215	L119-W211 HydrophobicContact CD2-CB 4.37Å; L119-W211 HydrophobicContact CD2-CD2 4.43Å; L119-W211 HydrophobicContact CD2-CG 3.93Å; I122-W211 HydrophobicContact CG2-CH2 4.15Å; I122-W211 HydrophobicContact CG2-CZ2 3.38Å; F149-W211 HydrophobicContact CE2-CH2 4.29Å; F149-W211 AromaticContact CE2-CZ2 3.86Å; F149-W211 HydrophobicContact CE2-CZ2 3.86Å; F149-W211 AromaticContact CZ-CH2 3.92Å; F149-W211 HydrophobicContact CZ-CH2 3.92Å; F149-W211 AromaticContact CZ-CZ2 3.75Å; F149-W211 HydrophobicContact CZ-CZ2 3.75Å; K153-W211 HydrophobicContact CB-CH2 3.94Å; K153-W211 HydrophobicContact CB-CZ3 3.98Å; K153-W211 HydrophobicContact CD-CH2 4.42Å; K153-W211 HydrophobicContact CD-CZ3 4.33Å; K153-W211 HydrophobicContact CG-CH2 4.32Å; K153-W211 HydrophobicContact CG-CZ3 3.98Å; L156-W211 HydrophobicContact CD1-CD2 3.69Å; L156-W211 HydrophobicContact CD1-CE3 3.35Å; L156-W211 HydrophobicContact CD1-CG 4.45Å; L156-W211 HydrophobicContact CD1-CH2 4.06Å; L156-W211 HydrophobicContact CD1-CZ2 4.35Å; L156-W211 HydrophobicContact CD1-CZ3 3.55Å; C207-W211 WeakPolarHBondContact O-CB 3.19Å; C207-W211 PolarHBondContact O-N 2.92Å; I208-W211 PolarHBondContact O-N 2.99Å; S209-W211 VanDerWaalsContact C-N 3.29Å; S209-W211 PolarHBondContact O-N 2.69Å; W211-V213 VanDerWaalsContact C-N 3.28Å; W211-V213 PolarHBondContact O-N 2.77Å; W211-E214 PolarHBondContact O-N 3.14Å; W211-Y215 AromaticContact CD1-CD2 3.74Å; W211-Y215 AromaticContact CD2-CD2 3.94Å; W211-Y215 HydrophobicContact CD2-CD2 3.94Å; W211-Y215 AromaticContact CE2-CD2 3.48Å; W211-Y215 VanDerWaalsContact CE2-CD2 3.48Å; W211-Y215 HydrophobicContact CG-CD2 4.07Å; W211-Y215 HydrophobicContact CH2-CG 4.48Å; W211-Y215 AromaticContact CZ2-CD2 3.88Å; W211-Y215 HydrophobicContact CZ2-CD2 3.88Å; W211-Y215 AromaticContact CZ2-CG 3.97Å; W211-Y215 HydrophobicContact CZ2-CG 3.97Å; W211-Y215 AromaticContact NE1-CD2 3.38Å; W211-Y215 AromaticContact NE1-CE2 3.79Å; W211-Y215 WeakPolarHBondContact O-CD2 3.38Å; W211-Y215 PolarHBondContact O-N 3.03Å
212	L	92.4	Very high	89.8	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.016	26%	0.258	C	S	.	.	H	α-helix	trans	-69.2	-24.1	177.9	-70.6	174.9	0	0	0	112.9	K153 L156 E157 F160 I208 S209 G216 F221	K153-L212 HydrophobicContact CG-CD2 4.47Å; L156-L212 HydrophobicContact CB-CD2 4.48Å; E157-L212 HydrophobicContact CG-CD1 4.03Å; E157-L212 HydrophobicContact CG-CD2 3.55Å; E157-L212 HydrophobicContact CG-CG 4.47Å; F160-L212 HydrophobicContact CB-CD1 4.5Å; I208-L212 HydrophobicContact CG2-CD1 3.68Å; I208-L212 HydrophobicContact CG2-CG 4.07Å; I208-L212 WeakPolarHBondContact O-CB 3.39Å; I208-L212 VanDerWaalsContact O-CG 3.27Å; I208-L212 WeakPolarHBondContact O-CG 3.37Å; I208-L212 PolarHBondContact O-N 3.42Å; S209-L212 PolarHBondContact O-N 3.44Å; S209-L212 VanDerWaalsContact O-N 3.15Å; L212-G216 WeakPolarHBondContact O-CA 3.38Å; L212-G216 PolarHBondContact O-N 2.96Å; L212-F221 HydrophobicContact CB-CD1 3.93Å; L212-F221 HydrophobicContact CB-CE1 3.99Å; L212-F221 HydrophobicContact CB-CG 4.38Å; L212-F221 HydrophobicContact CD1-CB 3.95Å; L212-F221 HydrophobicContact CD1-CD1 4.26Å; L212-F221 HydrophobicContact CD1-CD2 4.44Å; L212-F221 HydrophobicContact CD1-CG 3.96Å
213	V	91.4	Very high	89.7	Confident	74 Å²	74	52.2 Å²	52.2	45%	0.448	27%	0.272	S	S	.	.	H	α-helix	trans	-69.8	-38.8	174.2	171.2	0	0	0	0	111	S209 G210 W211 F221 M222 P338	S209-V213 WeakPolarHBondContact O-CG2 3.39Å; S209-V213 PolarHBondContact O-N 3.18Å; G210-V213 PolarHBondContact O-N 2.98Å; W211-V213 VanDerWaalsContact C-N 3.28Å; W211-V213 PolarHBondContact O-N 2.77Å; V213-F221 HydrophobicContact CG2-CE1 4.19Å; V213-F221 HydrophobicContact CG2-CZ 3.71Å; V213-M222 HydrophobicContact CG2-CE 4.32Å; V213-P338 HydrophobicContact CB-CG 4.3Å; V213-P338 HydrophobicContact CG1-CG 4Å; V213-P338 HydrophobicContact CG2-CG 3.33Å
214	E	88.1	Confident	89.8	Confident	134 Å²	134	49.6 Å²	49.6	63%	0.626	26%	0.262	S	S	*	.	H	α-helix	trans	-81.8	-41.6	-177.9	-166.3	178.6	167.2	0	0	112.4	G210 W211	G210-E214 PolarHBondContact O-N 3.01Å; W211-E214 PolarHBondContact O-N 3.14Å
215	Y	86.1	Confident	89.9	Confident	68 Å²	68	47.2 Å²	47.2	27%	0.267	25%	0.249	S	C	.	.	H	α-helix	trans	-115.5	1.2	-171.3	-55.9	-64.1	0	0	0	114.2	F149 K153 W211	F149-Y215 HydrophobicContact CZ-CG 4.43Å; K153-Y215 WeakPolarHBondContact CD-O 3.15Å; K153-Y215 WeakPolarHBondContact CE-O 3.22Å; K153-Y215 PolarHBondContact NZ-O 3.46Å; W211-Y215 AromaticContact CD1-CD2 3.74Å; W211-Y215 AromaticContact CD2-CD2 3.94Å; W211-Y215 HydrophobicContact CD2-CD2 3.94Å; W211-Y215 AromaticContact CE2-CD2 3.48Å; W211-Y215 VanDerWaalsContact CE2-CD2 3.48Å; W211-Y215 HydrophobicContact CG-CD2 4.07Å; W211-Y215 HydrophobicContact CH2-CG 4.48Å; W211-Y215 AromaticContact CZ2-CD2 3.88Å; W211-Y215 HydrophobicContact CZ2-CD2 3.88Å; W211-Y215 AromaticContact CZ2-CG 3.97Å; W211-Y215 HydrophobicContact CZ2-CG 3.97Å; W211-Y215 AromaticContact NE1-CD2 3.38Å; W211-Y215 AromaticContact NE1-CE2 3.79Å; W211-Y215 WeakPolarHBondContact O-CD2 3.38Å; W211-Y215 PolarHBondContact O-N 3.03Å
216	G	78.2	Confident	89.9	Confident	26 Å²	26	48.9 Å²	48.9	27%	0.268	26%	0.256	S	S	.	.			trans	-64.3	154.8	178.4	0	0	0	0	0	113.7	L212	L212-G216 WeakPolarHBondContact O-CA 3.38Å; L212-G216 PolarHBondContact O-N 2.96Å
217	R	71.3	Confident	90	Very high	154 Å²	154	51.7 Å²	51.7	58%	0.581	27%	0.268	S	S	*	.	S	Bend	trans	-86.1	-31	-180	-108.9	161.8	-170.4	-165.1	2	109.5	E150 K153	E150-R217 VanDerWaalsContact CG-NH2 3.27Å; E150-R217 IonicContact OE1-CZ 3.21Å; E150-R217 VanDerWaalsContact OE1-CZ 3.28Å; E150-R217 IonicContact OE1-NE 3.25Å; E150-R217 PolarHBondContact OE1-NE 3.19Å; E150-R217 IonicContact OE1-NH2 2.59Å; E150-R217 PolarHBondContact OE1-NH2 3.41Å; E150-R217 IonicContact OE2-CZ 2.66Å; E150-R217 IonicContact OE2-NE 2.61Å; E150-R217 PolarHBondContact OE2-NE 3.47Å; E150-R217 IonicContact OE2-NH2 2.71Å; E150-R217 PolarHBondContact OE2-NH2 3.5Å; E150-R217 VanDerWaalsContact OE2-NH2 3.15Å; K153-R217 VanDerWaalsContact NZ-CA 3.34Å; K153-R217 VanDerWaalsContact NZ-CB 3.34Å
218	N	76.8	Confident	90.1	Very high	70 Å²	70	50.1 Å²	50.1	37%	0.374	26%	0.256	S	S	.	.	S	Bend	trans	-154.6	178.8	-178.6	60.2	31.8	0	0	0	109.1	D220	N218-D220 VanDerWaalsContact C-N 3.29Å; N218-D220 VanDerWaalsContact CG-OD2 3.24Å; N218-D220 VanDerWaalsContact ND2-CG 3.29Å; N218-D220 PolarHBondContact ND2-OD2 2.9Å; N218-D220 WeakPolarHBondContact OD1-CB 3.41Å; N218-D220 VanDerWaalsContact OD1-CG 3.26Å; N218-D220 PolarHBondContact OD1-N 3.26Å; N218-D220 PolarHBondContact OD1-OD2 2.99Å
219	Q	81.3	Confident	90.3	Very high	100 Å²	100	50.1 Å²	50.1	47%	0.467	26%	0.256	S	S	.	.	S	Bend	trans	-95	22.8	179.2	-63	168.2	1.1	0	0	111.5	F221 M222 H341	Q219-F221 VanDerWaalsContact C-N 3.27Å; Q219-F221 PolarHBondContact O-N 3.23Å; Q219-M222 HydrophobicContact CB-CE 4.39Å; Q219-M222 HydrophobicContact CB-SD 4.16Å; Q219-M222 HydrophobicContact CG-CE 4.28Å; Q219-M222 WeakPolarHBondContact O-CB 3.34Å; Q219-M222 PolarHBondContact O-N 2.91Å; Q219-M222 VanDerWaalsContact O-N 3.11Å; Q219-H341 PolarHBondContact NE2-CE1 2.9Å; Q219-H341 VanDerWaalsContact NE2-CE1 3.29Å; Q219-H341 PolarHBondContact NE2-NE2 3.32Å; Q219-H341 VanDerWaalsContact NE2-NE2 3.2Å; Q219-H341 PolarHBondContact OE1-CE1 3.28Å; Q219-H341 PolarHBondContact OE1-ND1 3.46Å
220	D	87.2	Confident	90.5	Very high	82 Å²	82	50.3 Å²	50.3	44%	0.439	26%	0.257	S	S	.	.	H	α-helix	trans	-68.6	-25.7	-172.5	-71.8	-14.8	0	0	0	113	N218 M222 N223 V224	N218-D220 VanDerWaalsContact C-N 3.29Å; N218-D220 VanDerWaalsContact CG-OD2 3.24Å; N218-D220 VanDerWaalsContact ND2-CG 3.29Å; N218-D220 PolarHBondContact ND2-OD2 2.9Å; N218-D220 WeakPolarHBondContact OD1-CB 3.41Å; N218-D220 VanDerWaalsContact OD1-CG 3.26Å; N218-D220 PolarHBondContact OD1-N 3.26Å; N218-D220 PolarHBondContact OD1-OD2 2.99Å; D220-M222 PolarHBondContact O-N 3.03Å; D220-N223 WeakPolarHBondContact O-CA 3.27Å; D220-N223 VanDerWaalsContact O-CB 3.27Å; D220-N223 WeakPolarHBondContact O-CB 3.03Å; D220-N223 PolarHBondContact O-N 3.09Å; D220-N223 PolarHBondContact OD1-ND2 3.24Å; D220-V224 PolarHBondContact O-N 3.31Å
221	F	91.8	Very high	90.7	Very high	8 Å²	8	49.9 Å²	49.9	4%	0.035	25%	0.248	C	C	.	.	H	α-helix	trans	-60.9	-31	174.5	81.1	-90.4	0	0	0	111.5	F160 S209 L212 V213 Q219 N223 V224 Y225 I337	F160-F221 HydrophobicContact CD1-CB 4.17Å; F160-F221 HydrophobicContact CD1-CD2 4.46Å; F160-F221 HydrophobicContact CE1-CB 4.16Å; F160-F221 AromaticContact CE1-CD2 3.88Å; F160-F221 HydrophobicContact CE1-CD2 3.88Å; F160-F221 WeakPolarHBondContact CE1-O 3.47Å; F160-F221 HydrophobicContact CE2-CD2 4.12Å; F160-F221 AromaticContact CZ-CD2 3.7Å; F160-F221 HydrophobicContact CZ-CD2 3.7Å; F160-F221 HydrophobicContact CZ-CE2 4.36Å; S209-F221 VanDerWaalsContact OG-CE2 3.31Å; S209-F221 WeakPolarHBondContact OG-CE2 3.4Å; L212-F221 HydrophobicContact CB-CD1 3.93Å; L212-F221 HydrophobicContact CB-CE1 3.99Å; L212-F221 HydrophobicContact CB-CG 4.38Å; L212-F221 HydrophobicContact CD1-CB 3.95Å; L212-F221 HydrophobicContact CD1-CD1 4.26Å; L212-F221 HydrophobicContact CD1-CD2 4.44Å; L212-F221 HydrophobicContact CD1-CG 3.96Å; V213-F221 HydrophobicContact CG2-CE1 4.19Å; V213-F221 HydrophobicContact CG2-CZ 3.71Å; Q219-F221 VanDerWaalsContact C-N 3.27Å; Q219-F221 PolarHBondContact O-N 3.23Å; F221-N223 VanDerWaalsContact C-N 3.31Å; F221-V224 WeakPolarHBondContact O-CB 3.47Å; F221-V224 PolarHBondContact O-N 2.61Å; F221-Y225 PolarHBondContact O-N 3.15Å; F221-I337 HydrophobicContact CE2-CD1 4.38Å
222	M	94.1	Very high	90.9	Very high	7 Å²	7	49.5 Å²	49.5	3%	0.034	25%	0.247	C	C	.	.	H	α-helix	trans	-67.3	-35.8	173.5	-53.7	-177.3	-172.7	0	0	110.9	V213 Q219 D220 Y225 F226 I337 P338 H341	V213-M222 HydrophobicContact CG2-CE 4.32Å; Q219-M222 HydrophobicContact CB-CE 4.39Å; Q219-M222 HydrophobicContact CB-SD 4.16Å; Q219-M222 HydrophobicContact CG-CE 4.28Å; Q219-M222 WeakPolarHBondContact O-CB 3.34Å; Q219-M222 PolarHBondContact O-N 2.91Å; Q219-M222 VanDerWaalsContact O-N 3.11Å; D220-M222 PolarHBondContact O-N 3.03Å; M222-Y225 WeakPolarHBondContact O-CB 3.49Å; M222-Y225 PolarHBondContact O-N 3.3Å; M222-F226 WeakPolarHBondContact O-CD1 3.25Å; M222-F226 PolarHBondContact O-N 3.45Å; M222-I337 HydrophobicContact CB-CD1 4.35Å; M222-I337 HydrophobicContact CG-CD1 4.1Å; M222-I337 HydrophobicContact SD-CG2 4.29Å; M222-P338 HydrophobicContact CE-CG 3.96Å; M222-H341 HydrophobicContact CE-CB 4.21Å; M222-H341 HydrophobicContact SD-CB 3.58Å; M222-H341 VanDerWaalsContact SD-CB 3.58Å
223	N	93.9	Very high	91.2	Very high	65 Å²	65	49.4 Å²	49.4	35%	0.348	25%	0.247	S	C	.	.	H	α-helix	trans	-63.6	-44	172.8	-60.4	-33.4	0	0	0	111.2	D220 F221 Y225 F226 Q227	D220-N223 WeakPolarHBondContact O-CA 3.27Å; D220-N223 VanDerWaalsContact O-CB 3.27Å; D220-N223 WeakPolarHBondContact O-CB 3.03Å; D220-N223 PolarHBondContact O-N 3.09Å; D220-N223 PolarHBondContact OD1-ND2 3.24Å; F221-N223 VanDerWaalsContact C-N 3.31Å; N223-Y225 VanDerWaalsContact C-N 3.32Å; N223-Y225 PolarHBondContact O-N 2.89Å; N223-F226 VanDerWaalsContact CA-CE1 3.4Å; N223-F226 HydrophobicContact CB-CE1 3.96Å; N223-F226 HydrophobicContact CB-CZ 4.25Å; N223-F226 VanDerWaalsContact OD1-CE1 3.22Å; N223-F226 WeakPolarHBondContact OD1-CE1 3.36Å; N223-Q227 VanDerWaalsContact O-CB 3.3Å; N223-Q227 WeakPolarHBondContact O-CB 3.36Å; N223-Q227 WeakPolarHBondContact O-CG 3.09Å; N223-Q227 PolarHBondContact O-N 2.89Å
224	V	95.4	Very high	91.5	Very high	28 Å²	28	46.3 Å²	46.3	17%	0.17	23%	0.227	C	C	.	.	H	α-helix	trans	-60.9	-43.4	174.9	174.9	0	0	0	0	111	R161 D220 F221 I228	R161-V224 HydrophobicContact CB-CG1 3.92Å; R161-V224 HydrophobicContact CG-CG1 3.7Å; D220-V224 PolarHBondContact O-N 3.31Å; F221-V224 WeakPolarHBondContact O-CB 3.47Å; F221-V224 PolarHBondContact O-N 2.61Å; V224-I228 HydrophobicContact CG1-CD1 3.73Å; V224-I228 WeakPolarHBondContact O-CG1 3.48Å; V224-I228 PolarHBondContact O-N 3.49Å; V224-I228 VanDerWaalsContact O-N 3.11Å
225	Y	97.4	Very high	91.9	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-57	-59.8	177.4	176.3	-95.4	0	0	0	111.4	F160 L164 F221 M222 N223 Q227 I228 R229 L333 I336 I337 T345 L349	F160-Y225 HydrophobicContact CZ-CD2 4.27Å; L164-Y225 HydrophobicContact CD1-CD2 3.83Å; L164-Y225 HydrophobicContact CD2-CD2 3.93Å; L164-Y225 HydrophobicContact CD2-CE2 4.12Å; F221-Y225 PolarHBondContact O-N 3.15Å; M222-Y225 WeakPolarHBondContact O-CB 3.49Å; M222-Y225 PolarHBondContact O-N 3.3Å; N223-Y225 VanDerWaalsContact C-N 3.32Å; N223-Y225 PolarHBondContact O-N 2.89Å; Y225-Q227 VanDerWaalsContact C-N 3.29Å; Y225-Q227 PolarHBondContact O-N 3.36Å; Y225-I228 PolarHBondContact O-N 3.39Å; Y225-R229 HydrophobicContact CD1-CG 4.39Å; Y225-R229 HydrophobicContact CD2-CG 4.18Å; Y225-R229 HydrophobicContact CE1-CG 4.02Å; Y225-R229 HydrophobicContact CE2-CG 3.78Å; Y225-R229 HydrophobicContact CG-CG 4.46Å; Y225-R229 WeakPolarHBondContact O-CG 3.45Å; Y225-R229 PolarHBondContact O-N 3.33Å; Y225-L333 HydrophobicContact CE1-CB 4.14Å; Y225-L333 HydrophobicContact CE1-CD1 4.09Å; Y225-L333 HydrophobicContact CE1-CG 4.14Å; Y225-L333 WeakPolarHBondContact OH-CA 3.47Å; Y225-I336 HydrophobicContact CD2-CD1 4.43Å; Y225-I336 HydrophobicContact CD2-CG2 4.33Å; Y225-I336 HydrophobicContact CE2-CB 4.47Å; Y225-I336 HydrophobicContact CE2-CD1 3.57Å; Y225-I336 HydrophobicContact CE2-CG2 4.32Å; Y225-I337 HydrophobicContact CD1-CD1 4Å; Y225-I337 HydrophobicContact CD1-CG1 4.07Å; Y225-I337 HydrophobicContact CE1-CG1 4.18Å; Y225-I337 HydrophobicContact CG-CD1 4.11Å; Y225-T345 HydrophobicContact CD1-CG2 4.18Å; Y225-L349 HydrophobicContact CE1-CD1 4Å
226	F	96.4	Very high	92.5	Very high	36 Å²	36	43.3 Å²	43.3	16%	0.158	21%	0.211	C	C	.	.	H	α-helix	trans	-65.9	-33.3	-175.4	77.3	-115.8	0	0	0	112	M222 N223 S230 T345 L349	M222-F226 WeakPolarHBondContact O-CD1 3.25Å; M222-F226 PolarHBondContact O-N 3.45Å; N223-F226 VanDerWaalsContact CA-CE1 3.4Å; N223-F226 HydrophobicContact CB-CE1 3.96Å; N223-F226 HydrophobicContact CB-CZ 4.25Å; N223-F226 VanDerWaalsContact OD1-CE1 3.22Å; N223-F226 WeakPolarHBondContact OD1-CE1 3.36Å; F226-S230 WeakPolarHBondContact O-CA 3.2Å; F226-S230 WeakPolarHBondContact O-CB 3.22Å; F226-S230 PolarHBondContact O-N 3.26Å; F226-T345 HydrophobicContact CB-CG2 3.94Å; F226-T345 HydrophobicContact CD1-CG2 4.14Å; F226-L349 HydrophobicContact CB-CB 3.87Å; F226-L349 HydrophobicContact CB-CD1 4.5Å; F226-L349 HydrophobicContact CB-CG 4.36Å
227	Q	97.6	Very high	93.4	Very high	105 Å²	105	42.7 Å²	42.7	49%	0.491	20%	0.201	S	C	.	.	H	α-helix	trans	-62.9	-44.6	177.5	-77.8	174.4	-4.4	0	0	112.1	N223 Y225 S231	N223-Q227 VanDerWaalsContact O-CB 3.3Å; N223-Q227 WeakPolarHBondContact O-CB 3.36Å; N223-Q227 WeakPolarHBondContact O-CG 3.09Å; N223-Q227 PolarHBondContact O-N 2.89Å; Y225-Q227 VanDerWaalsContact C-N 3.29Å; Y225-Q227 PolarHBondContact O-N 3.36Å; Q227-S231 PolarHBondContact O-N 3.43Å
228	I	97.6	Very high	94.6	Very high	21 Å²	21	40.1 Å²	40.1	11%	0.108	19%	0.194	C	C	.	.	H	α-helix	trans	-66.4	-51.8	178.5	-66.9	168.2	0	0	0	109.3	R161 L164 T165 V224 Y225 S230 S231 Q232	R161-I228 HydrophobicContact CG-CD1 4.4Å; L164-I228 HydrophobicContact CB-CD1 3.75Å; L164-I228 HydrophobicContact CB-CG2 4.34Å; L164-I228 HydrophobicContact CD1-CD1 4.49Å; T165-I228 WeakPolarHBondContact OG1-CD1 3.35Å; V224-I228 HydrophobicContact CG1-CD1 3.73Å; V224-I228 WeakPolarHBondContact O-CG1 3.48Å; V224-I228 PolarHBondContact O-N 3.49Å; V224-I228 VanDerWaalsContact O-N 3.11Å; Y225-I228 PolarHBondContact O-N 3.39Å; I228-S230 PolarHBondContact O-N 3.01Å; I228-S231 PolarHBondContact O-N 3.11Å; I228-Q232 WeakPolarHBondContact O-CG 3.24Å; I228-Q232 PolarHBondContact O-N 3.14Å
229	R	97.9	Very high	95.5	Very high	1 Å²	1	38.2 Å²	38.2	0%	0.004	19%	0.19	C	C	.	.	H	α-helix	trans	-62.6	-41.1	-178.1	-63.1	-51	-56.5	-178.7	0.7	112.7	S168 H196 Y225 S231 Q232 L233 E329 L349	S168-R229 VanDerWaalsContact CB-NH1 3.28Å; S168-R229 PolarHBondContact OG-NH1 2.67Å; H196-R229 PolarHBondContact ND1-NH2 3.12Å; Y225-R229 HydrophobicContact CD1-CG 4.39Å; Y225-R229 HydrophobicContact CD2-CG 4.18Å; Y225-R229 HydrophobicContact CE1-CG 4.02Å; Y225-R229 HydrophobicContact CE2-CG 3.78Å; Y225-R229 HydrophobicContact CG-CG 4.46Å; Y225-R229 WeakPolarHBondContact O-CG 3.45Å; Y225-R229 PolarHBondContact O-N 3.33Å; R229-S231 VanDerWaalsContact C-N 3.33Å; R229-S231 PolarHBondContact O-N 2.89Å; R229-Q232 PolarHBondContact O-N 3.4Å; R229-Q232 VanDerWaalsContact O-N 3.08Å; R229-L233 PolarHBondContact O-N 3.47Å; R229-E329 IonicContact CZ-OE1 3.2Å; R229-E329 IonicContact CZ-OE2 3.49Å; R229-E329 IonicContact NE-OE1 2.8Å; R229-E329 PolarHBondContact NE-OE1 3.18Å; R229-E329 IonicContact NE-OE2 3.52Å; R229-E329 PolarHBondContact NE-OE2 3.4Å; R229-E329 IonicContact NH2-OE1 2.77Å; R229-E329 PolarHBondContact NH2-OE1 3.47Å; R229-E329 IonicContact NH2-OE2 2.69Å; R229-E329 PolarHBondContact NH2-OE2 2.88Å; R229-L349 HydrophobicContact CB-CD1 3.62Å; R229-L349 HydrophobicContact CB-CD2 4.48Å; R229-L349 HydrophobicContact CB-CG 3.99Å; R229-L349 HydrophobicContact CG-CD1 4.34Å
230	S	98.3	Very high	96.1	Very high	7 Å²	7	33.4 Å²	33.4	5%	0.049	17%	0.168	C	C	.	.	H	α-helix	trans	-55.3	-46.7	175.4	-170.1	0	0	0	0	112.1	F226 I228 Q232 L233 D234 L349	F226-S230 WeakPolarHBondContact O-CA 3.2Å; F226-S230 WeakPolarHBondContact O-CB 3.22Å; F226-S230 PolarHBondContact O-N 3.26Å; I228-S230 PolarHBondContact O-N 3.01Å; S230-Q232 VanDerWaalsContact C-N 3.29Å; S230-Q232 PolarHBondContact O-N 3.24Å; S230-L233 PolarHBondContact O-N 2.95Å; S230-D234 PolarHBondContact O-N 3.15Å; S230-L349 WeakPolarHBondContact CA-O 3.42Å; S230-L349 WeakPolarHBondContact CB-O 3.07Å; S230-L349 PolarHBondContact OG-O 3.36Å
231	S	97.9	Very high	96.4	Very high	31 Å²	31	33 Å²	33	22%	0.217	16%	0.162	C	C	.	.	H	α-helix	trans	-62.4	-36.8	177.9	-166.2	0	0	0	0	112.4	Q227 I228 R229 R235	Q227-S231 PolarHBondContact O-N 3.43Å; I228-S231 PolarHBondContact O-N 3.11Å; R229-S231 VanDerWaalsContact C-N 3.33Å; R229-S231 PolarHBondContact O-N 2.89Å; S231-R235 VanDerWaalsContact O-CB 3.31Å; S231-R235 WeakPolarHBondContact O-CB 3.22Å; S231-R235 WeakPolarHBondContact O-CD 3.3Å; S231-R235 WeakPolarHBondContact O-CG 3.46Å; S231-R235 PolarHBondContact O-N 3.39Å
232	Q	97.8	Very high	96.4	Very high	20 Å²	20	35.4 Å²	35.4	9%	0.093	17%	0.174	C	C	.	.	H	α-helix	trans	-74.6	-38.9	179.1	-57.6	-50.8	117.5	0	0	112.3	S168 K169 P170 I228 R229 S230 R235 S236	S168-Q232 PolarHBondContact O-NE2 3.14Å; K169-Q232 VanDerWaalsContact C-NE2 3.32Å; P170-Q232 VanDerWaalsContact N-NE2 3.12Å; I228-Q232 WeakPolarHBondContact O-CG 3.24Å; I228-Q232 PolarHBondContact O-N 3.14Å; R229-Q232 PolarHBondContact O-N 3.4Å; R229-Q232 VanDerWaalsContact O-N 3.08Å; S230-Q232 VanDerWaalsContact C-N 3.29Å; S230-Q232 PolarHBondContact O-N 3.24Å; Q232-R235 PolarHBondContact O-N 2.8Å; Q232-S236 WeakPolarHBondContact O-CB 3.38Å; Q232-S236 PolarHBondContact O-N 3.43Å; Q232-S236 PolarHBondContact O-OG 3.29Å
233	L	98.2	Very high	96.3	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-58.1	-52.8	172.9	174.9	62.3	0	0	0	111	R229 S230 R235 S236 I237 L325 L349 I350 A353	R229-L233 PolarHBondContact O-N 3.47Å; S230-L233 PolarHBondContact O-N 2.95Å; L233-R235 PolarHBondContact O-N 2.95Å; L233-S236 WeakPolarHBondContact O-CB 3.34Å; L233-S236 PolarHBondContact O-N 3Å; L233-S236 VanDerWaalsContact O-N 3.12Å; L233-I237 HydrophobicContact CD1-CD1 4.37Å; L233-I237 PolarHBondContact O-N 3.5Å; L233-L325 HydrophobicContact CD1-CB 3.38Å; L233-L325 HydrophobicContact CD1-CD1 4.02Å; L233-L325 HydrophobicContact CD1-CG 4.31Å; L233-L349 HydrophobicContact CD2-CD2 3.89Å; L233-I350 HydrophobicContact CD2-CG2 4.18Å; L233-A353 HydrophobicContact CD2-CB 3.79Å; L233-A353 HydrophobicContact CG-CB 3.73Å
234	D	98.1	Very high	96	Very high	8 Å²	8	36 Å²	36	4%	0.043	17%	0.173	C	C	.	.	H	α-helix	trans	-60.5	-43.6	178.9	174.4	74.7	0	0	0	112.1	S230 S236 I237 K238 E352 A353 N356	S230-D234 PolarHBondContact O-N 3.15Å; D234-S236 VanDerWaalsContact C-N 3.28Å; D234-S236 PolarHBondContact O-N 3.02Å; D234-I237 PolarHBondContact O-N 3.15Å; D234-K238 VanDerWaalsContact CG-NZ 3.32Å; D234-K238 WeakPolarHBondContact O-CB 3.37Å; D234-K238 WeakPolarHBondContact O-CG 3.46Å; D234-K238 PolarHBondContact O-N 3.07Å; D234-K238 VanDerWaalsContact OD1-CE 3.25Å; D234-K238 WeakPolarHBondContact OD1-CE 3.23Å; D234-K238 IonicContact OD1-NZ 2.85Å; D234-K238 PolarHBondContact OD1-NZ 2.93Å; D234-K238 WeakPolarHBondContact OD2-CD 3.36Å; D234-K238 WeakPolarHBondContact OD2-CE 3.39Å; D234-K238 IonicContact OD2-NZ 2.59Å; D234-K238 PolarHBondContact OD2-NZ 2.64Å; D234-E352 HydrophobicContact CB-CG 4.37Å; D234-A353 HydrophobicContact CB-CB 4.17Å; D234-N356 PolarHBondContact OD1-ND2 3.13Å
235	R	97.8	Very high	95.5	Very high	137 Å²	137	42.3 Å²	42.3	52%	0.517	19%	0.194	S	C	.	.	H	α-helix	trans	-62.8	-32.5	175.5	-75.9	172.4	-178.4	-171.9	0.2	113.2	P170 S231 Q232 L233 G239	P170-R235 HydrophobicContact CB-CB 4.03Å; P170-R235 HydrophobicContact CG-CB 3.91Å; S231-R235 VanDerWaalsContact O-CB 3.31Å; S231-R235 WeakPolarHBondContact O-CB 3.22Å; S231-R235 WeakPolarHBondContact O-CD 3.3Å; S231-R235 WeakPolarHBondContact O-CG 3.46Å; S231-R235 PolarHBondContact O-N 3.39Å; Q232-R235 PolarHBondContact O-N 2.8Å; L233-R235 PolarHBondContact O-N 2.95Å; R235-G239 PolarHBondContact O-N 2.92Å
236	S	98	Very high	94.9	Very high	3 Å²	3	48.3 Å²	48.3	2%	0.021	22%	0.22	C	C	.	.	H	α-helix	trans	-67.1	-46.2	178.1	-55.7	0	0	0	0	110.6	P170 V171 Q232 L233 D234 G239 L240	P170-S236 VanDerWaalsContact CA-OG 3.28Å; P170-S236 WeakPolarHBondContact CA-OG 3.13Å; V171-S236 PolarHBondContact N-OG 3.48Å; Q232-S236 WeakPolarHBondContact O-CB 3.38Å; Q232-S236 PolarHBondContact O-N 3.43Å; Q232-S236 PolarHBondContact O-OG 3.29Å; L233-S236 WeakPolarHBondContact O-CB 3.34Å; L233-S236 PolarHBondContact O-N 3Å; L233-S236 VanDerWaalsContact O-N 3.12Å; D234-S236 VanDerWaalsContact C-N 3.28Å; D234-S236 PolarHBondContact O-N 3.02Å; S236-G239 PolarHBondContact O-N 2.98Å; S236-L240 PolarHBondContact O-N 3.31Å
237	I	97.3	Very high	93.8	Very high	13 Å²	13	50.5 Å²	50.5	7%	0.067	23%	0.234	C	C	.	.	H	α-helix	trans	-65.4	-45.6	177.1	-61.8	170.6	0	0	0	110.8	L233 D234 G239 L240 K241 C318 F322 L325 A353	L233-I237 HydrophobicContact CD1-CD1 4.37Å; L233-I237 PolarHBondContact O-N 3.5Å; D234-I237 PolarHBondContact O-N 3.15Å; I237-G239 VanDerWaalsContact C-N 3.28Å; I237-G239 PolarHBondContact O-N 3.19Å; I237-L240 WeakPolarHBondContact O-CB 3.42Å; I237-L240 PolarHBondContact O-N 3.47Å; I237-L240 VanDerWaalsContact O-N 3.16Å; I237-K241 PolarHBondContact O-N 3.11Å; I237-C318 HydrophobicContact CG2-CB 3.97Å; I237-F322 HydrophobicContact CD1-CB 3.96Å; I237-F322 HydrophobicContact CD1-CD2 3.89Å; I237-F322 HydrophobicContact CD1-CG 4.43Å; I237-L325 HydrophobicContact CG1-CD1 3.97Å; I237-A353 HydrophobicContact CD1-CB 4.02Å
238	K	95.8	Very high	92.1	Very high	100 Å²	100	47.8 Å²	47.8	44%	0.435	23%	0.226	S	C	.	.	H	α-helix	trans	-61.2	-37.8	174.8	-73.7	175.5	-179.3	160.4	0	112.1	D234 K241 E242 N356	D234-K238 VanDerWaalsContact CG-NZ 3.32Å; D234-K238 WeakPolarHBondContact O-CB 3.37Å; D234-K238 WeakPolarHBondContact O-CG 3.46Å; D234-K238 PolarHBondContact O-N 3.07Å; D234-K238 VanDerWaalsContact OD1-CE 3.25Å; D234-K238 WeakPolarHBondContact OD1-CE 3.23Å; D234-K238 IonicContact OD1-NZ 2.85Å; D234-K238 PolarHBondContact OD1-NZ 2.93Å; D234-K238 WeakPolarHBondContact OD2-CD 3.36Å; D234-K238 WeakPolarHBondContact OD2-CE 3.39Å; D234-K238 IonicContact OD2-NZ 2.59Å; D234-K238 PolarHBondContact OD2-NZ 2.64Å; K238-K241 PolarHBondContact O-N 3.01Å; K238-E242 WeakPolarHBondContact O-CB 3.49Å; K238-E242 PolarHBondContact O-N 3.36Å; K238-N356 PolarHBondContact NZ-ND2 2.72Å; K238-N356 VanDerWaalsContact NZ-ND2 3.14Å
239	G	95.8	Very high	89.9	Confident	29 Å²	29	51 Å²	51	30%	0.299	26%	0.257	S	S	.	.	H	α-helix	trans	-62.4	-40.5	174.6	0	0	0	0	0	112.7	R235 S236 I237 E242 H243	R235-G239 PolarHBondContact O-N 2.92Å; S236-G239 PolarHBondContact O-N 2.98Å; I237-G239 VanDerWaalsContact C-N 3.28Å; I237-G239 PolarHBondContact O-N 3.19Å; G239-E242 PolarHBondContact O-N 3.43Å; G239-H243 WeakPolarHBondContact O-CB 3.38Å; G239-H243 PolarHBondContact O-N 3.31Å
240	L	95	Very high	87.4	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-63.8	-47.6	174.8	-178.8	64.4	0	0	0	111.6	P173 I176 L177 S236 I237 E242 H243 F244 H317 A321	P173-L240 HydrophobicContact CB-CD1 3.91Å; I176-L240 HydrophobicContact CD1-CB 4.41Å; I176-L240 HydrophobicContact CG2-CD2 3.96Å; L177-L240 HydrophobicContact CD1-CD1 4.35Å; L177-L240 HydrophobicContact CD2-CD1 4.01Å; L177-L240 HydrophobicContact CG-CD1 3.94Å; S236-L240 PolarHBondContact O-N 3.31Å; I237-L240 WeakPolarHBondContact O-CB 3.42Å; I237-L240 PolarHBondContact O-N 3.47Å; I237-L240 VanDerWaalsContact O-N 3.16Å; L240-E242 VanDerWaalsContact C-N 3.32Å; L240-E242 PolarHBondContact O-N 3.14Å; L240-H243 WeakPolarHBondContact O-CB 3.27Å; L240-H243 PolarHBondContact O-N 3.23Å; L240-H243 VanDerWaalsContact O-N 3.11Å; L240-F244 HydrophobicContact CD1-CD2 4.26Å; L240-F244 HydrophobicContact CD1-CE2 3.8Å; L240-F244 HydrophobicContact CG-CD2 4.29Å; L240-F244 HydrophobicContact CG-CE2 4.03Å; L240-F244 WeakPolarHBondContact O-CD2 3.24Å; L240-F244 PolarHBondContact O-N 3.48Å; L240-H317 HydrophobicContact CD2-CB 4.32Å; L240-A321 HydrophobicContact CD2-CB 3.55Å
241	K	92.5	Very high	84.8	Confident	72 Å²	72	60 Å²	60	31%	0.313	32%	0.319	S	S	.	.	H	α-helix	trans	-56.6	-46.5	176.2	-170.6	-178.4	-172.6	-177.4	0	111.8	I237 K238 H243 F244 R245 E360	I237-K241 PolarHBondContact O-N 3.11Å; K238-K241 PolarHBondContact O-N 3.01Å; K241-H243 VanDerWaalsContact C-N 3.28Å; K241-H243 PolarHBondContact O-N 3.36Å; K241-F244 PolarHBondContact O-N 3.03Å; K241-R245 PolarHBondContact O-N 3.38Å; K241-R245 VanDerWaalsContact O-N 3.15Å; K241-E360 IonicContact NZ-OE1 3.82Å; K241-E360 PolarHBondContact NZ-OE1 3.1Å; K241-E360 IonicContact NZ-OE2 3.5Å; K241-E360 PolarHBondContact NZ-OE2 3.1Å
242	E	91.4	Very high	81.7	Confident	59 Å²	59	62 Å²	62	28%	0.276	34%	0.344	S	S	.	.	H	α-helix	trans	-65.6	-31.2	178.9	-176.8	60.4	-168	0	0	112.6	K238 G239 L240 R245 K246	K238-E242 WeakPolarHBondContact O-CB 3.49Å; K238-E242 PolarHBondContact O-N 3.36Å; G239-E242 PolarHBondContact O-N 3.43Å; L240-E242 VanDerWaalsContact C-N 3.32Å; L240-E242 PolarHBondContact O-N 3.14Å; E242-R245 PolarHBondContact O-N 3.24Å; E242-R245 IonicContact OE1-CZ 2.86Å; E242-R245 IonicContact OE1-NE 3.17Å; E242-R245 IonicContact OE1-NH2 3.4Å; E242-R245 PolarHBondContact OE1-NH2 2.78Å; E242-R245 IonicContact OE2-CZ 2.85Å; E242-R245 IonicContact OE2-NE 2.7Å; E242-R245 PolarHBondContact OE2-NE 3.15Å; E242-R245 IonicContact OE2-NH2 3.87Å; E242-R245 PolarHBondContact OE2-NH2 3.31Å; E242-K246 HydrophobicContact CG-CD 4.14Å; E242-K246 HydrophobicContact CG-CG 4.4Å; E242-K246 WeakPolarHBondContact O-CB 3.5Å; E242-K246 WeakPolarHBondContact O-CG 3.28Å; E242-K246 PolarHBondContact O-N 3.35Å; E242-K246 WeakPolarHBondContact OE1-CE 3.41Å; E242-K246 IonicContact OE1-NZ 3.1Å
243	H	91.9	Very high	78.6	Confident	45 Å²	45	67.8 Å²	67.8	21%	0.208	38%	0.381	C	S	.	.	H	α-helix	trans	-64.1	-44.8	174.8	174.5	-98	0	0	0	112	P173 G239 L240 K241 R245 K246 N247	P173-H243 HydrophobicContact CB-CB 3.73Å; P173-H243 HydrophobicContact CG-CB 3.8Å; G239-H243 WeakPolarHBondContact O-CB 3.38Å; G239-H243 PolarHBondContact O-N 3.31Å; L240-H243 WeakPolarHBondContact O-CB 3.27Å; L240-H243 PolarHBondContact O-N 3.23Å; L240-H243 VanDerWaalsContact O-N 3.11Å; K241-H243 VanDerWaalsContact C-N 3.28Å; K241-H243 PolarHBondContact O-N 3.36Å; H243-R245 VanDerWaalsContact C-N 3.34Å; H243-R245 PolarHBondContact O-N 3.38Å; H243-K246 PolarHBondContact O-N 2.92Å; H243-N247 PolarHBondContact CE1-ND2 2.86Å; H243-N247 PolarHBondContact NE2-ND2 3.44Å; H243-N247 PolarHBondContact O-N 3.17Å
244	F	88.3	Confident	75.4	Confident	39 Å²	39	75.6 Å²	75.6	17%	0.171	42%	0.422	C	S	.	.	H	α-helix	trans	-59.6	-44.6	172.6	-80.8	-79	0	0	0	111.5	L177 L240 K241 K246 S248 H317	L177-F244 HydrophobicContact CD2-CE2 4.14Å; L177-F244 HydrophobicContact CD2-CZ 3.93Å; L240-F244 HydrophobicContact CD1-CD2 4.26Å; L240-F244 HydrophobicContact CD1-CE2 3.8Å; L240-F244 HydrophobicContact CG-CD2 4.29Å; L240-F244 HydrophobicContact CG-CE2 4.03Å; L240-F244 WeakPolarHBondContact O-CD2 3.24Å; L240-F244 PolarHBondContact O-N 3.48Å; K241-F244 PolarHBondContact O-N 3.03Å; F244-K246 VanDerWaalsContact C-N 3.34Å; F244-K246 PolarHBondContact O-N 3Å; F244-S248 PolarHBondContact O-N 2.89Å; F244-S248 PolarHBondContact O-OG 3.37Å; F244-H317 HydrophobicContact CE2-CB 3.72Å; F244-H317 AromaticContact CE2-CG 3.84Å; F244-H317 HydrophobicContact CZ-CB 3.94Å; F244-H317 AromaticContact CZ-CD2 3.75Å; F244-H317 AromaticContact CZ-CE1 3.89Å; F244-H317 AromaticContact CZ-CG 3.5Å; F244-H317 AromaticContact CZ-ND1 3.6Å; F244-H317 AromaticContact CZ-NE2 3.96Å
245	R	85.3	Confident	72.2	Confident	161 Å²	161	86 Å²	86	61%	0.608	46%	0.462	S	S	*	.	H	α-helix	trans	-61.5	-39.4	178.3	-162.1	179	73.4	94.4	2.1	113.2	K241 E242 H243	K241-R245 PolarHBondContact O-N 3.38Å; K241-R245 VanDerWaalsContact O-N 3.15Å; E242-R245 PolarHBondContact O-N 3.24Å; E242-R245 IonicContact OE1-CZ 2.86Å; E242-R245 IonicContact OE1-NE 3.17Å; E242-R245 IonicContact OE1-NH2 3.4Å; E242-R245 PolarHBondContact OE1-NH2 2.78Å; E242-R245 IonicContact OE2-CZ 2.85Å; E242-R245 IonicContact OE2-NE 2.7Å; E242-R245 PolarHBondContact OE2-NE 3.15Å; E242-R245 IonicContact OE2-NH2 3.87Å; E242-R245 PolarHBondContact OE2-NH2 3.31Å; H243-R245 VanDerWaalsContact C-N 3.34Å; H243-R245 PolarHBondContact O-N 3.38Å
246	K	84	Confident	68.7	Low	126 Å²	126	84.3 Å²	84.3	55%	0.548	47%	0.472	S	S	.	.	H	α-helix	trans	-76.3	-43	-178.5	-77.2	177.9	179.5	168.9	0	113.4	E242 H243 F244 S248 A249 S250	E242-K246 HydrophobicContact CG-CD 4.14Å; E242-K246 HydrophobicContact CG-CG 4.4Å; E242-K246 WeakPolarHBondContact O-CB 3.5Å; E242-K246 WeakPolarHBondContact O-CG 3.28Å; E242-K246 PolarHBondContact O-N 3.35Å; E242-K246 WeakPolarHBondContact OE1-CE 3.41Å; E242-K246 IonicContact OE1-NZ 3.1Å; H243-K246 PolarHBondContact O-N 2.92Å; F244-K246 VanDerWaalsContact C-N 3.34Å; F244-K246 PolarHBondContact O-N 3Å; K246-S248 PolarHBondContact O-N 3.45Å; K246-A249 PolarHBondContact O-N 3.49Å; K246-A249 VanDerWaalsContact O-N 3.15Å; K246-S250 PolarHBondContact O-N 3.36Å
247	N	73.9	Confident	65.7	Low	82 Å²	82	90.3 Å²	90.3	44%	0.439	51%	0.51	S	S	.	.	H	α-helix	trans	-64.1	-33.6	-178.5	-75.8	-3.2	0	0	0	111.3	H243 S250	H243-N247 PolarHBondContact CE1-ND2 2.86Å; H243-N247 PolarHBondContact NE2-ND2 3.44Å; H243-N247 PolarHBondContact O-N 3.17Å; N247-S250 PolarHBondContact O-N 3.34Å; N247-S250 PolarHBondContact O-OG 2.96Å
248	S	60.4	Low	62.4	Low	48 Å²	48	93.6 Å²	93.6	34%	0.336	54%	0.539	S	S	.	.	H	α-helix	trans	-68.1	-33.5	174.5	-56.3	0	0	0	0	114	F244 K246 S250 I310	F244-S248 PolarHBondContact O-N 2.89Å; F244-S248 PolarHBondContact O-OG 3.37Å; K246-S248 PolarHBondContact O-N 3.45Å; S248-S250 PolarHBondContact O-N 3.37Å; S248-I310 VanDerWaalsContact OG-CD1 3.25Å; S248-I310 WeakPolarHBondContact OG-CD1 2.73Å
249	A	52.4	Low	59.4	Low	90 Å²	90	95.3 Å²	95.3	74%	0.744	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	-8.9	176.1	0	0	0	0	0	113.7	K246	K246-A249 PolarHBondContact O-N 3.49Å; K246-A249 VanDerWaalsContact O-N 3.15Å
250	S	45.5	Very low	56.1	Low	87 Å²	87	103.1 Å²	103.1	61%	0.608	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.2	8.3	-175.9	78.1	0	0	0	0	114.9	K246 N247 S248 G252	K246-S250 PolarHBondContact O-N 3.36Å; N247-S250 PolarHBondContact O-N 3.34Å; N247-S250 PolarHBondContact O-OG 2.96Å; S248-S250 PolarHBondContact O-N 3.37Å; S250-G252 PolarHBondContact O-N 3.25Å
251	S	42.6	Very low	52.9	Low	109 Å²	109	109.2 Å²	109.2	76%	0.762	62%	0.624	S	S	*	*			trans	-31.4	119.3	-162.9	44.5	0	0	0	0	116.2
252	G	34.3	Very low	50.1	Low	72 Å²	72	115.4 Å²	115.4	74%	0.742	65%	0.651	S	S	*	*			trans	175.1	7	172.6	0	0	0	0	0	119.6	S250	S250-G252 PolarHBondContact O-N 3.25Å
253	V	32.2	Very low	47.1	Very low	143 Å²	143	124.3 Å²	124.3	87%	0.867	68%	0.682	S	S	*	*			trans	-148.1	118.7	168.7	-174.4	0	0	0	0	111.1
254	L	31.6	Very low	44	Very low	165 Å²	165	131.9 Å²	131.9	86%	0.864	71%	0.714	S	S	*	*			trans	-72.6	131.9	164.5	-75.7	158.2	0	0	0	109.2	S256	L254-S256 PolarHBondContact O-N 3.39Å
255	Y	29.5	Very low	41.1	Very low	226 Å²	226	137.1 Å²	137.1	89%	0.886	74%	0.744	S	S	*	*			trans	-70.8	122.4	164.9	-136.9	-105.4	0	0	0	108.2
256	S	25.6	Very low	38.3	Very low	102 Å²	102	136.1 Å²	136.1	71%	0.713	76%	0.756	S	S	*	*			trans	-118.5	132.8	160	-87.9	0	0	0	0	107.5	L254 A258	L254-S256 PolarHBondContact O-N 3.39Å; S256-A258 PolarHBondContact O-N 3.42Å
257	P	33.9	Very low	35.9	Very low	128 Å²	128	135.5 Å²	135.5	83%	0.831	77%	0.765	S	S	*	*			trans	-80.4	102.6	-178.3	31.7	-29.4	0	0	0	108.5
258	A	27.6	Very low	33.8	Very low	82 Å²	82	138 Å²	138	68%	0.678	78%	0.783	S	S	*	*			trans	-143.2	110.7	169.3	0	0	0	0	0	111.2	S256 Q260	S256-A258 PolarHBondContact O-N 3.42Å; A258-Q260 PolarHBondContact O-N 3Å
259	V	34.2	Very low	32.3	Very low	136 Å²	136	145.4 Å²	145.4	82%	0.824	81%	0.809	S	S	*	*			trans	-15.3	108.5	160.7	-176.7	0	0	0	0	113.9	T261	V259-T261 PolarHBondContact O-N 3.14Å
260	Q	26.8	Very low	31.2	Very low	193 Å²	193	151.4 Å²	151.4	90%	0.902	82%	0.819	S	S	*	*			trans	-85.1	101	168.2	-71.7	-169.3	9	0	0	110.4	A258	A258-Q260 PolarHBondContact O-N 3Å
261	T	27.6	Very low	30.3	Very low	128 Å²	128	152 Å²	152	79%	0.785	83%	0.829	S	S	*	*			trans	-75.3	126.5	159.4	36.5	0	0	0	0	109.4	V259	V259-T261 PolarHBondContact O-N 3.14Å
262	K	32.7	Very low	29.8	Very low	203 Å²	203	152 Å²	152	88%	0.883	83%	0.827	S	S	*	*			trans	-51.7	131.7	177.2	-67.1	179.3	175.2	177.2	0	112.1
263	R	28.7	Very low	29.5	Very low	246 Å²	246	157.1 Å²	157.1	93%	0.928	83%	0.828	S	S	*	*			trans	-161.3	103.5	150	-108	167	-164.3	-162.2	5.1	114.1
264	K	27.4	Very low	29.2	Very low	203 Å²	203	160.6 Å²	160.6	88%	0.883	83%	0.826	S	S	*	*			trans	23.8	129.2	134.9	-134	173.7	-176.8	179.5	0	120.6
265	D	26.3	Very low	29.1	Very low	150 Å²	150	158.3 Å²	158.3	80%	0.802	82%	0.821	S	S	*	*			trans	-52	145.6	173.5	-60.4	-74.9	0	0	0	117
266	T	27.1	Very low	28.9	Very low	140 Å²	140	154.5 Å²	154.5	86%	0.859	82%	0.821	S	S	*	*				-168.7	145.9	129.9	9.1	0	0	0	0	111.9
267	P	33	Very low	28.7	Very low	113 Å²	113	159.3 Å²	159.3	73%	0.734	83%	0.825	S	S	*	*			trans	-107.5	134.6	-173.7	36.1	-25.1	0	0	0	112.9
268	T	31	Very low	28.3	Very low	133 Å²	133	160.9 Å²	160.9	82%	0.816	83%	0.825	S	S	*	*			trans	-160.3	122.2	154.4	16.2	0	0	0	0	115.4
269	K	29.3	Very low	28.4	Very low	204 Å²	204	162.1 Å²	162.1	89%	0.887	83%	0.826	S	S	*	*			trans	52.9	121.4	136.1	-72.4	-179.8	175.6	177.4	0	121.9
270	K	28.1	Very low	27.9	Very low	216 Å²	216	159.1 Å²	159.1	94%	0.939	82%	0.822	S	S	*	*			trans	-71.6	149.1	162.3	-71.4	178.4	172.9	177.2	0	113.4
271	A	26	Very low	27.8	Very low	100 Å²	100	160.4 Å²	160.4	83%	0.826	82%	0.821	S	S	*	*			trans	-160	158.5	140.6	0	0	0	0	0	111.4
272	P	33.6	Very low	27.7	Very low	110 Å²	110	160.6 Å²	160.6	71%	0.714	82%	0.817	S	S	*	*			trans	-123.4	176.5	-150.1	40	-25.3	0	0	0	117.4
273	K	27.4	Very low	27.4	Very low	178 Å²	178	157.6 Å²	157.6	77%	0.774	81%	0.81	S	S	*	*			trans	85.8	143.3	163	-59.7	178.4	-176.4	176.6	0	115.5
274	R	26.3	Very low	27.3	Very low	216 Å²	216	153.8 Å²	153.8	82%	0.815	81%	0.808	S	S	*	*			cis	-167.4	176.2	11.3	-119	178.9	-169.6	-177.6	2.5	108.3
275	P	28.3	Very low	27.2	Very low	117 Å²	117	151.6 Å²	151.6	76%	0.76	81%	0.805	S	S	*	*			trans	-90.7	152.2	-158	37.1	-35.9	0	0	0	114.5
276	V	25.5	Very low	27.3	Very low	146 Å²	146	156.3 Å²	156.3	89%	0.885	81%	0.812	S	S	*	*			trans	-130.9	125.5	164.8	178.9	0	0	0	0	108.6
277	Y	22.5	Very low	27.2	Very low	203 Å²	203	154.9 Å²	154.9	80%	0.796	80%	0.803	S	S	*	*			trans	-99.6	137.1	173.8	-159.9	-93	0	0	0	107.4	P279	Y277-P279 HydrophobicContact CE1-CG 4.3Å
278	I	24.3	Very low	26.9	Very low	162 Å²	162	158.4 Å²	158.4	83%	0.831	81%	0.807	S	S	*	*			trans	-171.4	146.5	142.8	-94.2	152.9	0	0	0	109
279	P	29.8	Very low	26.7	Very low	107 Å²	107	160 Å²	160	70%	0.695	81%	0.81	S	S	*	*			trans	-104.7	159.4	-151.3	4	19.7	0	0	0	114.5	Y277	Y277-P279 HydrophobicContact CE1-CG 4.3Å
280	G	23.9	Very low	26.5	Very low	73 Å²	73	157.7 Å²	157.7	75%	0.753	80%	0.802	S	S	*	*			trans	175.7	118.9	166.1	0	0	0	0	0	114.3
281	Y	24.9	Very low	26.6	Very low	221 Å²	221	152.8 Å²	152.8	87%	0.867	79%	0.794	S	S	*	*			trans	-35.5	150.3	165	-69.1	-100.6	0	0	0	114.3
282	D	25	Very low	26.7	Very low	132 Å²	132	155.3 Å²	155.3	71%	0.706	79%	0.794	S	S	*	*			cis	-163.6	153.2	47.4	-101.6	-40.7	0	0	0	112.8
283	N	27.4	Very low	26.4	Very low	139 Å²	139	154.3 Å²	154.3	74%	0.743	80%	0.795	S	S	*	*			trans	39.9	106.5	146.5	-67	-23	0	0	0	121.8
284	D	26.1	Very low	26.6	Very low	167 Å²	167	154.2 Å²	154.2	89%	0.893	80%	0.802	S	S	*	*				-177.4	114.7	112	-113.8	-20.8	0	0	0	110.2
285	L	25.8	Very low	26.6	Very low	156 Å²	156	150.3 Å²	150.3	82%	0.817	80%	0.797	S	S	*	*			trans	-140.3	102.6	172.6	-100.5	156.2	0	0	0	109.3	V287	L285-V287 PolarHBondContact O-N 3.25Å; L285-V287 VanDerWaalsContact O-N 3.08Å
286	R	27.5	Very low	26.7	Very low	249 Å²	249	153.9 Å²	153.9	94%	0.94	80%	0.804	S	S	*	*			trans	-60.5	105.2	156.8	-79	169.9	77.9	157.5	0.6	107.2	K288	R286-K288 PolarHBondContact O-N 2.75Å; R286-K288 VanDerWaalsContact O-N 3.17Å
287	V	25.5	Very low	27.1	Very low	111 Å²	111	155.8 Å²	155.8	67%	0.673	80%	0.8	S	S	*	*			trans	-66.2	110.1	179.5	175	0	0	0	0	109.1	L285 L289	L285-V287 PolarHBondContact O-N 3.25Å; L285-V287 VanDerWaalsContact O-N 3.08Å; V287-L289 HydrophobicContact CG1-CG 4.29Å; V287-L289 PolarHBondContact O-N 2.91Å
288	K	27.3	Very low	27.3	Very low	186 Å²	186	154.7 Å²	154.7	81%	0.809	80%	0.802	S	S	*	*			trans	-61	111.5	148.9	-80.7	179.7	172.1	-176.4	0	106.5	R286 H290	R286-K288 PolarHBondContact O-N 2.75Å; R286-K288 VanDerWaalsContact O-N 3.17Å; K288-H290 VanDerWaalsContact C-N 3.35Å; K288-H290 PolarHBondContact O-N 2.79Å
289	L	25.8	Very low	27.3	Very low	168 Å²	168	150.6 Å²	150.6	88%	0.88	80%	0.8	S	S	*	*			trans	-70.8	93.9	172.3	-85.4	152.8	0	0	0	108.3	V287	V287-L289 HydrophobicContact CG1-CG 4.29Å; V287-L289 PolarHBondContact O-N 2.91Å
290	H	26.6	Very low	27.3	Very low	155 Å²	155	150.1 Å²	150.1	72%	0.718	81%	0.805	S	S	*	*			trans	-72.1	125.6	157.5	-97.4	-86.1	0	0	0	108.3	K288 D292	K288-H290 VanDerWaalsContact C-N 3.35Å; K288-H290 PolarHBondContact O-N 2.79Å; H290-D292 PolarHBondContact O-N 2.65Å
291	S	28.8	Very low	27.7	Very low	113 Å²	113	150.6 Å²	150.6	79%	0.79	80%	0.802	S	S	*	*			trans	-72.5	92.6	167.3	55.5	0	0	0	0	109.9
292	D	27.9	Very low	28.1	Very low	153 Å²	153	144.4 Å²	144.4	82%	0.818	80%	0.796	S	S	*	*			trans	-126	90.2	168.2	-92.2	-27.4	0	0	0	110.5	H290	H290-D292 PolarHBondContact O-N 2.65Å
293	A	27.8	Very low	28.9	Very low	89 Å²	89	140.2 Å²	140.2	74%	0.736	78%	0.784	S	S	*	*			trans	-172.8	99.1	152.2	0	0	0	0	0	104.8
294	L	31.1	Very low	29.9	Very low	175 Å²	175	141.2 Å²	141.2	92%	0.916	78%	0.782	S	S	*	*				-162.2	127.1	68.2	-73.5	161.4	0	0	0	108.3
295	N	26.6	Very low	31.2	Very low	134 Å²	134	138.7 Å²	138.7	72%	0.717	77%	0.769	S	S	*	*			trans	-136.3	93.3	164.4	-157	6.6	0	0	0	108.9
296	E	30.1	Very low	32.9	Very low	192 Å²	192	136 Å²	136	90%	0.897	76%	0.755	S	S	*	*			trans	-104.5	101.5	154.6	-85.1	-155.6	138.6	0	0	109.1
297	K	34.3	Very low	34.6	Very low	187 Å²	187	127.5 Å²	127.5	81%	0.813	73%	0.731	S	S	*	*	S	Bend	trans	43.3	84.5	155.9	-69.3	179.1	177.1	170.9	0	115.3
298	H	27.2	Very low	36.7	Very low	179 Å²	179	126 Å²	126	83%	0.829	72%	0.718	S	S	*	*	S	Bend		-148.1	148.6	121.3	-91.2	75.2	0	0	0	107
299	G	24.6	Very low	39	Very low	77 Å²	77	121.5 Å²	121.5	79%	0.794	70%	0.703	S	S	*	*			trans	-52.6	149.2	-162.7	0	0	0	0	0	116.8	A301	G299-A301 PolarHBondContact O-N 3.22Å
300	A	29.3	Very low	41.7	Very low	97 Å²	97	115.6 Å²	115.6	80%	0.802	67%	0.672	S	S	*	*			trans	-35.4	122.1	-178.9	0	0	0	0	0	115.7
301	A	32.2	Very low	44.4	Very low	83 Å²	83	113.3 Å²	113.3	69%	0.686	66%	0.662	S	S	*	*			trans	-110.7	32.1	166.9	0	0	0	0	0	112	G299 G303	G299-A301 PolarHBondContact O-N 3.22Å; A301-G303 PolarHBondContact O-N 3.24Å
302	A	33.7	Very low	47.2	Very low	91 Å²	91	108.7 Å²	108.7	75%	0.752	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	51.4	175.5	0	0	0	0	0	112.3
303	G	41.8	Very low	50.1	Low	44 Å²	44	105.4 Å²	105.4	45%	0.454	61%	0.61	S	S	.	*	T	Hydrogen-bonded Turn	trans	-159.8	9	-175.7	0	0	0	0	0	116.1	A301 V307	A301-G303 PolarHBondContact O-N 3.24Å; G303-V307 WeakPolarHBondContact O-CG2 3.33Å
304	K	48.7	Very low	53.1	Low	159 Å²	159	101.4 Å²	101.4	69%	0.691	58%	0.577	S	S	*	*	S	Bend	trans	-106.3	-43.4	172.8	-76.7	-176.3	177	176.5	0	111.8	V307 L308	K304-V307 PolarHBondContact O-N 2.98Å; K304-L308 WeakPolarHBondContact O-CG 3.44Å; K304-L308 PolarHBondContact O-N 3.27Å; K304-L308 VanDerWaalsContact O-N 3.1Å
305	D	53.4	Low	56.2	Low	114 Å²	114	93.3 Å²	93.3	61%	0.61	54%	0.535	S	S	*	.	H	α-helix	trans	-68.7	-46.8	-178.2	-62.8	-11.3	0	0	0	111.2	V307 L308 D309	D305-V307 PolarHBondContact O-N 2.96Å; D305-L308 PolarHBondContact O-N 3.25Å; D305-L308 VanDerWaalsContact O-N 3.14Å; D305-D309 PolarHBondContact O-N 3.37Å
306	D	60.5	Low	59.4	Low	100 Å²	100	88.2 Å²	88.2	54%	0.535	51%	0.507	S	S	.	.	H	α-helix	trans	-57.2	-35.7	174.5	-64.9	-19.2	0	0	0	112.8	I310	D306-I310 WeakPolarHBondContact O-CD1 3.42Å; D306-I310 WeakPolarHBondContact O-CG1 3.38Å; D306-I310 PolarHBondContact O-N 3.49Å; D306-I310 VanDerWaalsContact O-N 3.15Å
307	V	62.9	Low	62.4	Low	71 Å²	71	81.8 Å²	81.8	43%	0.43	48%	0.477	S	S	.	.	H	α-helix	trans	-72.3	-39.7	-179.6	176.4	0	0	0	0	111.2	G303 K304 D305 I310 E311	G303-V307 WeakPolarHBondContact O-CG2 3.33Å; K304-V307 PolarHBondContact O-N 2.98Å; D305-V307 PolarHBondContact O-N 2.96Å; V307-I310 PolarHBondContact O-N 2.86Å; V307-E311 WeakPolarHBondContact O-CG 3.47Å; V307-E311 PolarHBondContact O-N 3.42Å
308	L	70.6	Confident	65.4	Low	79 Å²	79	73.1 Å²	73.1	41%	0.414	44%	0.44	S	S	.	.	H	α-helix	trans	-67.1	-41.1	176.5	-71.3	169.2	0	0	0	111.2	K304 D305 I310 E311 I312	K304-L308 WeakPolarHBondContact O-CG 3.44Å; K304-L308 PolarHBondContact O-N 3.27Å; K304-L308 VanDerWaalsContact O-N 3.1Å; D305-L308 PolarHBondContact O-N 3.25Å; D305-L308 VanDerWaalsContact O-N 3.14Å; L308-I310 VanDerWaalsContact C-N 3.32Å; L308-I310 PolarHBondContact O-N 3.07Å; L308-E311 PolarHBondContact O-N 2.83Å; L308-E311 VanDerWaalsContact O-N 3.17Å; L308-I312 WeakPolarHBondContact O-CD1 3.2Å; L308-I312 WeakPolarHBondContact O-CG1 3.39Å; L308-I312 PolarHBondContact O-N 3.13Å
309	D	75.9	Confident	68.6	Low	91 Å²	91	64.7 Å²	64.7	49%	0.487	40%	0.401	S	S	.	.	H	α-helix	trans	-61.6	-41.2	176.1	-71.7	-15.2	0	0	0	111.4	D305 E311 I312 D313	D305-D309 PolarHBondContact O-N 3.37Å; D309-E311 PolarHBondContact O-N 3.3Å; D309-I312 PolarHBondContact O-N 3.33Å; D309-D313 WeakPolarHBondContact O-CB 3.39Å; D309-D313 PolarHBondContact O-N 3.21Å
310	I	81.1	Confident	72	Confident	45 Å²	45	61.6 Å²	61.6	23%	0.231	37%	0.367	C	S	.	.	H	α-helix	trans	-63.5	-42.1	174	-65.5	156.5	0	0	0	111.6	S248 D306 V307 L308 I312 S314	S248-I310 VanDerWaalsContact OG-CD1 3.25Å; S248-I310 WeakPolarHBondContact OG-CD1 2.73Å; D306-I310 WeakPolarHBondContact O-CD1 3.42Å; D306-I310 WeakPolarHBondContact O-CG1 3.38Å; D306-I310 PolarHBondContact O-N 3.49Å; D306-I310 VanDerWaalsContact O-N 3.15Å; V307-I310 PolarHBondContact O-N 2.86Å; L308-I310 VanDerWaalsContact C-N 3.32Å; L308-I310 PolarHBondContact O-N 3.07Å; I310-I312 VanDerWaalsContact C-N 3.34Å; I310-S314 WeakPolarHBondContact O-CB 3.46Å; I310-S314 PolarHBondContact O-N 3.22Å; I310-S314 PolarHBondContact O-OG 3.15Å
311	E	84.7	Confident	75.1	Confident	107 Å²	107	57 Å²	57	50%	0.5	33%	0.329	S	S	.	.	H	α-helix	trans	-63	-43	178.1	-76.7	-178.5	178.6	0	0	111	V307 L308 D309 S314 Y315	V307-E311 WeakPolarHBondContact O-CG 3.47Å; V307-E311 PolarHBondContact O-N 3.42Å; L308-E311 PolarHBondContact O-N 2.83Å; L308-E311 VanDerWaalsContact O-N 3.17Å; D309-E311 PolarHBondContact O-N 3.3Å; E311-S314 PolarHBondContact O-N 2.91Å; E311-S314 PolarHBondContact O-OG 2.92Å; E311-Y315 WeakPolarHBondContact O-CB 3.46Å; E311-Y315 PolarHBondContact O-N 3.46Å
312	I	87.1	Confident	78.2	Confident	16 Å²	16	53 Å²	53	8%	0.082	30%	0.296	C	S	.	.	H	α-helix	trans	-61.7	-52.4	176.2	-67.2	161.6	0	0	0	110.8	L308 D309 I310 S314 Y315 I316 T382 P385 I386	L308-I312 WeakPolarHBondContact O-CD1 3.2Å; L308-I312 WeakPolarHBondContact O-CG1 3.39Å; L308-I312 PolarHBondContact O-N 3.13Å; D309-I312 PolarHBondContact O-N 3.33Å; I310-I312 VanDerWaalsContact C-N 3.34Å; I312-S314 VanDerWaalsContact C-N 3.31Å; I312-S314 PolarHBondContact O-N 3.15Å; I312-Y315 PolarHBondContact O-N 3.49Å; I312-I316 HydrophobicContact CG2-CD1 3.92Å; I312-I316 WeakPolarHBondContact O-CG1 3.38Å; I312-I316 PolarHBondContact O-N 3.01Å; I312-T382 HydrophobicContact CD1-CG2 3.83Å; I312-P385 HydrophobicContact CG2-CB 4.21Å; I312-I386 HydrophobicContact CG1-CD1 4.33Å; I312-I386 HydrophobicContact CG2-CD1 4.29Å; I312-I386 HydrophobicContact CG2-CG1 3.91Å
313	D	87.8	Confident	81.1	Confident	83 Å²	83	48.7 Å²	48.7	44%	0.444	26%	0.26	S	S	.	.	H	α-helix	trans	-60.2	-43.3	179.2	-79.5	-14.1	0	0	0	111	D309 Y315 I316 H317	D309-D313 WeakPolarHBondContact O-CB 3.39Å; D309-D313 PolarHBondContact O-N 3.21Å; D313-Y315 VanDerWaalsContact C-N 3.31Å; D313-Y315 PolarHBondContact O-N 2.77Å; D313-I316 PolarHBondContact O-N 3.38Å; D313-H317 PolarHBondContact O-N 2.95Å; D313-H317 PolarHBondContact O-ND1 2.86Å
314	S	92.4	Very high	83.6	Confident	6 Å²	6	48.3 Å²	48.3	4%	0.042	25%	0.246	C	C	.	.	H	α-helix	trans	-61.5	-40.1	178	78.1	0	0	0	0	112.1	I310 E311 I312 C318	I310-S314 WeakPolarHBondContact O-CB 3.46Å; I310-S314 PolarHBondContact O-N 3.22Å; I310-S314 PolarHBondContact O-OG 3.15Å; E311-S314 PolarHBondContact O-N 2.91Å; E311-S314 PolarHBondContact O-OG 2.92Å; I312-S314 VanDerWaalsContact C-N 3.31Å; I312-S314 PolarHBondContact O-N 3.15Å; S314-C318 PolarHBondContact O-N 3.34Å; S314-C318 PolarHBondContact O-SG 2.91Å
315	Y	95.1	Very high	85.9	Confident	5 Å²	5	40.8 Å²	40.8	2%	0.02	21%	0.214	C	C	.	.	H	α-helix	trans	-68.9	-43	178.7	-176.7	-111	0	0	0	111.8	E311 I312 D313 H317 C318 I319 L357 E360 G361 I364 I386 L415 M419	E311-Y315 WeakPolarHBondContact O-CB 3.46Å; E311-Y315 PolarHBondContact O-N 3.46Å; I312-Y315 PolarHBondContact O-N 3.49Å; D313-Y315 VanDerWaalsContact C-N 3.31Å; D313-Y315 PolarHBondContact O-N 2.77Å; Y315-H317 VanDerWaalsContact C-N 3.35Å; Y315-H317 PolarHBondContact O-N 3.36Å; Y315-C318 WeakPolarHBondContact O-CB 3.34Å; Y315-C318 PolarHBondContact O-N 2.81Å; Y315-C318 VanDerWaalsContact O-N 3.14Å; Y315-I319 HydrophobicContact CE1-CD1 4.41Å; Y315-I319 HydrophobicContact CE1-CG1 4.22Å; Y315-I319 HydrophobicContact CE2-CD1 4.49Å; Y315-I319 PolarHBondContact O-N 2.97Å; Y315-I319 VanDerWaalsContact O-N 3.1Å; Y315-L357 HydrophobicContact CD2-CD1 4.35Å; Y315-L357 HydrophobicContact CE2-CD1 3.85Å; Y315-L357 HydrophobicContact CE2-CG 4.47Å; Y315-L357 WeakPolarHBondContact CE2-O 3.44Å; Y315-L357 PolarHBondContact OH-O 2.9Å; Y315-E360 HydrophobicContact CD2-CB 4.08Å; Y315-E360 HydrophobicContact CD2-CG 3.6Å; Y315-E360 HydrophobicContact CE2-CB 3.79Å; Y315-E360 HydrophobicContact CE2-CG 3.85Å; Y315-G361 VanDerWaalsContact OH-CA 3.3Å; Y315-G361 WeakPolarHBondContact OH-CA 3.42Å; Y315-G361 PolarHBondContact OH-N 3.37Å; Y315-I364 HydrophobicContact CD1-CD1 3.74Å; Y315-I364 HydrophobicContact CD2-CD1 4.29Å; Y315-I364 HydrophobicContact CE1-CD1 4.19Å; Y315-I364 HydrophobicContact CG-CD1 3.79Å; Y315-I386 HydrophobicContact CD1-CD1 4.09Å; Y315-I386 HydrophobicContact CD1-CG1 4.25Å; Y315-I386 HydrophobicContact CD1-CG2 3.68Å; Y315-I386 HydrophobicContact CE1-CG2 3.53Å; Y315-L415 VanDerWaalsContact OH-CD2 3.29Å; Y315-L415 WeakPolarHBondContact OH-CD2 3.32Å; Y315-M419 HydrophobicContact CE1-CE 4.39Å
316	I	94.2	Very high	87.9	Confident	26 Å²	26	35.4 Å²	35.4	13%	0.133	19%	0.185	C	C	.	.	H	α-helix	trans	-54.2	-51.6	173.5	-76	172.8	0	0	0	110.2	I312 D313 C318 I319 S320 P385 I386 H389	I312-I316 HydrophobicContact CG2-CD1 3.92Å; I312-I316 WeakPolarHBondContact O-CG1 3.38Å; I312-I316 PolarHBondContact O-N 3.01Å; D313-I316 PolarHBondContact O-N 3.38Å; I316-C318 VanDerWaalsContact C-N 3.3Å; I316-C318 PolarHBondContact O-N 2.86Å; I316-I319 WeakPolarHBondContact O-CB 3.5Å; I316-I319 PolarHBondContact O-N 3.29Å; I316-I319 VanDerWaalsContact O-N 3.14Å; I316-S320 PolarHBondContact O-N 3.09Å; I316-P385 HydrophobicContact CD1-CB 4.04Å; I316-I386 HydrophobicContact CG1-CG1 4.34Å; I316-H389 HydrophobicContact CG1-CB 4.22Å; I316-H389 HydrophobicContact CG2-CB 4.34Å; I316-H389 PolarHBondContact O-NE2 3.07Å
317	H	93.9	Very high	89.6	Confident	57 Å²	57	33.8 Å²	33.8	26%	0.264	17%	0.174	S	C	.	.	H	α-helix	trans	-65.2	-32.1	178.9	-70.8	82.6	0	0	0	113	L240 F244 D313 Y315 I319 S320 A321	L240-H317 HydrophobicContact CD2-CB 4.32Å; F244-H317 HydrophobicContact CE2-CB 3.72Å; F244-H317 AromaticContact CE2-CG 3.84Å; F244-H317 HydrophobicContact CZ-CB 3.94Å; F244-H317 AromaticContact CZ-CD2 3.75Å; F244-H317 AromaticContact CZ-CE1 3.89Å; F244-H317 AromaticContact CZ-CG 3.5Å; F244-H317 AromaticContact CZ-ND1 3.6Å; F244-H317 AromaticContact CZ-NE2 3.96Å; D313-H317 PolarHBondContact O-N 2.95Å; D313-H317 PolarHBondContact O-ND1 2.86Å; Y315-H317 VanDerWaalsContact C-N 3.35Å; Y315-H317 PolarHBondContact O-N 3.36Å; H317-I319 VanDerWaalsContact C-N 3.31Å; H317-I319 PolarHBondContact O-N 3.17Å; H317-S320 PolarHBondContact O-N 3Å; H317-A321 WeakPolarHBondContact O-CB 3.45Å; H317-A321 PolarHBondContact O-N 3.14Å
318	C	96.1	Very high	91.1	Very high	6 Å²	6	31.4 Å²	31.4	4%	0.041	16%	0.16	C	C	.	.	H	α-helix	trans	-66.3	-31.4	175.6	-71.2	0	0	0	0	112.7	I237 S314 Y315 I316 F322 L357	I237-C318 HydrophobicContact CG2-CB 3.97Å; S314-C318 PolarHBondContact O-N 3.34Å; S314-C318 PolarHBondContact O-SG 2.91Å; Y315-C318 WeakPolarHBondContact O-CB 3.34Å; Y315-C318 PolarHBondContact O-N 2.81Å; Y315-C318 VanDerWaalsContact O-N 3.14Å; I316-C318 VanDerWaalsContact C-N 3.3Å; I316-C318 PolarHBondContact O-N 2.86Å; C318-F322 WeakPolarHBondContact O-CB 3.34Å; C318-F322 PolarHBondContact O-N 2.92Å; C318-L357 HydrophobicContact CB-CD1 3.79Å
319	I	95.4	Very high	92.3	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-65.7	-53	174.3	-67	-74.8	0	0	0	110.6	Y315 I316 H317 A321 F322 V323 L357 M358 L390	Y315-I319 HydrophobicContact CE1-CD1 4.41Å; Y315-I319 HydrophobicContact CE1-CG1 4.22Å; Y315-I319 HydrophobicContact CE2-CD1 4.49Å; Y315-I319 PolarHBondContact O-N 2.97Å; Y315-I319 VanDerWaalsContact O-N 3.1Å; I316-I319 WeakPolarHBondContact O-CB 3.5Å; I316-I319 PolarHBondContact O-N 3.29Å; I316-I319 VanDerWaalsContact O-N 3.14Å; H317-I319 VanDerWaalsContact C-N 3.31Å; H317-I319 PolarHBondContact O-N 3.17Å; I319-A321 VanDerWaalsContact C-N 3.32Å; I319-A321 PolarHBondContact O-N 3.07Å; I319-F322 PolarHBondContact O-N 3.05Å; I319-V323 PolarHBondContact O-N 3.11Å; I319-L357 HydrophobicContact CD1-CD1 4.01Å; I319-L357 HydrophobicContact CD1-CD2 3.74Å; I319-L357 HydrophobicContact CD1-CG 3.76Å; I319-L357 HydrophobicContact CG1-CD1 4.41Å; I319-M358 HydrophobicContact CD1-CE 4.34Å; I319-L390 HydrophobicContact CB-CD2 4.36Å; I319-L390 HydrophobicContact CD1-CD2 3.47Å; I319-L390 VanDerWaalsContact CD1-CD2 3.47Å; I319-L390 HydrophobicContact CG1-CD2 3.65Å; I319-L390 HydrophobicContact CG2-CD2 3.94Å
320	S	94.3	Very high	93.3	Very high	12 Å²	12	26.1 Å²	26.1	8%	0.084	13%	0.129	C	C	.	.	H	α-helix	trans	-62.3	-40.3	176.5	-64.1	0	0	0	0	112.1	I316 H317 F322 V323 K324 H389	I316-S320 PolarHBondContact O-N 3.09Å; H317-S320 PolarHBondContact O-N 3Å; S320-F322 VanDerWaalsContact C-N 3.33Å; S320-F322 PolarHBondContact O-N 3.26Å; S320-V323 PolarHBondContact O-N 3.28Å; S320-K324 PolarHBondContact O-N 2.76Å; S320-K324 VanDerWaalsContact O-N 3.07Å; S320-H389 PolarHBondContact OG-CE1 3.45Å; S320-H389 PolarHBondContact OG-NE2 3.16Å
321	A	95.3	Very high	94	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-58.6	-44.1	175.9	0	0	0	0	0	112.1	I176 I180 L240 H317 I319 V323 K324 L325	I176-A321 HydrophobicContact CG2-CB 3.49Å; I176-A321 VanDerWaalsContact CG2-CB 3.49Å; I180-A321 HydrophobicContact CD1-CB 4.03Å; L240-A321 HydrophobicContact CD2-CB 3.55Å; H317-A321 WeakPolarHBondContact O-CB 3.45Å; H317-A321 PolarHBondContact O-N 3.14Å; I319-A321 VanDerWaalsContact C-N 3.32Å; I319-A321 PolarHBondContact O-N 3.07Å; A321-V323 VanDerWaalsContact C-N 3.3Å; A321-V323 PolarHBondContact O-N 3.47Å; A321-K324 PolarHBondContact O-N 2.96Å; A321-L325 VanDerWaalsContact O-CB 3.24Å; A321-L325 WeakPolarHBondContact O-CB 3.44Å; A321-L325 WeakPolarHBondContact O-CG 3.43Å; A321-L325 PolarHBondContact O-N 3.44Å
322	F	97.2	Very high	94.5	Very high	1 Å²	1	21.8 Å²	21.8	0%	0.004	12%	0.116	C	C	.	.	H	α-helix	trans	-58.2	-44.9	176.9	171.6	-92.8	0	0	0	111.3	I237 C318 I319 S320 A326 I350 A353 L354 L357 F397	I237-F322 HydrophobicContact CD1-CB 3.96Å; I237-F322 HydrophobicContact CD1-CD2 3.89Å; I237-F322 HydrophobicContact CD1-CG 4.43Å; C318-F322 WeakPolarHBondContact O-CB 3.34Å; C318-F322 PolarHBondContact O-N 2.92Å; I319-F322 PolarHBondContact O-N 3.05Å; S320-F322 VanDerWaalsContact C-N 3.33Å; S320-F322 PolarHBondContact O-N 3.26Å; F322-A326 HydrophobicContact CE1-CB 4.42Å; F322-A326 HydrophobicContact CZ-CB 4.36Å; F322-A326 WeakPolarHBondContact O-CB 3.45Å; F322-A326 PolarHBondContact O-N 2.74Å; F322-I350 HydrophobicContact CE2-CB 4.33Å; F322-I350 HydrophobicContact CZ-CB 4.27Å; F322-I350 HydrophobicContact CZ-CD1 4.48Å; F322-A353 HydrophobicContact CD2-CB 4.35Å; F322-A353 HydrophobicContact CE2-CB 4.3Å; F322-L354 HydrophobicContact CE1-CD1 4.15Å; F322-L354 HydrophobicContact CE2-CB 3.79Å; F322-L354 HydrophobicContact CE2-CD1 4.4Å; F322-L354 HydrophobicContact CZ-CB 3.84Å; F322-L354 HydrophobicContact CZ-CD1 3.96Å; F322-L354 HydrophobicContact CZ-CD2 4.31Å; F322-L354 HydrophobicContact CZ-CG 4.25Å; F322-L357 HydrophobicContact CB-CD2 3.57Å; F322-L357 HydrophobicContact CD1-CD2 4.32Å; F322-L357 HydrophobicContact CD2-CD2 4.26Å; F322-L357 HydrophobicContact CG-CD2 3.79Å; F322-F397 HydrophobicContact CD1-CD2 4.23Å; F322-F397 AromaticContact CD1-CE2 3.48Å; F322-F397 HydrophobicContact CD1-CE2 3.48Å; F322-F397 VanDerWaalsContact CD1-CE2 3.48Å; F322-F397 HydrophobicContact CD1-CZ 4.12Å; F322-F397 HydrophobicContact CE1-CD2 4.34Å; F322-F397 AromaticContact CE1-CE2 3.52Å; F322-F397 HydrophobicContact CE1-CE2 3.52Å; F322-F397 AromaticContact CE1-CZ 3.71Å; F322-F397 HydrophobicContact CE1-CZ 3.71Å
323	V	94.8	Very high	95	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-60.9	-54	180	175.5	0	0	0	0	110.9	I319 S320 A321 L325 A326 Q327 E396 F397	I319-V323 PolarHBondContact O-N 3.11Å; S320-V323 PolarHBondContact O-N 3.28Å; A321-V323 VanDerWaalsContact C-N 3.3Å; A321-V323 PolarHBondContact O-N 3.47Å; V323-L325 PolarHBondContact O-N 2.88Å; V323-A326 PolarHBondContact O-N 2.85Å; V323-Q327 VanDerWaalsContact O-CG 3.29Å; V323-Q327 WeakPolarHBondContact O-CG 3.28Å; V323-Q327 PolarHBondContact O-N 3.27Å; V323-E396 HydrophobicContact CG1-CB 4.28Å; V323-E396 VanDerWaalsContact CG1-CD 3.44Å; V323-E396 HydrophobicContact CG1-CG 3.59Å; V323-F397 HydrophobicContact CG2-CB 4.4Å; V323-F397 HydrophobicContact CG2-CD2 3.59Å; V323-F397 HydrophobicContact CG2-CE2 4.37Å; V323-F397 HydrophobicContact CG2-CG 4.41Å
324	K	94.3	Very high	95.4	Very high	35 Å²	35	19.8 Å²	19.8	15%	0.152	11%	0.108	C	C	.	.	H	α-helix	trans	-62.5	-42.9	-179.3	-64.4	-53.9	-172	-165	0	112.6	I180 D183 S320 A321 Q327 S328 E396	I180-K324 HydrophobicContact CG1-CG 4.37Å; D183-K324 IonicContact OD1-NZ 2.71Å; D183-K324 WeakPolarHBondContact OD2-CE 3.48Å; D183-K324 IonicContact OD2-NZ 3.41Å; D183-K324 PolarHBondContact OD2-NZ 2.82Å; S320-K324 PolarHBondContact O-N 2.76Å; S320-K324 VanDerWaalsContact O-N 3.07Å; A321-K324 PolarHBondContact O-N 2.96Å; K324-Q327 PolarHBondContact O-N 3.37Å; K324-S328 WeakPolarHBondContact O-CB 3.19Å; K324-S328 PolarHBondContact O-N 3.03Å; K324-E396 IonicContact NZ-OE1 3.8Å; K324-E396 PolarHBondContact NZ-OE1 2.99Å
325	L	96.1	Very high	95.5	Very high	2 Å²	2	24.4 Å²	24.4	1%	0.01	13%	0.128	C	C	.	.	H	α-helix	trans	-67.6	-39.9	177.7	-68	172.2	0	0	0	111.7	V171 I176 L194 L233 I237 A321 V323 S328 E329	V171-L325 HydrophobicContact CB-CD2 4.05Å; V171-L325 HydrophobicContact CG1-CD2 4.39Å; V171-L325 HydrophobicContact CG2-CD2 3.73Å; I176-L325 HydrophobicContact CD1-CD1 4.08Å; I176-L325 HydrophobicContact CG1-CD1 4.46Å; I176-L325 HydrophobicContact CG1-CD2 4.35Å; L194-L325 HydrophobicContact CD1-CD2 3.72Å; L233-L325 HydrophobicContact CD1-CB 3.38Å; L233-L325 HydrophobicContact CD1-CD1 4.02Å; L233-L325 HydrophobicContact CD1-CG 4.31Å; I237-L325 HydrophobicContact CG1-CD1 3.97Å; A321-L325 VanDerWaalsContact O-CB 3.24Å; A321-L325 WeakPolarHBondContact O-CB 3.44Å; A321-L325 WeakPolarHBondContact O-CG 3.43Å; A321-L325 PolarHBondContact O-N 3.44Å; V323-L325 PolarHBondContact O-N 2.88Å; L325-S328 PolarHBondContact O-N 3.16Å; L325-E329 WeakPolarHBondContact O-CB 3.38Å; L325-E329 VanDerWaalsContact O-CG 3.3Å; L325-E329 WeakPolarHBondContact O-CG 3.35Å; L325-E329 PolarHBondContact O-N 2.95Å
326	A	96.5	Very high	95.6	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-66.5	-39.2	177.3	0	0	0	0	0	112.1	F322 V323 S328 E329 Y330 F346 I350 T400	F322-A326 HydrophobicContact CE1-CB 4.42Å; F322-A326 HydrophobicContact CZ-CB 4.36Å; F322-A326 WeakPolarHBondContact O-CB 3.45Å; F322-A326 PolarHBondContact O-N 2.74Å; V323-A326 PolarHBondContact O-N 2.85Å; A326-S328 VanDerWaalsContact C-N 3.34Å; A326-E329 PolarHBondContact O-N 3.39Å; A326-Y330 WeakPolarHBondContact O-CB 3.48Å; A326-Y330 PolarHBondContact O-N 3.4Å; A326-F346 HydrophobicContact CB-CZ 4.23Å; A326-F346 WeakPolarHBondContact O-CE2 3.47Å; A326-I350 HydrophobicContact CB-CG2 4.35Å; A326-T400 HydrophobicContact CB-CG2 3.78Å
327	Q	95.1	Very high	95.6	Very high	67 Å²	67	23.3 Å²	23.3	31%	0.313	12%	0.123	S	C	.	.	H	α-helix	trans	-59.1	-46.8	171.6	-72.1	167.1	-6.7	0	0	111.1	V323 K324 Y330 A331 E396 T400	V323-Q327 VanDerWaalsContact O-CG 3.29Å; V323-Q327 WeakPolarHBondContact O-CG 3.28Å; V323-Q327 PolarHBondContact O-N 3.27Å; K324-Q327 PolarHBondContact O-N 3.37Å; Q327-Y330 WeakPolarHBondContact O-CB 3.25Å; Q327-Y330 PolarHBondContact O-N 3.43Å; Q327-A331 PolarHBondContact O-N 3.38Å; Q327-E396 PolarHBondContact NE2-OE1 3.3Å; Q327-T400 HydrophobicContact CG-CG2 3.83Å; Q327-T400 WeakPolarHBondContact CG-OG1 3.5Å; Q327-T400 PolarHBondContact NE2-OG1 2.84Å
328	S	95.2	Very high	95.6	Very high	20 Å²	20	22.3 Å²	22.3	14%	0.14	12%	0.122	C	C	.	.	H	α-helix	trans	-66.1	-39.4	179.2	-174	0	0	0	0	113	H196 K324 L325 A326 Y330 A331 L332	H196-S328 PolarHBondContact CD2-OG 3.01Å; H196-S328 PolarHBondContact NE2-OG 3.35Å; K324-S328 WeakPolarHBondContact O-CB 3.19Å; K324-S328 PolarHBondContact O-N 3.03Å; L325-S328 PolarHBondContact O-N 3.16Å; A326-S328 VanDerWaalsContact C-N 3.34Å; S328-Y330 VanDerWaalsContact C-N 3.32Å; S328-Y330 PolarHBondContact O-N 2.97Å; S328-A331 PolarHBondContact O-N 3.08Å; S328-L332 PolarHBondContact O-N 3.28Å; S328-L332 VanDerWaalsContact O-N 3.13Å
329	E	96.6	Very high	95.4	Very high	3 Å²	3	29.4 Å²	29.4	1%	0.014	16%	0.155	C	C	.	.	H	α-helix	trans	-64.9	-35.9	172.2	-72	-69.5	165.8	0	0	111.9	H196 R229 L325 A326 L333 L349	H196-E329 IonicContact CE1-OE1 3.8Å; H196-E329 IonicContact ND1-OE1 3.87Å; R229-E329 IonicContact CZ-OE1 3.2Å; R229-E329 IonicContact CZ-OE2 3.49Å; R229-E329 IonicContact NE-OE1 2.8Å; R229-E329 PolarHBondContact NE-OE1 3.18Å; R229-E329 IonicContact NE-OE2 3.52Å; R229-E329 PolarHBondContact NE-OE2 3.4Å; R229-E329 IonicContact NH2-OE1 2.77Å; R229-E329 PolarHBondContact NH2-OE1 3.47Å; R229-E329 IonicContact NH2-OE2 2.69Å; R229-E329 PolarHBondContact NH2-OE2 2.88Å; L325-E329 WeakPolarHBondContact O-CB 3.38Å; L325-E329 VanDerWaalsContact O-CG 3.3Å; L325-E329 WeakPolarHBondContact O-CG 3.35Å; L325-E329 PolarHBondContact O-N 2.95Å; A326-E329 PolarHBondContact O-N 3.39Å; E329-L333 WeakPolarHBondContact O-CB 3.5Å; E329-L333 PolarHBondContact O-N 2.87Å; E329-L349 HydrophobicContact CB-CD2 4.11Å; E329-L349 HydrophobicContact CG-CD2 4.11Å
330	Y	96.4	Very high	95.2	Very high	57 Å²	57	37.9 Å²	37.9	22%	0.224	19%	0.194	C	C	.	.	H	α-helix	trans	-65.9	-43.4	175.5	-169.7	-106	0	0	0	111.3	A326 Q327 S328 L333 T334 K343 F346	A326-Y330 WeakPolarHBondContact O-CB 3.48Å; A326-Y330 PolarHBondContact O-N 3.4Å; Q327-Y330 WeakPolarHBondContact O-CB 3.25Å; Q327-Y330 PolarHBondContact O-N 3.43Å; S328-Y330 VanDerWaalsContact C-N 3.32Å; S328-Y330 PolarHBondContact O-N 2.97Å; Y330-L333 HydrophobicContact CD2-CD2 4.43Å; Y330-L333 HydrophobicContact CE2-CD2 4.4Å; Y330-L333 PolarHBondContact O-N 3.25Å; Y330-T334 HydrophobicContact CD1-CG2 4.12Å; Y330-T334 HydrophobicContact CE1-CG2 3.71Å; Y330-T334 HydrophobicContact CE2-CG2 4.46Å; Y330-T334 WeakPolarHBondContact O-CG2 3.27Å; Y330-T334 PolarHBondContact O-N 3.18Å; Y330-K343 HydrophobicContact CE2-CD 4.26Å; Y330-K343 WeakPolarHBondContact OH-CE 3.5Å; Y330-K343 PolarHBondContact OH-NZ 3.02Å; Y330-F346 HydrophobicContact CD2-CB 3.97Å; Y330-F346 AromaticContact CD2-CD1 3.85Å; Y330-F346 HydrophobicContact CD2-CD1 3.85Å; Y330-F346 AromaticContact CD2-CD2 3.69Å; Y330-F346 HydrophobicContact CD2-CD2 3.69Å; Y330-F346 HydrophobicContact CD2-CE1 4.22Å; Y330-F346 HydrophobicContact CD2-CE2 4.08Å; Y330-F346 AromaticContact CD2-CG 3.55Å; Y330-F346 HydrophobicContact CD2-CG 3.55Å; Y330-F346 HydrophobicContact CD2-CZ 4.32Å; Y330-F346 HydrophobicContact CE2-CB 4.23Å; Y330-F346 HydrophobicContact CE2-CD1 4.32Å; Y330-F346 HydrophobicContact CE2-CG 4.18Å; Y330-F346 HydrophobicContact CG-CD2 4.37Å; Y330-F346 HydrophobicContact CG-CE2 4.36Å
331	A	95.1	Very high	95.2	Very high	49 Å²	49	39.6 Å²	39.6	41%	0.405	20%	0.2	S	C	.	.	H	α-helix	trans	-56	-53.2	175.1	0	0	0	0	0	111.2	Q327 S328 L333 T334	Q327-A331 PolarHBondContact O-N 3.38Å; S328-A331 PolarHBondContact O-N 3.08Å; A331-L333 VanDerWaalsContact C-N 3.31Å; A331-L333 PolarHBondContact O-N 3.39Å; A331-T334 PolarHBondContact O-N 3.22Å; A331-T334 VanDerWaalsContact O-N 3.15Å; A331-T334 PolarHBondContact O-OG1 2.86Å
332	L	96	Very high	95.2	Very high	12 Å²	12	40.8 Å²	40.8	6%	0.063	21%	0.206	C	C	.	.	H	α-helix	trans	-58.5	-42.3	176.5	-179.3	66.6	0	0	0	112.7	H196 L197 L202 S328 T334 E335 I336	H196-L332 HydrophobicContact CB-CD2 3.71Å; L197-L332 HydrophobicContact CD1-CD1 4.24Å; L197-L332 HydrophobicContact CD1-CD2 4.32Å; L202-L332 HydrophobicContact CD1-CD1 3.71Å; L202-L332 HydrophobicContact CD2-CD1 4.42Å; S328-L332 PolarHBondContact O-N 3.28Å; S328-L332 VanDerWaalsContact O-N 3.13Å; L332-T334 VanDerWaalsContact C-N 3.28Å; L332-T334 PolarHBondContact O-N 3.06Å; L332-E335 PolarHBondContact O-N 3.03Å; L332-I336 HydrophobicContact CD1-CD1 3.96Å; L332-I336 HydrophobicContact CG-CD1 4.02Å; L332-I336 PolarHBondContact O-N 3.37Å
333	L	96.8	Very high	95	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.5	-35.7	179.8	176.8	154.8	0	0	0	111.8	Y225 E329 Y330 A331 E335 I336 I337 Q342 T345 F346 L349	Y225-L333 HydrophobicContact CE1-CB 4.14Å; Y225-L333 HydrophobicContact CE1-CD1 4.09Å; Y225-L333 HydrophobicContact CE1-CG 4.14Å; Y225-L333 WeakPolarHBondContact OH-CA 3.47Å; E329-L333 WeakPolarHBondContact O-CB 3.5Å; E329-L333 PolarHBondContact O-N 2.87Å; Y330-L333 HydrophobicContact CD2-CD2 4.43Å; Y330-L333 HydrophobicContact CE2-CD2 4.4Å; Y330-L333 PolarHBondContact O-N 3.25Å; A331-L333 VanDerWaalsContact C-N 3.31Å; A331-L333 PolarHBondContact O-N 3.39Å; L333-E335 PolarHBondContact O-N 2.91Å; L333-I336 PolarHBondContact O-N 3.34Å; L333-I337 HydrophobicContact CD2-CB 4.25Å; L333-I337 HydrophobicContact CG-CB 4.19Å; L333-I337 HydrophobicContact CG-CG1 3.94Å; L333-I337 WeakPolarHBondContact O-CB 3.46Å; L333-I337 PolarHBondContact O-N 3.41Å; L333-Q342 HydrophobicContact CD2-CB 3.62Å; L333-Q342 HydrophobicContact CD2-CG 3.73Å; L333-T345 HydrophobicContact CD1-CG2 3.96Å; L333-F346 HydrophobicContact CD1-CB 3.8Å; L333-F346 HydrophobicContact CD1-CD2 4.4Å; L333-L349 HydrophobicContact CD1-CD1 4.22Å
334	T	95.8	Very high	95.1	Very high	57 Å²	57	51.9 Å²	51.9	35%	0.35	25%	0.254	S	S	.	.	H	α-helix	trans	-66.7	-25.5	179.7	58.1	0	0	0	0	113.7	Y330 A331 L332 Q342	Y330-T334 HydrophobicContact CD1-CG2 4.12Å; Y330-T334 HydrophobicContact CE1-CG2 3.71Å; Y330-T334 HydrophobicContact CE2-CG2 4.46Å; Y330-T334 WeakPolarHBondContact O-CG2 3.27Å; Y330-T334 PolarHBondContact O-N 3.18Å; A331-T334 PolarHBondContact O-N 3.22Å; A331-T334 VanDerWaalsContact O-N 3.15Å; A331-T334 PolarHBondContact O-OG1 2.86Å; L332-T334 VanDerWaalsContact C-N 3.28Å; L332-T334 PolarHBondContact O-N 3.06Å; T334-Q342 PolarHBondContact O-NE2 3.38Å
335	E	95.6	Very high	95.2	Very high	102 Å²	102	50.7 Å²	50.7	48%	0.477	25%	0.25	S	C	.	.	H	α-helix	trans	-78	-33.4	176.1	-62.6	-175.4	-141	0	0	112.5	L202 I206 L332 L333	L202-E335 WeakPolarHBondContact CD2-OE2 3.48Å; I206-E335 HydrophobicContact CD1-CB 4.16Å; L332-E335 PolarHBondContact O-N 3.03Å; L333-E335 PolarHBondContact O-N 2.91Å
336	I	96	Very high	95.3	Very high	6 Å²	6	50.6 Å²	50.6	3%	0.031	25%	0.249	C	C	.	.	H	α-helix	trans	-97.2	-40.1	-171.7	-60.5	166.8	0	0	0	112.1	F160 L202 I205 I206 S209 Y225 L332 L333	F160-I336 HydrophobicContact CE2-CG2 4.19Å; F160-I336 HydrophobicContact CZ-CG2 4.33Å; L202-I336 HydrophobicContact CD1-CD1 3.84Å; L202-I336 HydrophobicContact CD1-CG1 3.93Å; I205-I336 HydrophobicContact CG2-CD1 3.82Å; I205-I336 HydrophobicContact CG2-CG1 4.01Å; I205-I336 HydrophobicContact CG2-CG2 3.78Å; I206-I336 HydrophobicContact CG1-CG1 4.16Å; S209-I336 WeakPolarHBondContact CB-O 3.37Å; S209-I336 PolarHBondContact OG-O 3.34Å; Y225-I336 HydrophobicContact CD2-CD1 4.43Å; Y225-I336 HydrophobicContact CD2-CG2 4.33Å; Y225-I336 HydrophobicContact CE2-CB 4.47Å; Y225-I336 HydrophobicContact CE2-CD1 3.57Å; Y225-I336 HydrophobicContact CE2-CG2 4.32Å; L332-I336 HydrophobicContact CD1-CD1 3.96Å; L332-I336 HydrophobicContact CG-CD1 4.02Å; L332-I336 PolarHBondContact O-N 3.37Å; L333-I336 PolarHBondContact O-N 3.34Å
337	I	95.8	Very high	95.3	Very high	3 Å²	3	51.8 Å²	51.8	2%	0.015	26%	0.256	C	S	.	.	S	Bend	trans	-100	134.7	-169.4	-56.8	-62.7	0	0	0	110.7	F221 M222 Y225 L333 H341 Q342 T345	F221-I337 HydrophobicContact CE2-CD1 4.38Å; M222-I337 HydrophobicContact CB-CD1 4.35Å; M222-I337 HydrophobicContact CG-CD1 4.1Å; M222-I337 HydrophobicContact SD-CG2 4.29Å; Y225-I337 HydrophobicContact CD1-CD1 4Å; Y225-I337 HydrophobicContact CD1-CG1 4.07Å; Y225-I337 HydrophobicContact CE1-CG1 4.18Å; Y225-I337 HydrophobicContact CG-CD1 4.11Å; L333-I337 HydrophobicContact CD2-CB 4.25Å; L333-I337 HydrophobicContact CG-CB 4.19Å; L333-I337 HydrophobicContact CG-CG1 3.94Å; L333-I337 WeakPolarHBondContact O-CB 3.46Å; L333-I337 PolarHBondContact O-N 3.41Å; I337-H341 HydrophobicContact CG2-CB 3.93Å; I337-Q342 HydrophobicContact CB-CG 4.31Å; I337-Q342 HydrophobicContact CG2-CG 4.27Å; I337-Q342 VanDerWaalsContact O-CG 3.26Å; I337-Q342 WeakPolarHBondContact O-CG 3.47Å; I337-Q342 PolarHBondContact O-NE2 3.2Å; I337-T345 HydrophobicContact CD1-CG2 4.49Å; I337-T345 HydrophobicContact CG1-CG2 4.26Å
338	P	93.1	Very high	95.5	Very high	36 Å²	36	50.6 Å²	50.6	23%	0.234	26%	0.255	C	S	.	.			trans	-59.1	142.1	177.3	-24.4	33.4	0	0	0	113.5	V213 M222 H340 H341 Q342	V213-P338 HydrophobicContact CB-CG 4.3Å; V213-P338 HydrophobicContact CG1-CG 4Å; V213-P338 HydrophobicContact CG2-CG 3.33Å; M222-P338 HydrophobicContact CE-CG 3.96Å; P338-H340 VanDerWaalsContact C-N 3.3Å; P338-H340 PolarHBondContact O-N 3.09Å; P338-H340 VanDerWaalsContact O-N 3.09Å; P338-H341 PolarHBondContact O-N 2.87Å; P338-Q342 WeakPolarHBondContact O-CG 3.45Å; P338-Q342 PolarHBondContact O-N 2.66Å
339	E	92.4	Very high	95.6	Very high	155 Å²	155	49.7 Å²	49.7	72%	0.724	25%	0.248	S	C	*	.	H	α-helix	trans	-45.2	-47.5	-173.2	-167.1	-179.1	172	0	0	114.1	H341 Q342	E339-H341 PolarHBondContact O-N 3.39Å; E339-H341 VanDerWaalsContact O-N 3.16Å; E339-Q342 PolarHBondContact O-N 3.14Å
340	H	91.3	Very high	95.7	Very high	178 Å²	178	49.5 Å²	49.5	82%	0.824	25%	0.247	S	C	*	.	H	α-helix	trans	-61.4	-25.3	-179.7	-63.5	-57.7	0	0	0	114.5	P338	P338-H340 VanDerWaalsContact C-N 3.3Å; P338-H340 PolarHBondContact O-N 3.09Å; P338-H340 VanDerWaalsContact O-N 3.09Å
341	H	93	Very high	95.8	Very high	48 Å²	48	49.1 Å²	49.1	22%	0.222	25%	0.248	C	C	.	.	H	α-helix	trans	-103.2	-9.1	-177.6	-67.4	-72.3	0	0	0	113.4	Q219 M222 I337 P338 E339 K343 K344 T345	Q219-H341 PolarHBondContact NE2-CE1 2.9Å; Q219-H341 VanDerWaalsContact NE2-CE1 3.29Å; Q219-H341 PolarHBondContact NE2-NE2 3.32Å; Q219-H341 VanDerWaalsContact NE2-NE2 3.2Å; Q219-H341 PolarHBondContact OE1-CE1 3.28Å; Q219-H341 PolarHBondContact OE1-ND1 3.46Å; M222-H341 HydrophobicContact CE-CB 4.21Å; M222-H341 HydrophobicContact SD-CB 3.58Å; M222-H341 VanDerWaalsContact SD-CB 3.58Å; I337-H341 HydrophobicContact CG2-CB 3.93Å; P338-H341 PolarHBondContact O-N 2.87Å; E339-H341 PolarHBondContact O-N 3.39Å; E339-H341 VanDerWaalsContact O-N 3.16Å; H341-K343 PolarHBondContact O-N 3.4Å; H341-K344 PolarHBondContact O-N 2.92Å; H341-T345 VanDerWaalsContact O-CB 3.29Å; H341-T345 WeakPolarHBondContact O-CB 3.26Å; H341-T345 PolarHBondContact O-N 2.95Å; H341-T345 PolarHBondContact O-OG1 2.88Å
342	Q	95.3	Very high	95.9	Very high	26 Å²	26	51 Å²	51	12%	0.121	25%	0.248	C	C	.	.	H	α-helix	trans	-59.4	-51.2	-172.3	-71.6	175	-4.6	0	0	112.3	L333 T334 I337 P338 E339 K344 T345 F346	L333-Q342 HydrophobicContact CD2-CB 3.62Å; L333-Q342 HydrophobicContact CD2-CG 3.73Å; T334-Q342 PolarHBondContact O-NE2 3.38Å; I337-Q342 HydrophobicContact CB-CG 4.31Å; I337-Q342 HydrophobicContact CG2-CG 4.27Å; I337-Q342 VanDerWaalsContact O-CG 3.26Å; I337-Q342 WeakPolarHBondContact O-CG 3.47Å; I337-Q342 PolarHBondContact O-NE2 3.2Å; P338-Q342 WeakPolarHBondContact O-CG 3.45Å; P338-Q342 PolarHBondContact O-N 2.66Å; E339-Q342 PolarHBondContact O-N 3.14Å; Q342-K344 PolarHBondContact O-N 3.21Å; Q342-T345 PolarHBondContact O-N 3.09Å; Q342-F346 VanDerWaalsContact O-CB 3.25Å; Q342-F346 WeakPolarHBondContact O-CB 3.24Å; Q342-F346 PolarHBondContact O-N 3.13Å
343	K	95.1	Very high	96	Very high	80 Å²	80	50.5 Å²	50.5	35%	0.348	25%	0.246	S	C	.	.	H	α-helix	trans	-62.6	-42.8	-176.7	-63.7	-56.9	-172.7	-179.5	0	113.1	Y330 H341 D347 Q402	Y330-K343 HydrophobicContact CE2-CD 4.26Å; Y330-K343 WeakPolarHBondContact OH-CE 3.5Å; Y330-K343 PolarHBondContact OH-NZ 3.02Å; H341-K343 PolarHBondContact O-N 3.4Å; K343-D347 WeakPolarHBondContact O-CB 3.44Å; K343-D347 PolarHBondContact O-N 3.14Å; K343-Q402 PolarHBondContact NZ-O 3.34Å
344	K	95.2	Very high	96.1	Very high	154 Å²	154	50.5 Å²	50.5	67%	0.67	25%	0.246	S	C	*	.	H	α-helix	trans	-67.8	-41.5	178.3	-175.2	-175.7	176.3	-171.9	0	111.9	H341 Q342 S348	H341-K344 PolarHBondContact O-N 2.92Å; Q342-K344 PolarHBondContact O-N 3.21Å; K344-S348 PolarHBondContact O-N 3.41Å; K344-S348 VanDerWaalsContact O-N 3.14Å; K344-S348 PolarHBondContact O-OG 3Å
345	T	96.5	Very high	96.2	Very high	9 Å²	9	51.2 Å²	51.2	6%	0.055	25%	0.247	C	C	.	.	H	α-helix	trans	-67.3	-43.7	179	-55.3	0	0	0	0	110.4	Y225 F226 L333 I337 H341 Q342 S348 L349	Y225-T345 HydrophobicContact CD1-CG2 4.18Å; F226-T345 HydrophobicContact CB-CG2 3.94Å; F226-T345 HydrophobicContact CD1-CG2 4.14Å; L333-T345 HydrophobicContact CD1-CG2 3.96Å; I337-T345 HydrophobicContact CD1-CG2 4.49Å; I337-T345 HydrophobicContact CG1-CG2 4.26Å; H341-T345 VanDerWaalsContact O-CB 3.29Å; H341-T345 WeakPolarHBondContact O-CB 3.26Å; H341-T345 PolarHBondContact O-N 2.95Å; H341-T345 PolarHBondContact O-OG1 2.88Å; Q342-T345 PolarHBondContact O-N 3.09Å; T345-S348 PolarHBondContact O-N 3.35Å; T345-L349 WeakPolarHBondContact O-CB 3.38Å; T345-L349 PolarHBondContact O-N 3.46Å
346	F	98.2	Very high	96.3	Very high	1 Å²	1	49 Å²	49	0%	0.004	24%	0.239	C	C	.	.	H	α-helix	trans	-62.1	-46.7	175.7	-179.8	-116.5	0	0	0	112	A326 Y330 L333 Q342 S348 L349 I350 T400 T404	A326-F346 HydrophobicContact CB-CZ 4.23Å; A326-F346 WeakPolarHBondContact O-CE2 3.47Å; Y330-F346 HydrophobicContact CD2-CB 3.97Å; Y330-F346 AromaticContact CD2-CD1 3.85Å; Y330-F346 HydrophobicContact CD2-CD1 3.85Å; Y330-F346 AromaticContact CD2-CD2 3.69Å; Y330-F346 HydrophobicContact CD2-CD2 3.69Å; Y330-F346 HydrophobicContact CD2-CE1 4.22Å; Y330-F346 HydrophobicContact CD2-CE2 4.08Å; Y330-F346 AromaticContact CD2-CG 3.55Å; Y330-F346 HydrophobicContact CD2-CG 3.55Å; Y330-F346 HydrophobicContact CD2-CZ 4.32Å; Y330-F346 HydrophobicContact CE2-CB 4.23Å; Y330-F346 HydrophobicContact CE2-CD1 4.32Å; Y330-F346 HydrophobicContact CE2-CG 4.18Å; Y330-F346 HydrophobicContact CG-CD2 4.37Å; Y330-F346 HydrophobicContact CG-CE2 4.36Å; L333-F346 HydrophobicContact CD1-CB 3.8Å; L333-F346 HydrophobicContact CD1-CD2 4.4Å; Q342-F346 VanDerWaalsContact O-CB 3.25Å; Q342-F346 WeakPolarHBondContact O-CB 3.24Å; Q342-F346 PolarHBondContact O-N 3.13Å; F346-S348 PolarHBondContact O-N 3.17Å; F346-L349 WeakPolarHBondContact O-CB 3.46Å; F346-L349 PolarHBondContact O-N 3.46Å; F346-L349 VanDerWaalsContact O-N 3.09Å; F346-I350 HydrophobicContact CD2-CG2 4.07Å; F346-I350 HydrophobicContact CE1-CD1 4.19Å; F346-I350 HydrophobicContact CE1-CG2 4.47Å; F346-I350 HydrophobicContact CE2-CG2 3.59Å; F346-I350 HydrophobicContact CZ-CD1 4.43Å; F346-I350 HydrophobicContact CZ-CG2 3.83Å; F346-I350 WeakPolarHBondContact O-CG1 3.43Å; F346-I350 PolarHBondContact O-N 3Å; F346-I350 VanDerWaalsContact O-N 3.14Å; F346-T400 WeakPolarHBondContact CE1-O 3.37Å; F346-T400 HydrophobicContact CZ-CG2 4.46Å; F346-T404 HydrophobicContact CD1-CG2 3.81Å; F346-T404 HydrophobicContact CE1-CG2 4.1Å
347	D	97.9	Very high	96.3	Very high	25 Å²	25	49.1 Å²	49.1	13%	0.134	24%	0.239	C	C	.	.	H	α-helix	trans	-56.2	-41	177.1	-167.3	17.5	0	0	0	111.3	K343 I350 Q351 T404 A405 T408	K343-D347 WeakPolarHBondContact O-CB 3.44Å; K343-D347 PolarHBondContact O-N 3.14Å; D347-I350 WeakPolarHBondContact O-CG1 3.48Å; D347-Q351 VanDerWaalsContact O-CG 3.24Å; D347-Q351 WeakPolarHBondContact O-CG 3.47Å; D347-Q351 PolarHBondContact O-NE2 2.85Å; D347-Q351 PolarHBondContact OD1-NE2 3.42Å; D347-T404 HydrophobicContact CB-CG2 4.02Å; D347-A405 WeakPolarHBondContact OD2-CB 3.28Å; D347-A405 PolarHBondContact OD2-N 2.91Å; D347-T408 VanDerWaalsContact OD1-CB 3.32Å; D347-T408 WeakPolarHBondContact OD1-CB 3.05Å; D347-T408 WeakPolarHBondContact OD1-CG2 2.94Å; D347-T408 PolarHBondContact OD1-OG1 2.84Å
348	S	97.9	Very high	96.4	Very high	42 Å²	42	49.6 Å²	49.6	29%	0.294	24%	0.242	S	C	.	.	H	α-helix	trans	-70.8	-37.6	176.6	-53.6	0	0	0	0	112.9	K344 T345 F346 I350	K344-S348 PolarHBondContact O-N 3.41Å; K344-S348 VanDerWaalsContact O-N 3.14Å; K344-S348 PolarHBondContact O-OG 3Å; T345-S348 PolarHBondContact O-N 3.35Å; F346-S348 PolarHBondContact O-N 3.17Å; S348-I350 PolarHBondContact O-N 3.35Å
349	L	98.4	Very high	96.6	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-60.3	-44.8	179.8	-171.1	157.7	0	0	0	111.5	Y225 F226 R229 S230 L233 E329 L333 T345 F346	Y225-L349 HydrophobicContact CE1-CD1 4Å; F226-L349 HydrophobicContact CB-CB 3.87Å; F226-L349 HydrophobicContact CB-CD1 4.5Å; F226-L349 HydrophobicContact CB-CG 4.36Å; R229-L349 HydrophobicContact CB-CD1 3.62Å; R229-L349 HydrophobicContact CB-CD2 4.48Å; R229-L349 HydrophobicContact CB-CG 3.99Å; R229-L349 HydrophobicContact CG-CD1 4.34Å; S230-L349 WeakPolarHBondContact CA-O 3.42Å; S230-L349 WeakPolarHBondContact CB-O 3.07Å; S230-L349 PolarHBondContact OG-O 3.36Å; L233-L349 HydrophobicContact CD2-CD2 3.89Å; E329-L349 HydrophobicContact CB-CD2 4.11Å; E329-L349 HydrophobicContact CG-CD2 4.11Å; L333-L349 HydrophobicContact CD1-CD1 4.22Å; T345-L349 WeakPolarHBondContact O-CB 3.38Å; T345-L349 PolarHBondContact O-N 3.46Å; F346-L349 WeakPolarHBondContact O-CB 3.46Å; F346-L349 PolarHBondContact O-N 3.46Å; F346-L349 VanDerWaalsContact O-N 3.09Å
350	I	98.3	Very high	96.7	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-83.1	-11.9	-172.7	64.8	173.6	0	0	0	114.2	L233 F322 A326 F346 D347 S348 E352 A353 L354 L401 T404 T408	L233-I350 HydrophobicContact CD2-CG2 4.18Å; F322-I350 HydrophobicContact CE2-CB 4.33Å; F322-I350 HydrophobicContact CZ-CB 4.27Å; F322-I350 HydrophobicContact CZ-CD1 4.48Å; A326-I350 HydrophobicContact CB-CG2 4.35Å; F346-I350 HydrophobicContact CD2-CG2 4.07Å; F346-I350 HydrophobicContact CE1-CD1 4.19Å; F346-I350 HydrophobicContact CE1-CG2 4.47Å; F346-I350 HydrophobicContact CE2-CG2 3.59Å; F346-I350 HydrophobicContact CZ-CD1 4.43Å; F346-I350 HydrophobicContact CZ-CG2 3.83Å; F346-I350 WeakPolarHBondContact O-CG1 3.43Å; F346-I350 PolarHBondContact O-N 3Å; F346-I350 VanDerWaalsContact O-N 3.14Å; D347-I350 WeakPolarHBondContact O-CG1 3.48Å; S348-I350 PolarHBondContact O-N 3.35Å; I350-E352 PolarHBondContact O-N 3.44Å; I350-A353 PolarHBondContact O-N 3.05Å; I350-L354 WeakPolarHBondContact O-CB 3.14Å; I350-L354 PolarHBondContact O-N 3.33Å; I350-L401 HydrophobicContact CD1-CD2 3.29Å; I350-T404 HydrophobicContact CD1-CG2 4.34Å; I350-T408 HydrophobicContact CD1-CG2 3.98Å
351	Q	98	Very high	96.9	Very high	49 Å²	49	39 Å²	39	23%	0.229	19%	0.192	C	C	.	.	H	α-helix	trans	-56.2	-51.6	-170.4	-72.4	-52.5	-67.1	0	0	112.8	D347 A353 L354 D355 T408	D347-Q351 VanDerWaalsContact O-CG 3.24Å; D347-Q351 WeakPolarHBondContact O-CG 3.47Å; D347-Q351 PolarHBondContact O-NE2 2.85Å; D347-Q351 PolarHBondContact OD1-NE2 3.42Å; Q351-A353 PolarHBondContact O-N 2.71Å; Q351-L354 PolarHBondContact O-N 3.12Å; Q351-D355 VanDerWaalsContact O-CB 3.3Å; Q351-D355 WeakPolarHBondContact O-CB 3.45Å; Q351-D355 PolarHBondContact O-N 2.91Å; Q351-T408 PolarHBondContact NE2-OG1 3.33Å
352	E	97.9	Very high	97	Very high	88 Å²	88	40.1 Å²	40.1	41%	0.411	20%	0.199	S	C	.	.	H	α-helix	trans	-60.7	-49.1	-174.7	-176	175.9	-176.6	0	0	111.9	D234 I350 N356	D234-E352 HydrophobicContact CB-CG 4.37Å; I350-E352 PolarHBondContact O-N 3.44Å; E352-N356 WeakPolarHBondContact O-CB 3.31Å; E352-N356 VanDerWaalsContact O-CG 3.27Å; E352-N356 PolarHBondContact O-N 3.04Å; E352-N356 PolarHBondContact O-ND2 3.28Å
353	A	98.2	Very high	97	Very high	2 Å²	2	42.6 Å²	42.6	2%	0.017	21%	0.214	C	C	.	.	H	α-helix	trans	-62.5	-44.2	178.1	0	0	0	0	0	111.9	L233 D234 I237 F322 I350 Q351 L357	L233-A353 HydrophobicContact CD2-CB 3.79Å; L233-A353 HydrophobicContact CG-CB 3.73Å; D234-A353 HydrophobicContact CB-CB 4.17Å; I237-A353 HydrophobicContact CD1-CB 4.02Å; F322-A353 HydrophobicContact CD2-CB 4.35Å; F322-A353 HydrophobicContact CE2-CB 4.3Å; I350-A353 PolarHBondContact O-N 3.05Å; Q351-A353 PolarHBondContact O-N 2.71Å; A353-L357 WeakPolarHBondContact O-CB 3.45Å; A353-L357 PolarHBondContact O-N 2.59Å; A353-L357 VanDerWaalsContact O-N 3.07Å
354	L	98	Very high	96.9	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-67.2	-44.5	179.4	179.2	54.9	0	0	0	111.8	F322 I350 Q351 N356 L357 M358 F397 L401 T408 K411	F322-L354 HydrophobicContact CE1-CD1 4.15Å; F322-L354 HydrophobicContact CE2-CB 3.79Å; F322-L354 HydrophobicContact CE2-CD1 4.4Å; F322-L354 HydrophobicContact CZ-CB 3.84Å; F322-L354 HydrophobicContact CZ-CD1 3.96Å; F322-L354 HydrophobicContact CZ-CD2 4.31Å; F322-L354 HydrophobicContact CZ-CG 4.25Å; I350-L354 WeakPolarHBondContact O-CB 3.14Å; I350-L354 PolarHBondContact O-N 3.33Å; Q351-L354 PolarHBondContact O-N 3.12Å; L354-N356 PolarHBondContact O-N 3.19Å; L354-L357 WeakPolarHBondContact O-CB 3.36Å; L354-L357 PolarHBondContact O-N 3Å; L354-M358 HydrophobicContact CD1-CE 4.06Å; L354-M358 HydrophobicContact CD1-CG 3.97Å; L354-M358 HydrophobicContact CD1-SD 4.34Å; L354-M358 HydrophobicContact CG-CG 4.38Å; L354-M358 WeakPolarHBondContact O-CG 3.3Å; L354-M358 PolarHBondContact O-N 3.05Å; L354-F397 HydrophobicContact CD1-CE2 4.47Å; L354-F397 HydrophobicContact CD1-CZ 3.65Å; L354-L401 HydrophobicContact CD2-CD1 4.42Å; L354-T408 HydrophobicContact CD2-CG2 3.67Å; L354-K411 HydrophobicContact CD2-CD 3.88Å; L354-K411 HydrophobicContact CG-CD 3.94Å
355	D	98.2	Very high	96.9	Very high	72 Å²	72	33 Å²	33	39%	0.385	17%	0.173	S	C	.	.	H	α-helix	trans	-62.4	-42.8	178.7	-79.1	-36.7	0	0	0	111.8	Q351 L357 M358 L359 K411	Q351-D355 VanDerWaalsContact O-CB 3.3Å; Q351-D355 WeakPolarHBondContact O-CB 3.45Å; Q351-D355 PolarHBondContact O-N 2.91Å; D355-L357 VanDerWaalsContact C-N 3.31Å; D355-L357 PolarHBondContact O-N 3.28Å; D355-M358 PolarHBondContact O-N 3.12Å; D355-L359 VanDerWaalsContact O-CB 3.26Å; D355-L359 WeakPolarHBondContact O-CB 3.4Å; D355-L359 PolarHBondContact O-N 2.95Å; D355-K411 VanDerWaalsContact OD1-CE 3.31Å; D355-K411 WeakPolarHBondContact OD1-CE 3.41Å; D355-K411 IonicContact OD1-NZ 2.67Å; D355-K411 PolarHBondContact OD1-NZ 3.04Å; D355-K411 IonicContact OD2-NZ 3.77Å; D355-K411 PolarHBondContact OD2-NZ 3.38Å
356	N	97.7	Very high	96.8	Very high	56 Å²	56	34.8 Å²	34.8	30%	0.299	19%	0.186	S	C	.	.	H	α-helix	trans	-63.5	-38.5	175.7	-72.4	-27.9	0	0	0	111.8	D234 K238 E352 L354 E360	D234-N356 PolarHBondContact OD1-ND2 3.13Å; K238-N356 PolarHBondContact NZ-ND2 2.72Å; K238-N356 VanDerWaalsContact NZ-ND2 3.14Å; E352-N356 WeakPolarHBondContact O-CB 3.31Å; E352-N356 VanDerWaalsContact O-CG 3.27Å; E352-N356 PolarHBondContact O-N 3.04Å; E352-N356 PolarHBondContact O-ND2 3.28Å; L354-N356 PolarHBondContact O-N 3.19Å; N356-E360 PolarHBondContact O-N 3.19Å; N356-E360 VanDerWaalsContact O-N 3.09Å
357	L	96.8	Very high	96.5	Very high	7 Å²	7	36.9 Å²	36.9	4%	0.037	20%	0.203	C	C	.	.	H	α-helix	trans	-66.8	-43.6	176.8	-171	63.5	0	0	0	111.9	Y315 C318 I319 F322 A353 L354 D355 E360 G361	Y315-L357 HydrophobicContact CD2-CD1 4.35Å; Y315-L357 HydrophobicContact CE2-CD1 3.85Å; Y315-L357 HydrophobicContact CE2-CG 4.47Å; Y315-L357 WeakPolarHBondContact CE2-O 3.44Å; Y315-L357 PolarHBondContact OH-O 2.9Å; C318-L357 HydrophobicContact CB-CD1 3.79Å; I319-L357 HydrophobicContact CD1-CD1 4.01Å; I319-L357 HydrophobicContact CD1-CD2 3.74Å; I319-L357 HydrophobicContact CD1-CG 3.76Å; I319-L357 HydrophobicContact CG1-CD1 4.41Å; F322-L357 HydrophobicContact CB-CD2 3.57Å; F322-L357 HydrophobicContact CD1-CD2 4.32Å; F322-L357 HydrophobicContact CD2-CD2 4.26Å; F322-L357 HydrophobicContact CG-CD2 3.79Å; A353-L357 WeakPolarHBondContact O-CB 3.45Å; A353-L357 PolarHBondContact O-N 2.59Å; A353-L357 VanDerWaalsContact O-N 3.07Å; L354-L357 WeakPolarHBondContact O-CB 3.36Å; L354-L357 PolarHBondContact O-N 3Å; D355-L357 VanDerWaalsContact C-N 3.31Å; D355-L357 PolarHBondContact O-N 3.28Å; L357-E360 WeakPolarHBondContact O-CB 3.27Å; L357-E360 PolarHBondContact O-N 3.34Å; L357-G361 PolarHBondContact O-N 2.97Å; L357-G361 VanDerWaalsContact O-N 3.17Å
358	M	97.1	Very high	96.2	Very high	13 Å²	13	35.9 Å²	35.9	6%	0.064	20%	0.199	C	C	.	.	H	α-helix	trans	-66.5	-40.4	176.6	-62.9	-65.5	96.3	0	0	112	I319 L354 D355 E360 G361 D362 K411 L415	I319-M358 HydrophobicContact CD1-CE 4.34Å; L354-M358 HydrophobicContact CD1-CE 4.06Å; L354-M358 HydrophobicContact CD1-CG 3.97Å; L354-M358 HydrophobicContact CD1-SD 4.34Å; L354-M358 HydrophobicContact CG-CG 4.38Å; L354-M358 WeakPolarHBondContact O-CG 3.3Å; L354-M358 PolarHBondContact O-N 3.05Å; D355-M358 PolarHBondContact O-N 3.12Å; M358-E360 VanDerWaalsContact C-N 3.27Å; M358-E360 PolarHBondContact O-N 3.47Å; M358-G361 WeakPolarHBondContact O-CA 3.16Å; M358-G361 PolarHBondContact O-N 3.32Å; M358-G361 VanDerWaalsContact O-N 3.13Å; M358-D362 PolarHBondContact O-N 2.85Å; M358-K411 HydrophobicContact CG-CB 3.92Å; M358-K411 HydrophobicContact CG-CD 4.41Å; M358-K411 HydrophobicContact SD-CB 3.98Å; M358-L415 HydrophobicContact CE-CD2 3.93Å; M358-L415 HydrophobicContact SD-CB 4.17Å; M358-L415 HydrophobicContact SD-CD2 3.99Å
359	L	96.8	Very high	96	Very high	94 Å²	94	38.8 Å²	38.8	49%	0.492	20%	0.203	S	C	.	.	H	α-helix	trans	-59.7	-38.8	175.2	179.7	63.6	0	0	0	111.8	D355 D362 N363	D355-L359 VanDerWaalsContact O-CB 3.26Å; D355-L359 WeakPolarHBondContact O-CB 3.4Å; D355-L359 PolarHBondContact O-N 2.95Å; L359-D362 PolarHBondContact O-N 3.5Å; L359-N363 PolarHBondContact O-N 3.35Å; L359-N363 PolarHBondContact O-ND2 3.45Å
360	E	94.7	Very high	95.8	Very high	54 Å²	54	45.6 Å²	45.6	25%	0.252	23%	0.229	S	C	.	.	H	α-helix	trans	-63.3	-45.1	174.1	-170.8	70.2	-160.2	0	0	111.4	K241 Y315 N356 L357 M358 D362 N363 I364	K241-E360 IonicContact NZ-OE1 3.82Å; K241-E360 PolarHBondContact NZ-OE1 3.1Å; K241-E360 IonicContact NZ-OE2 3.5Å; K241-E360 PolarHBondContact NZ-OE2 3.1Å; Y315-E360 HydrophobicContact CD2-CB 4.08Å; Y315-E360 HydrophobicContact CD2-CG 3.6Å; Y315-E360 HydrophobicContact CE2-CB 3.79Å; Y315-E360 HydrophobicContact CE2-CG 3.85Å; N356-E360 PolarHBondContact O-N 3.19Å; N356-E360 VanDerWaalsContact O-N 3.09Å; L357-E360 WeakPolarHBondContact O-CB 3.27Å; L357-E360 PolarHBondContact O-N 3.34Å; M358-E360 VanDerWaalsContact C-N 3.27Å; M358-E360 PolarHBondContact O-N 3.47Å; E360-D362 VanDerWaalsContact C-N 3.33Å; E360-D362 PolarHBondContact O-N 3.18Å; E360-N363 WeakPolarHBondContact O-CB 3.34Å; E360-N363 PolarHBondContact O-N 3.14Å; E360-N363 VanDerWaalsContact O-N 3.14Å; E360-I364 WeakPolarHBondContact O-CG1 3.4Å; E360-I364 PolarHBondContact O-N 3.37Å
361	G	95.2	Very high	95.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-57.6	-43.4	172.8	0	0	0	0	0	113	Y315 L357 M358 N363 I364 V365	Y315-G361 VanDerWaalsContact OH-CA 3.3Å; Y315-G361 WeakPolarHBondContact OH-CA 3.42Å; Y315-G361 PolarHBondContact OH-N 3.37Å; L357-G361 PolarHBondContact O-N 2.97Å; L357-G361 VanDerWaalsContact O-N 3.17Å; M358-G361 WeakPolarHBondContact O-CA 3.16Å; M358-G361 PolarHBondContact O-N 3.32Å; M358-G361 VanDerWaalsContact O-N 3.13Å; G361-N363 VanDerWaalsContact C-N 3.31Å; G361-N363 PolarHBondContact O-N 3.14Å; G361-I364 WeakPolarHBondContact O-CB 3.43Å; G361-I364 PolarHBondContact O-N 3.35Å; G361-V365 WeakPolarHBondContact O-CG2 3.31Å; G361-V365 PolarHBondContact O-N 3Å
362	D	95.9	Very high	95.1	Very high	70 Å²	70	44.1 Å²	44.1	37%	0.374	23%	0.225	S	C	.	.	H	α-helix	trans	-66.3	-32.1	176.3	-80.3	-31.4	0	0	0	112.6	M358 L359 E360 V365 S366	M358-D362 PolarHBondContact O-N 2.85Å; L359-D362 PolarHBondContact O-N 3.5Å; E360-D362 VanDerWaalsContact C-N 3.33Å; E360-D362 PolarHBondContact O-N 3.18Å; D362-V365 PolarHBondContact O-N 3.46Å; D362-S366 VanDerWaalsContact O-CB 3.28Å; D362-S366 WeakPolarHBondContact O-CB 3.29Å; D362-S366 PolarHBondContact O-N 3.34Å; D362-S366 PolarHBondContact O-OG 3.4Å
363	N	94.6	Very high	94.8	Very high	79 Å²	79	45.1 Å²	45.1	42%	0.422	23%	0.231	S	C	.	.	H	α-helix	trans	-65.2	-40.1	172.8	-73.4	-33	0	0	0	111.5	L359 E360 G361 S366 A367	L359-N363 PolarHBondContact O-N 3.35Å; L359-N363 PolarHBondContact O-ND2 3.45Å; E360-N363 WeakPolarHBondContact O-CB 3.34Å; E360-N363 PolarHBondContact O-N 3.14Å; E360-N363 VanDerWaalsContact O-N 3.14Å; G361-N363 VanDerWaalsContact C-N 3.31Å; G361-N363 PolarHBondContact O-N 3.14Å; N363-S366 PolarHBondContact O-N 3.12Å; N363-A367 WeakPolarHBondContact O-CB 3.47Å; N363-A367 PolarHBondContact O-N 3.08Å
364	I	93.3	Very high	94.6	Very high	28 Å²	28	54.5 Å²	54.5	14%	0.144	27%	0.265	C	S	.	.	H	α-helix	trans	-64.3	-47.2	175.1	-65.5	168.9	0	0	0	110.2	Y315 E360 G361 S366 A367 A368 I383 I386	Y315-I364 HydrophobicContact CD1-CD1 3.74Å; Y315-I364 HydrophobicContact CD2-CD1 4.29Å; Y315-I364 HydrophobicContact CE1-CD1 4.19Å; Y315-I364 HydrophobicContact CG-CD1 3.79Å; E360-I364 WeakPolarHBondContact O-CG1 3.4Å; E360-I364 PolarHBondContact O-N 3.37Å; G361-I364 WeakPolarHBondContact O-CB 3.43Å; G361-I364 PolarHBondContact O-N 3.35Å; I364-S366 VanDerWaalsContact C-N 3.27Å; I364-S366 PolarHBondContact O-N 3.46Å; I364-A367 WeakPolarHBondContact O-CB 3.3Å; I364-A367 PolarHBondContact O-N 3.1Å; I364-A367 VanDerWaalsContact O-N 3.13Å; I364-A368 PolarHBondContact O-N 2.96Å; I364-I383 HydrophobicContact CG2-CD1 3.72Å; I364-I386 HydrophobicContact CD1-CD1 3.77Å; I364-I386 HydrophobicContact CG2-CD1 3.89Å
365	V	94.7	Very high	94.3	Very high	4 Å²	4	61 Å²	61	2%	0.024	30%	0.296	C	S	.	.	H	α-helix	trans	-57.5	-42.5	173.8	169.2	0	0	0	0	111.3	G361 D362 A368 R369 L415 M419 I422	G361-V365 WeakPolarHBondContact O-CG2 3.31Å; G361-V365 PolarHBondContact O-N 3Å; D362-V365 PolarHBondContact O-N 3.46Å; V365-A368 PolarHBondContact O-N 2.98Å; V365-R369 WeakPolarHBondContact O-CB 3.14Å; V365-R369 PolarHBondContact O-N 2.91Å; V365-L415 HydrophobicContact CG2-CD1 4.47Å; V365-M419 HydrophobicContact CG2-CB 4.41Å; V365-M419 HydrophobicContact CG2-CE 4.27Å; V365-M419 HydrophobicContact CG2-CG 3.46Å; V365-M419 VanDerWaalsContact CG2-CG 3.46Å; V365-I422 HydrophobicContact CG1-CB 4.26Å; V365-I422 HydrophobicContact CG1-CG2 4.02Å; V365-I422 HydrophobicContact CG2-CG2 4.43Å
366	S	94.5	Very high	93.9	Very high	46 Å²	46	61.1 Å²	61.1	32%	0.322	30%	0.296	S	S	.	.	H	α-helix	trans	-67.3	-35.6	177.9	-64	0	0	0	0	112.5	D362 N363 I364 R370	D362-S366 VanDerWaalsContact O-CB 3.28Å; D362-S366 WeakPolarHBondContact O-CB 3.29Å; D362-S366 PolarHBondContact O-N 3.34Å; D362-S366 PolarHBondContact O-OG 3.4Å; N363-S366 PolarHBondContact O-N 3.12Å; I364-S366 VanDerWaalsContact C-N 3.27Å; I364-S366 PolarHBondContact O-N 3.46Å; S366-R370 WeakPolarHBondContact O-CG 3.48Å; S366-R370 PolarHBondContact O-N 3.28Å; S366-R370 VanDerWaalsContact O-N 3.07Å
367	A	92.2	Very high	93.5	Very high	45 Å²	45	59.4 Å²	59.4	37%	0.372	29%	0.286	S	S	.	.	H	α-helix	trans	-65.9	-48.3	174	0	0	0	0	0	111.3	N363 I364 R369 R370 A371	N363-A367 WeakPolarHBondContact O-CB 3.47Å; N363-A367 PolarHBondContact O-N 3.08Å; I364-A367 WeakPolarHBondContact O-CB 3.3Å; I364-A367 PolarHBondContact O-N 3.1Å; I364-A367 VanDerWaalsContact O-N 3.13Å; A367-R369 VanDerWaalsContact C-N 3.32Å; A367-R369 PolarHBondContact O-N 2.99Å; A367-R370 PolarHBondContact O-N 2.84Å; A367-R370 VanDerWaalsContact O-N 3.11Å; A367-A371 PolarHBondContact O-N 3.14Å
368	A	91.6	Very high	93	Very high	4 Å²	4	61.9 Å²	61.9	3%	0.033	30%	0.304	C	S	.	.	H	α-helix	trans	-57.1	-45.3	174.3	0	0	0	0	0	111.3	I364 V365 R370 A371 I372 I383 I422	I364-A368 PolarHBondContact O-N 2.96Å; V365-A368 PolarHBondContact O-N 2.98Å; A368-R370 VanDerWaalsContact C-N 3.33Å; A368-R370 PolarHBondContact O-N 2.61Å; A368-A371 PolarHBondContact O-N 3.19Å; A368-A371 VanDerWaalsContact O-N 3.15Å; A368-I372 WeakPolarHBondContact O-CD1 3.33Å; A368-I372 VanDerWaalsContact O-CG1 3.23Å; A368-I372 WeakPolarHBondContact O-CG1 3.43Å; A368-I372 PolarHBondContact O-N 2.75Å; A368-I383 HydrophobicContact CB-CD1 4.04Å; A368-I383 HydrophobicContact CB-CG1 4.06Å; A368-I422 HydrophobicContact CB-CG1 4.48Å
369	R	94	Very high	92.5	Very high	103 Å²	103	62 Å²	62	39%	0.389	31%	0.306	S	S	.	.	H	α-helix	trans	-56.7	-43.5	175.1	-172.8	-175.2	-57.5	-78.1	-3.1	112.8	V365 A367 M373 I422	V365-R369 WeakPolarHBondContact O-CB 3.14Å; V365-R369 PolarHBondContact O-N 2.91Å; A367-R369 VanDerWaalsContact C-N 3.32Å; A367-R369 PolarHBondContact O-N 2.99Å; R369-M373 VanDerWaalsContact O-CG 3.27Å; R369-M373 WeakPolarHBondContact O-CG 3.37Å; R369-M373 PolarHBondContact O-N 3.45Å; R369-M373 VanDerWaalsContact O-N 3.15Å; R369-I422 HydrophobicContact CB-CD1 3.87Å; R369-I422 HydrophobicContact CB-CG1 4.37Å; R369-I422 HydrophobicContact CG-CD1 4.09Å
370	R	94	Very high	92.1	Very high	144 Å²	144	57.6 Å²	57.6	54%	0.543	28%	0.283	S	S	.	.	H	α-helix	trans	-67.2	-35.6	177.8	-74.7	-176.7	-66	-115	0	112.5	S366 A367 A368 R374	S366-R370 WeakPolarHBondContact O-CG 3.48Å; S366-R370 PolarHBondContact O-N 3.28Å; S366-R370 VanDerWaalsContact O-N 3.07Å; A367-R370 PolarHBondContact O-N 2.84Å; A367-R370 VanDerWaalsContact O-N 3.11Å; A368-R370 VanDerWaalsContact C-N 3.33Å; A368-R370 PolarHBondContact O-N 2.61Å; R370-R374 WeakPolarHBondContact O-CG 3.39Å; R370-R374 PolarHBondContact O-N 2.94Å
371	A	91.9	Very high	91.8	Very high	15 Å²	15	56.3 Å²	56.3	12%	0.124	28%	0.278	C	S	.	.	H	α-helix	trans	-67.4	-45.1	176.2	0	0	0	0	0	111.5	A367 A368 M373 R374 H375 D376 A379	A367-A371 PolarHBondContact O-N 3.14Å; A368-A371 PolarHBondContact O-N 3.19Å; A368-A371 VanDerWaalsContact O-N 3.15Å; A371-M373 VanDerWaalsContact C-N 3.32Å; A371-M373 PolarHBondContact O-N 3.45Å; A371-R374 CarbonylContact O-C 3.58Å; A371-R374 WeakPolarHBondContact O-CA 3.25Å; A371-R374 WeakPolarHBondContact O-CB 3.39Å; A371-R374 PolarHBondContact O-N 3.07Å; A371-H375 PolarHBondContact O-N 3.42Å; A371-D376 CarbonylContact C-O 3.59Å; A371-D376 HydrophobicContact CB-CB 4.22Å; A371-D376 PolarHBondContact O-N 3.34Å; A371-A379 HydrophobicContact CB-CB 3.32Å
372	I	90.9	Very high	91.5	Very high	2 Å²	2	58.1 Å²	58.1	1%	0.01	29%	0.289	C	S	.	.	H	α-helix	trans	-57.5	-43.7	175.7	-66.2	159.1	0	0	0	111.2	A368 R374 H375 Y377 I422 A426 E429	A368-I372 WeakPolarHBondContact O-CD1 3.33Å; A368-I372 VanDerWaalsContact O-CG1 3.23Å; A368-I372 WeakPolarHBondContact O-CG1 3.43Å; A368-I372 PolarHBondContact O-N 2.75Å; I372-R374 PolarHBondContact O-N 3.3Å; I372-R374 VanDerWaalsContact O-N 3.13Å; I372-H375 WeakPolarHBondContact O-CA 3.46Å; I372-H375 PolarHBondContact O-N 3.48Å; I372-Y377 HydrophobicContact CG2-CD1 4.29Å; I372-Y377 HydrophobicContact CG2-CE1 4.12Å; I372-I422 HydrophobicContact CD1-CD1 3.7Å; I372-I422 HydrophobicContact CD1-CG1 3.8Å; I372-A426 HydrophobicContact CD1-CB 3.49Å; I372-A426 VanDerWaalsContact CD1-CB 3.49Å; I372-A426 HydrophobicContact CG1-CB 3.85Å; I372-E429 WeakPolarHBondContact CG2-OE2 3.3Å
373	M	91.4	Very high	91.4	Very high	109 Å²	109	54.8 Å²	54.8	54%	0.537	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-18.8	175.5	-67.6	-69.9	110.9	0	0	113.9	R369 A371	R369-M373 VanDerWaalsContact O-CG 3.27Å; R369-M373 WeakPolarHBondContact O-CG 3.37Å; R369-M373 PolarHBondContact O-N 3.45Å; R369-M373 VanDerWaalsContact O-N 3.15Å; A371-M373 VanDerWaalsContact C-N 3.32Å; A371-M373 PolarHBondContact O-N 3.45Å
374	R	93.8	Very high	91.3	Very high	199 Å²	199	51 Å²	51	75%	0.751	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	10.7	174.7	-65.9	173.5	-179	166.1	0.1	112.5	R370 A371 I372 D376	R370-R374 WeakPolarHBondContact O-CG 3.39Å; R370-R374 PolarHBondContact O-N 2.94Å; A371-R374 CarbonylContact O-C 3.58Å; A371-R374 WeakPolarHBondContact O-CA 3.25Å; A371-R374 WeakPolarHBondContact O-CB 3.39Å; A371-R374 PolarHBondContact O-N 3.07Å; I372-R374 PolarHBondContact O-N 3.3Å; I372-R374 VanDerWaalsContact O-N 3.13Å; R374-D376 PolarHBondContact O-N 3.43Å
375	H	90.2	Very high	91.3	Very high	137 Å²	137	51.4 Å²	51.4	63%	0.634	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.1	20.4	-172.7	-54.7	-72.3	0	0	0	114.2	A371 I372 Y377	A371-H375 PolarHBondContact O-N 3.42Å; I372-H375 WeakPolarHBondContact O-CA 3.46Å; I372-H375 PolarHBondContact O-N 3.48Å; H375-Y377 HydrophobicContact CB-CE2 4.05Å; H375-Y377 AromaticContact ND1-CZ 3.79Å; H375-Y377 PolarHBondContact ND1-OH 2.9Å; H375-Y377 WeakPolarHBondContact O-CD2 3.43Å; H375-Y377 PolarHBondContact O-N 3.03Å
376	D	90.9	Very high	91.3	Very high	74 Å²	74	51.2 Å²	51.2	40%	0.396	26%	0.255	S	S	.	.			trans	-92.1	82.6	169.5	-179.7	10.6	0	0	0	109.4	A371 R374 S378	A371-D376 CarbonylContact C-O 3.59Å; A371-D376 HydrophobicContact CB-CB 4.22Å; A371-D376 PolarHBondContact O-N 3.34Å; R374-D376 PolarHBondContact O-N 3.43Å; D376-S378 VanDerWaalsContact C-N 3.26Å; D376-S378 PolarHBondContact O-N 3.44Å; D376-S378 WeakPolarHBondContact OD1-CB 3.47Å; D376-S378 PolarHBondContact OD1-N 3.37Å; D376-S378 PolarHBondContact OD1-OG 3.32Å
377	Y	89.9	Confident	91.3	Very high	21 Å²	21	49 Å²	49	8%	0.082	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-74.8	-17.5	179.9	-55.1	-67.7	0	0	0	112.8	I372 H375 A379 V380 E429 F430 S433	I372-Y377 HydrophobicContact CG2-CD1 4.29Å; I372-Y377 HydrophobicContact CG2-CE1 4.12Å; H375-Y377 HydrophobicContact CB-CE2 4.05Å; H375-Y377 AromaticContact ND1-CZ 3.79Å; H375-Y377 PolarHBondContact ND1-OH 2.9Å; H375-Y377 WeakPolarHBondContact O-CD2 3.43Å; H375-Y377 PolarHBondContact O-N 3.03Å; Y377-A379 PolarHBondContact O-N 2.96Å; Y377-V380 WeakPolarHBondContact O-CG1 3.36Å; Y377-V380 PolarHBondContact O-N 2.98Å; Y377-V380 VanDerWaalsContact O-N 3.15Å; Y377-E429 HydrophobicContact CD1-CB 4.27Å; Y377-E429 HydrophobicContact CE1-CB 3.53Å; Y377-F430 HydrophobicContact CD1-CB 4.21Å; Y377-F430 HydrophobicContact CD2-CB 4.23Å; Y377-F430 AromaticContact CD2-CD2 3.82Å; Y377-F430 HydrophobicContact CD2-CD2 3.82Å; Y377-F430 HydrophobicContact CG-CB 3.87Å; Y377-F430 HydrophobicContact CG-CD2 4.02Å; Y377-F430 HydrophobicContact CG-CG 4.46Å; Y377-S433 VanDerWaalsContact CE2-CB 3.49Å; Y377-S433 WeakPolarHBondContact CE2-OG 3.38Å
378	S	85.5	Confident	91.4	Very high	59 Å²	59	52.6 Å²	52.6	41%	0.413	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-63.4	-25.3	178.9	76.7	0	0	0	0	112.3	D376 V380 L381	D376-S378 VanDerWaalsContact C-N 3.26Å; D376-S378 PolarHBondContact O-N 3.44Å; D376-S378 WeakPolarHBondContact OD1-CB 3.47Å; D376-S378 PolarHBondContact OD1-N 3.37Å; D376-S378 PolarHBondContact OD1-OG 3.32Å; S378-V380 PolarHBondContact O-N 3Å; S378-L381 WeakPolarHBondContact O-CB 3.39Å; S378-L381 VanDerWaalsContact O-CG 3.24Å; S378-L381 WeakPolarHBondContact O-CG 3.42Å; S378-L381 PolarHBondContact O-N 3.17Å
379	A	87.1	Confident	91.5	Very high	14 Å²	14	54 Å²	54	12%	0.116	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-56.8	-22	174.6	0	0	0	0	0	113.9	A371 Y377 L381 T382	A371-A379 HydrophobicContact CB-CB 3.32Å; Y377-A379 PolarHBondContact O-N 2.96Å; A379-L381 PolarHBondContact O-N 2.89Å; A379-T382 PolarHBondContact O-N 3.06Å; A379-T382 PolarHBondContact O-OG1 2.89Å
380	V	88.8	Confident	91.5	Very high	2 Å²	2	49.2 Å²	49.2	1%	0.012	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-61.6	-27.5	173.3	75.7	0	0	0	0	112.5	Y377 S378 T382 I383 F384 A426 F460	Y377-V380 WeakPolarHBondContact O-CG1 3.36Å; Y377-V380 PolarHBondContact O-N 2.98Å; Y377-V380 VanDerWaalsContact O-N 3.15Å; S378-V380 PolarHBondContact O-N 3Å; V380-T382 PolarHBondContact O-N 2.87Å; V380-I383 WeakPolarHBondContact O-CB 3.46Å; V380-I383 PolarHBondContact O-N 3.22Å; V380-F384 HydrophobicContact CG1-CE2 4.14Å; V380-F384 HydrophobicContact CG2-CE2 4.33Å; V380-F384 HydrophobicContact CG2-CZ 4.2Å; V380-A426 HydrophobicContact CB-CB 3.74Å; V380-A426 HydrophobicContact CG1-CB 4.47Å; V380-A426 HydrophobicContact CG2-CB 3.74Å; V380-F460 HydrophobicContact CG1-CE2 3.93Å; V380-F460 HydrophobicContact CG1-CZ 3.95Å
381	L	88.6	Confident	91.4	Very high	28 Å²	28	45.8 Å²	45.8	15%	0.147	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-60.8	-31.2	179.7	-60.8	172.1	0	0	0	111.6	S378 A379 I383 F384 P385 Q463	S378-L381 WeakPolarHBondContact O-CB 3.39Å; S378-L381 VanDerWaalsContact O-CG 3.24Å; S378-L381 WeakPolarHBondContact O-CG 3.42Å; S378-L381 PolarHBondContact O-N 3.17Å; A379-L381 PolarHBondContact O-N 2.89Å; L381-I383 VanDerWaalsContact C-N 3.26Å; L381-I383 PolarHBondContact O-N 2.74Å; L381-F384 HydrophobicContact CD2-CD2 4.15Å; L381-F384 HydrophobicContact CD2-CE2 4.08Å; L381-F384 PolarHBondContact O-N 3.07Å; L381-P385 WeakPolarHBondContact O-CD 3.34Å; L381-Q463 HydrophobicContact CD1-CB 3.84Å; L381-Q463 HydrophobicContact CD1-CG 4.27Å; L381-Q463 HydrophobicContact CD2-CB 3.98Å
382	T	88.6	Confident	91.3	Very high	37 Å²	37	50.9 Å²	50.9	23%	0.227	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-67.1	-25.2	175.7	69.2	0	0	0	0	113.4	I312 A379 V380	I312-T382 HydrophobicContact CD1-CG2 3.83Å; A379-T382 PolarHBondContact O-N 3.06Å; A379-T382 PolarHBondContact O-OG1 2.89Å; V380-T382 PolarHBondContact O-N 2.87Å
383	I	92.6	Very high	91.2	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-77.3	-31.4	-180	-61.8	-66.6	0	0	0	111	I364 A368 V380 L381 I386 L387 M419 M474	I364-I383 HydrophobicContact CG2-CD1 3.72Å; A368-I383 HydrophobicContact CB-CD1 4.04Å; A368-I383 HydrophobicContact CB-CG1 4.06Å; V380-I383 WeakPolarHBondContact O-CB 3.46Å; V380-I383 PolarHBondContact O-N 3.22Å; L381-I383 VanDerWaalsContact C-N 3.26Å; L381-I383 PolarHBondContact O-N 2.74Å; I383-I386 PolarHBondContact O-N 3.45Å; I383-L387 HydrophobicContact CG2-CB 4.38Å; I383-L387 VanDerWaalsContact O-CB 3.28Å; I383-L387 WeakPolarHBondContact O-CB 3.32Å; I383-L387 PolarHBondContact O-N 3.37Å; I383-M419 HydrophobicContact CG2-CB 4.02Å; I383-M419 HydrophobicContact CG2-CG 4.37Å; I383-M474 HydrophobicContact CG2-CE 4.35Å
384	F	93.4	Very high	91.2	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63.7	-48.3	-172.6	-67.7	-56.2	0	0	0	114.3	V380 L381 I386 L387 R388 L464 F467 T470 A471 M474	V380-F384 HydrophobicContact CG1-CE2 4.14Å; V380-F384 HydrophobicContact CG2-CE2 4.33Å; V380-F384 HydrophobicContact CG2-CZ 4.2Å; L381-F384 HydrophobicContact CD2-CD2 4.15Å; L381-F384 HydrophobicContact CD2-CE2 4.08Å; L381-F384 PolarHBondContact O-N 3.07Å; F384-I386 VanDerWaalsContact C-N 3.3Å; F384-I386 PolarHBondContact O-N 3.48Å; F384-L387 PolarHBondContact O-N 3.22Å; F384-R388 VanDerWaalsContact O-CB 3.3Å; F384-R388 WeakPolarHBondContact O-CB 3.42Å; F384-R388 PolarHBondContact O-N 3.2Å; F384-L464 HydrophobicContact CE2-CD1 3.56Å; F384-L464 HydrophobicContact CZ-CD1 3.54Å; F384-F467 HydrophobicContact CB-CB 3.68Å; F384-F467 HydrophobicContact CB-CD1 3.5Å; F384-F467 HydrophobicContact CB-CD2 3.89Å; F384-F467 HydrophobicContact CB-CE1 4.09Å; F384-F467 HydrophobicContact CB-CE2 4.43Å; F384-F467 HydrophobicContact CB-CG 3.38Å; F384-F467 HydrophobicContact CD1-CB 4.23Å; F384-F467 HydrophobicContact CD2-CB 3.94Å; F384-F467 AromaticContact CD2-CD2 3.89Å; F384-F467 HydrophobicContact CD2-CD2 3.89Å; F384-F467 AromaticContact CD2-CG 4Å; F384-F467 HydrophobicContact CD2-CG 4Å; F384-F467 HydrophobicContact CG-CB 3.72Å; F384-F467 HydrophobicContact CG-CD1 4.45Å; F384-F467 HydrophobicContact CG-CD2 4.21Å; F384-F467 AromaticContact CG-CG 3.87Å; F384-F467 HydrophobicContact CG-CG 3.87Å; F384-T470 HydrophobicContact CD1-CG2 3.94Å; F384-A471 HydrophobicContact CE1-CB 3.8Å; F384-A471 HydrophobicContact CZ-CB 3.99Å; F384-M474 HydrophobicContact CD1-CE 3.77Å; F384-M474 HydrophobicContact CE1-CE 3.44Å; F384-M474 VanDerWaalsContact CE1-CE 3.44Å; F384-M474 HydrophobicContact CE1-SD 3.85Å; F384-M474 HydrophobicContact CZ-CE 4.42Å
385	P	93.3	Very high	91.1	Very high	35 Å²	35	44.7 Å²	44.7	23%	0.227	23%	0.23	C	C	.	.	H	α-helix	trans	-57.3	-44.4	176.5	-23.9	31.8	0	0	0	112.3	I312 I316 L381 R388 H389 F467	I312-P385 HydrophobicContact CG2-CB 4.21Å; I316-P385 HydrophobicContact CD1-CB 4.04Å; L381-P385 WeakPolarHBondContact O-CD 3.34Å; P385-R388 PolarHBondContact O-N 2.89Å; P385-H389 WeakPolarHBondContact O-CB 3.4Å; P385-H389 PolarHBondContact O-N 3.27Å; P385-F467 HydrophobicContact CB-CE1 4.45Å; P385-F467 HydrophobicContact CG-CE1 3.7Å; P385-F467 HydrophobicContact CG-CZ 3.75Å
386	I	95	Very high	91.1	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-64.3	-52.4	-179.7	-59.7	172.3	0	0	0	110.1	I312 Y315 I316 I364 I383 F384 R388 H389 L390 M419	I312-I386 HydrophobicContact CG1-CD1 4.33Å; I312-I386 HydrophobicContact CG2-CD1 4.29Å; I312-I386 HydrophobicContact CG2-CG1 3.91Å; Y315-I386 HydrophobicContact CD1-CD1 4.09Å; Y315-I386 HydrophobicContact CD1-CG1 4.25Å; Y315-I386 HydrophobicContact CD1-CG2 3.68Å; Y315-I386 HydrophobicContact CE1-CG2 3.53Å; I316-I386 HydrophobicContact CG1-CG1 4.34Å; I364-I386 HydrophobicContact CD1-CD1 3.77Å; I364-I386 HydrophobicContact CG2-CD1 3.89Å; I383-I386 PolarHBondContact O-N 3.45Å; F384-I386 VanDerWaalsContact C-N 3.3Å; F384-I386 PolarHBondContact O-N 3.48Å; I386-R388 VanDerWaalsContact C-N 3.28Å; I386-R388 PolarHBondContact O-N 2.88Å; I386-H389 PolarHBondContact O-N 3.5Å; I386-H389 VanDerWaalsContact O-N 3.1Å; I386-L390 HydrophobicContact CG2-CD1 4.13Å; I386-L390 HydrophobicContact CG2-CG 4.15Å; I386-L390 WeakPolarHBondContact O-CG 3.49Å; I386-L390 PolarHBondContact O-N 2.92Å; I386-M419 HydrophobicContact CG2-CE 3.67Å; I386-M419 HydrophobicContact CG2-SD 3.86Å
387	L	94.7	Very high	91.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.1	-40.4	-179	-179.9	61.8	0	0	0	111.7	I383 F384 L390 K391 I416 M419 E420 T470 M474	I383-L387 HydrophobicContact CG2-CB 4.38Å; I383-L387 VanDerWaalsContact O-CB 3.28Å; I383-L387 WeakPolarHBondContact O-CB 3.32Å; I383-L387 PolarHBondContact O-N 3.37Å; F384-L387 PolarHBondContact O-N 3.22Å; L387-L390 PolarHBondContact O-N 3.14Å; L387-K391 HydrophobicContact CD1-CG 4.41Å; L387-K391 WeakPolarHBondContact O-CB 3.3Å; L387-K391 WeakPolarHBondContact O-CG 3.37Å; L387-K391 PolarHBondContact O-N 3.48Å; L387-I416 HydrophobicContact CD1-CB 4.49Å; L387-I416 HydrophobicContact CD1-CG2 3.91Å; L387-M419 HydrophobicContact CD1-CB 4.19Å; L387-E420 HydrophobicContact CD1-CG 4.05Å; L387-E420 HydrophobicContact CD2-CG 3.85Å; L387-T470 HydrophobicContact CB-CG2 4.19Å; L387-T470 HydrophobicContact CD2-CG2 3.93Å; L387-T470 HydrophobicContact CG-CG2 4.06Å; L387-M474 HydrophobicContact CD2-CB 4.41Å; L387-M474 HydrophobicContact CD2-CE 3.38Å
388	R	93.8	Very high	91.4	Very high	119 Å²	119	38.9 Å²	38.9	45%	0.449	20%	0.204	S	C	.	.	H	α-helix	trans	-57.5	-51.1	173.5	-178.6	-179.6	176.4	172.4	0.4	110.5	F384 P385 I386 K391 M392 T470	F384-R388 VanDerWaalsContact O-CB 3.3Å; F384-R388 WeakPolarHBondContact O-CB 3.42Å; F384-R388 PolarHBondContact O-N 3.2Å; P385-R388 PolarHBondContact O-N 2.89Å; I386-R388 VanDerWaalsContact C-N 3.28Å; I386-R388 PolarHBondContact O-N 2.88Å; R388-K391 PolarHBondContact O-N 3.32Å; R388-M392 HydrophobicContact CG-SD 4Å; R388-M392 WeakPolarHBondContact O-CG 3.21Å; R388-M392 PolarHBondContact O-N 3.43Å; R388-T470 HydrophobicContact CB-CG2 4.35Å
389	H	93.6	Very high	91.9	Very high	35 Å²	35	39.8 Å²	39.8	16%	0.162	21%	0.21	C	C	.	.	H	α-helix	trans	-63.5	-43.3	-179.3	-174.6	82.3	0	0	0	112.8	I316 S320 P385 I386 K391 M392 N393	I316-H389 HydrophobicContact CG1-CB 4.22Å; I316-H389 HydrophobicContact CG2-CB 4.34Å; I316-H389 PolarHBondContact O-NE2 3.07Å; S320-H389 PolarHBondContact OG-CE1 3.45Å; S320-H389 PolarHBondContact OG-NE2 3.16Å; P385-H389 WeakPolarHBondContact O-CB 3.4Å; P385-H389 PolarHBondContact O-N 3.27Å; I386-H389 PolarHBondContact O-N 3.5Å; I386-H389 VanDerWaalsContact O-N 3.1Å; H389-K391 VanDerWaalsContact C-N 3.3Å; H389-K391 PolarHBondContact O-N 3.42Å; H389-M392 PolarHBondContact O-N 3.5Å; H389-N393 PolarHBondContact CD2-ND2 3.37Å; H389-N393 PolarHBondContact CE1-ND2 3.37Å; H389-N393 PolarHBondContact ND1-ND2 3.27Å; H389-N393 PolarHBondContact NE2-ND2 3.5Å; H389-N393 VanDerWaalsContact NE2-ND2 3.12Å; H389-N393 PolarHBondContact O-N 3.03Å; H389-N393 PolarHBondContact O-ND2 3.34Å
390	L	93.9	Very high	92.2	Very high	1 Å²	1	40 Å²	40	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-59.5	-40.3	175.4	-66.7	-175	0	0	0	112	I319 I386 L387 K394 L412 L415 I416 M419	I319-L390 HydrophobicContact CB-CD2 4.36Å; I319-L390 HydrophobicContact CD1-CD2 3.47Å; I319-L390 VanDerWaalsContact CD1-CD2 3.47Å; I319-L390 HydrophobicContact CG1-CD2 3.65Å; I319-L390 HydrophobicContact CG2-CD2 3.94Å; I386-L390 HydrophobicContact CG2-CD1 4.13Å; I386-L390 HydrophobicContact CG2-CG 4.15Å; I386-L390 WeakPolarHBondContact O-CG 3.49Å; I386-L390 PolarHBondContact O-N 2.92Å; L387-L390 PolarHBondContact O-N 3.14Å; L390-K394 PolarHBondContact O-N 2.81Å; L390-L412 HydrophobicContact CB-CD1 4.3Å; L390-L412 HydrophobicContact CD1-CD1 4.31Å; L390-L412 HydrophobicContact CD2-CD1 3.83Å; L390-L412 HydrophobicContact CG-CD1 4.36Å; L390-L415 HydrophobicContact CD1-CD2 4.08Å; L390-L415 HydrophobicContact CD1-CG 4.35Å; L390-I416 HydrophobicContact CB-CD1 4.15Å; L390-I416 HydrophobicContact CB-CG1 3.95Å; L390-I416 HydrophobicContact CD1-CG1 4.1Å; L390-M419 HydrophobicContact CD1-CE 4.17Å; L390-M419 HydrophobicContact CD1-SD 3.55Å; L390-M419 VanDerWaalsContact CD1-SD 3.55Å
391	K	91.1	Very high	92.5	Very high	72 Å²	72	40 Å²	40	31%	0.313	21%	0.21	S	C	.	.	H	α-helix	trans	-70.1	-39	177.1	-74.8	-171.7	177	-157	0	112.6	L387 R388 H389 K394 E420	L387-K391 HydrophobicContact CD1-CG 4.41Å; L387-K391 WeakPolarHBondContact O-CB 3.3Å; L387-K391 WeakPolarHBondContact O-CG 3.37Å; L387-K391 PolarHBondContact O-N 3.48Å; R388-K391 PolarHBondContact O-N 3.32Å; H389-K391 VanDerWaalsContact C-N 3.3Å; H389-K391 PolarHBondContact O-N 3.42Å; K391-K394 WeakPolarHBondContact O-CB 3.39Å; K391-K394 PolarHBondContact O-N 3.29Å; K391-E420 WeakPolarHBondContact CE-OE1 3.28Å; K391-E420 IonicContact NZ-OE1 2.74Å; K391-E420 PolarHBondContact NZ-OE1 2.89Å
392	M	90.4	Very high	92.7	Very high	123 Å²	123	44.8 Å²	44.8	61%	0.606	23%	0.232	S	C	*	.	H	α-helix	trans	-64.2	-42.6	176.6	-72.7	177.4	65.6	0	0	111.8	R388 H389 K394	R388-M392 HydrophobicContact CG-SD 4Å; R388-M392 WeakPolarHBondContact O-CG 3.21Å; R388-M392 PolarHBondContact O-N 3.43Å; H389-M392 PolarHBondContact O-N 3.5Å; M392-K394 VanDerWaalsContact C-N 3.28Å; M392-K394 PolarHBondContact O-N 3.22Å
393	N	88.7	Confident	92.8	Very high	21 Å²	21	45.1 Å²	45.1	11%	0.112	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-2.8	179.8	-72.3	-96	0	0	0	113.7	H389 S395 E396 F397	H389-N393 PolarHBondContact CD2-ND2 3.37Å; H389-N393 PolarHBondContact CE1-ND2 3.37Å; H389-N393 PolarHBondContact ND1-ND2 3.27Å; H389-N393 PolarHBondContact NE2-ND2 3.5Å; H389-N393 VanDerWaalsContact NE2-ND2 3.12Å; H389-N393 PolarHBondContact O-N 3.03Å; H389-N393 PolarHBondContact O-ND2 3.34Å; N393-S395 VanDerWaalsContact C-N 3.34Å; N393-S395 PolarHBondContact O-N 3.28Å; N393-E396 PolarHBondContact O-N 3.46Å; N393-F397 WeakPolarHBondContact O-CB 3.18Å; N393-F397 PolarHBondContact O-N 3.46Å
394	K	90.5	Very high	92.9	Very high	70 Å²	70	45.4 Å²	45.4	30%	0.304	24%	0.244	S	C	.	.	H	α-helix	trans	-57.9	-43.2	-172	176.2	167.8	171.3	42.3	0	112.9	L390 K391 M392 F397 D398 I416	L390-K394 PolarHBondContact O-N 2.81Å; K391-K394 WeakPolarHBondContact O-CB 3.39Å; K391-K394 PolarHBondContact O-N 3.29Å; M392-K394 VanDerWaalsContact C-N 3.28Å; M392-K394 PolarHBondContact O-N 3.22Å; K394-F397 PolarHBondContact O-N 3.03Å; K394-D398 IonicContact NZ-OD1 3.36Å; K394-D398 PolarHBondContact NZ-OD1 3.35Å; K394-D398 IonicContact NZ-OD2 2.66Å; K394-D398 PolarHBondContact NZ-OD2 3.17Å; K394-D398 WeakPolarHBondContact O-CB 3.24Å; K394-D398 PolarHBondContact O-N 2.94Å; K394-I416 HydrophobicContact CD-CD1 4.42Å
395	S	91.8	Very high	93.1	Very high	89 Å²	89	47.2 Å²	47.2	62%	0.622	26%	0.259	S	S	*	.	H	α-helix	trans	-64.8	-44.5	-179.2	49.3	0	0	0	0	112	N393 F397 D398 S399	N393-S395 VanDerWaalsContact C-N 3.34Å; N393-S395 PolarHBondContact O-N 3.28Å; S395-F397 VanDerWaalsContact C-N 3.34Å; S395-D398 PolarHBondContact O-N 3.09Å; S395-S399 WeakPolarHBondContact O-CB 3.39Å; S395-S399 PolarHBondContact O-N 2.93Å
396	E	91.8	Very high	93.1	Very high	46 Å²	46	48.4 Å²	48.4	22%	0.215	27%	0.271	C	S	.	.	H	α-helix	trans	-66.6	-39.1	178.4	-162.4	-175.7	-178.6	0	0	111.1	V323 K324 Q327 N393 S399 T400	V323-E396 HydrophobicContact CG1-CB 4.28Å; V323-E396 VanDerWaalsContact CG1-CD 3.44Å; V323-E396 HydrophobicContact CG1-CG 3.59Å; K324-E396 IonicContact NZ-OE1 3.8Å; K324-E396 PolarHBondContact NZ-OE1 2.99Å; Q327-E396 PolarHBondContact NE2-OE1 3.3Å; N393-E396 PolarHBondContact O-N 3.46Å; E396-S399 PolarHBondContact O-N 3.23Å; E396-T400 WeakPolarHBondContact O-CB 3.35Å; E396-T400 PolarHBondContact O-N 3.02Å; E396-T400 PolarHBondContact O-OG1 2.66Å
397	F	93.4	Very high	93.2	Very high	1 Å²	1	52.3 Å²	52.3	0%	0.004	30%	0.299	C	S	.	.	H	α-helix	trans	-63.2	-47.9	174.1	-159.5	-84.5	0	0	0	111.8	F322 V323 L354 N393 K394 S395 S399 T400 L401 L412	F322-F397 HydrophobicContact CD1-CD2 4.23Å; F322-F397 AromaticContact CD1-CE2 3.48Å; F322-F397 HydrophobicContact CD1-CE2 3.48Å; F322-F397 VanDerWaalsContact CD1-CE2 3.48Å; F322-F397 HydrophobicContact CD1-CZ 4.12Å; F322-F397 HydrophobicContact CE1-CD2 4.34Å; F322-F397 AromaticContact CE1-CE2 3.52Å; F322-F397 HydrophobicContact CE1-CE2 3.52Å; F322-F397 AromaticContact CE1-CZ 3.71Å; F322-F397 HydrophobicContact CE1-CZ 3.71Å; V323-F397 HydrophobicContact CG2-CB 4.4Å; V323-F397 HydrophobicContact CG2-CD2 3.59Å; V323-F397 HydrophobicContact CG2-CE2 4.37Å; V323-F397 HydrophobicContact CG2-CG 4.41Å; L354-F397 HydrophobicContact CD1-CE2 4.47Å; L354-F397 HydrophobicContact CD1-CZ 3.65Å; N393-F397 WeakPolarHBondContact O-CB 3.18Å; N393-F397 PolarHBondContact O-N 3.46Å; K394-F397 PolarHBondContact O-N 3.03Å; S395-F397 VanDerWaalsContact C-N 3.34Å; F397-S399 VanDerWaalsContact C-N 3.3Å; F397-S399 PolarHBondContact O-N 3.11Å; F397-T400 PolarHBondContact O-N 3.02Å; F397-L401 HydrophobicContact CD1-CD1 3.66Å; F397-L401 HydrophobicContact CD1-CG 4.08Å; F397-L401 HydrophobicContact CE1-CD1 3.21Å; F397-L401 HydrophobicContact CE1-CG 4.01Å; F397-L401 HydrophobicContact CZ-CD1 4.05Å; F397-L401 WeakPolarHBondContact O-CG 3.32Å; F397-L401 PolarHBondContact O-N 3.42Å; F397-L412 HydrophobicContact CB-CD2 3.71Å; F397-L412 HydrophobicContact CD1-CB 3.92Å; F397-L412 HydrophobicContact CD1-CD2 3.43Å; F397-L412 VanDerWaalsContact CD1-CD2 3.43Å; F397-L412 HydrophobicContact CD1-CG 4.29Å; F397-L412 HydrophobicContact CD2-CD2 3.88Å; F397-L412 HydrophobicContact CE1-CB 3.53Å; F397-L412 HydrophobicContact CE1-CD2 3.88Å; F397-L412 HydrophobicContact CE1-CG 4.3Å; F397-L412 HydrophobicContact CE2-CD2 4.31Å; F397-L412 HydrophobicContact CG-CD2 3.41Å; F397-L412 VanDerWaalsContact CG-CD2 3.41Å; F397-L412 HydrophobicContact CZ-CB 3.97Å; F397-L412 HydrophobicContact CZ-CD2 4.31Å
398	D	93.7	Very high	93.2	Very high	62 Å²	62	52.4 Å²	52.4	33%	0.332	30%	0.299	S	S	.	.	H	α-helix	trans	-61.5	-38.8	177.3	-72.4	-20.7	0	0	0	111.3	K394 S395 Q402	K394-D398 IonicContact NZ-OD1 3.36Å; K394-D398 PolarHBondContact NZ-OD1 3.35Å; K394-D398 IonicContact NZ-OD2 2.66Å; K394-D398 PolarHBondContact NZ-OD2 3.17Å; K394-D398 WeakPolarHBondContact O-CB 3.24Å; K394-D398 PolarHBondContact O-N 2.94Å; S395-D398 PolarHBondContact O-N 3.09Å; D398-Q402 PolarHBondContact O-N 3.41Å
399	S	94.7	Very high	93.3	Very high	78 Å²	78	50.5 Å²	50.5	55%	0.545	29%	0.294	S	S	.	.	H	α-helix	trans	-66.3	-44.7	175	-168.5	0	0	0	0	111.9	S395 E396 F397 L401 Q402	S395-S399 WeakPolarHBondContact O-CB 3.39Å; S395-S399 PolarHBondContact O-N 2.93Å; E396-S399 PolarHBondContact O-N 3.23Å; F397-S399 VanDerWaalsContact C-N 3.3Å; F397-S399 PolarHBondContact O-N 3.11Å; S399-L401 VanDerWaalsContact C-N 3.29Å; S399-L401 PolarHBondContact O-N 3.18Å; S399-Q402 WeakPolarHBondContact O-CB 3.28Å; S399-Q402 PolarHBondContact O-N 3.27Å; S399-Q402 VanDerWaalsContact O-N 3.12Å
400	T	94.2	Very high	93.4	Very high	19 Å²	19	53.2 Å²	53.2	12%	0.117	31%	0.31	C	S	.	.	H	α-helix	trans	-64.1	-37.3	-179.7	-58.1	0	0	0	0	111.1	A326 Q327 F346 E396 F397 Q402	A326-T400 HydrophobicContact CB-CG2 3.78Å; Q327-T400 HydrophobicContact CG-CG2 3.83Å; Q327-T400 WeakPolarHBondContact CG-OG1 3.5Å; Q327-T400 PolarHBondContact NE2-OG1 2.84Å; F346-T400 WeakPolarHBondContact CE1-O 3.37Å; F346-T400 HydrophobicContact CZ-CG2 4.46Å; E396-T400 WeakPolarHBondContact O-CB 3.35Å; E396-T400 PolarHBondContact O-N 3.02Å; E396-T400 PolarHBondContact O-OG1 2.66Å; F397-T400 PolarHBondContact O-N 3.02Å; T400-Q402 VanDerWaalsContact C-N 3.25Å; T400-Q402 PolarHBondContact O-N 3.47Å
401	L	94.8	Very high	93.5	Very high	1 Å²	1	54.8 Å²	54.8	1%	0.005	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	11.2	177.6	-61.1	-166.5	0	0	0	114	I350 L354 F397 S399 G403 T404 T408 K409	I350-L401 HydrophobicContact CD1-CD2 3.29Å; L354-L401 HydrophobicContact CD2-CD1 4.42Å; F397-L401 HydrophobicContact CD1-CD1 3.66Å; F397-L401 HydrophobicContact CD1-CG 4.08Å; F397-L401 HydrophobicContact CE1-CD1 3.21Å; F397-L401 HydrophobicContact CE1-CG 4.01Å; F397-L401 HydrophobicContact CZ-CD1 4.05Å; F397-L401 WeakPolarHBondContact O-CG 3.32Å; F397-L401 PolarHBondContact O-N 3.42Å; S399-L401 VanDerWaalsContact C-N 3.29Å; S399-L401 PolarHBondContact O-N 3.18Å; L401-G403 PolarHBondContact O-N 3.27Å; L401-G403 VanDerWaalsContact O-N 3.16Å; L401-T404 PolarHBondContact O-N 2.9Å; L401-T404 VanDerWaalsContact O-N 3.16Å; L401-T404 PolarHBondContact O-OG1 3.44Å; L401-T408 HydrophobicContact CD1-CG2 4.3Å; L401-K409 HydrophobicContact CB-CG 4.08Å
402	Q	93.1	Very high	93.7	Very high	130 Å²	130	51.4 Å²	51.4	61%	0.607	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	120.3	-178.3	-170.7	-179.8	12.6	0	0	111.6	K343 D398 S399 T400	K343-Q402 PolarHBondContact NZ-O 3.34Å; D398-Q402 PolarHBondContact O-N 3.41Å; S399-Q402 WeakPolarHBondContact O-CB 3.28Å; S399-Q402 PolarHBondContact O-N 3.27Å; S399-Q402 VanDerWaalsContact O-N 3.12Å; T400-Q402 VanDerWaalsContact C-N 3.25Å; T400-Q402 PolarHBondContact O-N 3.47Å
403	G	89.8	Confident	93.9	Very high	43 Å²	43	47.3 Å²	47.3	44%	0.443	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.4	-0.7	179.1	0	0	0	0	0	115.2	L401	L401-G403 PolarHBondContact O-N 3.27Å; L401-G403 VanDerWaalsContact O-N 3.16Å
404	T	96	Very high	94.3	Very high	8 Å²	8	50.7 Å²	50.7	5%	0.049	31%	0.306	C	S	.	.	S	Bend	trans	-78.5	170.2	170.2	66.3	0	0	0	0	112	F346 D347 I350 L401 K409	F346-T404 HydrophobicContact CD1-CG2 3.81Å; F346-T404 HydrophobicContact CE1-CG2 4.1Å; D347-T404 HydrophobicContact CB-CG2 4.02Å; I350-T404 HydrophobicContact CD1-CG2 4.34Å; L401-T404 PolarHBondContact O-N 2.9Å; L401-T404 VanDerWaalsContact O-N 3.16Å; L401-T404 PolarHBondContact O-OG1 3.44Å; T404-K409 WeakPolarHBondContact O-CE 3.39Å; T404-K409 WeakPolarHBondContact OG1-CG 3.25Å
405	A	96	Very high	94.6	Very high	37 Å²	37	47.5 Å²	47.5	31%	0.306	29%	0.293	S	S	.	.			trans	-57.1	149.9	177.3	0	0	0	0	0	112.4	D347 S407 T408 K409	D347-A405 WeakPolarHBondContact OD2-CB 3.28Å; D347-A405 PolarHBondContact OD2-N 2.91Å; A405-S407 PolarHBondContact O-N 3.07Å; A405-T408 WeakPolarHBondContact O-CB 3.39Å; A405-T408 PolarHBondContact O-N 2.88Å; A405-K409 PolarHBondContact O-N 3.49Å; A405-K409 VanDerWaalsContact O-N 3.12Å
406	A	95.1	Very high	94.8	Very high	60 Å²	60	43.9 Å²	43.9	50%	0.496	27%	0.266	S	S	.	.	H	α-helix	trans	-59.3	-35.7	177.1	0	0	0	0	0	112.2	T408 K409 N410	A406-T408 VanDerWaalsContact C-N 3.29Å; A406-T408 PolarHBondContact O-N 2.98Å; A406-K409 PolarHBondContact O-N 3.38Å; A406-N410 VanDerWaalsContact O-CB 3.29Å; A406-N410 WeakPolarHBondContact O-CB 3.4Å; A406-N410 PolarHBondContact O-N 3.26Å; A406-N410 PolarHBondContact O-ND2 3.27Å
407	S	95.8	Very high	94.9	Very high	84 Å²	84	45.3 Å²	45.3	59%	0.587	28%	0.278	S	S	*	.	H	α-helix	trans	-58.6	-39.6	174	48.4	0	0	0	0	112.3	A405 K411	A405-S407 PolarHBondContact O-N 3.07Å; S407-K411 WeakPolarHBondContact O-CG 3Å
408	T	96.1	Very high	95.1	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.006	29%	0.289	C	S	.	.	H	α-helix	trans	-69.4	-49.6	178.5	-53.3	0	0	0	0	111.1	D347 I350 Q351 L354 L401 A405 A406 N410 K411	D347-T408 VanDerWaalsContact OD1-CB 3.32Å; D347-T408 WeakPolarHBondContact OD1-CB 3.05Å; D347-T408 WeakPolarHBondContact OD1-CG2 2.94Å; D347-T408 PolarHBondContact OD1-OG1 2.84Å; I350-T408 HydrophobicContact CD1-CG2 3.98Å; Q351-T408 PolarHBondContact NE2-OG1 3.33Å; L354-T408 HydrophobicContact CD2-CG2 3.67Å; L401-T408 HydrophobicContact CD1-CG2 4.3Å; A405-T408 WeakPolarHBondContact O-CB 3.39Å; A405-T408 PolarHBondContact O-N 2.88Å; A406-T408 VanDerWaalsContact C-N 3.29Å; A406-T408 PolarHBondContact O-N 2.98Å; T408-N410 PolarHBondContact O-N 2.96Å; T408-K411 PolarHBondContact O-N 2.95Å
409	K	94.5	Very high	95.2	Very high	79 Å²	79	43.9 Å²	43.9	34%	0.343	27%	0.273	S	S	.	.	H	α-helix	trans	-62.5	-30.2	179.2	-65.6	-177.8	-66.3	-175	0	113.3	L401 T404 A405 A406 P413	L401-K409 HydrophobicContact CB-CG 4.08Å; T404-K409 WeakPolarHBondContact O-CE 3.39Å; T404-K409 WeakPolarHBondContact OG1-CG 3.25Å; A405-K409 PolarHBondContact O-N 3.49Å; A405-K409 VanDerWaalsContact O-N 3.12Å; A406-K409 PolarHBondContact O-N 3.38Å; K409-P413 WeakPolarHBondContact O-CD 3.13Å
410	N	95.2	Very high	95.2	Very high	92 Å²	92	41 Å²	41	49%	0.492	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-7.7	-178.7	-72.3	-20.6	0	0	0	114.1	A406 T408 T414	A406-N410 VanDerWaalsContact O-CB 3.29Å; A406-N410 WeakPolarHBondContact O-CB 3.4Å; A406-N410 PolarHBondContact O-N 3.26Å; A406-N410 PolarHBondContact O-ND2 3.27Å; T408-N410 PolarHBondContact O-N 2.96Å; N410-T414 VanDerWaalsContact O-CB 3.31Å; N410-T414 WeakPolarHBondContact O-CB 3.47Å; N410-T414 PolarHBondContact O-N 3.43Å; N410-T414 PolarHBondContact O-OG1 2.68Å
411	K	96.2	Very high	95.2	Very high	35 Å²	35	43 Å²	43	15%	0.152	26%	0.264	C	S	.	.	H	α-helix	trans	-62.1	-52.2	-179.5	-66	-173.6	-173.3	174.7	0	112.3	L354 D355 M358 S407 T408 T414 L415	L354-K411 HydrophobicContact CD2-CD 3.88Å; L354-K411 HydrophobicContact CG-CD 3.94Å; D355-K411 VanDerWaalsContact OD1-CE 3.31Å; D355-K411 WeakPolarHBondContact OD1-CE 3.41Å; D355-K411 IonicContact OD1-NZ 2.67Å; D355-K411 PolarHBondContact OD1-NZ 3.04Å; D355-K411 IonicContact OD2-NZ 3.77Å; D355-K411 PolarHBondContact OD2-NZ 3.38Å; M358-K411 HydrophobicContact CG-CB 3.92Å; M358-K411 HydrophobicContact CG-CD 4.41Å; M358-K411 HydrophobicContact SD-CB 3.98Å; S407-K411 WeakPolarHBondContact O-CG 3Å; T408-K411 PolarHBondContact O-N 2.95Å; K411-T414 WeakPolarHBondContact O-CB 3.03Å; K411-T414 PolarHBondContact O-N 2.95Å; K411-L415 PolarHBondContact O-N 3.41Å
412	L	95.4	Very high	95.2	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-62.8	-48.9	178.4	173.4	68.4	0	0	0	112.6	L390 F397 T414 L415 I416	L390-L412 HydrophobicContact CB-CD1 4.3Å; L390-L412 HydrophobicContact CD1-CD1 4.31Å; L390-L412 HydrophobicContact CD2-CD1 3.83Å; L390-L412 HydrophobicContact CG-CD1 4.36Å; F397-L412 HydrophobicContact CB-CD2 3.71Å; F397-L412 HydrophobicContact CD1-CB 3.92Å; F397-L412 HydrophobicContact CD1-CD2 3.43Å; F397-L412 VanDerWaalsContact CD1-CD2 3.43Å; F397-L412 HydrophobicContact CD1-CG 4.29Å; F397-L412 HydrophobicContact CD2-CD2 3.88Å; F397-L412 HydrophobicContact CE1-CB 3.53Å; F397-L412 HydrophobicContact CE1-CD2 3.88Å; F397-L412 HydrophobicContact CE1-CG 4.3Å; F397-L412 HydrophobicContact CE2-CD2 4.31Å; F397-L412 HydrophobicContact CG-CD2 3.41Å; F397-L412 VanDerWaalsContact CG-CD2 3.41Å; F397-L412 HydrophobicContact CZ-CB 3.97Å; F397-L412 HydrophobicContact CZ-CD2 4.31Å; L412-T414 VanDerWaalsContact C-N 3.27Å; L412-T414 PolarHBondContact O-N 3.49Å; L412-L415 PolarHBondContact O-N 3.39Å; L412-L415 VanDerWaalsContact O-N 3.17Å; L412-I416 HydrophobicContact CD1-CD1 4.1Å; L412-I416 HydrophobicContact CD1-CG1 4.2Å; L412-I416 HydrophobicContact CD2-CD1 4.49Å; L412-I416 HydrophobicContact CG-CD1 3.95Å; L412-I416 HydrophobicContact CG-CG1 4.45Å; L412-I416 WeakPolarHBondContact O-CG1 3.41Å; L412-I416 PolarHBondContact O-N 3.44Å
413	P	95.2	Very high	95.3	Very high	36 Å²	36	37 Å²	37	23%	0.234	24%	0.235	C	C	.	.	H	α-helix	trans	-54.3	-41.3	173.1	-28.5	34.7	0	0	0	113.7	K409 L415 I416 T417	K409-P413 WeakPolarHBondContact O-CD 3.13Å; P413-L415 PolarHBondContact O-N 3.25Å; P413-I416 PolarHBondContact O-N 3Å; P413-T417 PolarHBondContact O-N 3.32Å; P413-T417 PolarHBondContact O-OG1 2.92Å
414	T	96.3	Very high	95.5	Very high	92 Å²	92	35.5 Å²	35.5	56%	0.564	22%	0.219	S	C	*	.	H	α-helix	trans	-62.5	-43.3	177.9	-58	0	0	0	0	111.2	N410 K411 L412 T417 S418	N410-T414 VanDerWaalsContact O-CB 3.31Å; N410-T414 WeakPolarHBondContact O-CB 3.47Å; N410-T414 PolarHBondContact O-N 3.43Å; N410-T414 PolarHBondContact O-OG1 2.68Å; K411-T414 WeakPolarHBondContact O-CB 3.03Å; K411-T414 PolarHBondContact O-N 2.95Å; L412-T414 VanDerWaalsContact C-N 3.27Å; L412-T414 PolarHBondContact O-N 3.49Å; T414-T417 PolarHBondContact O-N 3.38Å; T414-S418 WeakPolarHBondContact O-CB 3.31Å; T414-S418 PolarHBondContact O-N 3.44Å
415	L	96.9	Very high	95.4	Very high	4 Å²	4	39.2 Å²	39.2	2%	0.021	24%	0.235	C	C	.	.	H	α-helix	trans	-64	-44.1	175.8	-178.8	63.7	0	0	0	111.9	Y315 M358 V365 L390 K411 L412 P413 T417 S418 M419	Y315-L415 VanDerWaalsContact OH-CD2 3.29Å; Y315-L415 WeakPolarHBondContact OH-CD2 3.32Å; M358-L415 HydrophobicContact CE-CD2 3.93Å; M358-L415 HydrophobicContact SD-CB 4.17Å; M358-L415 HydrophobicContact SD-CD2 3.99Å; V365-L415 HydrophobicContact CG2-CD1 4.47Å; L390-L415 HydrophobicContact CD1-CD2 4.08Å; L390-L415 HydrophobicContact CD1-CG 4.35Å; K411-L415 PolarHBondContact O-N 3.41Å; L412-L415 PolarHBondContact O-N 3.39Å; L412-L415 VanDerWaalsContact O-N 3.17Å; P413-L415 PolarHBondContact O-N 3.25Å; L415-T417 PolarHBondContact O-N 3.34Å; L415-S418 WeakPolarHBondContact O-CB 3.22Å; L415-S418 PolarHBondContact O-N 3.08Å; L415-M419 HydrophobicContact CD1-CE 4Å; L415-M419 HydrophobicContact CD2-CE 4.22Å; L415-M419 HydrophobicContact CG-CE 4.08Å; L415-M419 HydrophobicContact CG-SD 4.43Å; L415-M419 WeakPolarHBondContact O-CG 3.36Å; L415-M419 PolarHBondContact O-N 3.28Å
416	I	96.1	Very high	95.4	Very high	12 Å²	12	37.4 Å²	37.4	6%	0.062	22%	0.22	C	C	.	.	H	α-helix	trans	-57.4	-49.8	176	-71.5	171.9	0	0	0	110.2	L387 L390 K394 L412 P413 S418 M419 E420	L387-I416 HydrophobicContact CD1-CB 4.49Å; L387-I416 HydrophobicContact CD1-CG2 3.91Å; L390-I416 HydrophobicContact CB-CD1 4.15Å; L390-I416 HydrophobicContact CB-CG1 3.95Å; L390-I416 HydrophobicContact CD1-CG1 4.1Å; K394-I416 HydrophobicContact CD-CD1 4.42Å; L412-I416 HydrophobicContact CD1-CD1 4.1Å; L412-I416 HydrophobicContact CD1-CG1 4.2Å; L412-I416 HydrophobicContact CD2-CD1 4.49Å; L412-I416 HydrophobicContact CG-CD1 3.95Å; L412-I416 HydrophobicContact CG-CG1 4.45Å; L412-I416 WeakPolarHBondContact O-CG1 3.41Å; L412-I416 PolarHBondContact O-N 3.44Å; P413-I416 PolarHBondContact O-N 3Å; I416-S418 VanDerWaalsContact C-N 3.32Å; I416-S418 PolarHBondContact O-N 2.9Å; I416-M419 PolarHBondContact O-N 3.16Å; I416-E420 HydrophobicContact CG2-CG 4.46Å; I416-E420 WeakPolarHBondContact O-CG 3.22Å; I416-E420 PolarHBondContact O-N 2.66Å
417	T	95.4	Very high	95.5	Very high	76 Å²	76	34.6 Å²	34.6	47%	0.466	20%	0.196	S	C	.	.	H	α-helix	trans	-61.6	-40.3	177.3	-60.3	0	0	0	0	111.8	P413 T414 L415 M419 E420 T421	P413-T417 PolarHBondContact O-N 3.32Å; P413-T417 PolarHBondContact O-OG1 2.92Å; T414-T417 PolarHBondContact O-N 3.38Å; L415-T417 PolarHBondContact O-N 3.34Å; T417-M419 PolarHBondContact O-N 3.13Å; T417-E420 PolarHBondContact O-N 2.79Å; T417-T421 WeakPolarHBondContact O-CB 3.14Å; T417-T421 PolarHBondContact O-N 2.61Å; T417-T421 PolarHBondContact O-OG1 3.01Å
418	S	96	Very high	95.4	Very high	34 Å²	34	34.3 Å²	34.3	24%	0.238	19%	0.186	C	C	.	.	H	α-helix	trans	-60.3	-45.2	175.9	-170.4	0	0	0	0	112	T414 L415 I416 T421 I422	T414-S418 WeakPolarHBondContact O-CB 3.31Å; T414-S418 PolarHBondContact O-N 3.44Å; L415-S418 WeakPolarHBondContact O-CB 3.22Å; L415-S418 PolarHBondContact O-N 3.08Å; I416-S418 VanDerWaalsContact C-N 3.32Å; I416-S418 PolarHBondContact O-N 2.9Å; S418-T421 PolarHBondContact O-N 3.45Å; S418-I422 WeakPolarHBondContact O-CG2 3.31Å; S418-I422 PolarHBondContact O-N 3.3Å
419	M	96	Very high	95.4	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-64.5	-41.3	175.3	-75.5	-176.6	175.2	0	0	112.5	Y315 V365 I383 I386 L387 L390 L415 I416 T417 I422 G423	Y315-M419 HydrophobicContact CE1-CE 4.39Å; V365-M419 HydrophobicContact CG2-CB 4.41Å; V365-M419 HydrophobicContact CG2-CE 4.27Å; V365-M419 HydrophobicContact CG2-CG 3.46Å; V365-M419 VanDerWaalsContact CG2-CG 3.46Å; I383-M419 HydrophobicContact CG2-CB 4.02Å; I383-M419 HydrophobicContact CG2-CG 4.37Å; I386-M419 HydrophobicContact CG2-CE 3.67Å; I386-M419 HydrophobicContact CG2-SD 3.86Å; L387-M419 HydrophobicContact CD1-CB 4.19Å; L390-M419 HydrophobicContact CD1-CE 4.17Å; L390-M419 HydrophobicContact CD1-SD 3.55Å; L390-M419 VanDerWaalsContact CD1-SD 3.55Å; L415-M419 HydrophobicContact CD1-CE 4Å; L415-M419 HydrophobicContact CD2-CE 4.22Å; L415-M419 HydrophobicContact CG-CE 4.08Å; L415-M419 HydrophobicContact CG-SD 4.43Å; L415-M419 WeakPolarHBondContact O-CG 3.36Å; L415-M419 PolarHBondContact O-N 3.28Å; I416-M419 PolarHBondContact O-N 3.16Å; T417-M419 PolarHBondContact O-N 3.13Å; M419-I422 VanDerWaalsContact O-CG2 3.27Å; M419-I422 WeakPolarHBondContact O-CG2 3.39Å; M419-G423 PolarHBondContact O-N 3.28Å
420	E	95.1	Very high	95.5	Very high	16 Å²	16	33.6 Å²	33.6	8%	0.075	18%	0.183	C	C	.	.	H	α-helix	trans	-64.8	-46	176.3	-73.9	176	161.4	0	0	112.1	L387 K391 I416 T417 I422 G423 A424 M474 S477	L387-E420 HydrophobicContact CD1-CG 4.05Å; L387-E420 HydrophobicContact CD2-CG 3.85Å; K391-E420 WeakPolarHBondContact CE-OE1 3.28Å; K391-E420 IonicContact NZ-OE1 2.74Å; K391-E420 PolarHBondContact NZ-OE1 2.89Å; I416-E420 HydrophobicContact CG2-CG 4.46Å; I416-E420 WeakPolarHBondContact O-CG 3.22Å; I416-E420 PolarHBondContact O-N 2.66Å; T417-E420 PolarHBondContact O-N 2.79Å; E420-I422 PolarHBondContact O-N 2.94Å; E420-G423 PolarHBondContact O-N 3.46Å; E420-A424 WeakPolarHBondContact O-CB 3.5Å; E420-A424 PolarHBondContact O-N 2.78Å; E420-M474 HydrophobicContact CB-CG 4.24Å; E420-M474 HydrophobicContact CG-CG 4.44Å; E420-M474 WeakPolarHBondContact O-CG 3.12Å; E420-S477 WeakPolarHBondContact OE2-CB 3.43Å; E420-S477 PolarHBondContact OE2-OG 3.22Å
421	T	95	Very high	95.5	Very high	63 Å²	63	29.2 Å²	29.2	39%	0.387	16%	0.16	S	C	.	.	H	α-helix	trans	-63.8	-42.8	179.7	-67.3	0	0	0	0	111.6	T417 S418 K425 Q478	T417-T421 WeakPolarHBondContact O-CB 3.14Å; T417-T421 PolarHBondContact O-N 2.61Å; T417-T421 PolarHBondContact O-OG1 3.01Å; S418-T421 PolarHBondContact O-N 3.45Å; T421-K425 VanDerWaalsContact O-CB 3.24Å; T421-K425 WeakPolarHBondContact O-CB 3.33Å; T421-K425 PolarHBondContact O-N 2.92Å; T421-Q478 PolarHBondContact OG1-OE1 3.39Å
422	I	94.7	Very high	95.5	Very high	3 Å²	3	30.4 Å²	30.4	2%	0.015	17%	0.168	C	C	.	.	H	α-helix	trans	-68.5	-38.3	177.5	-166.4	57.4	0	0	0	111.7	V365 A368 R369 I372 S418 M419 E420 K425 A426	V365-I422 HydrophobicContact CG1-CB 4.26Å; V365-I422 HydrophobicContact CG1-CG2 4.02Å; V365-I422 HydrophobicContact CG2-CG2 4.43Å; A368-I422 HydrophobicContact CB-CG1 4.48Å; R369-I422 HydrophobicContact CB-CD1 3.87Å; R369-I422 HydrophobicContact CB-CG1 4.37Å; R369-I422 HydrophobicContact CG-CD1 4.09Å; I372-I422 HydrophobicContact CD1-CD1 3.7Å; I372-I422 HydrophobicContact CD1-CG1 3.8Å; S418-I422 WeakPolarHBondContact O-CG2 3.31Å; S418-I422 PolarHBondContact O-N 3.3Å; M419-I422 VanDerWaalsContact O-CG2 3.27Å; M419-I422 WeakPolarHBondContact O-CG2 3.39Å; E420-I422 PolarHBondContact O-N 2.94Å; I422-K425 PolarHBondContact O-N 3.47Å; I422-A426 WeakPolarHBondContact O-CB 3.4Å; I422-A426 PolarHBondContact O-N 3.31Å
423	G	94.9	Very high	95.5	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-68.9	-43.8	179.3	0	0	0	0	0	112.6	M419 E420 K425 A426 L427 M474	M419-G423 PolarHBondContact O-N 3.28Å; E420-G423 PolarHBondContact O-N 3.46Å; G423-K425 VanDerWaalsContact C-N 3.31Å; G423-K425 PolarHBondContact O-N 3.39Å; G423-A426 WeakPolarHBondContact O-CB 3.3Å; G423-A426 PolarHBondContact O-N 3.17Å; G423-A426 VanDerWaalsContact O-N 3.15Å; G423-L427 WeakPolarHBondContact O-CG 3.2Å; G423-L427 PolarHBondContact O-N 3.44Å; G423-M474 WeakPolarHBondContact CA-SD 3.35Å
424	A	94.6	Very high	95.6	Very high	13 Å²	13	30.4 Å²	30.4	11%	0.107	17%	0.169	C	C	.	.	H	α-helix	trans	-62.5	-40.2	174.7	0	0	0	0	0	111.6	E420 A426 L427 E428 M474 Q478	E420-A424 WeakPolarHBondContact O-CB 3.5Å; E420-A424 PolarHBondContact O-N 2.78Å; A424-A426 VanDerWaalsContact C-N 3.35Å; A424-A426 PolarHBondContact O-N 3.32Å; A424-L427 PolarHBondContact O-N 2.92Å; A424-E428 PolarHBondContact O-N 3.06Å; A424-M474 HydrophobicContact CB-CG 4.25Å; A424-M474 PolarHBondContact N-SD 3.04Å; A424-Q478 HydrophobicContact CB-CG 3.47Å; A424-Q478 VanDerWaalsContact CB-CG 3.47Å
425	K	93.9	Very high	95.5	Very high	85 Å²	85	31.3 Å²	31.3	37%	0.37	17%	0.165	S	C	.	.	H	α-helix	trans	-61.3	-42.1	173.2	-179.6	172.3	175.5	171.3	0	112	T421 I422 G423 E428 E429	T421-K425 VanDerWaalsContact O-CB 3.24Å; T421-K425 WeakPolarHBondContact O-CB 3.33Å; T421-K425 PolarHBondContact O-N 2.92Å; I422-K425 PolarHBondContact O-N 3.47Å; G423-K425 VanDerWaalsContact C-N 3.31Å; G423-K425 PolarHBondContact O-N 3.39Å; K425-E428 PolarHBondContact O-N 3.18Å; K425-E429 WeakPolarHBondContact CE-OE1 3.34Å; K425-E429 HydrophobicContact CG-CG 4.38Å; K425-E429 IonicContact NZ-OE1 3.68Å; K425-E429 WeakPolarHBondContact O-CB 3.09Å; K425-E429 WeakPolarHBondContact O-CG 3.32Å; K425-E429 PolarHBondContact O-N 3.31Å
426	A	95.4	Very high	95.4	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.1	-44	177.1	0	0	0	0	0	111.9	I372 V380 I422 G423 A424 F430	I372-A426 HydrophobicContact CD1-CB 3.49Å; I372-A426 VanDerWaalsContact CD1-CB 3.49Å; I372-A426 HydrophobicContact CG1-CB 3.85Å; V380-A426 HydrophobicContact CB-CB 3.74Å; V380-A426 HydrophobicContact CG1-CB 4.47Å; V380-A426 HydrophobicContact CG2-CB 3.74Å; I422-A426 WeakPolarHBondContact O-CB 3.4Å; I422-A426 PolarHBondContact O-N 3.31Å; G423-A426 WeakPolarHBondContact O-CB 3.3Å; G423-A426 PolarHBondContact O-N 3.17Å; G423-A426 VanDerWaalsContact O-N 3.15Å; A424-A426 VanDerWaalsContact C-N 3.35Å; A424-A426 PolarHBondContact O-N 3.32Å; A426-F430 VanDerWaalsContact O-CB 3.27Å; A426-F430 WeakPolarHBondContact O-CB 3.38Å; A426-F430 PolarHBondContact O-N 2.63Å
427	L	96	Very high	95.3	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-61.5	-43.6	176.9	-70.4	178.4	0	0	0	111.7	G423 A424 A431 F460 L464 M474 L475 Y498	G423-L427 WeakPolarHBondContact O-CG 3.2Å; G423-L427 PolarHBondContact O-N 3.44Å; A424-L427 PolarHBondContact O-N 2.92Å; L427-A431 PolarHBondContact O-N 2.7Å; L427-A431 VanDerWaalsContact O-N 3.09Å; L427-F460 HydrophobicContact CD2-CE1 3.95Å; L427-F460 HydrophobicContact CD2-CZ 3.8Å; L427-L464 HydrophobicContact CD2-CD1 4.19Å; L427-L464 HydrophobicContact CD2-CD2 4.33Å; L427-M474 HydrophobicContact CD1-SD 4.41Å; L427-L475 HydrophobicContact CD1-CD1 4.4Å; L427-L475 HydrophobicContact CD1-CD2 3.93Å; L427-L475 HydrophobicContact CD1-CG 4.12Å; L427-Y498 WeakPolarHBondContact CA-OH 3.32Å; L427-Y498 HydrophobicContact CB-CE1 4.44Å; L427-Y498 HydrophobicContact CB-CE2 3.73Å; L427-Y498 HydrophobicContact CD2-CE1 3.94Å; L427-Y498 WeakPolarHBondContact CD2-OH 3.29Å; L427-Y498 VanDerWaalsContact O-CE2 3.24Å; L427-Y498 WeakPolarHBondContact O-CE2 3.48Å; L427-Y498 PolarHBondContact O-OH 3.06Å
428	E	94.8	Very high	95.1	Very high	78 Å²	78	37 Å²	37	36%	0.364	20%	0.195	S	C	.	.	H	α-helix	trans	-67.4	-47.4	178.7	-173.8	61.7	-165.6	0	0	111.9	A424 K425 F430 A431 D432 K501	A424-E428 PolarHBondContact O-N 3.06Å; K425-E428 PolarHBondContact O-N 3.18Å; E428-F430 VanDerWaalsContact C-N 3.28Å; E428-F430 PolarHBondContact O-N 3.05Å; E428-A431 WeakPolarHBondContact O-CB 3.49Å; E428-A431 PolarHBondContact O-N 2.68Å; E428-A431 VanDerWaalsContact O-N 3.14Å; E428-D432 PolarHBondContact O-N 3.25Å; E428-K501 IonicContact OE1-NZ 2.66Å; E428-K501 PolarHBondContact OE1-NZ 3.41Å; E428-K501 IonicContact OE2-NZ 3.2Å; E428-K501 PolarHBondContact OE2-NZ 2.94Å
429	E	95.5	Very high	94.6	Very high	47 Å²	47	39.3 Å²	39.3	22%	0.22	21%	0.205	C	C	.	.	H	α-helix	trans	-64.2	-33.6	177.1	-72.4	-170.1	-168.2	0	0	112.3	I372 Y377 K425 D432 S433	I372-E429 WeakPolarHBondContact CG2-OE2 3.3Å; Y377-E429 HydrophobicContact CD1-CB 4.27Å; Y377-E429 HydrophobicContact CE1-CB 3.53Å; K425-E429 WeakPolarHBondContact CE-OE1 3.34Å; K425-E429 HydrophobicContact CG-CG 4.38Å; K425-E429 IonicContact NZ-OE1 3.68Å; K425-E429 WeakPolarHBondContact O-CB 3.09Å; K425-E429 WeakPolarHBondContact O-CG 3.32Å; K425-E429 PolarHBondContact O-N 3.31Å; E429-D432 PolarHBondContact O-N 3.41Å; E429-S433 WeakPolarHBondContact O-CB 3.49Å; E429-S433 PolarHBondContact O-N 3.25Å
430	F	96.6	Very high	94.1	Very high	18 Å²	18	45.2 Å²	45.2	8%	0.079	23%	0.231	C	C	.	.	H	α-helix	trans	-61.6	-47.8	171.5	174.5	-103.6	0	0	0	111.5	Y377 A426 E428 D432 S433 I434 F460 V502	Y377-F430 HydrophobicContact CD1-CB 4.21Å; Y377-F430 HydrophobicContact CD2-CB 4.23Å; Y377-F430 AromaticContact CD2-CD2 3.82Å; Y377-F430 HydrophobicContact CD2-CD2 3.82Å; Y377-F430 HydrophobicContact CG-CB 3.87Å; Y377-F430 HydrophobicContact CG-CD2 4.02Å; Y377-F430 HydrophobicContact CG-CG 4.46Å; A426-F430 VanDerWaalsContact O-CB 3.27Å; A426-F430 WeakPolarHBondContact O-CB 3.38Å; A426-F430 PolarHBondContact O-N 2.63Å; E428-F430 VanDerWaalsContact C-N 3.28Å; E428-F430 PolarHBondContact O-N 3.05Å; F430-D432 VanDerWaalsContact C-N 3.28Å; F430-D432 PolarHBondContact O-N 3.27Å; F430-S433 PolarHBondContact O-N 3.49Å; F430-S433 VanDerWaalsContact O-N 3.14Å; F430-S433 PolarHBondContact O-OG 3.48Å; F430-I434 HydrophobicContact CD1-CD1 4.04Å; F430-I434 HydrophobicContact CE1-CD1 3.42Å; F430-I434 VanDerWaalsContact CE1-CD1 3.42Å; F430-I434 HydrophobicContact CE2-CD1 4.07Å; F430-I434 HydrophobicContact CZ-CD1 3.46Å; F430-I434 VanDerWaalsContact CZ-CD1 3.46Å; F430-I434 HydrophobicContact CZ-CG1 4.36Å; F430-I434 PolarHBondContact O-N 3.22Å; F430-I434 VanDerWaalsContact O-N 3.12Å; F430-F460 AromaticContact CD1-CD1 3.67Å; F430-F460 HydrophobicContact CD1-CD1 3.67Å; F430-F460 AromaticContact CD1-CE1 3.59Å; F430-F460 HydrophobicContact CD1-CE1 3.59Å; F430-F460 HydrophobicContact CD1-CG 4.39Å; F430-F460 HydrophobicContact CD1-CZ 4.26Å; F430-F460 HydrophobicContact CD2-CG 4.48Å; F430-F460 HydrophobicContact CE1-CB 4.2Å; F430-F460 AromaticContact CE1-CD1 3.17Å; F430-F460 HydrophobicContact CE1-CD1 3.17Å; F430-F460 AromaticContact CE1-CE1 3.62Å; F430-F460 HydrophobicContact CE1-CE1 3.62Å; F430-F460 AromaticContact CE1-CG 3.78Å; F430-F460 HydrophobicContact CE1-CG 3.78Å; F430-F460 HydrophobicContact CE2-CB 4.08Å; F430-F460 HydrophobicContact CE2-CD1 4.11Å; F430-F460 HydrophobicContact CE2-CD2 4.26Å; F430-F460 AromaticContact CE2-CG 3.88Å; F430-F460 HydrophobicContact CE2-CG 3.88Å; F430-F460 HydrophobicContact CG-CD1 4.3Å; F430-F460 HydrophobicContact CG-CE1 4.1Å; F430-F460 HydrophobicContact CG-CZ 4.33Å; F430-F460 HydrophobicContact CZ-CB 3.54Å; F430-F460 AromaticContact CZ-CD1 3.4Å; F430-F460 HydrophobicContact CZ-CD1 3.4Å; F430-F460 HydrophobicContact CZ-CD2 4.27Å; F430-F460 HydrophobicContact CZ-CE1 4.15Å; F430-F460 AromaticContact CZ-CG 3.46Å; F430-F460 HydrophobicContact CZ-CG 3.46Å; F430-F460 VanDerWaalsContact CZ-CG 3.46Å; F430-V502 HydrophobicContact CD1-CG2 4.42Å; F430-V502 HydrophobicContact CE1-CG1 4.05Å; F430-V502 HydrophobicContact CE1-CG2 4.46Å
431	A	96.5	Very high	93.5	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60.9	-38.3	177.6	0	0	0	0	0	112	L427 E428 K435 Y498 V502 N505	L427-A431 PolarHBondContact O-N 2.7Å; L427-A431 VanDerWaalsContact O-N 3.09Å; E428-A431 WeakPolarHBondContact O-CB 3.49Å; E428-A431 PolarHBondContact O-N 2.68Å; E428-A431 VanDerWaalsContact O-N 3.14Å; A431-K435 PolarHBondContact O-N 3Å; A431-Y498 HydrophobicContact CB-CE2 4.2Å; A431-V502 HydrophobicContact CB-CG2 3.93Å; A431-N505 PolarHBondContact O-ND2 3.16Å
432	D	95.4	Very high	93.1	Very high	61 Å²	61	57.7 Å²	57.7	33%	0.326	28%	0.278	S	S	.	.	H	α-helix	trans	-70.4	-35.3	174.6	-81.4	-17.9	0	0	0	112.8	E428 E429 F430 I434 K435 N436	E428-D432 PolarHBondContact O-N 3.25Å; E429-D432 PolarHBondContact O-N 3.41Å; F430-D432 VanDerWaalsContact C-N 3.28Å; F430-D432 PolarHBondContact O-N 3.27Å; D432-I434 VanDerWaalsContact C-N 3.33Å; D432-I434 PolarHBondContact O-N 2.88Å; D432-K435 WeakPolarHBondContact O-CB 3.44Å; D432-K435 PolarHBondContact O-N 3.26Å; D432-N436 WeakPolarHBondContact O-CB 3.35Å; D432-N436 PolarHBondContact O-N 3.49Å; D432-N436 PolarHBondContact O-ND2 3.45Å
433	S	95.4	Very high	92.8	Very high	34 Å²	34	60 Å²	60	24%	0.238	29%	0.29	C	S	.	.	H	α-helix	trans	-62.2	-41.6	176.2	78.4	0	0	0	0	111.4	Y377 E429 F430 K435 N436 D437	Y377-S433 VanDerWaalsContact CE2-CB 3.49Å; Y377-S433 WeakPolarHBondContact CE2-OG 3.38Å; E429-S433 WeakPolarHBondContact O-CB 3.49Å; E429-S433 PolarHBondContact O-N 3.25Å; F430-S433 PolarHBondContact O-N 3.49Å; F430-S433 VanDerWaalsContact O-N 3.14Å; F430-S433 PolarHBondContact O-OG 3.48Å; S433-K435 VanDerWaalsContact C-N 3.34Å; S433-K435 PolarHBondContact O-N 2.74Å; S433-N436 CarbonylContact O-C 3.56Å; S433-N436 PolarHBondContact O-N 3.16Å; S433-D437 PolarHBondContact O-N 2.82Å
434	I	96.4	Very high	92.7	Very high	2 Å²	2	60.8 Å²	60.8	1%	0.01	29%	0.294	C	S	.	.	H	α-helix	trans	-64	-42	175.7	-70.1	170.4	0	0	0	111.1	F430 D432 N436 L453 A457 V502 N505 L506 N509	F430-I434 HydrophobicContact CD1-CD1 4.04Å; F430-I434 HydrophobicContact CE1-CD1 3.42Å; F430-I434 VanDerWaalsContact CE1-CD1 3.42Å; F430-I434 HydrophobicContact CE2-CD1 4.07Å; F430-I434 HydrophobicContact CZ-CD1 3.46Å; F430-I434 VanDerWaalsContact CZ-CD1 3.46Å; F430-I434 HydrophobicContact CZ-CG1 4.36Å; F430-I434 PolarHBondContact O-N 3.22Å; F430-I434 VanDerWaalsContact O-N 3.12Å; D432-I434 VanDerWaalsContact C-N 3.33Å; D432-I434 PolarHBondContact O-N 2.88Å; I434-N436 VanDerWaalsContact C-N 3.31Å; I434-N436 PolarHBondContact O-N 3.35Å; I434-L453 HydrophobicContact CG1-CD1 4.15Å; I434-A457 HydrophobicContact CD1-CB 3.69Å; I434-A457 HydrophobicContact CG1-CB 4.48Å; I434-V502 HydrophobicContact CD1-CG1 3.61Å; I434-N505 HydrophobicContact CG2-CB 4.23Å; I434-L506 HydrophobicContact CG2-CB 3.78Å; I434-L506 HydrophobicContact CG2-CD1 4.1Å; I434-N509 WeakPolarHBondContact O-CB 3.37Å; I434-N509 PolarHBondContact O-ND2 3.27Å
435	K	95.6	Very high	92.7	Very high	112 Å²	112	61.4 Å²	61.4	49%	0.487	30%	0.297	S	S	.	.	H	α-helix	trans	-62.4	-41.4	179.1	-175.7	179	173.3	-175.2	0	111.6	A431 D432 S433 N505 N509	A431-K435 PolarHBondContact O-N 3Å; D432-K435 WeakPolarHBondContact O-CB 3.44Å; D432-K435 PolarHBondContact O-N 3.26Å; S433-K435 VanDerWaalsContact C-N 3.34Å; S433-K435 PolarHBondContact O-N 2.74Å; K435-N505 HydrophobicContact CB-CB 4.07Å; K435-N509 PolarHBondContact O-ND2 2.87Å
436	N	93.7	Very high	92.7	Very high	119 Å²	119	66.8 Å²	66.8	64%	0.636	32%	0.321	S	S	*	.	H	α-helix	trans	-97.6	6.8	-172.7	-60.4	-47.2	0	0	0	114	D432 S433 I434	D432-N436 WeakPolarHBondContact O-CB 3.35Å; D432-N436 PolarHBondContact O-N 3.49Å; D432-N436 PolarHBondContact O-ND2 3.45Å; S433-N436 CarbonylContact O-C 3.56Å; S433-N436 PolarHBondContact O-N 3.16Å; I434-N436 VanDerWaalsContact C-N 3.31Å; I434-N436 PolarHBondContact O-N 3.35Å
437	D	94.4	Very high	92.6	Very high	40 Å²	40	69.2 Å²	69.2	21%	0.214	33%	0.334	C	S	.	.			trans	-58.1	130.4	179	-175.2	-89.9	0	0	0	110.9	S433 D439 L453 N509 K513	S433-D437 PolarHBondContact O-N 2.82Å; D437-D439 PolarHBondContact O-N 2.91Å; D437-L453 HydrophobicContact CB-CD1 3.92Å; D437-L453 HydrophobicContact CB-CD2 3.68Å; D437-L453 HydrophobicContact CB-CG 4.42Å; D437-N509 PolarHBondContact O-ND2 3.16Å; D437-K513 PolarHBondContact O-NZ 3.28Å; D437-K513 WeakPolarHBondContact OD1-CE 3.41Å; D437-K513 IonicContact OD1-NZ 3.28Å; D437-K513 PolarHBondContact OD1-NZ 2.69Å
438	P	91	Very high	92.5	Very high	51 Å²	51	69.2 Å²	69.2	33%	0.331	33%	0.334	S	S	.	.			trans	-64.7	132.2	-168.7	25.1	-34.7	0	0	0	112.9	K440 K513	P438-K440 VanDerWaalsContact C-N 3.33Å; P438-K440 HydrophobicContact CB-CG 4.39Å; P438-K440 PolarHBondContact O-N 3.3Å; P438-K513 WeakPolarHBondContact O-CE 3.49Å; P438-K513 PolarHBondContact O-NZ 2.71Å
439	D	85.1	Confident	92.6	Very high	84 Å²	84	67.3 Å²	67.3	45%	0.449	33%	0.328	S	S	.	.			trans	-95.1	40.8	177.2	60.6	-19.1	0	0	0	112.5	D437 K513 V516	D437-D439 PolarHBondContact O-N 2.91Å; D439-K513 HydrophobicContact CB-CG 3.76Å; D439-V516 WeakPolarHBondContact O-CG2 3.36Å
440	K	87.2	Confident	92.7	Very high	124 Å²	124	66.6 Å²	66.6	54%	0.539	33%	0.326	S	S	.	.			trans	-89.1	146.1	180	-55.9	-160.4	-162.3	172.9	0	111.4	P438 Y442 N443	P438-K440 VanDerWaalsContact C-N 3.33Å; P438-K440 HydrophobicContact CB-CG 4.39Å; P438-K440 PolarHBondContact O-N 3.3Å; K440-Y442 VanDerWaalsContact C-N 3.26Å; K440-Y442 HydrophobicContact CB-CD1 3.8Å; K440-Y442 HydrophobicContact CB-CE1 3.64Å; K440-Y442 HydrophobicContact CD-CE1 3.85Å; K440-Y442 HydrophobicContact CG-CE1 4.25Å; K440-Y442 PolarHBondContact O-N 2.69Å; K440-Y442 VanDerWaalsContact O-N 3.13Å; K440-N443 WeakPolarHBondContact O-CB 3.34Å; K440-N443 PolarHBondContact O-N 2.88Å
441	E	81.5	Confident	92.7	Very high	159 Å²	159	66 Å²	66	74%	0.743	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-53.3	-36.7	-175.7	-167.9	-178.1	173.6	0	0	114.3	N443 M444 V516	E441-N443 PolarHBondContact O-N 3.43Å; E441-M444 PolarHBondContact O-N 3.38Å; E441-M444 VanDerWaalsContact O-N 3.11Å; E441-V516 HydrophobicContact CB-CG1 4.08Å; E441-V516 HydrophobicContact CG-CG1 4.32Å
442	Y	86.5	Confident	92.6	Very high	182 Å²	182	72 Å²	72	71%	0.714	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-64.9	-20.8	179.2	74.4	-101.9	0	0	0	113.8	K440	K440-Y442 VanDerWaalsContact C-N 3.26Å; K440-Y442 HydrophobicContact CB-CD1 3.8Å; K440-Y442 HydrophobicContact CB-CE1 3.64Å; K440-Y442 HydrophobicContact CD-CE1 3.85Å; K440-Y442 HydrophobicContact CG-CE1 4.25Å; K440-Y442 PolarHBondContact O-N 2.69Å; K440-Y442 VanDerWaalsContact O-N 3.13Å
443	N	88.2	Confident	92.6	Very high	50 Å²	50	69.9 Å²	69.9	27%	0.267	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-96.4	-0.4	179.9	-161.9	28.6	0	0	0	112.1	K440 E441 H451	K440-N443 WeakPolarHBondContact O-CB 3.34Å; K440-N443 PolarHBondContact O-N 2.88Å; E441-N443 PolarHBondContact O-N 3.43Å; N443-H451 PolarHBondContact O-NE2 2.83Å
444	M	93.7	Very high	92.7	Very high	17 Å²	17	68.2 Å²	68.2	8%	0.084	33%	0.329	C	S	.	.	S	Bend	trans	-95.8	132.1	-176.8	-66.9	-59.1	-60.4	0	0	111.1	E441 K446 K513 V516 Y517 F526	E441-M444 PolarHBondContact O-N 3.38Å; E441-M444 VanDerWaalsContact O-N 3.11Å; M444-K446 PolarHBondContact O-N 2.99Å; M444-K513 HydrophobicContact CE-CB 3.79Å; M444-K513 HydrophobicContact CE-CG 4.48Å; M444-K513 WeakPolarHBondContact CE-O 3.47Å; M444-K513 HydrophobicContact SD-CB 3.65Å; M444-K513 HydrophobicContact SD-CD 3.88Å; M444-K513 HydrophobicContact SD-CG 3.7Å; M444-V516 HydrophobicContact CG-CB 4.21Å; M444-V516 HydrophobicContact CG-CG1 4.07Å; M444-V516 HydrophobicContact CG-CG2 4.41Å; M444-Y517 HydrophobicContact CE-CD2 4.37Å; M444-Y517 HydrophobicContact CE-CE2 3.43Å; M444-Y517 VanDerWaalsContact CE-CE2 3.43Å; M444-Y517 WeakPolarHBondContact CE-OH 3.36Å; M444-F526 HydrophobicContact CE-CD2 4.42Å; M444-F526 HydrophobicContact CE-CE1 4.06Å; M444-F526 HydrophobicContact CE-CE2 3.96Å; M444-F526 HydrophobicContact CE-CZ 3.76Å
445	P	94.3	Very high	92.7	Very high	26 Å²	26	69.8 Å²	69.8	17%	0.169	34%	0.34	C	S	.	.			trans	-68.8	123.7	177	25.8	-31.6	0	0	0	110.9	D447 G448 T449 Y517 F526	P445-D447 WeakPolarHBondContact CB-OD1 3.41Å; P445-D447 PolarHBondContact O-N 3.43Å; P445-D447 VanDerWaalsContact O-N 3.14Å; P445-G448 PolarHBondContact O-N 2.83Å; P445-G448 VanDerWaalsContact O-N 3.07Å; P445-T449 HydrophobicContact CB-CG2 3.81Å; P445-T449 HydrophobicContact CG-CG2 4.36Å; P445-Y517 WeakPolarHBondContact O-CE1 3.26Å; P445-Y517 PolarHBondContact O-OH 3.43Å; P445-F526 HydrophobicContact CG-CD2 4.1Å; P445-F526 HydrophobicContact CG-CE2 3.93Å
446	K	92.7	Very high	92.7	Very high	198 Å²	198	68 Å²	68	86%	0.861	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-24.5	-175.6	-63.2	-174.6	179.6	-178.3	0	114	M444	M444-K446 PolarHBondContact O-N 2.99Å
447	D	94.2	Very high	92.8	Very high	52 Å²	52	62.4 Å²	62.4	28%	0.278	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-2.8	-179.5	65.3	-9.2	0	0	0	113.2	P445 T449 G622 W623 A624	P445-D447 WeakPolarHBondContact CB-OD1 3.41Å; P445-D447 PolarHBondContact O-N 3.43Å; P445-D447 VanDerWaalsContact O-N 3.14Å; D447-T449 VanDerWaalsContact C-N 3.31Å; D447-T449 PolarHBondContact O-N 3.3Å; D447-T449 WeakPolarHBondContact OD1-CB 3.49Å; D447-T449 VanDerWaalsContact OD1-CG2 3.28Å; D447-T449 WeakPolarHBondContact OD1-CG2 3.39Å; D447-T449 PolarHBondContact OD1-N 3.45Å; D447-G622 WeakPolarHBondContact CA-O 3.35Å; D447-G622 VanDerWaalsContact CB-O 3.3Å; D447-G622 WeakPolarHBondContact CB-O 3.22Å; D447-W623 CarbonylContact O-C 3.57Å; D447-W623 WeakPolarHBondContact O-CA 3.14Å; D447-A624 HydrophobicContact CB-CB 3.97Å; D447-A624 PolarHBondContact O-N 3.49Å; D447-A624 WeakPolarHBondContact OD2-CB 3.34Å
448	G	94.9	Very high	92.9	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.295	C	S	.	.			trans	70.6	22.1	-176.5	0	0	0	0	0	114.1	P445 F526 N529	P445-G448 PolarHBondContact O-N 2.83Å; P445-G448 VanDerWaalsContact O-N 3.07Å; G448-F526 VanDerWaalsContact O-CA 3.27Å; G448-F526 WeakPolarHBondContact O-CA 3.39Å; G448-N529 PolarHBondContact O-ND2 3.45Å
449	T	96.1	Very high	93.1	Very high	38 Å²	38	62.2 Å²	62.2	23%	0.233	30%	0.302	C	S	.	.			trans	-67.3	-177.8	176.5	-162.1	0	0	0	0	113.2	P445 D447 H451 F526 P626	P445-T449 HydrophobicContact CB-CG2 3.81Å; P445-T449 HydrophobicContact CG-CG2 4.36Å; D447-T449 VanDerWaalsContact C-N 3.31Å; D447-T449 PolarHBondContact O-N 3.3Å; D447-T449 WeakPolarHBondContact OD1-CB 3.49Å; D447-T449 VanDerWaalsContact OD1-CG2 3.28Å; D447-T449 WeakPolarHBondContact OD1-CG2 3.39Å; D447-T449 PolarHBondContact OD1-N 3.45Å; T449-H451 PolarHBondContact O-N 3.03Å; T449-F526 WeakPolarHBondContact O-CD2 3.45Å; T449-P626 WeakPolarHBondContact OG1-CG 3.35Å
450	V	97.3	Very high	93.5	Very high	31 Å²	31	58.7 Å²	58.7	19%	0.188	28%	0.282	C	S	.	.			trans	-61.7	130.4	175.6	-179.3	0	0	0	0	109.7	T454 N529 Y533 P626	V450-T454 HydrophobicContact CG1-CG2 4.14Å; V450-N529 HydrophobicContact CG2-CB 4.22Å; V450-Y533 HydrophobicContact CG1-CD1 4.22Å; V450-Y533 HydrophobicContact CG1-CD2 4.19Å; V450-Y533 HydrophobicContact CG1-CG 3.93Å; V450-Y533 HydrophobicContact CG2-CD2 4.14Å; V450-Y533 HydrophobicContact CG2-CG 4.2Å; V450-P626 HydrophobicContact CG2-CG 4.44Å
451	H	97	Very high	93.9	Very high	6 Å²	6	52.9 Å²	52.9	3%	0.028	26%	0.257	C	S	.	.			trans	-77.6	144.7	179.2	-167	-77.9	0	0	0	110.9	N443 T449 L453 T454 S455 L510 K513 F526 N530	N443-H451 PolarHBondContact O-NE2 2.83Å; T449-H451 PolarHBondContact O-N 3.03Å; H451-L453 VanDerWaalsContact C-N 3.3Å; H451-L453 WeakPolarHBondContact ND1-CB 3.3Å; H451-L453 PolarHBondContact ND1-N 3.4Å; H451-L453 PolarHBondContact O-N 3.48Å; H451-T454 WeakPolarHBondContact O-CA 3.13Å; H451-T454 VanDerWaalsContact O-CB 3.27Å; H451-T454 WeakPolarHBondContact O-CB 3.15Å; H451-T454 PolarHBondContact O-N 2.94Å; H451-S455 PolarHBondContact O-N 3.28Å; H451-L510 HydrophobicContact CB-CD2 4.3Å; H451-K513 WeakPolarHBondContact NE2-CE 3.24Å; H451-F526 HydrophobicContact CB-CE2 3.92Å; H451-F526 HydrophobicContact CB-CZ 4.02Å; H451-N530 PolarHBondContact N-OD1 3.3Å
452	E	94.8	Very high	94.5	Very high	125 Å²	125	48.3 Å²	48.3	58%	0.584	24%	0.236	S	C	*	.	H	α-helix	trans	-57.5	-41.4	-179.6	-163	-165.2	146.1	0	0	112.6	T454 S455 N456	E452-T454 PolarHBondContact O-N 3.19Å; E452-T454 VanDerWaalsContact O-N 3.14Å; E452-S455 WeakPolarHBondContact CA-OG 3.46Å; E452-S455 PolarHBondContact O-N 3.27Å; E452-S455 VanDerWaalsContact O-N 3.1Å; E452-S455 PolarHBondContact O-OG 3.13Å; E452-N456 WeakPolarHBondContact O-CB 3.46Å; E452-N456 VanDerWaalsContact O-CG 3.28Å; E452-N456 PolarHBondContact O-N 2.65Å; E452-N456 PolarHBondContact OE1-ND2 3.44Å
453	L	95.9	Very high	94.8	Very high	17 Å²	17	43.1 Å²	43.1	9%	0.089	22%	0.218	C	C	.	.	H	α-helix	trans	-47.2	-41	170.5	-173.2	67.1	0	0	0	113.2	I434 D437 H451 A457 L506 N509	I434-L453 HydrophobicContact CG1-CD1 4.15Å; D437-L453 HydrophobicContact CB-CD1 3.92Å; D437-L453 HydrophobicContact CB-CD2 3.68Å; D437-L453 HydrophobicContact CB-CG 4.42Å; H451-L453 VanDerWaalsContact C-N 3.3Å; H451-L453 WeakPolarHBondContact ND1-CB 3.3Å; H451-L453 PolarHBondContact ND1-N 3.4Å; H451-L453 PolarHBondContact O-N 3.48Å; L453-A457 WeakPolarHBondContact O-CB 3.43Å; L453-A457 PolarHBondContact O-N 2.83Å; L453-L506 HydrophobicContact CD2-CD1 3.88Å; L453-L506 HydrophobicContact CG-CD1 3.82Å; L453-N509 WeakPolarHBondContact CD2-OD1 3.39Å
454	T	97.4	Very high	95	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-70.3	-45.6	-179.8	-58.7	0	0	0	0	111.2	V450 H451 E452 I458 L506 N530 Y533 I534	V450-T454 HydrophobicContact CG1-CG2 4.14Å; H451-T454 WeakPolarHBondContact O-CA 3.13Å; H451-T454 VanDerWaalsContact O-CB 3.27Å; H451-T454 WeakPolarHBondContact O-CB 3.15Å; H451-T454 PolarHBondContact O-N 2.94Å; E452-T454 PolarHBondContact O-N 3.19Å; E452-T454 VanDerWaalsContact O-N 3.14Å; T454-I458 WeakPolarHBondContact O-CB 3.32Å; T454-I458 VanDerWaalsContact O-CG1 3.26Å; T454-I458 WeakPolarHBondContact O-CG1 3.29Å; T454-I458 PolarHBondContact O-N 3.37Å; T454-I458 VanDerWaalsContact O-N 3.11Å; T454-L506 HydrophobicContact CG2-CD2 4.3Å; T454-N530 WeakPolarHBondContact CB-OD1 3.34Å; T454-N530 HydrophobicContact CG2-CB 4.38Å; T454-N530 PolarHBondContact OG1-OD1 2.97Å; T454-Y533 HydrophobicContact CG2-CD1 3.78Å; T454-Y533 HydrophobicContact CG2-CE1 4.45Å; T454-I534 HydrophobicContact CG2-CD1 4.05Å; T454-I534 HydrophobicContact CG2-CG1 3.66Å
455	S	95.9	Very high	94.8	Very high	34 Å²	34	41.3 Å²	41.3	24%	0.238	21%	0.208	C	C	.	.	H	α-helix	trans	-64.1	-43.4	177	49.1	0	0	0	0	111.7	H451 E452 I458 L459	H451-S455 PolarHBondContact O-N 3.28Å; E452-S455 WeakPolarHBondContact CA-OG 3.46Å; E452-S455 PolarHBondContact O-N 3.27Å; E452-S455 VanDerWaalsContact O-N 3.1Å; E452-S455 PolarHBondContact O-OG 3.13Å; S455-I458 PolarHBondContact O-N 3.29Å; S455-L459 WeakPolarHBondContact O-CB 3.4Å; S455-L459 PolarHBondContact O-N 2.92Å
456	N	94.9	Very high	94.7	Very high	75 Å²	75	45.8 Å²	45.8	40%	0.401	23%	0.231	S	C	.	.	H	α-helix	trans	-67.3	-41.9	-179.1	-66.1	-6.2	0	0	0	111.4	E452 I458 L459 F460	E452-N456 WeakPolarHBondContact O-CB 3.46Å; E452-N456 VanDerWaalsContact O-CG 3.28Å; E452-N456 PolarHBondContact O-N 2.65Å; E452-N456 PolarHBondContact OE1-ND2 3.44Å; N456-I458 PolarHBondContact O-N 3.42Å; N456-L459 PolarHBondContact O-N 3.12Å; N456-F460 WeakPolarHBondContact O-CB 3.44Å; N456-F460 PolarHBondContact O-N 3Å
457	A	96.6	Very high	94.6	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.008	20%	0.198	C	C	.	.	H	α-helix	trans	-61.7	-44.8	176.4	0	0	0	0	0	112.2	I434 L453 L461 L506	I434-A457 HydrophobicContact CD1-CB 3.69Å; I434-A457 HydrophobicContact CG1-CB 4.48Å; L453-A457 WeakPolarHBondContact O-CB 3.43Å; L453-A457 PolarHBondContact O-N 2.83Å; A457-L461 VanDerWaalsContact O-CG 3.3Å; A457-L461 WeakPolarHBondContact O-CG 3.5Å; A457-L461 PolarHBondContact O-N 3.39Å; A457-L461 VanDerWaalsContact O-N 3.09Å; A457-L506 HydrophobicContact CB-CD1 4.44Å; A457-L506 HydrophobicContact CB-CD2 3.94Å
458	I	96.3	Very high	94.5	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-67	-43	178.1	-69.9	-61.6	0	0	0	111.5	T454 S455 N456 F460 L461 Q462 L503 Y533 I534	T454-I458 WeakPolarHBondContact O-CB 3.32Å; T454-I458 VanDerWaalsContact O-CG1 3.26Å; T454-I458 WeakPolarHBondContact O-CG1 3.29Å; T454-I458 PolarHBondContact O-N 3.37Å; T454-I458 VanDerWaalsContact O-N 3.11Å; S455-I458 PolarHBondContact O-N 3.29Å; N456-I458 PolarHBondContact O-N 3.42Å; I458-F460 VanDerWaalsContact C-N 3.34Å; I458-F460 PolarHBondContact O-N 3.01Å; I458-L461 PolarHBondContact O-N 3.48Å; I458-Q462 HydrophobicContact CG2-CG 4.42Å; I458-Q462 WeakPolarHBondContact O-CG 3.47Å; I458-Q462 PolarHBondContact O-N 3.03Å; I458-L503 HydrophobicContact CD1-CD2 4.12Å; I458-Y533 HydrophobicContact CB-CE1 4.16Å; I458-Y533 HydrophobicContact CG1-CD1 4.37Å; I458-Y533 HydrophobicContact CG1-CE1 4.15Å; I458-Y533 HydrophobicContact CG2-CE1 4.22Å; I458-I534 HydrophobicContact CD1-CB 4.49Å; I458-I534 HydrophobicContact CD1-CG1 4.25Å; I458-I534 HydrophobicContact CD1-CG2 4.3Å; I458-I534 HydrophobicContact CG1-CG1 4.38Å
459	L	94.3	Very high	94.3	Very high	88 Å²	88	45.4 Å²	45.4	46%	0.461	23%	0.23	S	C	.	.	H	α-helix	trans	-58.9	-46.7	177.8	178.7	62.4	0	0	0	111.1	S455 N456 L461 Q462 Q463	S455-L459 WeakPolarHBondContact O-CB 3.4Å; S455-L459 PolarHBondContact O-N 2.92Å; N456-L459 PolarHBondContact O-N 3.12Å; L459-L461 PolarHBondContact O-N 2.88Å; L459-Q462 WeakPolarHBondContact O-CB 3.45Å; L459-Q462 PolarHBondContact O-N 2.93Å; L459-Q463 WeakPolarHBondContact O-CG 3.39Å; L459-Q463 PolarHBondContact O-N 2.74Å
460	F	94.9	Very high	94.2	Very high	10 Å²	10	44.2 Å²	44.2	4%	0.044	22%	0.223	C	C	.	.	H	α-helix	trans	-60.1	-45.8	176.6	179.7	-92.6	0	0	0	112.2	V380 L427 F430 N456 I458 Q462 Q463 L464	V380-F460 HydrophobicContact CG1-CE2 3.93Å; V380-F460 HydrophobicContact CG1-CZ 3.95Å; L427-F460 HydrophobicContact CD2-CE1 3.95Å; L427-F460 HydrophobicContact CD2-CZ 3.8Å; F430-F460 AromaticContact CD1-CD1 3.67Å; F430-F460 HydrophobicContact CD1-CD1 3.67Å; F430-F460 AromaticContact CD1-CE1 3.59Å; F430-F460 HydrophobicContact CD1-CE1 3.59Å; F430-F460 HydrophobicContact CD1-CG 4.39Å; F430-F460 HydrophobicContact CD1-CZ 4.26Å; F430-F460 HydrophobicContact CD2-CG 4.48Å; F430-F460 HydrophobicContact CE1-CB 4.2Å; F430-F460 AromaticContact CE1-CD1 3.17Å; F430-F460 HydrophobicContact CE1-CD1 3.17Å; F430-F460 AromaticContact CE1-CE1 3.62Å; F430-F460 HydrophobicContact CE1-CE1 3.62Å; F430-F460 AromaticContact CE1-CG 3.78Å; F430-F460 HydrophobicContact CE1-CG 3.78Å; F430-F460 HydrophobicContact CE2-CB 4.08Å; F430-F460 HydrophobicContact CE2-CD1 4.11Å; F430-F460 HydrophobicContact CE2-CD2 4.26Å; F430-F460 AromaticContact CE2-CG 3.88Å; F430-F460 HydrophobicContact CE2-CG 3.88Å; F430-F460 HydrophobicContact CG-CD1 4.3Å; F430-F460 HydrophobicContact CG-CE1 4.1Å; F430-F460 HydrophobicContact CG-CZ 4.33Å; F430-F460 HydrophobicContact CZ-CB 3.54Å; F430-F460 AromaticContact CZ-CD1 3.4Å; F430-F460 HydrophobicContact CZ-CD1 3.4Å; F430-F460 HydrophobicContact CZ-CD2 4.27Å; F430-F460 HydrophobicContact CZ-CE1 4.15Å; F430-F460 AromaticContact CZ-CG 3.46Å; F430-F460 HydrophobicContact CZ-CG 3.46Å; F430-F460 VanDerWaalsContact CZ-CG 3.46Å; N456-F460 WeakPolarHBondContact O-CB 3.44Å; N456-F460 PolarHBondContact O-N 3Å; I458-F460 VanDerWaalsContact C-N 3.34Å; I458-F460 PolarHBondContact O-N 3.01Å; F460-Q462 VanDerWaalsContact C-N 3.28Å; F460-Q462 PolarHBondContact O-N 2.87Å; F460-Q463 PolarHBondContact O-N 2.81Å; F460-L464 PolarHBondContact O-N 3.13Å
461	L	95.4	Very high	94.1	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-62.7	-35.9	177.2	-70.4	177.7	0	0	0	112	A457 I458 L459 L464 L465 I499 V502 L503 L543	A457-L461 VanDerWaalsContact O-CG 3.3Å; A457-L461 WeakPolarHBondContact O-CG 3.5Å; A457-L461 PolarHBondContact O-N 3.39Å; A457-L461 VanDerWaalsContact O-N 3.09Å; I458-L461 PolarHBondContact O-N 3.48Å; L459-L461 PolarHBondContact O-N 2.88Å; L461-L464 WeakPolarHBondContact O-CB 3.48Å; L461-L464 PolarHBondContact O-N 2.87Å; L461-L465 PolarHBondContact O-N 3.45Å; L461-I499 HydrophobicContact CD1-CG2 4.19Å; L461-I499 HydrophobicContact CD2-CG1 4.15Å; L461-I499 HydrophobicContact CD2-CG2 4.28Å; L461-V502 HydrophobicContact CD1-CG1 3.95Å; L461-V502 HydrophobicContact CD2-CB 4.32Å; L461-V502 HydrophobicContact CD2-CG1 4.15Å; L461-V502 HydrophobicContact CD2-CG2 4.48Å; L461-V502 HydrophobicContact CG-CG1 4.23Å; L461-L503 HydrophobicContact CD1-CD2 3.89Å; L461-L503 HydrophobicContact CD1-CG 4.16Å; L461-L543 HydrophobicContact CB-CD1 3.89Å; L461-L543 HydrophobicContact CB-CD2 4.13Å
462	Q	93.7	Very high	93.9	Very high	63 Å²	63	42.5 Å²	42.5	29%	0.294	21%	0.212	S	C	.	.	H	α-helix	trans	-65.9	-43.9	174.6	-74	175.1	-19.6	0	0	111.7	I458 L459 F460 L464 L465 L543	I458-Q462 HydrophobicContact CG2-CG 4.42Å; I458-Q462 WeakPolarHBondContact O-CG 3.47Å; I458-Q462 PolarHBondContact O-N 3.03Å; L459-Q462 WeakPolarHBondContact O-CB 3.45Å; L459-Q462 PolarHBondContact O-N 2.93Å; F460-Q462 VanDerWaalsContact C-N 3.28Å; F460-Q462 PolarHBondContact O-N 2.87Å; Q462-L464 PolarHBondContact O-N 3.31Å; Q462-L465 VanDerWaalsContact O-CB 3.25Å; Q462-L465 WeakPolarHBondContact O-CB 3.26Å; Q462-L465 PolarHBondContact O-N 2.97Å; Q462-L465 VanDerWaalsContact O-N 3.1Å; Q462-L543 HydrophobicContact CG-CD1 3.86Å
463	Q	91.9	Very high	93.7	Very high	73 Å²	73	37.5 Å²	37.5	34%	0.341	19%	0.192	S	C	.	.	H	α-helix	trans	-63.9	-31.2	175.1	-68.4	173.1	-46.6	0	0	112.4	L381 L459 F460 L465	L381-Q463 HydrophobicContact CD1-CB 3.84Å; L381-Q463 HydrophobicContact CD1-CG 4.27Å; L381-Q463 HydrophobicContact CD2-CB 3.98Å; L459-Q463 WeakPolarHBondContact O-CG 3.39Å; L459-Q463 PolarHBondContact O-N 2.74Å; F460-Q463 PolarHBondContact O-N 2.81Å; Q463-L465 PolarHBondContact O-N 3.44Å
464	L	92.2	Very high	93.7	Very high	3 Å²	3	36.7 Å²	36.7	2%	0.016	19%	0.188	C	C	.	.	H	α-helix	trans	-66.5	-22.9	175.4	-169.5	63.1	0	0	0	112.9	F384 L427 F460 L461 Q462 D466 F467 H468 A471 L495 Y498	F384-L464 HydrophobicContact CE2-CD1 3.56Å; F384-L464 HydrophobicContact CZ-CD1 3.54Å; L427-L464 HydrophobicContact CD2-CD1 4.19Å; L427-L464 HydrophobicContact CD2-CD2 4.33Å; F460-L464 PolarHBondContact O-N 3.13Å; L461-L464 WeakPolarHBondContact O-CB 3.48Å; L461-L464 PolarHBondContact O-N 2.87Å; Q462-L464 PolarHBondContact O-N 3.31Å; L464-D466 VanDerWaalsContact C-N 3.33Å; L464-D466 PolarHBondContact O-N 3.31Å; L464-F467 CarbonylContact O-C 3.6Å; L464-F467 PolarHBondContact O-N 3.03Å; L464-H468 PolarHBondContact O-N 3.33Å; L464-A471 HydrophobicContact CD1-CB 3.63Å; L464-A471 HydrophobicContact CG-CB 4.29Å; L464-L495 HydrophobicContact CD2-CD1 3.89Å; L464-L495 HydrophobicContact CG-CD1 4.41Å; L464-Y498 HydrophobicContact CD2-CD1 4.14Å; L464-Y498 HydrophobicContact CD2-CE1 3.81Å
465	L	91.1	Very high	93.5	Very high	26 Å²	26	38.1 Å²	38.1	14%	0.136	20%	0.196	C	C	.	.	H	α-helix	trans	-61	-41.3	178.8	-75.5	178.6	0	0	0	112.2	L461 Q462 Q463 F467 H468 E542 L543 L546	L461-L465 PolarHBondContact O-N 3.45Å; Q462-L465 VanDerWaalsContact O-CB 3.25Å; Q462-L465 WeakPolarHBondContact O-CB 3.26Å; Q462-L465 PolarHBondContact O-N 2.97Å; Q462-L465 VanDerWaalsContact O-N 3.1Å; Q463-L465 PolarHBondContact O-N 3.44Å; L465-F467 PolarHBondContact O-N 3.48Å; L465-H468 WeakPolarHBondContact O-CB 3.43Å; L465-H468 PolarHBondContact O-CD2 3.28Å; L465-H468 PolarHBondContact O-N 3.11Å; L465-H468 VanDerWaalsContact O-N 3.07Å; L465-E542 HydrophobicContact CD1-CB 4.36Å; L465-L543 HydrophobicContact CD1-CD2 4.24Å; L465-L543 HydrophobicContact CD1-CG 3.81Å; L465-L543 HydrophobicContact CD2-CD2 3.62Å; L465-L543 HydrophobicContact CD2-CG 4.03Å; L465-L543 HydrophobicContact CG-CD2 3.77Å; L465-L543 HydrophobicContact CG-CG 3.93Å; L465-L546 HydrophobicContact CD2-CD1 3.48Å; L465-L546 VanDerWaalsContact CD2-CD1 3.48Å; L465-L546 HydrophobicContact CD2-CG 4.39Å
466	D	90.3	Very high	93.2	Very high	120 Å²	120	36.8 Å²	36.8	64%	0.642	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	-19.7	-178.6	-65	-23.9	0	0	0	112.3	L464	L464-D466 VanDerWaalsContact C-N 3.33Å; L464-D466 PolarHBondContact O-N 3.31Å
467	F	92.6	Very high	92.9	Very high	40 Å²	40	35.6 Å²	35.6	18%	0.175	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.5	23.9	-177.7	-53.4	-73	0	0	0	113.3	F384 P385 L464 L465 E469 T470 A471	F384-F467 HydrophobicContact CB-CB 3.68Å; F384-F467 HydrophobicContact CB-CD1 3.5Å; F384-F467 HydrophobicContact CB-CD2 3.89Å; F384-F467 HydrophobicContact CB-CE1 4.09Å; F384-F467 HydrophobicContact CB-CE2 4.43Å; F384-F467 HydrophobicContact CB-CG 3.38Å; F384-F467 HydrophobicContact CD1-CB 4.23Å; F384-F467 HydrophobicContact CD2-CB 3.94Å; F384-F467 AromaticContact CD2-CD2 3.89Å; F384-F467 HydrophobicContact CD2-CD2 3.89Å; F384-F467 AromaticContact CD2-CG 4Å; F384-F467 HydrophobicContact CD2-CG 4Å; F384-F467 HydrophobicContact CG-CB 3.72Å; F384-F467 HydrophobicContact CG-CD1 4.45Å; F384-F467 HydrophobicContact CG-CD2 4.21Å; F384-F467 AromaticContact CG-CG 3.87Å; F384-F467 HydrophobicContact CG-CG 3.87Å; P385-F467 HydrophobicContact CB-CE1 4.45Å; P385-F467 HydrophobicContact CG-CE1 3.7Å; P385-F467 HydrophobicContact CG-CZ 3.75Å; L464-F467 CarbonylContact O-C 3.6Å; L464-F467 PolarHBondContact O-N 3.03Å; L465-F467 PolarHBondContact O-N 3.48Å; F467-E469 VanDerWaalsContact C-N 3.28Å; F467-E469 PolarHBondContact O-N 3.03Å; F467-E469 VanDerWaalsContact O-N 3.14Å; F467-T470 PolarHBondContact O-N 3.49Å; F467-A471 WeakPolarHBondContact O-CB 3.43Å; F467-A471 PolarHBondContact O-N 2.89Å
468	H	91.4	Very high	92.5	Very high	80 Å²	80	39.2 Å²	39.2	37%	0.37	20%	0.201	S	C	.	.	H	α-helix	trans	-55	-37.9	-171.9	68.2	70.4	0	0	0	114	L464 L465 G472 L495 L546	L464-H468 PolarHBondContact O-N 3.33Å; L465-H468 WeakPolarHBondContact O-CB 3.43Å; L465-H468 PolarHBondContact O-CD2 3.28Å; L465-H468 PolarHBondContact O-N 3.11Å; L465-H468 VanDerWaalsContact O-N 3.07Å; H468-G472 PolarHBondContact O-N 3.09Å; H468-L495 HydrophobicContact CB-CD2 3.54Å; H468-L495 VanDerWaalsContact O-CD2 3.31Å; H468-L495 WeakPolarHBondContact O-CD2 3.36Å; H468-L546 HydrophobicContact CB-CD1 4.26Å
469	E	91.3	Very high	91.8	Very high	123 Å²	123	43.7 Å²	43.7	58%	0.575	22%	0.222	S	C	*	.	H	α-helix	trans	-68.4	-42.8	177.6	-56.5	-169	141.1	0	0	111.5	F467 A473	F467-E469 VanDerWaalsContact C-N 3.28Å; F467-E469 PolarHBondContact O-N 3.03Å; F467-E469 VanDerWaalsContact O-N 3.14Å; E469-A473 WeakPolarHBondContact O-CB 3.28Å; E469-A473 PolarHBondContact O-N 3.14Å
470	T	93.5	Very high	90.1	Very high	13 Å²	13	46 Å²	46	8%	0.08	24%	0.24	C	C	.	.	H	α-helix	trans	-69.7	-44.4	-177.9	-54.2	0	0	0	0	110.4	F384 L387 R388 F467 A473 M474	F384-T470 HydrophobicContact CD1-CG2 3.94Å; L387-T470 HydrophobicContact CB-CG2 4.19Å; L387-T470 HydrophobicContact CD2-CG2 3.93Å; L387-T470 HydrophobicContact CG-CG2 4.06Å; R388-T470 HydrophobicContact CB-CG2 4.35Å; F467-T470 PolarHBondContact O-N 3.49Å; T470-A473 PolarHBondContact O-N 3.2Å; T470-M474 VanDerWaalsContact O-CB 3.25Å; T470-M474 WeakPolarHBondContact O-CB 3.5Å; T470-M474 PolarHBondContact O-N 2.85Å
471	A	93.9	Very high	88.2	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63.1	-44.2	175.2	0	0	0	0	0	112.1	F384 L464 F467 M474 L475 L495	F384-A471 HydrophobicContact CE1-CB 3.8Å; F384-A471 HydrophobicContact CZ-CB 3.99Å; L464-A471 HydrophobicContact CD1-CB 3.63Å; L464-A471 HydrophobicContact CG-CB 4.29Å; F467-A471 WeakPolarHBondContact O-CB 3.43Å; F467-A471 PolarHBondContact O-N 2.89Å; A471-M474 PolarHBondContact O-N 2.99Å; A471-L475 WeakPolarHBondContact O-CG 3.28Å; A471-L475 PolarHBondContact O-N 3.2Å; A471-L495 HydrophobicContact CB-CD1 4.1Å
472	G	93.1	Very high	86.1	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-61.9	-44.5	175.9	0	0	0	0	0	112.7	H468 L475 A476	H468-G472 PolarHBondContact O-N 3.09Å; G472-L475 PolarHBondContact O-N 3.03Å; G472-A476 WeakPolarHBondContact O-CB 3.38Å; G472-A476 PolarHBondContact O-N 2.96Å
473	A	91.9	Very high	84	Confident	20 Å²	20	53.4 Å²	53.4	17%	0.165	31%	0.305	C	S	.	.	H	α-helix	trans	-66.7	-35.8	176.8	0	0	0	0	0	112.8	E469 T470 A476 S477	E469-A473 WeakPolarHBondContact O-CB 3.28Å; E469-A473 PolarHBondContact O-N 3.14Å; T470-A473 PolarHBondContact O-N 3.2Å; A473-A476 PolarHBondContact O-N 3.27Å; A473-S477 PolarHBondContact O-N 3.12Å
474	M	94.3	Very high	81.9	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-64.4	-44.6	174.9	173.3	-169.8	-68.3	0	0	111.8	I383 F384 L387 E420 G423 A424 L427 T470 A471 A476 S477	I383-M474 HydrophobicContact CG2-CE 4.35Å; F384-M474 HydrophobicContact CD1-CE 3.77Å; F384-M474 HydrophobicContact CE1-CE 3.44Å; F384-M474 VanDerWaalsContact CE1-CE 3.44Å; F384-M474 HydrophobicContact CE1-SD 3.85Å; F384-M474 HydrophobicContact CZ-CE 4.42Å; L387-M474 HydrophobicContact CD2-CB 4.41Å; L387-M474 HydrophobicContact CD2-CE 3.38Å; E420-M474 HydrophobicContact CB-CG 4.24Å; E420-M474 HydrophobicContact CG-CG 4.44Å; E420-M474 WeakPolarHBondContact O-CG 3.12Å; G423-M474 WeakPolarHBondContact CA-SD 3.35Å; A424-M474 HydrophobicContact CB-CG 4.25Å; A424-M474 PolarHBondContact N-SD 3.04Å; L427-M474 HydrophobicContact CD1-SD 4.41Å; T470-M474 VanDerWaalsContact O-CB 3.25Å; T470-M474 WeakPolarHBondContact O-CB 3.5Å; T470-M474 PolarHBondContact O-N 2.85Å; A471-M474 PolarHBondContact O-N 2.99Å; M474-A476 VanDerWaalsContact C-N 3.33Å; M474-S477 PolarHBondContact O-N 3Å; M474-S477 PolarHBondContact O-OG 2.62Å; M474-S477 VanDerWaalsContact O-OG 3.07Å
475	L	92.9	Very high	79.9	Confident	30 Å²	30	59.6 Å²	59.6	16%	0.157	36%	0.357	C	S	.	.	H	α-helix	trans	-63.8	-41.2	174.8	-70.1	170.9	0	0	0	111.1	L427 A471 G472 S477 Q478 L495 Y498	L427-L475 HydrophobicContact CD1-CD1 4.4Å; L427-L475 HydrophobicContact CD1-CD2 3.93Å; L427-L475 HydrophobicContact CD1-CG 4.12Å; A471-L475 WeakPolarHBondContact O-CG 3.28Å; A471-L475 PolarHBondContact O-N 3.2Å; G472-L475 PolarHBondContact O-N 3.03Å; L475-S477 VanDerWaalsContact C-N 3.29Å; L475-S477 PolarHBondContact O-N 3.4Å; L475-Q478 PolarHBondContact O-N 3.21Å; L475-L495 HydrophobicContact CD1-CD1 4.33Å; L475-Y498 HydrophobicContact CD1-CG 4.08Å
476	A	90.9	Very high	78.4	Confident	6 Å²	6	61.4 Å²	61.4	5%	0.05	37%	0.372	C	S	.	.	H	α-helix	trans	-62.8	-32.8	178	0	0	0	0	0	113.4	G472 A473 M474 Q478 E479 F490 N491 L494	G472-A476 WeakPolarHBondContact O-CB 3.38Å; G472-A476 PolarHBondContact O-N 2.96Å; A473-A476 PolarHBondContact O-N 3.27Å; M474-A476 VanDerWaalsContact C-N 3.33Å; A476-Q478 PolarHBondContact O-N 3Å; A476-E479 PolarHBondContact O-N 3.43Å; A476-F490 HydrophobicContact CB-CD1 4.16Å; A476-F490 HydrophobicContact CB-CE1 3.95Å; A476-N491 WeakPolarHBondContact CB-OD1 3.24Å; A476-L494 VanDerWaalsContact CA-CD1 3.5Å; A476-L494 HydrophobicContact CB-CD1 3.75Å
477	S	88.4	Confident	77.7	Confident	50 Å²	50	59.5 Å²	59.5	35%	0.35	37%	0.365	S	S	.	.	H	α-helix	trans	-70.4	-17.7	-179.5	80.5	0	0	0	0	113.8	E420 A473 M474 L475	E420-S477 WeakPolarHBondContact OE2-CB 3.43Å; E420-S477 PolarHBondContact OE2-OG 3.22Å; A473-S477 PolarHBondContact O-N 3.12Å; M474-S477 PolarHBondContact O-N 3Å; M474-S477 PolarHBondContact O-OG 2.62Å; M474-S477 VanDerWaalsContact O-OG 3.07Å; L475-S477 VanDerWaalsContact C-N 3.29Å; L475-S477 PolarHBondContact O-N 3.4Å
478	Q	87.1	Confident	77.2	Confident	77 Å²	77	61.7 Å²	61.7	36%	0.36	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-13.7	174.5	-53.3	-51.7	-69.8	0	0	113.1	T421 A424 L475 A476 T480	T421-Q478 PolarHBondContact OG1-OE1 3.39Å; A424-Q478 HydrophobicContact CB-CG 3.47Å; A424-Q478 VanDerWaalsContact CB-CG 3.47Å; L475-Q478 PolarHBondContact O-N 3.21Å; A476-Q478 PolarHBondContact O-N 3Å; Q478-T480 PolarHBondContact O-N 3.32Å
479	E	82.6	Confident	77	Confident	94 Å²	94	62.9 Å²	62.9	44%	0.439	39%	0.394	S	S	.	.			trans	-82.3	100.1	178.1	-70.7	-69.7	160.4	0	0	110.2	A476 S481 S482 L494	A476-E479 PolarHBondContact O-N 3.43Å; E479-S481 PolarHBondContact O-N 2.95Å; E479-S482 PolarHBondContact O-N 2.81Å; E479-L494 HydrophobicContact CG-CD1 4.2Å; E479-L494 HydrophobicContact CG-CD2 4.49Å
480	T	59.7	Low	76.9	Confident	137 Å²	137	59.8 Å²	59.8	84%	0.84	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-12.7	-176.2	51	0	0	0	0	115	Q478	Q478-T480 PolarHBondContact O-N 3.32Å
481	S	54.8	Low	76.7	Confident	104 Å²	104	60.3 Å²	60.3	73%	0.727	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	1.4	-172.4	-58.8	0	0	0	0	114.9	E479	E479-S481 PolarHBondContact O-N 2.95Å
482	S	51.5	Low	76.6	Confident	33 Å²	33	64.9 Å²	64.9	23%	0.231	40%	0.401	C	S	.	.			trans	-142.8	14.9	-171.9	-56.2	0	0	0	0	115.6	E479 S484 S485	E479-S482 PolarHBondContact O-N 2.81Å; S482-S484 PolarHBondContact O-N 3.27Å; S482-S485 PolarHBondContact O-N 2.89Å
483	A	48.8	Very low	76.6	Confident	92 Å²	92	72.3 Å²	72.3	76%	0.76	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-14.7	-175.5	0	0	0	0	0	115.2
484	S	47.5	Very low	76.6	Confident	122 Å²	122	73 Å²	73	85%	0.853	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-2.9	-179.6	54.8	0	0	0	0	114.8	S482	S482-S484 PolarHBondContact O-N 3.27Å
485	S	50.5	Low	76.7	Confident	84 Å²	84	73 Å²	73	59%	0.587	43%	0.43	S	S	*	.			trans	-155.1	35.4	-176.6	65.4	0	0	0	0	115.2	S482 T487	S482-S485 PolarHBondContact O-N 2.89Å; S485-T487 PolarHBondContact O-N 3.21Å
486	S	59.6	Low	76.8	Confident	64 Å²	64	71.6 Å²	71.6	45%	0.448	42%	0.423	S	S	.	.			trans	-62.9	95.3	175.2	64.1	0	0	0	0	110.7
487	T	75.8	Confident	77	Confident	81 Å²	81	74.6 Å²	74.6	50%	0.497	44%	0.443	S	S	.	.			trans	-76	154.8	172.7	61.2	0	0	0	0	109.8	S485 D489 F490 N491	S485-T487 PolarHBondContact O-N 3.21Å; T487-D489 PolarHBondContact O-N 3.15Å; T487-D489 VanDerWaalsContact O-N 3.13Å; T487-F490 WeakPolarHBondContact O-CB 3.4Å; T487-F490 PolarHBondContact O-N 2.72Å; T487-F490 PolarHBondContact OG1-N 2.95Å; T487-N491 PolarHBondContact O-N 3.4Å; T487-N491 VanDerWaalsContact O-N 3.13Å
488	S	82.4	Confident	77.4	Confident	86 Å²	86	72.8 Å²	72.8	60%	0.601	43%	0.429	S	S	*	.	H	α-helix	trans	-50.8	-38	173.5	179.8	0	0	0	0	112	F490 N491 K492	S488-F490 PolarHBondContact O-N 3.18Å; S488-N491 PolarHBondContact O-N 2.98Å; S488-K492 WeakPolarHBondContact O-CB 3.04Å; S488-K492 PolarHBondContact O-N 3.06Å
489	D	86.3	Confident	77.8	Confident	105 Å²	105	69.2 Å²	69.2	56%	0.561	41%	0.412	S	S	*	.	H	α-helix	trans	-65.8	-37.4	177.2	-72.7	-26.9	0	0	0	113.5	T487 R493	T487-D489 PolarHBondContact O-N 3.15Å; T487-D489 VanDerWaalsContact O-N 3.13Å; D489-R493 WeakPolarHBondContact O-CB 3.46Å; D489-R493 VanDerWaalsContact O-CG 3.28Å; D489-R493 WeakPolarHBondContact O-CG 3.16Å; D489-R493 PolarHBondContact O-N 2.97Å
490	F	88.9	Confident	78.5	Confident	57 Å²	57	66.3 Å²	66.3	25%	0.25	40%	0.402	C	S	.	.	H	α-helix	trans	-64.6	-47.8	175.4	177.5	-104.2	0	0	0	110.8	A476 T487 S488 K492 R493 L494	A476-F490 HydrophobicContact CB-CD1 4.16Å; A476-F490 HydrophobicContact CB-CE1 3.95Å; T487-F490 WeakPolarHBondContact O-CB 3.4Å; T487-F490 PolarHBondContact O-N 2.72Å; T487-F490 PolarHBondContact OG1-N 2.95Å; S488-F490 PolarHBondContact O-N 3.18Å; F490-K492 VanDerWaalsContact C-N 3.33Å; F490-K492 PolarHBondContact O-N 3.18Å; F490-R493 PolarHBondContact O-N 2.98Å; F490-R493 VanDerWaalsContact O-N 3.16Å; F490-L494 HydrophobicContact CD1-CD1 3.96Å; F490-L494 HydrophobicContact CE1-CD1 3.33Å; F490-L494 HydrophobicContact CE1-CG 4.19Å; F490-L494 HydrophobicContact CE2-CD1 4.37Å; F490-L494 HydrophobicContact CE2-CG 4.45Å; F490-L494 HydrophobicContact CZ-CD1 3.57Å; F490-L494 HydrophobicContact CZ-CG 4.09Å; F490-L494 PolarHBondContact O-N 3.13Å
491	N	90.8	Very high	80.2	Confident	24 Å²	24	63.5 Å²	63.5	13%	0.128	38%	0.378	C	S	.	.	H	α-helix	trans	-60.2	-43.6	178.1	-64.3	-3.1	0	0	0	111.4	A476 T487 S488 R493 L494 L495	A476-N491 WeakPolarHBondContact CB-OD1 3.24Å; T487-N491 PolarHBondContact O-N 3.4Å; T487-N491 VanDerWaalsContact O-N 3.13Å; S488-N491 PolarHBondContact O-N 2.98Å; N491-R493 VanDerWaalsContact C-N 3.34Å; N491-R493 PolarHBondContact O-N 3.4Å; N491-L494 PolarHBondContact O-N 3.5Å; N491-L495 PolarHBondContact O-N 2.98Å
492	K	91.1	Very high	82.3	Confident	96 Å²	96	58.5 Å²	58.5	42%	0.417	34%	0.343	S	S	.	.	H	α-helix	trans	-62.1	-39.5	176.3	-172.3	174	-176.1	171.1	0	112.3	S488 F490 S496 L546 V549	S488-K492 WeakPolarHBondContact O-CB 3.04Å; S488-K492 PolarHBondContact O-N 3.06Å; F490-K492 VanDerWaalsContact C-N 3.33Å; F490-K492 PolarHBondContact O-N 3.18Å; K492-S496 WeakPolarHBondContact O-CB 3.43Å; K492-S496 PolarHBondContact O-N 3.4Å; K492-L546 HydrophobicContact CG-CD2 4.09Å; K492-V549 HydrophobicContact CD-CG2 4.4Å; K492-V549 HydrophobicContact CG-CG2 4.32Å
493	R	92.3	Very high	84.5	Confident	156 Å²	156	57.2 Å²	57.2	59%	0.589	33%	0.334	S	S	*	.	H	α-helix	trans	-68	-40.1	175.9	-75.5	173.8	-174.5	-178.8	6.2	112.5	D489 F490 N491 S496 S497 V549	D489-R493 WeakPolarHBondContact O-CB 3.46Å; D489-R493 VanDerWaalsContact O-CG 3.28Å; D489-R493 WeakPolarHBondContact O-CG 3.16Å; D489-R493 PolarHBondContact O-N 2.97Å; F490-R493 PolarHBondContact O-N 2.98Å; F490-R493 VanDerWaalsContact O-N 3.16Å; N491-R493 VanDerWaalsContact C-N 3.34Å; N491-R493 PolarHBondContact O-N 3.4Å; R493-S496 WeakPolarHBondContact O-CB 3.36Å; R493-S496 PolarHBondContact O-N 2.74Å; R493-S497 WeakPolarHBondContact O-CB 3.47Å; R493-S497 PolarHBondContact O-N 3.48Å; R493-V549 HydrophobicContact CB-CG1 4.47Å; R493-V549 HydrophobicContact CG-CG1 3.65Å
494	L	93.1	Very high	86.8	Confident	34 Å²	34	54 Å²	54	18%	0.178	31%	0.309	C	S	.	.	H	α-helix	trans	-63.5	-46.2	175.7	-81	176.6	0	0	0	111.6	A476 E479 F490 N491 S496 S497 Y498	A476-L494 VanDerWaalsContact CA-CD1 3.5Å; A476-L494 HydrophobicContact CB-CD1 3.75Å; E479-L494 HydrophobicContact CG-CD1 4.2Å; E479-L494 HydrophobicContact CG-CD2 4.49Å; F490-L494 HydrophobicContact CD1-CD1 3.96Å; F490-L494 HydrophobicContact CE1-CD1 3.33Å; F490-L494 HydrophobicContact CE1-CG 4.19Å; F490-L494 HydrophobicContact CE2-CD1 4.37Å; F490-L494 HydrophobicContact CE2-CG 4.45Å; F490-L494 HydrophobicContact CZ-CD1 3.57Å; F490-L494 HydrophobicContact CZ-CG 4.09Å; F490-L494 PolarHBondContact O-N 3.13Å; N491-L494 PolarHBondContact O-N 3.5Å; L494-S496 VanDerWaalsContact C-N 3.33Å; L494-S496 PolarHBondContact O-N 2.87Å; L494-S497 WeakPolarHBondContact O-CB 3.41Å; L494-S497 PolarHBondContact O-N 3.37Å; L494-Y498 PolarHBondContact O-N 3.33Å
495	L	95	Very high	89.2	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-60	-44.2	174.8	-179.7	62.8	0	0	0	111.5	L464 H468 A471 L475 N491 S497 Y498 I499 L546	L464-L495 HydrophobicContact CD2-CD1 3.89Å; L464-L495 HydrophobicContact CG-CD1 4.41Å; H468-L495 HydrophobicContact CB-CD2 3.54Å; H468-L495 VanDerWaalsContact O-CD2 3.31Å; H468-L495 WeakPolarHBondContact O-CD2 3.36Å; A471-L495 HydrophobicContact CB-CD1 4.1Å; L475-L495 HydrophobicContact CD1-CD1 4.33Å; N491-L495 PolarHBondContact O-N 2.98Å; L495-S497 VanDerWaalsContact C-N 3.32Å; L495-S497 PolarHBondContact O-N 3.2Å; L495-Y498 HydrophobicContact CD1-CD1 4.33Å; L495-Y498 WeakPolarHBondContact O-CB 3.29Å; L495-Y498 PolarHBondContact O-N 3.2Å; L495-I499 HydrophobicContact CD1-CD1 4.27Å; L495-I499 HydrophobicContact CD1-CG1 4.31Å; L495-I499 HydrophobicContact CG-CD1 3.98Å; L495-I499 HydrophobicContact CG-CG1 4.43Å; L495-I499 VanDerWaalsContact O-CG1 3.32Å; L495-I499 WeakPolarHBondContact O-CG1 3.37Å; L495-I499 PolarHBondContact O-N 2.87Å; L495-L546 HydrophobicContact CD2-CD1 3.98Å
496	S	95.4	Very high	91.4	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-56.6	-45.7	174.2	-179.7	0	0	0	0	112.1	K492 R493 L494 Y498 I499 C500 L546 T550	K492-S496 WeakPolarHBondContact O-CB 3.43Å; K492-S496 PolarHBondContact O-N 3.4Å; R493-S496 WeakPolarHBondContact O-CB 3.36Å; R493-S496 PolarHBondContact O-N 2.74Å; L494-S496 VanDerWaalsContact C-N 3.33Å; L494-S496 PolarHBondContact O-N 2.87Å; S496-Y498 VanDerWaalsContact C-N 3.34Å; S496-Y498 PolarHBondContact O-N 3.08Å; S496-I499 PolarHBondContact O-N 3.33Å; S496-C500 WeakPolarHBondContact O-CB 3.37Å; S496-C500 PolarHBondContact O-N 2.92Å; S496-C500 PolarHBondContact O-SG 3.4Å; S496-L546 WeakPolarHBondContact CB-O 3.49Å; S496-L546 PolarHBondContact OG-O 3.41Å; S496-T550 WeakPolarHBondContact OG-CB 3.47Å; S496-T550 WeakPolarHBondContact OG-CG2 3.35Å; S496-T550 PolarHBondContact OG-N 2.83Å; S496-T550 PolarHBondContact OG-OG1 2.87Å
497	S	95	Very high	93.2	Very high	68 Å²	68	44.3 Å²	44.3	48%	0.476	24%	0.235	S	C	.	.	H	α-helix	trans	-60.6	-42.7	176.7	-171	0	0	0	0	111.8	R493 L494 L495 C500 K501	R493-S497 WeakPolarHBondContact O-CB 3.47Å; R493-S497 PolarHBondContact O-N 3.48Å; L494-S497 WeakPolarHBondContact O-CB 3.41Å; L494-S497 PolarHBondContact O-N 3.37Å; L495-S497 VanDerWaalsContact C-N 3.32Å; L495-S497 PolarHBondContact O-N 3.2Å; S497-C500 PolarHBondContact O-N 3.36Å; S497-K501 WeakPolarHBondContact O-CB 3.21Å; S497-K501 PolarHBondContact O-N 2.97Å
498	Y	96.5	Very high	94.2	Very high	12 Å²	12	45.6 Å²	45.6	5%	0.047	24%	0.238	C	C	.	.	H	α-helix	trans	-61.4	-49.3	175.1	171.7	-99.1	0	0	0	112.3	L427 A431 L464 L475 L494 L495 S496 C500 K501 V502	L427-Y498 WeakPolarHBondContact CA-OH 3.32Å; L427-Y498 HydrophobicContact CB-CE1 4.44Å; L427-Y498 HydrophobicContact CB-CE2 3.73Å; L427-Y498 HydrophobicContact CD2-CE1 3.94Å; L427-Y498 WeakPolarHBondContact CD2-OH 3.29Å; L427-Y498 VanDerWaalsContact O-CE2 3.24Å; L427-Y498 WeakPolarHBondContact O-CE2 3.48Å; L427-Y498 PolarHBondContact O-OH 3.06Å; A431-Y498 HydrophobicContact CB-CE2 4.2Å; L464-Y498 HydrophobicContact CD2-CD1 4.14Å; L464-Y498 HydrophobicContact CD2-CE1 3.81Å; L475-Y498 HydrophobicContact CD1-CG 4.08Å; L494-Y498 PolarHBondContact O-N 3.33Å; L495-Y498 HydrophobicContact CD1-CD1 4.33Å; L495-Y498 WeakPolarHBondContact O-CB 3.29Å; L495-Y498 PolarHBondContact O-N 3.2Å; S496-Y498 VanDerWaalsContact C-N 3.34Å; S496-Y498 PolarHBondContact O-N 3.08Å; Y498-C500 VanDerWaalsContact C-N 3.3Å; Y498-C500 PolarHBondContact O-N 3.12Å; Y498-K501 WeakPolarHBondContact O-CB 3.25Å; Y498-K501 PolarHBondContact O-N 3.25Å; Y498-K501 VanDerWaalsContact O-N 3.09Å; Y498-V502 HydrophobicContact CD1-CG2 4.48Å; Y498-V502 HydrophobicContact CE1-CG2 3.92Å; Y498-V502 HydrophobicContact CE2-CG2 3.99Å; Y498-V502 PolarHBondContact O-N 3.36Å
499	I	96.8	Very high	95	Very high	2 Å²	2	42 Å²	42	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-59.6	-44.5	177.7	-64.2	170.4	0	0	0	110	L461 L495 S496 K501 V502 L503 L543 L546 V547	L461-I499 HydrophobicContact CD1-CG2 4.19Å; L461-I499 HydrophobicContact CD2-CG1 4.15Å; L461-I499 HydrophobicContact CD2-CG2 4.28Å; L495-I499 HydrophobicContact CD1-CD1 4.27Å; L495-I499 HydrophobicContact CD1-CG1 4.31Å; L495-I499 HydrophobicContact CG-CD1 3.98Å; L495-I499 HydrophobicContact CG-CG1 4.43Å; L495-I499 VanDerWaalsContact O-CG1 3.32Å; L495-I499 WeakPolarHBondContact O-CG1 3.37Å; L495-I499 PolarHBondContact O-N 2.87Å; S496-I499 PolarHBondContact O-N 3.33Å; I499-K501 VanDerWaalsContact C-N 3.32Å; I499-K501 PolarHBondContact O-N 2.91Å; I499-V502 PolarHBondContact O-N 3.23Å; I499-L503 HydrophobicContact CG2-CD1 4.02Å; I499-L503 HydrophobicContact CG2-CG 4.44Å; I499-L503 WeakPolarHBondContact O-CG 3.47Å; I499-L503 PolarHBondContact O-N 2.88Å; I499-L543 HydrophobicContact CD1-CD2 4.07Å; I499-L543 HydrophobicContact CG2-CD2 4.49Å; I499-L546 HydrophobicContact CD1-CB 4.05Å; I499-L546 HydrophobicContact CD1-CD1 3.77Å; I499-V547 HydrophobicContact CG2-CG2 3.64Å
500	C	96.3	Very high	95.5	Very high	34 Å²	34	37 Å²	37	23%	0.23	19%	0.185	C	C	.	.	H	α-helix	trans	-60.6	-39	175.3	-74.1	0	0	0	0	112.5	S496 S497 Y498 L503 G504 T550	S496-C500 WeakPolarHBondContact O-CB 3.37Å; S496-C500 PolarHBondContact O-N 2.92Å; S496-C500 PolarHBondContact O-SG 3.4Å; S497-C500 PolarHBondContact O-N 3.36Å; Y498-C500 VanDerWaalsContact C-N 3.3Å; Y498-C500 PolarHBondContact O-N 3.12Å; C500-L503 PolarHBondContact O-N 3.22Å; C500-G504 PolarHBondContact O-N 3.34Å; C500-T550 PolarHBondContact SG-OG1 3.4Å; C500-T550 VanDerWaalsContact SG-OG1 3.32Å
501	K	96.8	Very high	95.9	Very high	77 Å²	77	37.1 Å²	37.1	34%	0.335	19%	0.188	S	C	.	.	H	α-helix	trans	-62.8	-45.8	174.5	177.6	-177.3	174.6	-178.4	0	111.4	E428 S497 Y498 I499 G504 N505	E428-K501 IonicContact OE1-NZ 2.66Å; E428-K501 PolarHBondContact OE1-NZ 3.41Å; E428-K501 IonicContact OE2-NZ 3.2Å; E428-K501 PolarHBondContact OE2-NZ 2.94Å; S497-K501 WeakPolarHBondContact O-CB 3.21Å; S497-K501 PolarHBondContact O-N 2.97Å; Y498-K501 WeakPolarHBondContact O-CB 3.25Å; Y498-K501 PolarHBondContact O-N 3.25Å; Y498-K501 VanDerWaalsContact O-N 3.09Å; I499-K501 VanDerWaalsContact C-N 3.32Å; I499-K501 PolarHBondContact O-N 2.91Å; K501-G504 PolarHBondContact O-N 2.96Å; K501-N505 WeakPolarHBondContact O-CB 3.27Å; K501-N505 VanDerWaalsContact O-CG 3.31Å; K501-N505 PolarHBondContact O-N 3.44Å
502	V	97.9	Very high	96.2	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60	-49	176.5	171.4	0	0	0	0	111	F430 A431 I434 L461 Y498 I499 G504 N505 L506	F430-V502 HydrophobicContact CD1-CG2 4.42Å; F430-V502 HydrophobicContact CE1-CG1 4.05Å; F430-V502 HydrophobicContact CE1-CG2 4.46Å; A431-V502 HydrophobicContact CB-CG2 3.93Å; I434-V502 HydrophobicContact CD1-CG1 3.61Å; L461-V502 HydrophobicContact CD1-CG1 3.95Å; L461-V502 HydrophobicContact CD2-CB 4.32Å; L461-V502 HydrophobicContact CD2-CG1 4.15Å; L461-V502 HydrophobicContact CD2-CG2 4.48Å; L461-V502 HydrophobicContact CG-CG1 4.23Å; Y498-V502 HydrophobicContact CD1-CG2 4.48Å; Y498-V502 HydrophobicContact CE1-CG2 3.92Å; Y498-V502 HydrophobicContact CE2-CG2 3.99Å; Y498-V502 PolarHBondContact O-N 3.36Å; I499-V502 PolarHBondContact O-N 3.23Å; V502-G504 VanDerWaalsContact C-N 3.35Å; V502-G504 PolarHBondContact O-N 3.41Å; V502-N505 PolarHBondContact O-N 2.73Å; V502-L506 WeakPolarHBondContact O-CB 3.39Å; V502-L506 PolarHBondContact O-N 2.93Å
503	L	97.4	Very high	96.4	Very high	5 Å²	5	33.8 Å²	33.8	3%	0.026	18%	0.179	C	C	.	.	H	α-helix	trans	-63.2	-39.9	178.5	-67.9	173.2	0	0	0	112.3	I458 L461 I499 C500 L506 Q507 I534 L538 V547	I458-L503 HydrophobicContact CD1-CD2 4.12Å; L461-L503 HydrophobicContact CD1-CD2 3.89Å; L461-L503 HydrophobicContact CD1-CG 4.16Å; I499-L503 HydrophobicContact CG2-CD1 4.02Å; I499-L503 HydrophobicContact CG2-CG 4.44Å; I499-L503 WeakPolarHBondContact O-CG 3.47Å; I499-L503 PolarHBondContact O-N 2.88Å; C500-L503 PolarHBondContact O-N 3.22Å; L503-L506 PolarHBondContact O-N 3.5Å; L503-Q507 WeakPolarHBondContact O-CB 3.17Å; L503-Q507 PolarHBondContact O-N 3.38Å; L503-I534 HydrophobicContact CD2-CG2 4.07Å; L503-L538 HydrophobicContact CD1-CD1 4.4Å; L503-L538 HydrophobicContact CD1-CD2 4.03Å; L503-V547 HydrophobicContact CD1-CG2 3.87Å
504	G	97	Very high	96.6	Very high	24 Å²	24	26.6 Å²	26.6	25%	0.247	15%	0.153	C	C	.	.	H	α-helix	trans	-65.4	-42.3	175.2	0	0	0	0	0	112.6	C500 K501 V502 Q507 L508	C500-G504 PolarHBondContact O-N 3.34Å; K501-G504 PolarHBondContact O-N 2.96Å; V502-G504 VanDerWaalsContact C-N 3.35Å; V502-G504 PolarHBondContact O-N 3.41Å; G504-Q507 PolarHBondContact O-N 3.22Å; G504-L508 WeakPolarHBondContact O-CG 3.12Å; G504-L508 PolarHBondContact O-N 3.28Å
505	N	98	Very high	96.8	Very high	20 Å²	20	32.8 Å²	32.8	11%	0.107	18%	0.178	C	C	.	.	H	α-helix	trans	-61.8	-44.9	174.1	-77.5	-5.1	0	0	0	111.1	A431 I434 K435 K501 V502 L508 N509	A431-N505 PolarHBondContact O-ND2 3.16Å; I434-N505 HydrophobicContact CG2-CB 4.23Å; K435-N505 HydrophobicContact CB-CB 4.07Å; K501-N505 WeakPolarHBondContact O-CB 3.27Å; K501-N505 VanDerWaalsContact O-CG 3.31Å; K501-N505 PolarHBondContact O-N 3.44Å; V502-N505 PolarHBondContact O-N 2.73Å; N505-L508 PolarHBondContact O-N 2.95Å; N505-N509 VanDerWaalsContact O-CB 3.32Å; N505-N509 WeakPolarHBondContact O-CB 3.33Å; N505-N509 PolarHBondContact O-N 3.29Å
506	L	97.9	Very high	96.8	Very high	1 Å²	1	35 Å²	35	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-59.6	-47.7	175.8	-179.8	61.7	0	0	0	111	I434 L453 T454 A457 V502 L503 L508 N509 L510 I534	I434-L506 HydrophobicContact CG2-CB 3.78Å; I434-L506 HydrophobicContact CG2-CD1 4.1Å; L453-L506 HydrophobicContact CD2-CD1 3.88Å; L453-L506 HydrophobicContact CG-CD1 3.82Å; T454-L506 HydrophobicContact CG2-CD2 4.3Å; A457-L506 HydrophobicContact CB-CD1 4.44Å; A457-L506 HydrophobicContact CB-CD2 3.94Å; V502-L506 WeakPolarHBondContact O-CB 3.39Å; V502-L506 PolarHBondContact O-N 2.93Å; L503-L506 PolarHBondContact O-N 3.5Å; L506-L508 PolarHBondContact O-N 3Å; L506-N509 PolarHBondContact O-N 3.15Å; L506-L510 HydrophobicContact CD1-CD1 4.2Å; L506-L510 HydrophobicContact CD1-CG 4.21Å; L506-L510 HydrophobicContact CG-CD1 3.97Å; L506-L510 HydrophobicContact CG-CG 4.41Å; L506-L510 WeakPolarHBondContact O-CB 3.37Å; L506-L510 WeakPolarHBondContact O-CG 3.48Å; L506-L510 PolarHBondContact O-N 3.2Å; L506-I534 HydrophobicContact CD2-CD1 3.67Å; L506-I534 HydrophobicContact CD2-CG1 4.13Å; L506-I534 HydrophobicContact CG-CD1 4.25Å
507	Q	97	Very high	96.8	Very high	47 Å²	47	36.4 Å²	36.4	22%	0.22	20%	0.197	C	C	.	.	H	α-helix	trans	-59.2	-47.8	178	-179.6	179.5	28.2	0	0	112.3	L503 G504 N509 L510 L511 Y531	L503-Q507 WeakPolarHBondContact O-CB 3.17Å; L503-Q507 PolarHBondContact O-N 3.38Å; G504-Q507 PolarHBondContact O-N 3.22Å; Q507-N509 VanDerWaalsContact C-N 3.33Å; Q507-N509 PolarHBondContact O-N 2.96Å; Q507-L510 PolarHBondContact O-N 3.16Å; Q507-L511 HydrophobicContact CG-CD1 4.32Å; Q507-L511 WeakPolarHBondContact O-CG 3.22Å; Q507-L511 PolarHBondContact O-N 2.87Å; Q507-Y531 HydrophobicContact CG-CE1 3.85Å
508	L	97	Very high	96.7	Very high	108 Å²	108	42.9 Å²	42.9	57%	0.565	22%	0.22	S	C	*	.	H	α-helix	trans	-63.2	-40.1	178.4	-73	174.2	0	0	0	111.8	G504 N505 L506 L511 S512	G504-L508 WeakPolarHBondContact O-CG 3.12Å; G504-L508 PolarHBondContact O-N 3.28Å; N505-L508 PolarHBondContact O-N 2.95Å; L506-L508 PolarHBondContact O-N 3Å; L508-L511 WeakPolarHBondContact O-CB 3.35Å; L508-L511 PolarHBondContact O-N 3.26Å; L508-S512 PolarHBondContact O-N 3.31Å; L508-S512 VanDerWaalsContact O-N 3.1Å; L508-S512 PolarHBondContact O-OG 2.83Å
509	N	97.6	Very high	96.7	Very high	10 Å²	10	45.1 Å²	45.1	5%	0.053	23%	0.233	C	C	.	.	H	α-helix	trans	-66	-44.3	177.3	-171.7	-79.6	0	0	0	111.4	I434 K435 D437 L453 N505 L506 Q507 L511 S512 K513	I434-N509 WeakPolarHBondContact O-CB 3.37Å; I434-N509 PolarHBondContact O-ND2 3.27Å; K435-N509 PolarHBondContact O-ND2 2.87Å; D437-N509 PolarHBondContact O-ND2 3.16Å; L453-N509 WeakPolarHBondContact CD2-OD1 3.39Å; N505-N509 VanDerWaalsContact O-CB 3.32Å; N505-N509 WeakPolarHBondContact O-CB 3.33Å; N505-N509 PolarHBondContact O-N 3.29Å; L506-N509 PolarHBondContact O-N 3.15Å; Q507-N509 VanDerWaalsContact C-N 3.33Å; Q507-N509 PolarHBondContact O-N 2.96Å; N509-L511 VanDerWaalsContact C-N 3.31Å; N509-L511 PolarHBondContact O-N 3.11Å; N509-S512 WeakPolarHBondContact O-CB 3.46Å; N509-S512 PolarHBondContact O-N 2.95Å; N509-S512 VanDerWaalsContact O-N 3.12Å; N509-K513 PolarHBondContact O-N 2.93Å; N509-K513 WeakPolarHBondContact OD1-CD 3.29Å; N509-K513 WeakPolarHBondContact OD1-CE 3.31Å; N509-K513 PolarHBondContact OD1-NZ 3.4Å
510	L	97.8	Very high	96.6	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-59.9	-39.2	174.4	-72.3	171.5	0	0	0	112.4	H451 L506 Q507 K513 S514 F526 L527 N530 I534	H451-L510 HydrophobicContact CB-CD2 4.3Å; L506-L510 HydrophobicContact CD1-CD1 4.2Å; L506-L510 HydrophobicContact CD1-CG 4.21Å; L506-L510 HydrophobicContact CG-CD1 3.97Å; L506-L510 HydrophobicContact CG-CG 4.41Å; L506-L510 WeakPolarHBondContact O-CB 3.37Å; L506-L510 WeakPolarHBondContact O-CG 3.48Å; L506-L510 PolarHBondContact O-N 3.2Å; Q507-L510 PolarHBondContact O-N 3.16Å; L510-K513 PolarHBondContact O-N 3.14Å; L510-S514 WeakPolarHBondContact O-CB 3.46Å; L510-S514 PolarHBondContact O-N 3.38Å; L510-F526 HydrophobicContact CD2-CE1 3.94Å; L510-F526 HydrophobicContact CD2-CZ 3.7Å; L510-L527 HydrophobicContact CB-CD2 4.18Å; L510-N530 HydrophobicContact CD1-CB 3.7Å; L510-N530 HydrophobicContact CD2-CB 4.14Å; L510-I534 HydrophobicContact CD1-CD1 4.08Å
511	L	96.9	Very high	96.6	Very high	59 Å²	59	47.5 Å²	47.5	31%	0.309	25%	0.25	S	C	.	.	H	α-helix	trans	-62	-42	173.7	-76.8	168.1	0	0	0	112	Q507 L508 N509 S514 L527 Y531	Q507-L511 HydrophobicContact CG-CD1 4.32Å; Q507-L511 WeakPolarHBondContact O-CG 3.22Å; Q507-L511 PolarHBondContact O-N 2.87Å; L508-L511 WeakPolarHBondContact O-CB 3.35Å; L508-L511 PolarHBondContact O-N 3.26Å; N509-L511 VanDerWaalsContact C-N 3.31Å; N509-L511 PolarHBondContact O-N 3.11Å; L511-S514 PolarHBondContact O-OG 3.36Å; L511-L527 HydrophobicContact CD2-CD1 3.86Å; L511-L527 HydrophobicContact CD2-CD2 4.21Å; L511-Y531 WeakPolarHBondContact CD2-OH 3.33Å; L511-Y531 WeakPolarHBondContact CG-OH 3.26Å
512	S	96.5	Very high	96.6	Very high	50 Å²	50	44.6 Å²	44.6	35%	0.35	24%	0.238	S	C	.	.	H	α-helix	trans	-63.9	-48.3	174.1	-64.4	0	0	0	0	111.5	L508 N509 S514 K515	L508-S512 PolarHBondContact O-N 3.31Å; L508-S512 VanDerWaalsContact O-N 3.1Å; L508-S512 PolarHBondContact O-OG 2.83Å; N509-S512 WeakPolarHBondContact O-CB 3.46Å; N509-S512 PolarHBondContact O-N 2.95Å; N509-S512 VanDerWaalsContact O-N 3.12Å; S512-S514 VanDerWaalsContact C-N 3.3Å; S512-S514 PolarHBondContact O-N 2.78Å; S512-K515 WeakPolarHBondContact O-CB 3.21Å; S512-K515 PolarHBondContact O-N 3.04Å; S512-K515 VanDerWaalsContact O-N 3.08Å
513	K	96.5	Very high	96.6	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-57.1	-39	176.3	-82.6	-177.9	165.7	59.1	0	113.5	D437 P438 D439 M444 H451 N509 L510 K515 V516 F526	D437-K513 PolarHBondContact O-NZ 3.28Å; D437-K513 WeakPolarHBondContact OD1-CE 3.41Å; D437-K513 IonicContact OD1-NZ 3.28Å; D437-K513 PolarHBondContact OD1-NZ 2.69Å; P438-K513 WeakPolarHBondContact O-CE 3.49Å; P438-K513 PolarHBondContact O-NZ 2.71Å; D439-K513 HydrophobicContact CB-CG 3.76Å; M444-K513 HydrophobicContact CE-CB 3.79Å; M444-K513 HydrophobicContact CE-CG 4.48Å; M444-K513 WeakPolarHBondContact CE-O 3.47Å; M444-K513 HydrophobicContact SD-CB 3.65Å; M444-K513 HydrophobicContact SD-CD 3.88Å; M444-K513 HydrophobicContact SD-CG 3.7Å; H451-K513 WeakPolarHBondContact NE2-CE 3.24Å; N509-K513 PolarHBondContact O-N 2.93Å; N509-K513 WeakPolarHBondContact OD1-CD 3.29Å; N509-K513 WeakPolarHBondContact OD1-CE 3.31Å; N509-K513 PolarHBondContact OD1-NZ 3.4Å; L510-K513 PolarHBondContact O-N 3.14Å; K513-K515 PolarHBondContact O-N 2.93Å; K513-K515 VanDerWaalsContact O-N 3.13Å; K513-V516 VanDerWaalsContact O-CB 3.31Å; K513-V516 WeakPolarHBondContact O-CB 3.21Å; K513-V516 VanDerWaalsContact O-CG2 3.26Å; K513-V516 WeakPolarHBondContact O-CG2 3.5Å; K513-V516 PolarHBondContact O-N 3.1Å; K513-V516 VanDerWaalsContact O-N 3.08Å; K513-F526 HydrophobicContact CB-CE1 4.18Å; K513-F526 HydrophobicContact CB-CZ 4.37Å
514	S	96.7	Very high	96.7	Very high	6 Å²	6	45.3 Å²	45.3	4%	0.042	24%	0.243	C	C	.	.	H	α-helix	trans	-61.2	-23.1	178.9	76.8	0	0	0	0	113.5	L510 L511 S512 V516 Y517 S523	L510-S514 WeakPolarHBondContact O-CB 3.46Å; L510-S514 PolarHBondContact O-N 3.38Å; L511-S514 PolarHBondContact O-OG 3.36Å; S512-S514 VanDerWaalsContact C-N 3.3Å; S512-S514 PolarHBondContact O-N 2.78Å; S514-V516 VanDerWaalsContact C-N 3.25Å; S514-V516 PolarHBondContact O-N 3.36Å; S514-Y517 WeakPolarHBondContact O-CD2 3.4Å; S514-S523 WeakPolarHBondContact CB-OG 3.27Å; S514-S523 VanDerWaalsContact O-CB 3.27Å; S514-S523 WeakPolarHBondContact O-CB 3.25Å; S514-S523 PolarHBondContact O-OG 3.25Å
515	K	95.8	Very high	96.7	Very high	163 Å²	163	44.2 Å²	44.2	71%	0.709	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-8.5	179.2	-61.5	170.5	-175.1	171.4	0	113.4	S512 K513 Y517	S512-K515 WeakPolarHBondContact O-CB 3.21Å; S512-K515 PolarHBondContact O-N 3.04Å; S512-K515 VanDerWaalsContact O-N 3.08Å; K513-K515 PolarHBondContact O-N 2.93Å; K513-K515 VanDerWaalsContact O-N 3.13Å; K515-Y517 VanDerWaalsContact C-N 3.33Å
516	V	95.3	Very high	96.7	Very high	48 Å²	48	43.2 Å²	43.2	29%	0.291	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-29.6	177.2	-178.7	0	0	0	0	111.1	D439 E441 M444 K513 S514	D439-V516 WeakPolarHBondContact O-CG2 3.36Å; E441-V516 HydrophobicContact CB-CG1 4.08Å; E441-V516 HydrophobicContact CG-CG1 4.32Å; M444-V516 HydrophobicContact CG-CB 4.21Å; M444-V516 HydrophobicContact CG-CG1 4.07Å; M444-V516 HydrophobicContact CG-CG2 4.41Å; K513-V516 VanDerWaalsContact O-CB 3.31Å; K513-V516 WeakPolarHBondContact O-CB 3.21Å; K513-V516 VanDerWaalsContact O-CG2 3.26Å; K513-V516 WeakPolarHBondContact O-CG2 3.5Å; K513-V516 PolarHBondContact O-N 3.1Å; K513-V516 VanDerWaalsContact O-N 3.08Å; S514-V516 VanDerWaalsContact C-N 3.25Å; S514-V516 PolarHBondContact O-N 3.36Å
517	Y	95.6	Very high	96.8	Very high	30 Å²	30	43.5 Å²	43.5	12%	0.118	23%	0.228	C	C	.	.			trans	-71.4	132	176.1	-58.5	-74.3	0	0	0	111.1	M444 P445 S514 K515 L522 F526	M444-Y517 HydrophobicContact CE-CD2 4.37Å; M444-Y517 HydrophobicContact CE-CE2 3.43Å; M444-Y517 VanDerWaalsContact CE-CE2 3.43Å; M444-Y517 WeakPolarHBondContact CE-OH 3.36Å; P445-Y517 WeakPolarHBondContact O-CE1 3.26Å; P445-Y517 PolarHBondContact O-OH 3.43Å; S514-Y517 WeakPolarHBondContact O-CD2 3.4Å; K515-Y517 VanDerWaalsContact C-N 3.33Å; Y517-L522 HydrophobicContact CD1-CD2 3.47Å; Y517-L522 VanDerWaalsContact CD1-CD2 3.47Å; Y517-L522 HydrophobicContact CD1-CG 3.74Å; Y517-L522 HydrophobicContact CE1-CD2 3.88Å; Y517-L522 HydrophobicContact CE1-CG 4.05Å; Y517-L522 HydrophobicContact CG-CD2 4.19Å; Y517-L522 HydrophobicContact CG-CG 4.07Å; Y517-F526 HydrophobicContact CD2-CB 4.43Å; Y517-F526 HydrophobicContact CE2-CB 3.66Å; Y517-F526 AromaticContact CE2-CD1 3.96Å; Y517-F526 HydrophobicContact CE2-CD1 3.96Å; Y517-F526 HydrophobicContact CE2-CD2 4.03Å; Y517-F526 AromaticContact CE2-CG 3.6Å; Y517-F526 HydrophobicContact CE2-CG 3.6Å; Y517-F526 WeakPolarHBondContact OH-CD2 3.4Å
518	E	93.7	Very high	96.8	Very high	205 Å²	205	41.3 Å²	41.3	96%	0.958	22%	0.218	S	C	*	.	S	Bend	trans	-67.3	-38.7	173.7	-61.3	-174.6	166.1	0	0	111.9	S520	E518-S520 PolarHBondContact O-N 3.12Å
519	D	95.1	Very high	96.9	Very high	58 Å²	58	36.3 Å²	36.3	31%	0.31	19%	0.192	S	C	.	.	S	Bend	trans	-83.9	114.4	178.7	-167.2	-30.4	0	0	0	111	A521 L522 S523 W623	D519-A521 PolarHBondContact O-N 2.93Å; D519-A521 WeakPolarHBondContact OD1-CB 3.19Å; D519-A521 PolarHBondContact OD1-N 2.8Å; D519-L522 HydrophobicContact CB-CB 4.09Å; D519-L522 PolarHBondContact O-N 2.94Å; D519-L522 VanDerWaalsContact O-N 3.11Å; D519-S523 PolarHBondContact O-N 3.38Å; D519-W623 HydrophobicContact CB-CZ2 4.39Å; D519-W623 WeakPolarHBondContact OD2-CZ2 3.3Å
520	S	96.1	Very high	96.9	Very high	85 Å²	85	35.9 Å²	35.9	59%	0.594	19%	0.189	S	C	*	.	H	α-helix	trans	-57.6	-27.8	176.7	64.2	0	0	0	0	114.3	E518 S523 A524	E518-S520 PolarHBondContact O-N 3.12Å; S520-S523 WeakPolarHBondContact O-CB 3.46Å; S520-A524 PolarHBondContact O-N 3.43Å; S520-A524 VanDerWaalsContact O-N 3.09Å
521	A	96.4	Very high	97	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.008	19%	0.189	C	C	.	.	H	α-helix	trans	-79.1	-33.9	177.4	0	0	0	0	0	111.9	D519 A524 I525 Y569 W623	D519-A521 PolarHBondContact O-N 2.93Å; D519-A521 WeakPolarHBondContact OD1-CB 3.19Å; D519-A521 PolarHBondContact OD1-N 2.8Å; A521-A524 PolarHBondContact O-N 3.37Å; A521-I525 WeakPolarHBondContact O-CG1 3.42Å; A521-I525 PolarHBondContact O-N 3.16Å; A521-Y569 HydrophobicContact CB-CD2 4.35Å; A521-W623 HydrophobicContact CB-CH2 3.76Å; A521-W623 HydrophobicContact CB-CZ3 3.86Å
522	L	97.1	Very high	97	Very high	17 Å²	17	33.6 Å²	33.6	9%	0.089	18%	0.178	C	C	.	.	H	α-helix	trans	-66.2	-41.5	170.2	-178.9	54.4	0	0	0	111	Y517 D519 A524 I525 F526 W623	Y517-L522 HydrophobicContact CD1-CD2 3.47Å; Y517-L522 VanDerWaalsContact CD1-CD2 3.47Å; Y517-L522 HydrophobicContact CD1-CG 3.74Å; Y517-L522 HydrophobicContact CE1-CD2 3.88Å; Y517-L522 HydrophobicContact CE1-CG 4.05Å; Y517-L522 HydrophobicContact CG-CD2 4.19Å; Y517-L522 HydrophobicContact CG-CG 4.07Å; D519-L522 HydrophobicContact CB-CB 4.09Å; D519-L522 PolarHBondContact O-N 2.94Å; D519-L522 VanDerWaalsContact O-N 3.11Å; L522-A524 VanDerWaalsContact C-N 3.28Å; L522-A524 PolarHBondContact O-N 3.44Å; L522-I525 PolarHBondContact O-N 2.87Å; L522-F526 WeakPolarHBondContact O-CB 3.42Å; L522-F526 PolarHBondContact O-N 3.46Å; L522-W623 HydrophobicContact CB-CD2 4.34Å; L522-W623 HydrophobicContact CB-CH2 4.06Å; L522-W623 HydrophobicContact CB-CZ2 3.72Å; L522-W623 HydrophobicContact CB-CZ3 4.48Å; L522-W623 HydrophobicContact CD1-CB 4.39Å; L522-W623 HydrophobicContact CD1-CD2 3.82Å; L522-W623 HydrophobicContact CD1-CE3 4.44Å; L522-W623 HydrophobicContact CD1-CG 3.75Å
523	S	97.8	Very high	97.1	Very high	18 Å²	18	35.2 Å²	35.2	13%	0.126	18%	0.177	C	C	.	.	H	α-helix	trans	-54.5	-44.1	171.9	-176	0	0	0	0	112.1	S514 D519 S520 F526 L527	S514-S523 WeakPolarHBondContact CB-OG 3.27Å; S514-S523 VanDerWaalsContact O-CB 3.27Å; S514-S523 WeakPolarHBondContact O-CB 3.25Å; S514-S523 PolarHBondContact O-OG 3.25Å; D519-S523 PolarHBondContact O-N 3.38Å; S520-S523 WeakPolarHBondContact O-CB 3.46Å; S523-F526 PolarHBondContact O-N 3.38Å; S523-L527 PolarHBondContact O-N 2.69Å
524	A	98.2	Very high	97.2	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.008	18%	0.177	C	C	.	.	H	α-helix	trans	-67.4	-42	176.8	0	0	0	0	0	112.9	S520 A521 L522 F526 L527 H528 I568	S520-A524 PolarHBondContact O-N 3.43Å; S520-A524 VanDerWaalsContact O-N 3.09Å; A521-A524 PolarHBondContact O-N 3.37Å; L522-A524 VanDerWaalsContact C-N 3.28Å; L522-A524 PolarHBondContact O-N 3.44Å; A524-F526 VanDerWaalsContact C-N 3.33Å; A524-F526 PolarHBondContact O-N 3.26Å; A524-L527 PolarHBondContact O-N 3.15Å; A524-H528 VanDerWaalsContact O-CB 3.31Å; A524-H528 WeakPolarHBondContact O-CB 3.44Å; A524-H528 PolarHBondContact O-N 3.33Å; A524-I568 HydrophobicContact CB-CB 3.96Å; A524-I568 HydrophobicContact CB-CG2 3.72Å
525	I	97.9	Very high	97.1	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-61.2	-42.5	174.4	-70.2	-60.3	0	0	0	111.1	A521 L522 H528 N529 Y569 W623 A624 I625	A521-I525 WeakPolarHBondContact O-CG1 3.42Å; A521-I525 PolarHBondContact O-N 3.16Å; L522-I525 PolarHBondContact O-N 2.87Å; I525-H528 WeakPolarHBondContact O-CB 3.44Å; I525-H528 PolarHBondContact O-N 3.36Å; I525-N529 WeakPolarHBondContact O-CB 3.36Å; I525-N529 VanDerWaalsContact O-CG 3.29Å; I525-N529 PolarHBondContact O-N 3.42Å; I525-N529 PolarHBondContact O-ND2 2.61Å; I525-Y569 HydrophobicContact CD1-CD1 4.45Å; I525-Y569 HydrophobicContact CD1-CD2 3.69Å; I525-Y569 HydrophobicContact CD1-CE2 4.23Å; I525-Y569 HydrophobicContact CD1-CG 3.81Å; I525-Y569 HydrophobicContact CG1-CD2 3.79Å; I525-Y569 HydrophobicContact CG1-CE2 4.42Å; I525-Y569 HydrophobicContact CG1-CG 4.3Å; I525-W623 HydrophobicContact CG1-CE3 4.04Å; I525-W623 HydrophobicContact CG1-CZ3 4.38Å; I525-A624 WeakPolarHBondContact CG2-O 3.4Å; I525-I625 HydrophobicContact CD1-CD1 3.93Å; I525-I625 HydrophobicContact CD1-CG1 4.38Å; I525-I625 HydrophobicContact CG2-CG1 4.21Å
526	F	98.3	Very high	97.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-58.7	-51.1	175.4	172.4	-100	0	0	0	112.6	M444 P445 G448 T449 H451 L510 K513 Y517 L522 S523 A524 H528 N529 N530	M444-F526 HydrophobicContact CE-CD2 4.42Å; M444-F526 HydrophobicContact CE-CE1 4.06Å; M444-F526 HydrophobicContact CE-CE2 3.96Å; M444-F526 HydrophobicContact CE-CZ 3.76Å; P445-F526 HydrophobicContact CG-CD2 4.1Å; P445-F526 HydrophobicContact CG-CE2 3.93Å; G448-F526 VanDerWaalsContact O-CA 3.27Å; G448-F526 WeakPolarHBondContact O-CA 3.39Å; T449-F526 WeakPolarHBondContact O-CD2 3.45Å; H451-F526 HydrophobicContact CB-CE2 3.92Å; H451-F526 HydrophobicContact CB-CZ 4.02Å; L510-F526 HydrophobicContact CD2-CE1 3.94Å; L510-F526 HydrophobicContact CD2-CZ 3.7Å; K513-F526 HydrophobicContact CB-CE1 4.18Å; K513-F526 HydrophobicContact CB-CZ 4.37Å; Y517-F526 HydrophobicContact CD2-CB 4.43Å; Y517-F526 HydrophobicContact CE2-CB 3.66Å; Y517-F526 AromaticContact CE2-CD1 3.96Å; Y517-F526 HydrophobicContact CE2-CD1 3.96Å; Y517-F526 HydrophobicContact CE2-CD2 4.03Å; Y517-F526 AromaticContact CE2-CG 3.6Å; Y517-F526 HydrophobicContact CE2-CG 3.6Å; Y517-F526 WeakPolarHBondContact OH-CD2 3.4Å; L522-F526 WeakPolarHBondContact O-CB 3.42Å; L522-F526 PolarHBondContact O-N 3.46Å; S523-F526 PolarHBondContact O-N 3.38Å; A524-F526 VanDerWaalsContact C-N 3.33Å; A524-F526 PolarHBondContact O-N 3.26Å; F526-H528 VanDerWaalsContact C-N 3.34Å; F526-H528 PolarHBondContact O-N 3.36Å; F526-N529 PolarHBondContact O-N 3.16Å; F526-N530 WeakPolarHBondContact CD2-ND2 3.44Å; F526-N530 VanDerWaalsContact CE2-ND2 3.29Å; F526-N530 WeakPolarHBondContact CE2-ND2 3.33Å; F526-N530 PolarHBondContact O-N 2.82Å; F526-N530 VanDerWaalsContact O-N 3.14Å; F526-N530 PolarHBondContact O-ND2 2.88Å
527	L	98.6	Very high	97.2	Very high	7 Å²	7	27.6 Å²	27.6	4%	0.037	14%	0.14	C	C	.	.	H	α-helix	trans	-63	-41.6	177.7	-72	176.6	0	0	0	111.7	L510 L511 S523 A524 N529 N530 Y531 Q565	L510-L527 HydrophobicContact CB-CD2 4.18Å; L511-L527 HydrophobicContact CD2-CD1 3.86Å; L511-L527 HydrophobicContact CD2-CD2 4.21Å; S523-L527 PolarHBondContact O-N 2.69Å; A524-L527 PolarHBondContact O-N 3.15Å; L527-N529 PolarHBondContact O-N 3.49Å; L527-N530 PolarHBondContact O-N 3.31Å; L527-Y531 HydrophobicContact CB-CD2 4.39Å; L527-Y531 HydrophobicContact CB-CE2 4.03Å; L527-Y531 HydrophobicContact CD2-CE2 4.42Å; L527-Y531 WeakPolarHBondContact O-CB 3.4Å; L527-Y531 VanDerWaalsContact O-CD2 3.28Å; L527-Y531 WeakPolarHBondContact O-CD2 3.42Å; L527-Y531 PolarHBondContact O-N 2.84Å; L527-Q565 HydrophobicContact CB-CG 3.76Å
528	H	98.5	Very high	97.1	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-54.2	-54.8	173.1	171.7	-32.4	0	0	0	110.5	A524 I525 F526 N530 Y531 N532 Q565 I566 Q630 I634	A524-H528 VanDerWaalsContact O-CB 3.31Å; A524-H528 WeakPolarHBondContact O-CB 3.44Å; A524-H528 PolarHBondContact O-N 3.33Å; I525-H528 WeakPolarHBondContact O-CB 3.44Å; I525-H528 PolarHBondContact O-N 3.36Å; F526-H528 VanDerWaalsContact C-N 3.34Å; F526-H528 PolarHBondContact O-N 3.36Å; H528-N530 VanDerWaalsContact C-N 3.31Å; H528-N530 PolarHBondContact O-N 2.91Å; H528-Y531 PolarHBondContact O-N 2.86Å; H528-N532 VanDerWaalsContact O-CB 3.29Å; H528-N532 WeakPolarHBondContact O-CB 3.44Å; H528-N532 PolarHBondContact O-N 3.22Å; H528-Q565 HydrophobicContact CB-CB 3.97Å; H528-I566 VanDerWaalsContact CD2-CG1 3.46Å; H528-I566 WeakPolarHBondContact CD2-CG1 3.42Å; H528-Q630 PolarHBondContact CE1-OE1 3.07Å; H528-Q630 PolarHBondContact NE2-OE1 3.5Å; H528-I634 VanDerWaalsContact NE2-CD1 3.3Å; H528-I634 WeakPolarHBondContact NE2-CD1 3.48Å
529	N	98.3	Very high	97	Very high	3 Å²	3	20 Å²	20	2%	0.016	11%	0.106	C	C	.	.	H	α-helix	trans	-58	-46.4	-173.8	-77.3	-27	0	0	0	111.2	G448 V450 I525 F526 L527 Y533 A624 P626	G448-N529 PolarHBondContact O-ND2 3.45Å; V450-N529 HydrophobicContact CG2-CB 4.22Å; I525-N529 WeakPolarHBondContact O-CB 3.36Å; I525-N529 VanDerWaalsContact O-CG 3.29Å; I525-N529 PolarHBondContact O-N 3.42Å; I525-N529 PolarHBondContact O-ND2 2.61Å; F526-N529 PolarHBondContact O-N 3.16Å; L527-N529 PolarHBondContact O-N 3.49Å; N529-Y533 WeakPolarHBondContact O-CB 3.44Å; N529-Y533 PolarHBondContact O-N 2.86Å; N529-A624 PolarHBondContact ND2-O 3.42Å; N529-P626 WeakPolarHBondContact OD1-CD 3.34Å
530	N	98.5	Very high	96.9	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-68.8	-43.5	179.9	-71.3	-89.4	0	0	0	112.2	H451 T454 L510 F526 L527 H528 N532 Y533 I534	H451-N530 PolarHBondContact N-OD1 3.3Å; T454-N530 WeakPolarHBondContact CB-OD1 3.34Å; T454-N530 HydrophobicContact CG2-CB 4.38Å; T454-N530 PolarHBondContact OG1-OD1 2.97Å; L510-N530 HydrophobicContact CD1-CB 3.7Å; L510-N530 HydrophobicContact CD2-CB 4.14Å; F526-N530 WeakPolarHBondContact CD2-ND2 3.44Å; F526-N530 VanDerWaalsContact CE2-ND2 3.29Å; F526-N530 WeakPolarHBondContact CE2-ND2 3.33Å; F526-N530 PolarHBondContact O-N 2.82Å; F526-N530 VanDerWaalsContact O-N 3.14Å; F526-N530 PolarHBondContact O-ND2 2.88Å; L527-N530 PolarHBondContact O-N 3.31Å; H528-N530 VanDerWaalsContact C-N 3.31Å; H528-N530 PolarHBondContact O-N 2.91Å; N530-N532 PolarHBondContact O-N 3.46Å; N530-Y533 PolarHBondContact O-N 3.3Å; N530-I534 VanDerWaalsContact O-CG1 3.27Å; N530-I534 WeakPolarHBondContact O-CG1 3.38Å; N530-I534 PolarHBondContact O-N 2.75Å
531	Y	98.6	Very high	96.5	Very high	1 Å²	1	22.6 Å²	22.6	0%	0.004	11%	0.106	C	C	.	.	H	α-helix	trans	-65	-40	177	-65.7	-22.5	0	0	0	112.9	Q507 L511 L527 H528 I534 L535 Y558 L561 Q565	Q507-Y531 HydrophobicContact CG-CE1 3.85Å; L511-Y531 WeakPolarHBondContact CD2-OH 3.33Å; L511-Y531 WeakPolarHBondContact CG-OH 3.26Å; L527-Y531 HydrophobicContact CB-CD2 4.39Å; L527-Y531 HydrophobicContact CB-CE2 4.03Å; L527-Y531 HydrophobicContact CD2-CE2 4.42Å; L527-Y531 WeakPolarHBondContact O-CB 3.4Å; L527-Y531 VanDerWaalsContact O-CD2 3.28Å; L527-Y531 WeakPolarHBondContact O-CD2 3.42Å; L527-Y531 PolarHBondContact O-N 2.84Å; H528-Y531 PolarHBondContact O-N 2.86Å; Y531-I534 PolarHBondContact O-N 3.33Å; Y531-L535 WeakPolarHBondContact O-CB 3.41Å; Y531-L535 PolarHBondContact O-N 3.42Å; Y531-Y558 HydrophobicContact CD1-CE1 4.33Å; Y531-L561 HydrophobicContact CD2-CB 3.89Å; Y531-L561 HydrophobicContact CE2-CB 4.06Å; Y531-Q565 HydrophobicContact CD2-CG 4.3Å; Y531-Q565 HydrophobicContact CE2-CG 4.32Å
532	N	98.1	Very high	96.1	Very high	11 Å²	11	28.5 Å²	28.5	6%	0.059	13%	0.134	C	C	.	.	H	α-helix	trans	-64.6	-41.4	174.6	178.9	74.4	0	0	0	111.3	H528 N530 L535 K536 I562 D627 Q630	H528-N532 VanDerWaalsContact O-CB 3.29Å; H528-N532 WeakPolarHBondContact O-CB 3.44Å; H528-N532 PolarHBondContact O-N 3.22Å; N530-N532 PolarHBondContact O-N 3.46Å; N532-L535 PolarHBondContact O-N 3.02Å; N532-K536 WeakPolarHBondContact O-CB 3Å; N532-K536 PolarHBondContact O-N 3.01Å; N532-I562 HydrophobicContact CB-CD1 4.13Å; N532-D627 VanDerWaalsContact ND2-CB 3.33Å; N532-D627 WeakPolarHBondContact ND2-CB 3.25Å; N532-Q630 WeakPolarHBondContact OD1-CG 3.27Å
533	Y	98	Very high	95.8	Very high	84 Å²	84	27.7 Å²	27.7	33%	0.329	13%	0.129	S	C	.	.	H	α-helix	trans	-61.4	-46.4	175.7	-175.3	-87.2	0	0	0	111.8	V450 T454 I458 N529 N530 S537	V450-Y533 HydrophobicContact CG1-CD1 4.22Å; V450-Y533 HydrophobicContact CG1-CD2 4.19Å; V450-Y533 HydrophobicContact CG1-CG 3.93Å; V450-Y533 HydrophobicContact CG2-CD2 4.14Å; V450-Y533 HydrophobicContact CG2-CG 4.2Å; T454-Y533 HydrophobicContact CG2-CD1 3.78Å; T454-Y533 HydrophobicContact CG2-CE1 4.45Å; I458-Y533 HydrophobicContact CB-CE1 4.16Å; I458-Y533 HydrophobicContact CG1-CD1 4.37Å; I458-Y533 HydrophobicContact CG1-CE1 4.15Å; I458-Y533 HydrophobicContact CG2-CE1 4.22Å; N529-Y533 WeakPolarHBondContact O-CB 3.44Å; N529-Y533 PolarHBondContact O-N 2.86Å; N530-Y533 PolarHBondContact O-N 3.3Å; Y533-S537 VanDerWaalsContact O-CB 3.24Å; Y533-S537 WeakPolarHBondContact O-CB 3.41Å; Y533-S537 PolarHBondContact O-N 3.23Å; Y533-S537 PolarHBondContact O-OG 2.7Å
534	I	97.9	Very high	95.5	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-58.5	-52	176.2	-69.5	164.4	0	0	0	110.2	T454 I458 L503 L506 L510 N530 Y531 S537 L538 Y558	T454-I534 HydrophobicContact CG2-CD1 4.05Å; T454-I534 HydrophobicContact CG2-CG1 3.66Å; I458-I534 HydrophobicContact CD1-CB 4.49Å; I458-I534 HydrophobicContact CD1-CG1 4.25Å; I458-I534 HydrophobicContact CD1-CG2 4.3Å; I458-I534 HydrophobicContact CG1-CG1 4.38Å; L503-I534 HydrophobicContact CD2-CG2 4.07Å; L506-I534 HydrophobicContact CD2-CD1 3.67Å; L506-I534 HydrophobicContact CD2-CG1 4.13Å; L506-I534 HydrophobicContact CG-CD1 4.25Å; L510-I534 HydrophobicContact CD1-CD1 4.08Å; N530-I534 VanDerWaalsContact O-CG1 3.27Å; N530-I534 WeakPolarHBondContact O-CG1 3.38Å; N530-I534 PolarHBondContact O-N 2.75Å; Y531-I534 PolarHBondContact O-N 3.33Å; I534-S537 PolarHBondContact O-N 2.98Å; I534-L538 HydrophobicContact CG2-CD1 3.54Å; I534-L538 HydrophobicContact CG2-CG 4.4Å; I534-L538 WeakPolarHBondContact O-CB 3.5Å; I534-L538 WeakPolarHBondContact O-CD1 3.33Å; I534-L538 VanDerWaalsContact O-CG 3.27Å; I534-L538 WeakPolarHBondContact O-CG 3.2Å; I534-L538 PolarHBondContact O-N 2.64Å; I534-Y558 HydrophobicContact CB-CE1 4.48Å; I534-Y558 HydrophobicContact CG2-CE1 3.87Å; I534-Y558 HydrophobicContact CG2-CE2 4.24Å
535	L	96.4	Very high	95.2	Very high	3 Å²	3	33.3 Å²	33.3	2%	0.016	15%	0.154	C	C	.	.	H	α-helix	trans	-59.9	-50.9	-179.3	178.7	60.2	0	0	0	112.1	Y531 N532 S537 L538 E539 E555 R559 I562	Y531-L535 WeakPolarHBondContact O-CB 3.41Å; Y531-L535 PolarHBondContact O-N 3.42Å; N532-L535 PolarHBondContact O-N 3.02Å; L535-S537 PolarHBondContact O-N 3.44Å; L535-L538 WeakPolarHBondContact O-CB 3.44Å; L535-L538 PolarHBondContact O-N 3.44Å; L535-E539 HydrophobicContact CD1-CG 4.21Å; L535-E539 WeakPolarHBondContact O-CG 3.42Å; L535-E539 PolarHBondContact O-N 3.13Å; L535-E555 HydrophobicContact CD1-CB 4.49Å; L535-E555 HydrophobicContact CD1-CG 3.76Å; L535-R559 HydrophobicContact CD2-CG 3.64Å; L535-I562 HydrophobicContact CB-CD1 4.31Å; L535-I562 HydrophobicContact CD2-CD1 3.74Å
536	K	95.8	Very high	94.9	Very high	41 Å²	41	33.9 Å²	33.9	18%	0.178	16%	0.157	C	C	.	.	H	α-helix	trans	-62.7	-33.5	178.9	-76.4	-162.3	170.1	-169.4	0	112.1	N532 K540 D627 E629	N532-K536 WeakPolarHBondContact O-CB 3Å; N532-K536 PolarHBondContact O-N 3.01Å; K536-K540 WeakPolarHBondContact O-CB 3.5Å; K536-K540 WeakPolarHBondContact O-CG 3.3Å; K536-K540 PolarHBondContact O-N 3.24Å; K536-D627 VanDerWaalsContact CD-OD2 3.27Å; K536-D627 WeakPolarHBondContact CD-OD2 3.43Å; K536-D627 VanDerWaalsContact CE-OD2 3.24Å; K536-D627 WeakPolarHBondContact CE-OD2 3.21Å; K536-D627 VanDerWaalsContact NZ-CG 3.3Å; K536-D627 IonicContact NZ-OD1 3.12Å; K536-D627 PolarHBondContact NZ-OD1 2.8Å; K536-D627 IonicContact NZ-OD2 2.83Å; K536-D627 PolarHBondContact NZ-OD2 3.41Å; K536-E629 IonicContact NZ-OE2 3.15Å; K536-E629 PolarHBondContact NZ-OE2 3.28Å
537	S	96.3	Very high	94.6	Very high	12 Å²	12	34 Å²	34	8%	0.084	16%	0.158	C	C	.	.	H	α-helix	trans	-72.8	-37	177.5	-57.9	0	0	0	0	112.4	Y533 I534 L535 S541	Y533-S537 VanDerWaalsContact O-CB 3.24Å; Y533-S537 WeakPolarHBondContact O-CB 3.41Å; Y533-S537 PolarHBondContact O-N 3.23Å; Y533-S537 PolarHBondContact O-OG 2.7Å; I534-S537 PolarHBondContact O-N 2.98Å; L535-S537 PolarHBondContact O-N 3.44Å; S537-S541 WeakPolarHBondContact O-CB 3.34Å; S537-S541 PolarHBondContact O-N 3.48Å; S537-S541 PolarHBondContact O-OG 3.44Å
538	L	94.2	Very high	94.3	Very high	1 Å²	1	36 Å²	36	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-62.8	-43.2	171.5	-74.2	157	0	0	0	111.2	L503 I534 L535 S541 L543 I544 V547 Y558	L503-L538 HydrophobicContact CD1-CD1 4.4Å; L503-L538 HydrophobicContact CD1-CD2 4.03Å; I534-L538 HydrophobicContact CG2-CD1 3.54Å; I534-L538 HydrophobicContact CG2-CG 4.4Å; I534-L538 WeakPolarHBondContact O-CB 3.5Å; I534-L538 WeakPolarHBondContact O-CD1 3.33Å; I534-L538 VanDerWaalsContact O-CG 3.27Å; I534-L538 WeakPolarHBondContact O-CG 3.2Å; I534-L538 PolarHBondContact O-N 2.64Å; L535-L538 WeakPolarHBondContact O-CB 3.44Å; L535-L538 PolarHBondContact O-N 3.44Å; L538-S541 PolarHBondContact O-N 3.33Å; L538-L543 HydrophobicContact CD2-CB 3.86Å; L538-I544 HydrophobicContact CB-CB 4.42Å; L538-I544 HydrophobicContact CB-CD1 4.38Å; L538-I544 WeakPolarHBondContact O-CB 3.32Å; L538-I544 PolarHBondContact O-N 2.84Å; L538-V547 HydrophobicContact CD2-CG2 3.93Å; L538-Y558 HydrophobicContact CD1-CD2 4.37Å; L538-Y558 HydrophobicContact CD1-CE2 4.07Å
539	E	92.1	Very high	94	Very high	76 Å²	76	38.4 Å²	38.4	36%	0.355	19%	0.185	S	C	.	.	H	α-helix	trans	-70.3	-34.8	179.7	-71.3	171.4	167.7	0	0	113.1	L535 S541 R559	L535-E539 HydrophobicContact CD1-CG 4.21Å; L535-E539 WeakPolarHBondContact O-CG 3.42Å; L535-E539 PolarHBondContact O-N 3.13Å; E539-S541 VanDerWaalsContact C-N 3.28Å; E539-S541 PolarHBondContact O-N 3.45Å; E539-R559 IonicContact OE1-CZ 2.88Å; E539-R559 IonicContact OE1-NH1 3.15Å; E539-R559 IonicContact OE1-NH2 2.96Å; E539-R559 PolarHBondContact OE1-NH2 3.44Å
540	K	91.1	Very high	93.7	Very high	177 Å²	177	41.1 Å²	41.1	77%	0.77	20%	0.202	S	C	*	.	H	α-helix	trans	-74.1	-18.4	177.8	-77.5	176.5	-179.7	-175.7	0	113.7	K536	K536-K540 WeakPolarHBondContact O-CB 3.5Å; K536-K540 WeakPolarHBondContact O-CG 3.3Å; K536-K540 PolarHBondContact O-N 3.24Å
541	S	88.4	Confident	93.3	Very high	20 Å²	20	45.9 Å²	45.9	14%	0.14	22%	0.224	C	C	.	.	S	Bend	trans	-116.8	166.9	-177.5	61.3	0	0	0	0	110.9	S537 L538 E539 L543	S537-S541 WeakPolarHBondContact O-CB 3.34Å; S537-S541 PolarHBondContact O-N 3.48Å; S537-S541 PolarHBondContact O-OG 3.44Å; L538-S541 PolarHBondContact O-N 3.33Å; E539-S541 VanDerWaalsContact C-N 3.28Å; E539-S541 PolarHBondContact O-N 3.45Å; S541-L543 PolarHBondContact O-N 2.97Å; S541-L543 VanDerWaalsContact O-N 3.15Å; S541-L543 WeakPolarHBondContact OG-CB 3.5Å; S541-L543 WeakPolarHBondContact OG-CD1 3.46Å; S541-L543 WeakPolarHBondContact OG-CG 3.34Å
542	E	88.3	Confident	92.9	Very high	124 Å²	124	56.4 Å²	56.4	58%	0.579	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	1.8	173.3	-60.5	-168.1	159.5	0	0	112.8	L465 I544 Q545 L546	L465-E542 HydrophobicContact CD1-CB 4.36Å; E542-I544 VanDerWaalsContact C-N 3.25Å; E542-I544 PolarHBondContact O-N 3.01Å; E542-Q545 WeakPolarHBondContact O-CB 3.48Å; E542-Q545 PolarHBondContact O-N 3.36Å; E542-L546 PolarHBondContact O-N 2.97Å
543	L	91.1	Very high	92.7	Very high	0 Å²	0	63 Å²	63	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-57.7	-37	177.3	-76.3	172.1	0	0	0	112.3	L461 Q462 L465 I499 L538 S541 Q545 L546 V547	L461-L543 HydrophobicContact CB-CD1 3.89Å; L461-L543 HydrophobicContact CB-CD2 4.13Å; Q462-L543 HydrophobicContact CG-CD1 3.86Å; L465-L543 HydrophobicContact CD1-CD2 4.24Å; L465-L543 HydrophobicContact CD1-CG 3.81Å; L465-L543 HydrophobicContact CD2-CD2 3.62Å; L465-L543 HydrophobicContact CD2-CG 4.03Å; L465-L543 HydrophobicContact CG-CD2 3.77Å; L465-L543 HydrophobicContact CG-CG 3.93Å; I499-L543 HydrophobicContact CD1-CD2 4.07Å; I499-L543 HydrophobicContact CG2-CD2 4.49Å; L538-L543 HydrophobicContact CD2-CB 3.86Å; S541-L543 PolarHBondContact O-N 2.97Å; S541-L543 VanDerWaalsContact O-N 3.15Å; S541-L543 WeakPolarHBondContact OG-CB 3.5Å; S541-L543 WeakPolarHBondContact OG-CD1 3.46Å; S541-L543 WeakPolarHBondContact OG-CG 3.34Å; L543-Q545 PolarHBondContact O-N 2.96Å; L543-L546 PolarHBondContact O-N 3.43Å; L543-L546 VanDerWaalsContact O-N 3.11Å; L543-V547 WeakPolarHBondContact O-CG2 3.44Å; L543-V547 PolarHBondContact O-N 3.43Å
544	I	91.8	Very high	92.3	Very high	27 Å²	27	59.3 Å²	59.3	14%	0.138	28%	0.279	C	S	.	.	H	α-helix	trans	-61.1	-33.9	178.9	-167.5	62.1	0	0	0	111.9	L538 E542 V547 T548 E555	L538-I544 HydrophobicContact CB-CB 4.42Å; L538-I544 HydrophobicContact CB-CD1 4.38Å; L538-I544 WeakPolarHBondContact O-CB 3.32Å; L538-I544 PolarHBondContact O-N 2.84Å; E542-I544 VanDerWaalsContact C-N 3.25Å; E542-I544 PolarHBondContact O-N 3.01Å; I544-V547 PolarHBondContact O-N 3.15Å; I544-T548 HydrophobicContact CD1-CG2 4.3Å; I544-T548 HydrophobicContact CG1-CG2 4.3Å; I544-T548 WeakPolarHBondContact O-CB 3.37Å; I544-T548 WeakPolarHBondContact O-CG2 3.46Å; I544-T548 PolarHBondContact O-N 2.83Å; I544-T548 PolarHBondContact O-OG1 2.88Å; I544-E555 HydrophobicContact CD1-CB 4.35Å
545	Q	90.8	Very high	92.1	Very high	110 Å²	110	63.1 Å²	63.1	51%	0.514	30%	0.297	S	S	.	.	H	α-helix	trans	-68.2	-37.3	177.4	-56.2	-177.7	22.6	0	0	111.2	E542 L543 T548 V549	E542-Q545 WeakPolarHBondContact O-CB 3.48Å; E542-Q545 PolarHBondContact O-N 3.36Å; L543-Q545 PolarHBondContact O-N 2.96Å; Q545-T548 PolarHBondContact O-OG1 2.97Å; Q545-T548 VanDerWaalsContact O-OG1 3.05Å; Q545-V549 WeakPolarHBondContact O-CG2 3.48Å
546	L	91.1	Very high	92	Very high	13 Å²	13	65.9 Å²	65.9	7%	0.068	32%	0.316	C	S	.	.	H	α-helix	trans	-71	-44.9	174.3	-70.6	-178.7	0	0	0	111.9	L465 H468 K492 L495 S496 I499 E542 L543 T548 V549	L465-L546 HydrophobicContact CD2-CD1 3.48Å; L465-L546 VanDerWaalsContact CD2-CD1 3.48Å; L465-L546 HydrophobicContact CD2-CG 4.39Å; H468-L546 HydrophobicContact CB-CD1 4.26Å; K492-L546 HydrophobicContact CG-CD2 4.09Å; L495-L546 HydrophobicContact CD2-CD1 3.98Å; S496-L546 WeakPolarHBondContact CB-O 3.49Å; S496-L546 PolarHBondContact OG-O 3.41Å; I499-L546 HydrophobicContact CD1-CB 4.05Å; I499-L546 HydrophobicContact CD1-CD1 3.77Å; E542-L546 PolarHBondContact O-N 2.97Å; L543-L546 PolarHBondContact O-N 3.43Å; L543-L546 VanDerWaalsContact O-N 3.11Å; L546-T548 VanDerWaalsContact C-N 3.3Å; L546-T548 PolarHBondContact O-N 3.29Å; L546-V549 VanDerWaalsContact O-CB 3.27Å; L546-V549 WeakPolarHBondContact O-CB 3.41Å; L546-V549 WeakPolarHBondContact O-CG2 3.42Å; L546-V549 PolarHBondContact O-N 3.44Å
547	V	92.8	Very high	92	Very high	3 Å²	3	66 Å²	66	2%	0.018	32%	0.323	C	S	.	.	H	α-helix	trans	-60.7	-40.7	179.6	169.5	0	0	0	0	111.2	I499 L503 L538 L543 I544 V549 T550 Q551 A554	I499-V547 HydrophobicContact CG2-CG2 3.64Å; L503-V547 HydrophobicContact CD1-CG2 3.87Å; L538-V547 HydrophobicContact CD2-CG2 3.93Å; L543-V547 WeakPolarHBondContact O-CG2 3.44Å; L543-V547 PolarHBondContact O-N 3.43Å; I544-V547 PolarHBondContact O-N 3.15Å; V547-V549 PolarHBondContact O-N 3.28Å; V547-T550 PolarHBondContact O-N 2.98Å; V547-Q551 HydrophobicContact CG1-CB 4.34Å; V547-Q551 PolarHBondContact O-N 2.87Å; V547-A554 HydrophobicContact CG1-CB 3.5Å
548	T	92.7	Very high	92	Very high	50 Å²	50	66.3 Å²	66.3	31%	0.307	32%	0.322	S	S	.	.	H	α-helix	trans	-68.7	-13.5	-178.8	51.3	0	0	0	0	114.2	I544 Q545 L546 T550	I544-T548 HydrophobicContact CD1-CG2 4.3Å; I544-T548 HydrophobicContact CG1-CG2 4.3Å; I544-T548 WeakPolarHBondContact O-CB 3.37Å; I544-T548 WeakPolarHBondContact O-CG2 3.46Å; I544-T548 PolarHBondContact O-N 2.83Å; I544-T548 PolarHBondContact O-OG1 2.88Å; Q545-T548 PolarHBondContact O-OG1 2.97Å; Q545-T548 VanDerWaalsContact O-OG1 3.05Å; L546-T548 VanDerWaalsContact C-N 3.3Å; L546-T548 PolarHBondContact O-N 3.29Å; T548-T550 VanDerWaalsContact C-N 3.31Å; T548-T550 PolarHBondContact O-N 2.94Å
549	V	92.3	Very high	92.1	Very high	51 Å²	51	72 Å²	72	31%	0.309	34%	0.343	S	S	.	.	H	α-helix	trans	-58.6	-42.7	171.5	175.7	0	0	0	0	111.3	K492 R493 Q545 L546 V547	K492-V549 HydrophobicContact CD-CG2 4.4Å; K492-V549 HydrophobicContact CG-CG2 4.32Å; R493-V549 HydrophobicContact CB-CG1 4.47Å; R493-V549 HydrophobicContact CG-CG1 3.65Å; Q545-V549 WeakPolarHBondContact O-CG2 3.48Å; L546-V549 VanDerWaalsContact O-CB 3.27Å; L546-V549 WeakPolarHBondContact O-CB 3.41Å; L546-V549 WeakPolarHBondContact O-CG2 3.42Å; L546-V549 PolarHBondContact O-N 3.44Å; V547-V549 PolarHBondContact O-N 3.28Å
550	T	91.3	Very high	92.4	Very high	60 Å²	60	74.1 Å²	74.1	37%	0.368	35%	0.353	S	S	.	.	H	α-helix	trans	-103.9	-39.6	178.6	55.7	0	0	0	0	112	S496 C500 V547 T548	S496-T550 WeakPolarHBondContact OG-CB 3.47Å; S496-T550 WeakPolarHBondContact OG-CG2 3.35Å; S496-T550 PolarHBondContact OG-N 2.83Å; S496-T550 PolarHBondContact OG-OG1 2.87Å; C500-T550 PolarHBondContact SG-OG1 3.4Å; C500-T550 VanDerWaalsContact SG-OG1 3.32Å; V547-T550 PolarHBondContact O-N 2.98Å; T548-T550 VanDerWaalsContact C-N 3.31Å; T548-T550 PolarHBondContact O-N 2.94Å
551	Q	90.8	Very high	92.7	Very high	100 Å²	100	67.5 Å²	67.5	47%	0.467	33%	0.326	S	S	.	.			trans	-115	77.3	-175.2	-166.1	63.5	15	0	0	111.8	V547 K553 A554	V547-Q551 HydrophobicContact CG1-CB 4.34Å; V547-Q551 PolarHBondContact O-N 2.87Å; Q551-K553 PolarHBondContact O-N 3.04Å; Q551-A554 HydrophobicContact CB-CB 4.24Å; Q551-A554 HydrophobicContact CG-CB 3.92Å; Q551-A554 WeakPolarHBondContact O-CB 3.33Å; Q551-A554 PolarHBondContact O-N 2.87Å
552	R	90.6	Very high	93.1	Very high	221 Å²	221	67 Å²	67	83%	0.834	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-26.6	-175.8	-65.3	-174.2	-176.8	176	1.1	115.4
553	K	92.2	Very high	93.6	Very high	150 Å²	150	67.4 Å²	67.4	65%	0.652	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	8.4	-177.3	-68.2	-172.5	179.2	-177.6	0	113.8	Q551 E555 S556 S557	Q551-K553 PolarHBondContact O-N 3.04Å; K553-E555 VanDerWaalsContact C-N 3.32Å; K553-E555 PolarHBondContact O-N 3.29Å; K553-S556 PolarHBondContact O-N 3.4Å; K553-S556 VanDerWaalsContact O-N 3.14Å; K553-S556 PolarHBondContact O-OG 2.97Å; K553-S557 PolarHBondContact O-N 3.27Å; K553-S557 PolarHBondContact O-OG 3.09Å; K553-S557 VanDerWaalsContact O-OG 3.14Å
554	A	90.9	Very high	93.9	Very high	7 Å²	7	71.2 Å²	71.2	6%	0.058	34%	0.34	C	S	.	.	H	α-helix	trans	-51	-48.4	-173.4	0	0	0	0	0	113	V547 Q551 S557 Y558	V547-A554 HydrophobicContact CG1-CB 3.5Å; Q551-A554 HydrophobicContact CB-CB 4.24Å; Q551-A554 HydrophobicContact CG-CB 3.92Å; Q551-A554 WeakPolarHBondContact O-CB 3.33Å; Q551-A554 PolarHBondContact O-N 2.87Å; A554-S557 PolarHBondContact O-N 3.02Å; A554-Y558 VanDerWaalsContact O-CD2 3.3Å; A554-Y558 WeakPolarHBondContact O-CD2 3.49Å; A554-Y558 PolarHBondContact O-N 3.23Å
555	E	92.6	Very high	94.2	Very high	79 Å²	79	70.8 Å²	70.8	37%	0.369	34%	0.337	S	S	.	.	H	α-helix	trans	-58.3	-52.8	178.9	-163.8	-161.7	138.5	0	0	111.8	L535 I544 K553 S557 Y558 R559	L535-E555 HydrophobicContact CD1-CB 4.49Å; L535-E555 HydrophobicContact CD1-CG 3.76Å; I544-E555 HydrophobicContact CD1-CB 4.35Å; K553-E555 VanDerWaalsContact C-N 3.32Å; K553-E555 PolarHBondContact O-N 3.29Å; E555-S557 VanDerWaalsContact C-N 3.27Å; E555-S557 PolarHBondContact O-N 3.43Å; E555-Y558 PolarHBondContact O-N 3.03Å; E555-R559 WeakPolarHBondContact O-CG 3.35Å; E555-R559 PolarHBondContact O-N 2.95Å; E555-R559 IonicContact OE1-CZ 3.33Å; E555-R559 VanDerWaalsContact OE1-CZ 3.24Å; E555-R559 IonicContact OE1-NE 2.87Å; E555-R559 PolarHBondContact OE1-NE 3.41Å; E555-R559 IonicContact OE1-NH2 3.2Å; E555-R559 PolarHBondContact OE1-NH2 3.33Å
556	S	94.6	Very high	94.6	Very high	61 Å²	61	66 Å²	66	43%	0.427	32%	0.315	S	S	.	.	H	α-helix	trans	-60.7	-36.3	178.6	58.4	0	0	0	0	112.8	K553 R559 E560	K553-S556 PolarHBondContact O-N 3.4Å; K553-S556 VanDerWaalsContact O-N 3.14Å; K553-S556 PolarHBondContact O-OG 2.97Å; S556-R559 PolarHBondContact O-N 3.31Å; S556-E560 PolarHBondContact O-N 3.4Å
557	S	95.3	Very high	94.8	Very high	45 Å²	45	68.7 Å²	68.7	32%	0.315	33%	0.329	S	S	.	.	H	α-helix	trans	-66.6	-43.4	177.2	-63.4	0	0	0	0	111.9	K553 A554 E555 E560 L561	K553-S557 PolarHBondContact O-N 3.27Å; K553-S557 PolarHBondContact O-OG 3.09Å; K553-S557 VanDerWaalsContact O-OG 3.14Å; A554-S557 PolarHBondContact O-N 3.02Å; E555-S557 VanDerWaalsContact C-N 3.27Å; E555-S557 PolarHBondContact O-N 3.43Å; S557-E560 PolarHBondContact O-N 3.35Å; S557-L561 VanDerWaalsContact O-CG 3.28Å; S557-L561 WeakPolarHBondContact O-CG 3.48Å; S557-L561 PolarHBondContact O-N 2.62Å
558	Y	96.4	Very high	95	Very high	17 Å²	17	71.3 Å²	71.3	7%	0.067	34%	0.342	C	S	.	.	H	α-helix	trans	-64.6	-41.2	174.2	-83.1	-70.2	0	0	0	112.2	Y531 I534 L538 A554 E555 E560 L561 I562	Y531-Y558 HydrophobicContact CD1-CE1 4.33Å; I534-Y558 HydrophobicContact CB-CE1 4.48Å; I534-Y558 HydrophobicContact CG2-CE1 3.87Å; I534-Y558 HydrophobicContact CG2-CE2 4.24Å; L538-Y558 HydrophobicContact CD1-CD2 4.37Å; L538-Y558 HydrophobicContact CD1-CE2 4.07Å; A554-Y558 VanDerWaalsContact O-CD2 3.3Å; A554-Y558 WeakPolarHBondContact O-CD2 3.49Å; A554-Y558 PolarHBondContact O-N 3.23Å; E555-Y558 PolarHBondContact O-N 3.03Å; Y558-E560 VanDerWaalsContact C-N 3.3Å; Y558-E560 PolarHBondContact O-N 2.92Å; Y558-L561 HydrophobicContact CD1-CD1 4.38Å; Y558-L561 PolarHBondContact O-N 3.15Å; Y558-I562 WeakPolarHBondContact O-CD1 3.49Å; Y558-I562 VanDerWaalsContact O-CG1 3.25Å; Y558-I562 WeakPolarHBondContact O-CG1 3.19Å; Y558-I562 PolarHBondContact O-N 3.16Å
559	R	97.1	Very high	95.3	Very high	121 Å²	121	69 Å²	69	46%	0.457	33%	0.328	S	S	.	.	H	α-helix	trans	-59.5	-41	174.8	-69.1	-176.9	-172.6	-66.9	1.5	112.1	L535 E539 E555 S556 K563	L535-R559 HydrophobicContact CD2-CG 3.64Å; E539-R559 IonicContact OE1-CZ 2.88Å; E539-R559 IonicContact OE1-NH1 3.15Å; E539-R559 IonicContact OE1-NH2 2.96Å; E539-R559 PolarHBondContact OE1-NH2 3.44Å; E555-R559 WeakPolarHBondContact O-CG 3.35Å; E555-R559 PolarHBondContact O-N 2.95Å; E555-R559 IonicContact OE1-CZ 3.33Å; E555-R559 VanDerWaalsContact OE1-CZ 3.24Å; E555-R559 IonicContact OE1-NE 2.87Å; E555-R559 PolarHBondContact OE1-NE 3.41Å; E555-R559 IonicContact OE1-NH2 3.2Å; E555-R559 PolarHBondContact OE1-NH2 3.33Å; S556-R559 PolarHBondContact O-N 3.31Å; R559-K563 WeakPolarHBondContact O-CB 3.45Å; R559-K563 PolarHBondContact O-N 3.37Å
560	E	97.7	Very high	95.4	Very high	120 Å²	120	68.6 Å²	68.6	56%	0.561	32%	0.323	S	S	*	.	H	α-helix	trans	-65.2	-44.3	175.9	-172.3	176.7	-178	0	0	111.7	S556 S557 Y558 I562 K563 Q564	S556-E560 PolarHBondContact O-N 3.4Å; S557-E560 PolarHBondContact O-N 3.35Å; Y558-E560 VanDerWaalsContact C-N 3.3Å; Y558-E560 PolarHBondContact O-N 2.92Å; E560-I562 PolarHBondContact O-N 2.84Å; E560-K563 PolarHBondContact O-N 2.87Å; E560-Q564 VanDerWaalsContact O-CG 3.3Å; E560-Q564 WeakPolarHBondContact O-CG 3.39Å; E560-Q564 PolarHBondContact O-N 3.2Å
561	L	97.4	Very high	95.6	Very high	38 Å²	38	73.5 Å²	73.5	20%	0.199	34%	0.335	C	S	.	.	H	α-helix	trans	-60.7	-44.7	176.5	-71.5	163.6	0	0	0	112.1	Y531 S557 Y558 K563 Q564 Q565	Y531-L561 HydrophobicContact CD2-CB 3.89Å; Y531-L561 HydrophobicContact CE2-CB 4.06Å; S557-L561 VanDerWaalsContact O-CG 3.28Å; S557-L561 WeakPolarHBondContact O-CG 3.48Å; S557-L561 PolarHBondContact O-N 2.62Å; Y558-L561 HydrophobicContact CD1-CD1 4.38Å; Y558-L561 PolarHBondContact O-N 3.15Å; L561-K563 VanDerWaalsContact C-N 3.34Å; L561-K563 PolarHBondContact O-N 2.97Å; L561-Q564 PolarHBondContact O-N 3.29Å; L561-Q565 WeakPolarHBondContact O-CG 3.4Å; L561-Q565 PolarHBondContact O-N 2.91Å
562	I	98.3	Very high	95.7	Very high	9 Å²	9	70.3 Å²	70.3	5%	0.046	32%	0.323	C	S	.	.	H	α-helix	trans	-58.9	-48	176	-67.9	161.4	0	0	0	109.8	N532 L535 Y558 E560 Q564 Q565 I566	N532-I562 HydrophobicContact CB-CD1 4.13Å; L535-I562 HydrophobicContact CB-CD1 4.31Å; L535-I562 HydrophobicContact CD2-CD1 3.74Å; Y558-I562 WeakPolarHBondContact O-CD1 3.49Å; Y558-I562 VanDerWaalsContact O-CG1 3.25Å; Y558-I562 WeakPolarHBondContact O-CG1 3.19Å; Y558-I562 PolarHBondContact O-N 3.16Å; E560-I562 PolarHBondContact O-N 2.84Å; I562-Q564 PolarHBondContact O-N 3.09Å; I562-Q565 PolarHBondContact O-N 3.28Å; I562-Q565 VanDerWaalsContact O-N 3.14Å; I562-I566 HydrophobicContact CG2-CD1 4.13Å; I562-I566 WeakPolarHBondContact O-CG1 3.08Å; I562-I566 PolarHBondContact O-N 3.05Å
563	K	97.9	Very high	96	Very high	134 Å²	134	59.8 Å²	59.8	58%	0.583	28%	0.283	S	S	*	.	H	α-helix	trans	-59.6	-44.1	177.5	-174.7	-178	176.6	-176.3	0	112.2	R559 E560 L561 Q565 I566 D567	R559-K563 WeakPolarHBondContact O-CB 3.45Å; R559-K563 PolarHBondContact O-N 3.37Å; E560-K563 PolarHBondContact O-N 2.87Å; L561-K563 VanDerWaalsContact C-N 3.34Å; L561-K563 PolarHBondContact O-N 2.97Å; K563-Q565 VanDerWaalsContact C-N 3.28Å; K563-Q565 PolarHBondContact O-N 3.28Å; K563-I566 WeakPolarHBondContact O-CB 3.34Å; K563-I566 PolarHBondContact O-N 2.86Å; K563-I566 VanDerWaalsContact O-N 3.16Å; K563-D567 PolarHBondContact O-N 2.79Å
564	Q	97.9	Very high	96	Very high	80 Å²	80	57.5 Å²	57.5	37%	0.374	28%	0.278	S	S	.	.	H	α-helix	trans	-59.2	-39.4	176.5	-72.4	173.2	8.3	0	0	111.8	E560 L561 I562 D567 I568	E560-Q564 VanDerWaalsContact O-CG 3.3Å; E560-Q564 WeakPolarHBondContact O-CG 3.39Å; E560-Q564 PolarHBondContact O-N 3.2Å; L561-Q564 PolarHBondContact O-N 3.29Å; I562-Q564 PolarHBondContact O-N 3.09Å; Q564-D567 PolarHBondContact O-N 3.41Å; Q564-I568 VanDerWaalsContact O-CG1 3.29Å; Q564-I568 WeakPolarHBondContact O-CG1 3.4Å; Q564-I568 PolarHBondContact O-N 2.94Å
565	Q	98.3	Very high	96	Very high	18 Å²	18	63.9 Å²	63.9	8%	0.084	30%	0.304	C	S	.	.	H	α-helix	trans	-68.1	-38.2	176	-61.4	-39.2	-55.4	0	0	112.4	L527 H528 Y531 L561 I562 K563 D567 I568 Y569	L527-Q565 HydrophobicContact CB-CG 3.76Å; H528-Q565 HydrophobicContact CB-CB 3.97Å; Y531-Q565 HydrophobicContact CD2-CG 4.3Å; Y531-Q565 HydrophobicContact CE2-CG 4.32Å; L561-Q565 WeakPolarHBondContact O-CG 3.4Å; L561-Q565 PolarHBondContact O-N 2.91Å; I562-Q565 PolarHBondContact O-N 3.28Å; I562-Q565 VanDerWaalsContact O-N 3.14Å; K563-Q565 VanDerWaalsContact C-N 3.28Å; K563-Q565 PolarHBondContact O-N 3.28Å; Q565-D567 VanDerWaalsContact C-N 3.34Å; Q565-D567 PolarHBondContact O-N 2.94Å; Q565-I568 PolarHBondContact O-N 3.34Å; Q565-Y569 PolarHBondContact O-N 3.38Å
566	I	97.4	Very high	96.1	Very high	9 Å²	9	60.3 Å²	60.3	5%	0.046	29%	0.288	C	S	.	.	H	α-helix	trans	-59.5	-46.4	172.5	-65	170.6	0	0	0	110.4	H528 I562 K563 I568 Y569 Q570 Y633 I634	H528-I566 VanDerWaalsContact CD2-CG1 3.46Å; H528-I566 WeakPolarHBondContact CD2-CG1 3.42Å; I562-I566 HydrophobicContact CG2-CD1 4.13Å; I562-I566 WeakPolarHBondContact O-CG1 3.08Å; I562-I566 PolarHBondContact O-N 3.05Å; K563-I566 WeakPolarHBondContact O-CB 3.34Å; K563-I566 PolarHBondContact O-N 2.86Å; K563-I566 VanDerWaalsContact O-N 3.16Å; I566-I568 VanDerWaalsContact C-N 3.31Å; I566-I568 PolarHBondContact O-N 2.99Å; I566-Y569 PolarHBondContact O-N 3.5Å; I566-Q570 HydrophobicContact CG2-CG 4.42Å; I566-Q570 WeakPolarHBondContact O-CG 3.31Å; I566-Q570 PolarHBondContact O-N 2.91Å; I566-Y633 HydrophobicContact CD1-CD1 4.31Å; I566-Y633 HydrophobicContact CD1-CE1 4.06Å; I566-I634 HydrophobicContact CD1-CD1 4.46Å; I566-I634 HydrophobicContact CD1-CG1 4.36Å; I566-I634 HydrophobicContact CG1-CD1 4.12Å; I566-I634 HydrophobicContact CG1-CG1 4.27Å; I566-I634 HydrophobicContact CG2-CG1 4.37Å
567	D	96.9	Very high	96	Very high	70 Å²	70	58.8 Å²	58.8	37%	0.374	28%	0.275	S	S	.	.	H	α-helix	trans	-62.3	-37.1	178.9	-68.6	-17.8	0	0	0	111.8	K563 Q564 Q565 R571	K563-D567 PolarHBondContact O-N 2.79Å; Q564-D567 PolarHBondContact O-N 3.41Å; Q565-D567 VanDerWaalsContact C-N 3.34Å; Q565-D567 PolarHBondContact O-N 2.94Å; D567-R571 WeakPolarHBondContact O-CG 3.49Å; D567-R571 PolarHBondContact O-N 3.1Å
568	I	97.1	Very high	95.9	Very high	57 Å²	57	61.5 Å²	61.5	29%	0.292	28%	0.282	S	S	.	.	H	α-helix	trans	-68	-46.5	175.5	-67	164.3	0	0	0	110.6	A524 Q564 Q565 I566 Q570 R571	A524-I568 HydrophobicContact CB-CB 3.96Å; A524-I568 HydrophobicContact CB-CG2 3.72Å; Q564-I568 VanDerWaalsContact O-CG1 3.29Å; Q564-I568 WeakPolarHBondContact O-CG1 3.4Å; Q564-I568 PolarHBondContact O-N 2.94Å; Q565-I568 PolarHBondContact O-N 3.34Å; I566-I568 VanDerWaalsContact C-N 3.31Å; I566-I568 PolarHBondContact O-N 2.99Å; I568-Q570 VanDerWaalsContact C-N 3.3Å; I568-Q570 PolarHBondContact O-N 3.11Å; I568-R571 WeakPolarHBondContact O-CB 3.18Å; I568-R571 PolarHBondContact O-N 2.71Å; I568-R571 VanDerWaalsContact O-N 3.11Å
569	Y	97.2	Very high	95.8	Very high	3 Å²	3	63.7 Å²	63.7	1%	0.012	29%	0.293	C	S	.	.	H	α-helix	trans	-56	-45.5	175.5	156.9	-99	0	0	0	111.5	A521 I525 Q565 I566 R571 S572 W573 Q620 W623 I634 F681	A521-Y569 HydrophobicContact CB-CD2 4.35Å; I525-Y569 HydrophobicContact CD1-CD1 4.45Å; I525-Y569 HydrophobicContact CD1-CD2 3.69Å; I525-Y569 HydrophobicContact CD1-CE2 4.23Å; I525-Y569 HydrophobicContact CD1-CG 3.81Å; I525-Y569 HydrophobicContact CG1-CD2 3.79Å; I525-Y569 HydrophobicContact CG1-CE2 4.42Å; I525-Y569 HydrophobicContact CG1-CG 4.3Å; Q565-Y569 PolarHBondContact O-N 3.38Å; I566-Y569 PolarHBondContact O-N 3.5Å; Y569-R571 PolarHBondContact O-N 3.07Å; Y569-R571 VanDerWaalsContact O-N 3.12Å; Y569-S572 WeakPolarHBondContact O-CB 3.36Å; Y569-S572 PolarHBondContact O-N 3.49Å; Y569-S572 PolarHBondContact O-OG 3.3Å; Y569-W573 AromaticContact CZ-NE1 3.45Å; Y569-W573 PolarHBondContact OH-NE1 2.85Å; Y569-Q620 PolarHBondContact OH-OE1 2.88Å; Y569-Q620 VanDerWaalsContact OH-OE1 3.14Å; Y569-W623 HydrophobicContact CD2-CZ3 4.3Å; Y569-W623 HydrophobicContact CE2-CZ3 4.28Å; Y569-I634 HydrophobicContact CD1-CG2 3.99Å; Y569-I634 HydrophobicContact CE1-CG2 3.41Å; Y569-I634 VanDerWaalsContact CE1-CG2 3.41Å; Y569-F681 AromaticContact CE2-CZ 3.74Å; Y569-F681 HydrophobicContact CE2-CZ 3.74Å; Y569-F681 AromaticContact CZ-CZ 3.72Å; Y569-F681 WeakPolarHBondContact OH-CZ 3.32Å
570	Q	94.8	Very high	95.5	Very high	42 Å²	42	58.4 Å²	58.4	20%	0.196	27%	0.274	C	S	.	.	H	α-helix	trans	-60.4	-24.4	-180	-74.8	-179.1	-12.1	0	0	113.1	I566 I568 S572 W573 S637	I566-Q570 HydrophobicContact CG2-CG 4.42Å; I566-Q570 WeakPolarHBondContact O-CG 3.31Å; I566-Q570 PolarHBondContact O-N 2.91Å; I568-Q570 VanDerWaalsContact C-N 3.3Å; I568-Q570 PolarHBondContact O-N 3.11Å; Q570-S572 PolarHBondContact O-N 3.28Å; Q570-W573 WeakPolarHBondContact O-CB 3.48Å; Q570-W573 PolarHBondContact O-N 3.23Å; Q570-W573 VanDerWaalsContact O-N 3.15Å; Q570-S637 PolarHBondContact NE2-OG 3.37Å; Q570-S637 VanDerWaalsContact NE2-OG 3.15Å
571	R	95.1	Very high	95.1	Very high	163 Å²	163	55 Å²	55	62%	0.615	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-64.6	-24.2	175.5	-66.5	171.7	-172.4	-178.4	1.6	113.1	D567 I568 Y569 W573 L574	D567-R571 WeakPolarHBondContact O-CG 3.49Å; D567-R571 PolarHBondContact O-N 3.1Å; I568-R571 WeakPolarHBondContact O-CB 3.18Å; I568-R571 PolarHBondContact O-N 2.71Å; I568-R571 VanDerWaalsContact O-N 3.11Å; Y569-R571 PolarHBondContact O-N 3.07Å; Y569-R571 VanDerWaalsContact O-N 3.12Å; R571-W573 PolarHBondContact O-N 3.07Å; R571-L574 HydrophobicContact CB-CD1 3.99Å; R571-L574 HydrophobicContact CG-CD1 4.02Å; R571-L574 VanDerWaalsContact O-CB 3.31Å; R571-L574 WeakPolarHBondContact O-CB 3.33Å; R571-L574 WeakPolarHBondContact O-CG 3.47Å; R571-L574 PolarHBondContact O-N 3.32Å
572	S	94.9	Very high	94.4	Very high	32 Å²	32	57.6 Å²	57.6	22%	0.224	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-58.5	-29.7	174.3	63	0	0	0	0	112.6	Y569 Q570 L574 Q620	Y569-S572 WeakPolarHBondContact O-CB 3.36Å; Y569-S572 PolarHBondContact O-N 3.49Å; Y569-S572 PolarHBondContact O-OG 3.3Å; Q570-S572 PolarHBondContact O-N 3.28Å; S572-L574 VanDerWaalsContact C-N 3.34Å; S572-Q620 PolarHBondContact OG-NE2 3.45Å
573	W	95.4	Very high	93.7	Very high	0 Å²	0	63 Å²	63	0%	0	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-80	-13.6	179.7	-66.6	85.2	0	0	0	113.6	Y569 Q570 R571 K575 V576 L577 L613 L616 Q638 V642 I677 L680	Y569-W573 AromaticContact CZ-NE1 3.45Å; Y569-W573 PolarHBondContact OH-NE1 2.85Å; Q570-W573 WeakPolarHBondContact O-CB 3.48Å; Q570-W573 PolarHBondContact O-N 3.23Å; Q570-W573 VanDerWaalsContact O-N 3.15Å; R571-W573 PolarHBondContact O-N 3.07Å; W573-K575 VanDerWaalsContact C-N 3.27Å; W573-K575 PolarHBondContact O-N 3.28Å; W573-V576 PolarHBondContact O-N 3.38Å; W573-V576 VanDerWaalsContact O-N 3.14Å; W573-L577 HydrophobicContact CB-CD1 4.26Å; W573-L577 WeakPolarHBondContact O-CB 3.34Å; W573-L577 VanDerWaalsContact O-CG 3.28Å; W573-L577 WeakPolarHBondContact O-CG 3.44Å; W573-L577 PolarHBondContact O-N 3.48Å; W573-L613 HydrophobicContact CH2-CD1 4.46Å; W573-L613 HydrophobicContact CZ3-CD1 3.87Å; W573-L616 HydrophobicContact CD2-CD1 3.77Å; W573-L616 HydrophobicContact CD2-CD2 4.08Å; W573-L616 HydrophobicContact CE3-CD1 3.97Å; W573-L616 HydrophobicContact CE3-CD2 4.24Å; W573-L616 HydrophobicContact CG-CD1 4.11Å; W573-L616 HydrophobicContact CH2-CD2 3.49Å; W573-L616 VanDerWaalsContact CH2-CD2 3.49Å; W573-L616 HydrophobicContact CZ2-CD2 3.29Å; W573-L616 HydrophobicContact CZ3-CD1 4.42Å; W573-L616 HydrophobicContact CZ3-CD2 3.97Å; W573-Q638 VanDerWaalsContact CB-NE2 3.32Å; W573-Q638 VanDerWaalsContact CD2-CD 3.41Å; W573-Q638 HydrophobicContact CD2-CG 3.65Å; W573-Q638 HydrophobicContact CE3-CG 4.17Å; W573-Q638 HydrophobicContact CG-CG 4.08Å; W573-Q638 HydrophobicContact CH2-CG 4.13Å; W573-Q638 HydrophobicContact CZ2-CG 3.59Å; W573-Q638 HydrophobicContact CZ3-CG 4.38Å; W573-V642 HydrophobicContact CD2-CG2 4.39Å; W573-V642 HydrophobicContact CE3-CG2 3.62Å; W573-V642 HydrophobicContact CZ3-CG2 3.91Å; W573-I677 HydrophobicContact CH2-CD1 4.27Å; W573-I677 HydrophobicContact CH2-CG1 3.79Å; W573-I677 HydrophobicContact CZ3-CD1 4.29Å; W573-I677 HydrophobicContact CZ3-CG1 4.24Å; W573-L680 HydrophobicContact CH2-CD1 3.85Å; W573-L680 HydrophobicContact CZ2-CD1 3.57Å
574	L	93.4	Very high	92.9	Very high	103 Å²	103	63.5 Å²	63.5	54%	0.539	31%	0.308	S	S	.	.	H	α-helix	trans	-61.1	-35.9	-178.5	-69.5	173.2	0	0	0	112.4	R571 S572 V576 L577 E578	R571-L574 HydrophobicContact CB-CD1 3.99Å; R571-L574 HydrophobicContact CG-CD1 4.02Å; R571-L574 VanDerWaalsContact O-CB 3.31Å; R571-L574 WeakPolarHBondContact O-CB 3.33Å; R571-L574 WeakPolarHBondContact O-CG 3.47Å; R571-L574 PolarHBondContact O-N 3.32Å; S572-L574 VanDerWaalsContact C-N 3.34Å; L574-V576 VanDerWaalsContact C-N 3.33Å; L574-V576 PolarHBondContact O-N 3Å; L574-L577 PolarHBondContact O-N 3.41Å; L574-E578 WeakPolarHBondContact O-CB 3.28Å; L574-E578 PolarHBondContact O-N 3.03Å
575	K	90.8	Very high	92.2	Very high	141 Å²	141	61 Å²	61	61%	0.613	30%	0.296	S	S	*	.	H	α-helix	trans	-61.6	-42.2	177	-171.7	-176.1	177.2	-165.9	0	111.3	W573 H579	W573-K575 VanDerWaalsContact C-N 3.27Å; W573-K575 PolarHBondContact O-N 3.28Å; K575-H579 PolarHBondContact O-CD2 3.4Å; K575-H579 VanDerWaalsContact O-CD2 3.26Å
576	V	93.6	Very high	91.3	Very high	4 Å²	4	60.9 Å²	60.9	2%	0.024	30%	0.297	C	S	.	.	H	α-helix	trans	-70.3	-44.8	176.9	179.9	0	0	0	0	110.6	W573 L574 E578 H579 F609 L613 L616	W573-V576 PolarHBondContact O-N 3.38Å; W573-V576 VanDerWaalsContact O-N 3.14Å; L574-V576 VanDerWaalsContact C-N 3.33Å; L574-V576 PolarHBondContact O-N 3Å; V576-E578 VanDerWaalsContact C-N 3.33Å; V576-E578 PolarHBondContact O-N 2.94Å; V576-H579 PolarHBondContact O-N 3.09Å; V576-F609 HydrophobicContact CG1-CD2 3.48Å; V576-F609 VanDerWaalsContact CG1-CD2 3.48Å; V576-F609 HydrophobicContact CG1-CE2 3.56Å; V576-L613 HydrophobicContact CG1-CB 4.31Å; V576-L616 HydrophobicContact CG2-CB 4.48Å; V576-L616 HydrophobicContact CG2-CD1 3.93Å
577	L	93.9	Very high	90.3	Very high	29 Å²	29	67.7 Å²	67.7	15%	0.152	33%	0.332	C	S	.	.	H	α-helix	trans	-67	-30	-179.6	-68.4	171.4	0	0	0	113	W573 L574 H579 L580 T581 I641 V642 A645	W573-L577 HydrophobicContact CB-CD1 4.26Å; W573-L577 WeakPolarHBondContact O-CB 3.34Å; W573-L577 VanDerWaalsContact O-CG 3.28Å; W573-L577 WeakPolarHBondContact O-CG 3.44Å; W573-L577 PolarHBondContact O-N 3.48Å; L574-L577 PolarHBondContact O-N 3.41Å; L577-H579 PolarHBondContact O-N 3.35Å; L577-L580 HydrophobicContact CD2-CD1 4.27Å; L577-L580 WeakPolarHBondContact O-CB 3.42Å; L577-L580 PolarHBondContact O-N 3.28Å; L577-T581 PolarHBondContact O-N 3.36Å; L577-I641 HydrophobicContact CD1-CG2 3.85Å; L577-V642 HydrophobicContact CD2-CG2 4.14Å; L577-A645 HydrophobicContact CD2-CB 3.97Å
578	E	93.4	Very high	89.2	Confident	101 Å²	101	68 Å²	68	47%	0.472	33%	0.33	S	S	.	.	H	α-helix	trans	-60.5	-34.1	179.3	-177.7	160.1	-138.4	0	0	112.1	L574 V576 L580 T581 K583	L574-E578 WeakPolarHBondContact O-CB 3.28Å; L574-E578 PolarHBondContact O-N 3.03Å; V576-E578 VanDerWaalsContact C-N 3.33Å; V576-E578 PolarHBondContact O-N 2.94Å; E578-L580 PolarHBondContact O-N 3.4Å; E578-T581 PolarHBondContact O-N 2.91Å; E578-T581 PolarHBondContact O-OG1 3.24Å; E578-K583 IonicContact OE1-NZ 3.8Å; E578-K583 PolarHBondContact OE1-NZ 3.05Å
579	H	92.7	Very high	87.9	Confident	63 Å²	63	72 Å²	72	29%	0.292	35%	0.347	S	S	.	.	H	α-helix	trans	-62.5	-28.1	174.6	-68.5	-64.7	0	0	0	112.9	K575 V576 L577 K605 G608 F609	K575-H579 PolarHBondContact O-CD2 3.4Å; K575-H579 VanDerWaalsContact O-CD2 3.26Å; V576-H579 PolarHBondContact O-N 3.09Å; L577-H579 PolarHBondContact O-N 3.35Å; H579-K605 WeakPolarHBondContact O-CB 3.2Å; H579-K605 WeakPolarHBondContact O-CD 3.46Å; H579-K605 WeakPolarHBondContact O-CG 3.5Å; H579-K605 PolarHBondContact O-NZ 2.89Å; H579-G608 VanDerWaalsContact CD2-C 3.46Å; H579-F609 HydrophobicContact CB-CB 4.11Å
580	L	91.7	Very high	86.2	Confident	10 Å²	10	78.4 Å²	78.4	5%	0.052	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-6.7	179.3	-56.2	-178.6	0	0	0	114.1	L577 E578 F609 A645 Y646 F649	L577-L580 HydrophobicContact CD2-CD1 4.27Å; L577-L580 WeakPolarHBondContact O-CB 3.42Å; L577-L580 PolarHBondContact O-N 3.28Å; E578-L580 PolarHBondContact O-N 3.4Å; L580-F609 HydrophobicContact CD1-CD2 3.74Å; L580-F609 HydrophobicContact CD1-CE2 3.57Å; L580-F609 HydrophobicContact CD1-CZ 4.35Å; L580-F609 HydrophobicContact CD2-CB 4.08Å; L580-F609 HydrophobicContact CD2-CD1 4.37Å; L580-F609 HydrophobicContact CD2-CD2 3.61Å; L580-F609 HydrophobicContact CD2-CE2 4.13Å; L580-F609 HydrophobicContact CD2-CG 3.74Å; L580-F609 HydrophobicContact CG-CD2 3.66Å; L580-F609 HydrophobicContact CG-CE2 4.05Å; L580-F609 HydrophobicContact CG-CG 4.3Å; L580-A645 HydrophobicContact CD1-CB 3.88Å; L580-Y646 HydrophobicContact CD1-CD2 4.33Å; L580-Y646 HydrophobicContact CD2-CD2 3.78Å; L580-Y646 HydrophobicContact CD2-CE2 4.43Å; L580-F649 HydrophobicContact CB-CB 4.32Å; L580-F649 HydrophobicContact CB-CG 4.47Å; L580-F649 HydrophobicContact CD2-CB 4.06Å; L580-F649 HydrophobicContact CD2-CD1 3.79Å; L580-F649 HydrophobicContact CD2-CE1 4.43Å; L580-F649 HydrophobicContact CD2-CG 3.91Å; L580-F649 WeakPolarHBondContact O-CD2 3.49Å
581	T	90	Very high	84.7	Confident	48 Å²	48	80.6 Å²	80.6	29%	0.294	42%	0.423	S	S	.	.	S	Bend	trans	-76.9	163.1	-179.6	67.1	0	0	0	0	112.9	L577 E578 K583 K605	L577-T581 PolarHBondContact O-N 3.36Å; E578-T581 PolarHBondContact O-N 2.91Å; E578-T581 PolarHBondContact O-OG1 3.24Å; T581-K583 PolarHBondContact O-N 3.39Å; T581-K605 PolarHBondContact O-NZ 3.41Å
582	D	82.7	Confident	83.5	Confident	93 Å²	93	75.8 Å²	75.8	50%	0.497	42%	0.419	S	S	.	.	S	Bend	trans	-72.5	-7.6	176.7	-61.3	23	0	0	0	112.5	N584 M585 R652	D582-N584 PolarHBondContact O-N 3.27Å; D582-M585 WeakPolarHBondContact O-CB 3.35Å; D582-M585 PolarHBondContact O-N 3.2Å; D582-R652 VanDerWaalsContact CG-NH1 3.28Å; D582-R652 IonicContact OD1-CZ 3.98Å; D582-R652 IonicContact OD1-NH1 3.97Å; D582-R652 PolarHBondContact OD1-NH1 2.7Å; D582-R652 IonicContact OD1-NH2 2.68Å; D582-R652 PolarHBondContact OD1-NH2 3.31Å; D582-R652 VanDerWaalsContact OD1-NH2 3.1Å; D582-R652 IonicContact OD2-CZ 2.65Å; D582-R652 IonicContact OD2-NH1 3.69Å; D582-R652 IonicContact OD2-NH2 3.03Å; D582-R652 PolarHBondContact OD2-NH2 2.88Å
583	K	82.6	Confident	82.4	Confident	123 Å²	123	83.8 Å²	83.8	54%	0.535	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	127	177.5	-66.3	-174.4	-172.9	175.2	0	109.9	E578 T581 M585 K605	E578-K583 IonicContact OE1-NZ 3.8Å; E578-K583 PolarHBondContact OE1-NZ 3.05Å; T581-K583 PolarHBondContact O-N 3.39Å; K583-M585 PolarHBondContact O-N 3.11Å; K583-K605 WeakPolarHBondContact O-CE 3.4Å; K583-K605 PolarHBondContact O-NZ 3.35Å
584	N	80.7	Confident	81.7	Confident	145 Å²	145	85 Å²	85	78%	0.775	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	11.2	-177.5	-53.4	-36.5	0	0	0	115.1	D582 V601	D582-N584 PolarHBondContact O-N 3.27Å; N584-V601 VanDerWaalsContact O-CG1 3.32Å; N584-V601 WeakPolarHBondContact O-CG1 3.41Å
585	M	82.9	Confident	81.2	Confident	27 Å²	27	87.1 Å²	87.1	13%	0.133	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-72.2	139.6	174.1	-77.1	-66.6	-80.8	0	0	111.4	D582 K583 F588 I602 K605 F649	D582-M585 WeakPolarHBondContact O-CB 3.35Å; D582-M585 PolarHBondContact O-N 3.2Å; K583-M585 PolarHBondContact O-N 3.11Å; M585-F588 HydrophobicContact CE-CE2 4Å; M585-F588 HydrophobicContact CE-CZ 3.62Å; M585-I602 HydrophobicContact CE-CG1 4.35Å; M585-I602 HydrophobicContact SD-CG1 4.38Å; M585-K605 HydrophobicContact CG-CD 4.16Å; M585-K605 HydrophobicContact SD-CD 3.5Å; M585-K605 WeakPolarHBondContact SD-CD 3.35Å; M585-F649 HydrophobicContact CE-CE2 3.94Å; M585-F649 HydrophobicContact SD-CE2 3.96Å; M585-F649 HydrophobicContact SD-CZ 4.48Å
586	P	79.4	Confident	80.8	Confident	15 Å²	15	86.1 Å²	86.1	10%	0.097	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-67.1	144.2	174.3	26.9	-31.9	0	0	0	110.9	F588 L594 E598 I602	P586-F588 HydrophobicContact CB-CE1 4.41Å; P586-F588 HydrophobicContact CG-CE1 3.65Å; P586-F588 HydrophobicContact CG-CZ 4.04Å; P586-F588 PolarHBondContact O-N 2.63Å; P586-L594 HydrophobicContact CB-CD2 4.24Å; P586-L594 HydrophobicContact CG-CD2 4.15Å; P586-E598 HydrophobicContact CB-CB 3.83Å; P586-E598 HydrophobicContact CB-CG 3.86Å; P586-E598 HydrophobicContact CG-CB 4.04Å; P586-I602 HydrophobicContact CG-CD1 4.13Å; P586-I602 HydrophobicContact CG-CG1 4.3Å
587	I	77	Confident	80.4	Confident	153 Å²	153	94.5 Å²	94.5	79%	0.785	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-75.5	118.3	175.5	-59.4	172.4	0	0	0	108.3	Q589	I587-Q589 PolarHBondContact O-N 3.26Å
588	F	74.3	Confident	80.1	Confident	75 Å²	75	96 Å²	96	33%	0.329	50%	0.504	S	S	.	.			trans	-81.5	108.3	-177.5	-55.1	-56.5	0	0	0	110.9	M585 P586 L594 I602 R652 I656	M585-F588 HydrophobicContact CE-CE2 4Å; M585-F588 HydrophobicContact CE-CZ 3.62Å; P586-F588 HydrophobicContact CB-CE1 4.41Å; P586-F588 HydrophobicContact CG-CE1 3.65Å; P586-F588 HydrophobicContact CG-CZ 4.04Å; P586-F588 PolarHBondContact O-N 2.63Å; F588-L594 HydrophobicContact CD1-CD2 4.36Å; F588-L594 HydrophobicContact CE1-CD2 4.28Å; F588-I602 HydrophobicContact CE1-CD1 4.2Å; F588-I602 HydrophobicContact CZ-CD1 4.38Å; F588-R652 HydrophobicContact CD2-CG 4.32Å; F588-R652 HydrophobicContact CE2-CG 3.85Å; F588-I656 HydrophobicContact CD1-CD1 3.4Å; F588-I656 VanDerWaalsContact CD1-CD1 3.4Å; F588-I656 HydrophobicContact CD2-CD1 3.89Å; F588-I656 HydrophobicContact CE1-CD1 3.14Å; F588-I656 HydrophobicContact CE1-CG1 4.47Å; F588-I656 HydrophobicContact CE1-CG2 4.42Å; F588-I656 HydrophobicContact CE2-CD1 3.66Å; F588-I656 HydrophobicContact CG-CD1 3.77Å; F588-I656 HydrophobicContact CZ-CD1 3.26Å
589	Q	69.1	Low	79.8	Confident	141 Å²	141	94.1 Å²	94.1	66%	0.659	49%	0.493	S	S	*	.			trans	-94.2	131.3	170	-68.6	-173.3	-5.7	0	0	110.2	I587 G591 A592	I587-Q589 PolarHBondContact O-N 3.26Å; Q589-G591 PolarHBondContact O-N 2.96Å; Q589-A592 HydrophobicContact CB-CB 4.06Å; Q589-A592 PolarHBondContact O-N 3.48Å
590	P	61.5	Low	79.7	Confident	138 Å²	138	95.2 Å²	95.2	90%	0.896	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	121.9	178.7	-21.5	31.2	0	0	0	111.5
591	G	63.8	Low	79.6	Confident	88 Å²	88	97 Å²	97	91%	0.907	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.4	-7	176.7	0	0	0	0	0	116.5	Q589	Q589-G591 PolarHBondContact O-N 2.96Å
592	A	70	Confident	79.6	Confident	62 Å²	62	94.7 Å²	94.7	51%	0.512	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-82.7	130.5	176.3	0	0	0	0	0	111.6	Q589	Q589-A592 HydrophobicContact CB-CB 4.06Å; Q589-A592 PolarHBondContact O-N 3.48Å
593	K	71.9	Confident	80	Confident	200 Å²	200	92.2 Å²	92.2	87%	0.87	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-73.1	127.9	171.9	-71.7	-177.2	179.7	176.9	0	109.5
594	L	79.5	Confident	80.4	Confident	25 Å²	25	90.2 Å²	90.2	13%	0.131	48%	0.475	C	S	.	.	P	Polyproline II helix	trans	-56.3	144.7	173.5	-72.6	172.9	0	0	0	111.6	P586 F588 E598 R599 I602 I656 F658	P586-L594 HydrophobicContact CB-CD2 4.24Å; P586-L594 HydrophobicContact CG-CD2 4.15Å; F588-L594 HydrophobicContact CD1-CD2 4.36Å; F588-L594 HydrophobicContact CE1-CD2 4.28Å; L594-E598 WeakPolarHBondContact CA-OE2 3.47Å; L594-E598 HydrophobicContact CB-CB 4.44Å; L594-E598 HydrophobicContact CD2-CB 3.92Å; L594-R599 HydrophobicContact CB-CG 3.79Å; L594-R599 HydrophobicContact CD1-CG 4.13Å; L594-R599 PolarHBondContact O-NH1 2.79Å; L594-I602 HydrophobicContact CD1-CD1 3.86Å; L594-I656 HydrophobicContact CD1-CG2 3.23Å; L594-I656 HydrophobicContact CG-CG2 4.27Å; L594-F658 HydrophobicContact CD1-CB 4.27Å
595	K	83.7	Confident	81	Confident	149 Å²	149	84.1 Å²	84.1	65%	0.648	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-75.3	157.3	168.6	-64	175.1	-177.8	171.7	0	110.1	K597 E598 R599	K595-K597 VanDerWaalsContact C-N 3.26Å; K595-K597 PolarHBondContact O-N 3.25Å; K595-E598 HydrophobicContact CB-CG 4.16Å; K595-E598 PolarHBondContact N-OE2 2.88Å; K595-E598 PolarHBondContact O-N 2.97Å; K595-R599 PolarHBondContact O-N 2.83Å
596	D	83.1	Confident	81.4	Confident	119 Å²	119	82.8 Å²	82.8	64%	0.636	44%	0.435	S	S	*	.	H	α-helix	trans	-56.9	-39.3	178.7	-75.8	-53.3	0	0	0	113.1	E598 R599 Q600	D596-E598 PolarHBondContact O-N 2.93Å; D596-R599 PolarHBondContact O-N 3.41Å; D596-R599 IonicContact OD1-CZ 3.37Å; D596-R599 IonicContact OD1-NE 3.31Å; D596-R599 PolarHBondContact OD1-NE 2.98Å; D596-R599 IonicContact OD1-NH2 2.65Å; D596-R599 PolarHBondContact OD1-NH2 3.27Å; D596-R599 IonicContact OD2-NH2 3.54Å; D596-Q600 WeakPolarHBondContact O-CB 3.37Å; D596-Q600 PolarHBondContact O-N 3.24Å
597	K	85.4	Confident	82.1	Confident	181 Å²	181	87.7 Å²	87.7	79%	0.787	46%	0.455	S	S	*	.	H	α-helix	trans	-61.5	-42	175.2	-68.5	-172.6	177.6	-175.7	0	112.3	K595 Q600 V601	K595-K597 VanDerWaalsContact C-N 3.26Å; K595-K597 PolarHBondContact O-N 3.25Å; K597-Q600 WeakPolarHBondContact O-CB 3.36Å; K597-Q600 PolarHBondContact O-N 3.44Å; K597-V601 WeakPolarHBondContact O-CG2 3.43Å; K597-V601 PolarHBondContact O-N 2.88Å; K597-V601 VanDerWaalsContact O-N 3.07Å
598	E	86.6	Confident	82.9	Confident	59 Å²	59	81.1 Å²	81.1	28%	0.276	43%	0.425	S	S	.	.	H	α-helix	trans	-69.6	-39.8	-179.5	-61.7	170.7	156	0	0	111.4	P586 L594 K595 D596 Q600 V601 I602	P586-E598 HydrophobicContact CB-CB 3.83Å; P586-E598 HydrophobicContact CB-CG 3.86Å; P586-E598 HydrophobicContact CG-CB 4.04Å; L594-E598 WeakPolarHBondContact CA-OE2 3.47Å; L594-E598 HydrophobicContact CB-CB 4.44Å; L594-E598 HydrophobicContact CD2-CB 3.92Å; K595-E598 HydrophobicContact CB-CG 4.16Å; K595-E598 PolarHBondContact N-OE2 2.88Å; K595-E598 PolarHBondContact O-N 2.97Å; D596-E598 PolarHBondContact O-N 2.93Å; E598-Q600 VanDerWaalsContact C-N 3.28Å; E598-Q600 PolarHBondContact O-N 2.82Å; E598-V601 PolarHBondContact O-N 3.49Å; E598-I602 PolarHBondContact O-N 3.21Å
599	R	87.6	Confident	83.9	Confident	63 Å²	63	77.6 Å²	77.6	24%	0.238	41%	0.41	C	S	.	.	H	α-helix	trans	-59.6	-40.8	170.6	-70.1	-167	-84.1	-91.3	-2.3	111.8	L594 K595 D596 I602 K603 F658	L594-R599 HydrophobicContact CB-CG 3.79Å; L594-R599 HydrophobicContact CD1-CG 4.13Å; L594-R599 PolarHBondContact O-NH1 2.79Å; K595-R599 PolarHBondContact O-N 2.83Å; D596-R599 PolarHBondContact O-N 3.41Å; D596-R599 IonicContact OD1-CZ 3.37Å; D596-R599 IonicContact OD1-NE 3.31Å; D596-R599 PolarHBondContact OD1-NE 2.98Å; D596-R599 IonicContact OD1-NH2 2.65Å; D596-R599 PolarHBondContact OD1-NH2 3.27Å; D596-R599 IonicContact OD2-NH2 3.54Å; R599-I602 PolarHBondContact O-N 3.45Å; R599-K603 WeakPolarHBondContact O-CG 3.39Å; R599-K603 PolarHBondContact O-N 3.44Å; R599-K603 VanDerWaalsContact O-N 3.13Å; R599-F658 HydrophobicContact CB-CB 4.43Å; R599-F658 WeakPolarHBondContact CD-O 3.31Å; R599-F658 HydrophobicContact CG-CB 4.27Å
600	Q	89.4	Confident	85.2	Confident	86 Å²	86	71.1 Å²	71.1	40%	0.402	38%	0.379	S	S	.	.	H	α-helix	trans	-65.7	-40.5	-180	-169.8	57.9	40.3	0	0	111.7	D596 K597 E598 I602 K603 D604	D596-Q600 WeakPolarHBondContact O-CB 3.37Å; D596-Q600 PolarHBondContact O-N 3.24Å; K597-Q600 WeakPolarHBondContact O-CB 3.36Å; K597-Q600 PolarHBondContact O-N 3.44Å; E598-Q600 VanDerWaalsContact C-N 3.28Å; E598-Q600 PolarHBondContact O-N 2.82Å; Q600-I602 VanDerWaalsContact C-N 3.33Å; Q600-I602 PolarHBondContact O-N 3.23Å; Q600-K603 WeakPolarHBondContact O-CB 3.35Å; Q600-K603 PolarHBondContact O-N 3.03Å; Q600-K603 VanDerWaalsContact O-N 3.16Å; Q600-D604 PolarHBondContact NE2-OD1 3.44Å; Q600-D604 WeakPolarHBondContact O-CB 3.5Å; Q600-D604 PolarHBondContact O-N 3.1Å
601	V	90.3	Very high	86.8	Confident	47 Å²	47	68.4 Å²	68.4	29%	0.285	36%	0.357	S	S	.	.	H	α-helix	trans	-59.9	-42.6	176.2	176.3	0	0	0	0	112.2	N584 K597 E598 K603 D604 K605	N584-V601 VanDerWaalsContact O-CG1 3.32Å; N584-V601 WeakPolarHBondContact O-CG1 3.41Å; K597-V601 WeakPolarHBondContact O-CG2 3.43Å; K597-V601 PolarHBondContact O-N 2.88Å; K597-V601 VanDerWaalsContact O-N 3.07Å; E598-V601 PolarHBondContact O-N 3.49Å; V601-K603 VanDerWaalsContact C-N 3.35Å; V601-K603 PolarHBondContact O-N 3.37Å; V601-D604 PolarHBondContact O-N 2.83Å; V601-K605 HydrophobicContact CG1-CD 4.45Å; V601-K605 PolarHBondContact O-N 2.92Å
602	I	89.1	Confident	88.2	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-62.8	-44.1	176.8	-61.6	169.4	0	0	0	110.3	M585 P586 F588 L594 E598 R599 Q600 D604 K605 F606 I656 F658	M585-I602 HydrophobicContact CE-CG1 4.35Å; M585-I602 HydrophobicContact SD-CG1 4.38Å; P586-I602 HydrophobicContact CG-CD1 4.13Å; P586-I602 HydrophobicContact CG-CG1 4.3Å; F588-I602 HydrophobicContact CE1-CD1 4.2Å; F588-I602 HydrophobicContact CZ-CD1 4.38Å; L594-I602 HydrophobicContact CD1-CD1 3.86Å; E598-I602 PolarHBondContact O-N 3.21Å; R599-I602 PolarHBondContact O-N 3.45Å; Q600-I602 VanDerWaalsContact C-N 3.33Å; Q600-I602 PolarHBondContact O-N 3.23Å; I602-D604 PolarHBondContact O-N 3.03Å; I602-K605 PolarHBondContact O-N 3.42Å; I602-F606 HydrophobicContact CG2-CD2 3.85Å; I602-F606 HydrophobicContact CG2-CE2 3.78Å; I602-F606 WeakPolarHBondContact O-CD2 3.43Å; I602-F606 PolarHBondContact O-N 2.94Å; I602-F606 VanDerWaalsContact O-N 3.07Å; I602-I656 HydrophobicContact CD1-CG2 4.19Å; I602-F658 HydrophobicContact CB-CB 4.36Å; I602-F658 HydrophobicContact CB-CD2 4.27Å; I602-F658 HydrophobicContact CB-CG 4.25Å; I602-F658 HydrophobicContact CD1-CB 4.04Å; I602-F658 HydrophobicContact CG2-CB 4.28Å; I602-F658 HydrophobicContact CG2-CD1 3.86Å; I602-F658 HydrophobicContact CG2-CD2 3.79Å; I602-F658 HydrophobicContact CG2-CE1 4.08Å; I602-F658 HydrophobicContact CG2-CE2 4.01Å; I602-F658 HydrophobicContact CG2-CG 3.71Å; I602-F658 HydrophobicContact CG2-CZ 4.15Å
603	K	91.3	Very high	89.5	Confident	41 Å²	41	61.9 Å²	61.9	18%	0.178	30%	0.297	C	S	.	.	H	α-helix	trans	-60	-44	175.8	-72.1	173.1	178.2	177.6	0	112.4	R599 Q600 V601 K605 F606 K607 F658 Y665	R599-K603 WeakPolarHBondContact O-CG 3.39Å; R599-K603 PolarHBondContact O-N 3.44Å; R599-K603 VanDerWaalsContact O-N 3.13Å; Q600-K603 WeakPolarHBondContact O-CB 3.35Å; Q600-K603 PolarHBondContact O-N 3.03Å; Q600-K603 VanDerWaalsContact O-N 3.16Å; V601-K603 VanDerWaalsContact C-N 3.35Å; V601-K603 PolarHBondContact O-N 3.37Å; K603-K605 VanDerWaalsContact C-N 3.34Å; K603-F606 PolarHBondContact O-N 2.95Å; K603-K607 VanDerWaalsContact O-CB 3.31Å; K603-K607 WeakPolarHBondContact O-CB 3.33Å; K603-K607 PolarHBondContact O-N 3Å; K603-F658 VanDerWaalsContact CE-O 3.25Å; K603-F658 WeakPolarHBondContact CE-O 3.5Å; K603-F658 HydrophobicContact CG-CD2 3.84Å; K603-F658 HydrophobicContact CG-CE2 4.1Å; K603-Y665 HydrophobicContact CB-CD1 4.04Å; K603-Y665 HydrophobicContact CB-CE1 3.39Å; K603-Y665 HydrophobicContact CD-CE1 4.36Å; K603-Y665 HydrophobicContact CD-CE2 4.21Å; K603-Y665 WeakPolarHBondContact CD-OH 3.34Å; K603-Y665 HydrophobicContact CG-CD1 4.19Å; K603-Y665 HydrophobicContact CG-CD2 4.44Å; K603-Y665 HydrophobicContact CG-CE1 3.64Å; K603-Y665 HydrophobicContact CG-CE2 3.92Å; K603-Y665 VanDerWaalsContact CG-CZ 3.47Å; K603-Y665 WeakPolarHBondContact O-CD1 3.47Å; K603-Y665 WeakPolarHBondContact O-CE1 3.44Å
604	D	92.1	Very high	90.6	Very high	81 Å²	81	55.1 Å²	55.1	43%	0.433	27%	0.268	S	S	.	.	H	α-helix	trans	-67.8	-35.1	-179.2	-66.7	-21.4	0	0	0	111.5	Q600 V601 I602 G608	Q600-D604 PolarHBondContact NE2-OD1 3.44Å; Q600-D604 WeakPolarHBondContact O-CB 3.5Å; Q600-D604 PolarHBondContact O-N 3.1Å; V601-D604 PolarHBondContact O-N 2.83Å; I602-D604 PolarHBondContact O-N 3.03Å; D604-G608 PolarHBondContact O-N 3.24Å
605	K	92.1	Very high	91.3	Very high	16 Å²	16	59 Å²	59	7%	0.07	29%	0.286	C	S	.	.	H	α-helix	trans	-65.3	-49.1	172.7	-79.4	179	169.6	-82.4	0	112.7	H579 T581 K583 M585 V601 I602 K603 K607 G608 F609 F649	H579-K605 WeakPolarHBondContact O-CB 3.2Å; H579-K605 WeakPolarHBondContact O-CD 3.46Å; H579-K605 WeakPolarHBondContact O-CG 3.5Å; H579-K605 PolarHBondContact O-NZ 2.89Å; T581-K605 PolarHBondContact O-NZ 3.41Å; K583-K605 WeakPolarHBondContact O-CE 3.4Å; K583-K605 PolarHBondContact O-NZ 3.35Å; M585-K605 HydrophobicContact CG-CD 4.16Å; M585-K605 HydrophobicContact SD-CD 3.5Å; M585-K605 WeakPolarHBondContact SD-CD 3.35Å; V601-K605 HydrophobicContact CG1-CD 4.45Å; V601-K605 PolarHBondContact O-N 2.92Å; I602-K605 PolarHBondContact O-N 3.42Å; K603-K605 VanDerWaalsContact C-N 3.34Å; K605-K607 VanDerWaalsContact C-N 3.33Å; K605-K607 PolarHBondContact O-N 2.82Å; K605-G608 PolarHBondContact O-N 3.12Å; K605-F609 WeakPolarHBondContact O-CB 3.35Å; K605-F609 PolarHBondContact O-N 2.84Å; K605-F649 HydrophobicContact CB-CZ 3.84Å; K605-F649 HydrophobicContact CD-CE2 4.04Å; K605-F649 HydrophobicContact CD-CZ 4.13Å
606	F	92.8	Very high	91.8	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60.4	-44.4	175.3	-85.7	-69.7	0	0	0	111.7	I602 K603 F609 N610 Y646 F649 L650 C653 F658 Y665 H666	I602-F606 HydrophobicContact CG2-CD2 3.85Å; I602-F606 HydrophobicContact CG2-CE2 3.78Å; I602-F606 WeakPolarHBondContact O-CD2 3.43Å; I602-F606 PolarHBondContact O-N 2.94Å; I602-F606 VanDerWaalsContact O-N 3.07Å; K603-F606 PolarHBondContact O-N 2.95Å; F606-F609 PolarHBondContact O-N 2.93Å; F606-N610 WeakPolarHBondContact O-CB 3.35Å; F606-N610 PolarHBondContact O-N 2.69Å; F606-N610 PolarHBondContact O-ND2 3.31Å; F606-Y646 HydrophobicContact CE1-CE2 4.45Å; F606-F649 HydrophobicContact CD1-CE1 4.03Å; F606-F649 AromaticContact CD2-CE1 4Å; F606-F649 HydrophobicContact CD2-CE1 4Å; F606-F649 AromaticContact CE1-CD1 4Å; F606-F649 HydrophobicContact CE1-CD1 4Å; F606-F649 AromaticContact CE1-CE1 3.72Å; F606-F649 HydrophobicContact CE1-CE1 3.72Å; F606-F649 AromaticContact CE2-CE1 3.68Å; F606-F649 HydrophobicContact CE2-CE1 3.68Å; F606-F649 HydrophobicContact CE2-CZ 4.32Å; F606-F649 HydrophobicContact CG-CE1 4.15Å; F606-F649 AromaticContact CZ-CD1 3.97Å; F606-F649 HydrophobicContact CZ-CD1 3.97Å; F606-F649 AromaticContact CZ-CE1 3.53Å; F606-F649 HydrophobicContact CZ-CE1 3.53Å; F606-L650 HydrophobicContact CE1-CD2 3.75Å; F606-L650 HydrophobicContact CZ-CD2 4.04Å; F606-C653 HydrophobicContact CE2-CB 4.06Å; F606-C653 HydrophobicContact CZ-CB 4.06Å; F606-F658 HydrophobicContact CD2-CE2 4.2Å; F606-F658 AromaticContact CD2-CZ 3.86Å; F606-F658 HydrophobicContact CD2-CZ 3.86Å; F606-F658 HydrophobicContact CE2-CE1 4.04Å; F606-F658 HydrophobicContact CE2-CE2 4.45Å; F606-F658 AromaticContact CE2-CZ 3.71Å; F606-F658 HydrophobicContact CE2-CZ 3.71Å; F606-Y665 HydrophobicContact CB-CD1 3.95Å; F606-Y665 HydrophobicContact CB-CG 4.42Å; F606-Y665 WeakPolarHBondContact CD1-O 3.27Å; F606-H666 AromaticContact CZ-NE2 3.97Å
607	K	93.2	Very high	92.3	Very high	117 Å²	117	47.6 Å²	47.6	51%	0.509	23%	0.233	S	C	.	.	H	α-helix	trans	-62.3	-48.5	177.4	-172.2	-174.3	175.7	-161.4	0	111.3	K603 K605 F609 N610 D611	K603-K607 VanDerWaalsContact O-CB 3.31Å; K603-K607 WeakPolarHBondContact O-CB 3.33Å; K603-K607 PolarHBondContact O-N 3Å; K605-K607 VanDerWaalsContact C-N 3.33Å; K605-K607 PolarHBondContact O-N 2.82Å; K607-F609 VanDerWaalsContact C-N 3.33Å; K607-F609 PolarHBondContact O-N 3.44Å; K607-N610 PolarHBondContact O-N 2.94Å; K607-D611 VanDerWaalsContact CE-OD2 3.22Å; K607-D611 WeakPolarHBondContact CE-OD2 3.42Å; K607-D611 WeakPolarHBondContact CG-OD2 3.49Å; K607-D611 WeakPolarHBondContact O-CB 3.48Å; K607-D611 VanDerWaalsContact O-CG 3.25Å; K607-D611 PolarHBondContact O-N 2.85Å
608	G	94.3	Very high	92.7	Very high	16 Å²	16	47.4 Å²	47.4	17%	0.165	23%	0.232	C	C	.	.	H	α-helix	trans	-61.5	-39.1	179	0	0	0	0	0	113.1	H579 D604 K605 G612	H579-G608 VanDerWaalsContact CD2-C 3.46Å; D604-G608 PolarHBondContact O-N 3.24Å; K605-G608 PolarHBondContact O-N 3.12Å; G608-G612 PolarHBondContact O-N 2.91Å
609	F	95.9	Very high	93	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-64	-50.6	172.5	174.6	-101	0	0	0	112	V576 H579 L580 K605 F606 K607 G612 L613 V642 Y646 V673	V576-F609 HydrophobicContact CG1-CD2 3.48Å; V576-F609 VanDerWaalsContact CG1-CD2 3.48Å; V576-F609 HydrophobicContact CG1-CE2 3.56Å; H579-F609 HydrophobicContact CB-CB 4.11Å; L580-F609 HydrophobicContact CD1-CD2 3.74Å; L580-F609 HydrophobicContact CD1-CE2 3.57Å; L580-F609 HydrophobicContact CD1-CZ 4.35Å; L580-F609 HydrophobicContact CD2-CB 4.08Å; L580-F609 HydrophobicContact CD2-CD1 4.37Å; L580-F609 HydrophobicContact CD2-CD2 3.61Å; L580-F609 HydrophobicContact CD2-CE2 4.13Å; L580-F609 HydrophobicContact CD2-CG 3.74Å; L580-F609 HydrophobicContact CG-CD2 3.66Å; L580-F609 HydrophobicContact CG-CE2 4.05Å; L580-F609 HydrophobicContact CG-CG 4.3Å; K605-F609 WeakPolarHBondContact O-CB 3.35Å; K605-F609 PolarHBondContact O-N 2.84Å; F606-F609 PolarHBondContact O-N 2.93Å; K607-F609 VanDerWaalsContact C-N 3.33Å; K607-F609 PolarHBondContact O-N 3.44Å; F609-G612 PolarHBondContact O-N 3.45Å; F609-L613 HydrophobicContact CE1-CD2 4.07Å; F609-L613 HydrophobicContact CZ-CD2 4Å; F609-L613 VanDerWaalsContact O-CB 3.23Å; F609-L613 WeakPolarHBondContact O-CB 3.42Å; F609-L613 PolarHBondContact O-N 3.12Å; F609-V642 HydrophobicContact CE2-CG1 4.29Å; F609-V642 HydrophobicContact CZ-CG1 4.36Å; F609-Y646 AromaticContact CD1-CD2 3.91Å; F609-Y646 HydrophobicContact CD1-CD2 3.91Å; F609-Y646 AromaticContact CD1-CE2 3.58Å; F609-Y646 HydrophobicContact CD1-CE2 3.58Å; F609-Y646 HydrophobicContact CE1-CD1 4.5Å; F609-Y646 AromaticContact CE1-CD2 3.44Å; F609-Y646 HydrophobicContact CE1-CD2 3.44Å; F609-Y646 VanDerWaalsContact CE1-CD2 3.44Å; F609-Y646 HydrophobicContact CE1-CE1 4.39Å; F609-Y646 AromaticContact CE1-CE2 3.31Å; F609-Y646 HydrophobicContact CE1-CE2 3.31Å; F609-Y646 HydrophobicContact CE1-CG 4.06Å; F609-Y646 AromaticContact CE1-CZ 3.83Å; F609-Y646 HydrophobicContact CE2-CD2 4.33Å; F609-Y646 HydrophobicContact CG-CE2 4.48Å; F609-Y646 AromaticContact CZ-CD2 3.67Å; F609-Y646 HydrophobicContact CZ-CD2 3.67Å; F609-Y646 HydrophobicContact CZ-CE2 4.05Å; F609-Y646 AromaticContact CZ-CG 3.99Å; F609-Y646 HydrophobicContact CZ-CG 3.99Å; F609-V673 HydrophobicContact CE1-CG2 4.39Å; F609-V673 HydrophobicContact CZ-CG1 4.36Å; F609-V673 HydrophobicContact CZ-CG2 4.42Å
610	N	94.7	Very high	93.3	Very high	5 Å²	5	45.6 Å²	45.6	3%	0.027	23%	0.228	C	C	.	.	H	α-helix	trans	-62.7	-49.1	-177.8	-65.5	-21.6	0	0	0	111.5	F606 K607 G612 L613 E614 Y665 Y668	F606-N610 WeakPolarHBondContact O-CB 3.35Å; F606-N610 PolarHBondContact O-N 2.69Å; F606-N610 PolarHBondContact O-ND2 3.31Å; K607-N610 PolarHBondContact O-N 2.94Å; N610-G612 VanDerWaalsContact C-N 3.35Å; N610-G612 PolarHBondContact O-N 2.85Å; N610-L613 PolarHBondContact O-N 3.09Å; N610-E614 WeakPolarHBondContact O-CB 3.44Å; N610-E614 WeakPolarHBondContact O-CG 3.43Å; N610-E614 PolarHBondContact O-N 3.48Å; N610-Y665 PolarHBondContact ND2-O 3.22Å; N610-Y665 VanDerWaalsContact ND2-O 3.14Å; N610-Y668 HydrophobicContact CB-CE2 4.32Å
611	D	94.9	Very high	93.4	Very high	81 Å²	81	46.8 Å²	46.8	43%	0.433	23%	0.232	S	C	.	.	H	α-helix	trans	-62.6	-43.8	179.5	-66.6	-7.8	0	0	0	110.3	K607 E615	K607-D611 VanDerWaalsContact CE-OD2 3.22Å; K607-D611 WeakPolarHBondContact CE-OD2 3.42Å; K607-D611 WeakPolarHBondContact CG-OD2 3.49Å; K607-D611 WeakPolarHBondContact O-CB 3.48Å; K607-D611 VanDerWaalsContact O-CG 3.25Å; K607-D611 PolarHBondContact O-N 2.85Å; D611-E615 WeakPolarHBondContact O-CB 3.31Å; D611-E615 PolarHBondContact O-N 3.01Å
612	G	95.2	Very high	93.4	Very high	14 Å²	14	47 Å²	47	14%	0.144	24%	0.243	C	C	.	.	H	α-helix	trans	-68	-39.4	179.1	0	0	0	0	0	113.7	G608 F609 N610 L616	G608-G612 PolarHBondContact O-N 2.91Å; F609-G612 PolarHBondContact O-N 3.45Å; N610-G612 VanDerWaalsContact C-N 3.35Å; N610-G612 PolarHBondContact O-N 2.85Å; G612-L616 WeakPolarHBondContact O-CB 3.34Å; G612-L616 PolarHBondContact O-N 2.85Å
613	L	95.4	Very high	93.7	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64.1	-46.1	175.3	178.9	67.6	0	0	0	110.9	W573 V576 F609 N610 L616 C617 Y668 V673 M676	W573-L613 HydrophobicContact CH2-CD1 4.46Å; W573-L613 HydrophobicContact CZ3-CD1 3.87Å; V576-L613 HydrophobicContact CG1-CB 4.31Å; F609-L613 HydrophobicContact CE1-CD2 4.07Å; F609-L613 HydrophobicContact CZ-CD2 4Å; F609-L613 VanDerWaalsContact O-CB 3.23Å; F609-L613 WeakPolarHBondContact O-CB 3.42Å; F609-L613 PolarHBondContact O-N 3.12Å; N610-L613 PolarHBondContact O-N 3.09Å; L613-L616 PolarHBondContact O-N 3.23Å; L613-C617 VanDerWaalsContact O-CB 3.31Å; L613-C617 WeakPolarHBondContact O-CB 3.4Å; L613-C617 PolarHBondContact O-N 3.27Å; L613-C617 PolarHBondContact O-SG 2.91Å; L613-C617 VanDerWaalsContact O-SG 3.39Å; L613-Y668 HydrophobicContact CD2-CD2 4.42Å; L613-V673 HydrophobicContact CD1-CG1 4.49Å; L613-V673 HydrophobicContact CD2-CB 4.46Å; L613-V673 HydrophobicContact CD2-CG1 4Å; L613-V673 HydrophobicContact CD2-CG2 3.96Å; L613-M676 HydrophobicContact CD2-CE 4.18Å; L613-M676 HydrophobicContact CD2-SD 4.08Å; L613-M676 HydrophobicContact CG-CE 4.07Å
614	E	95	Very high	93.9	Very high	58 Å²	58	46.4 Å²	46.4	27%	0.271	24%	0.243	S	C	.	.	H	α-helix	trans	-63.4	-44.9	178.7	-76.1	166.3	-142.1	0	0	112.3	N610 K618 K667 Y668	N610-E614 WeakPolarHBondContact O-CB 3.44Å; N610-E614 WeakPolarHBondContact O-CG 3.43Å; N610-E614 PolarHBondContact O-N 3.48Å; E614-K618 WeakPolarHBondContact O-CB 3.34Å; E614-K618 PolarHBondContact O-N 3.32Å; E614-K667 WeakPolarHBondContact OE1-CD 3.36Å; E614-K667 VanDerWaalsContact OE1-CE 3.31Å; E614-K667 WeakPolarHBondContact OE1-CE 3.5Å; E614-K667 IonicContact OE1-NZ 2.65Å; E614-K667 PolarHBondContact OE1-NZ 3.26Å; E614-K667 IonicContact OE2-NZ 3.06Å; E614-K667 PolarHBondContact OE2-NZ 3.48Å; E614-Y668 HydrophobicContact CG-CE2 4.39Å; E614-Y668 VanDerWaalsContact CG-OH 3.28Å; E614-Y668 WeakPolarHBondContact CG-OH 3.34Å; E614-Y668 WeakPolarHBondContact OE1-CE2 3.35Å; E614-Y668 PolarHBondContact OE1-OH 3.4Å
615	E	94.9	Very high	94.1	Very high	106 Å²	106	42.6 Å²	42.6	50%	0.495	22%	0.222	S	C	.	.	H	α-helix	trans	-60.7	-49.8	176.3	-177.8	178.3	-155.4	0	0	111.1	D611 K618 I619	D611-E615 WeakPolarHBondContact O-CB 3.31Å; D611-E615 PolarHBondContact O-N 3.01Å; E615-K618 PolarHBondContact O-N 3.48Å; E615-I619 HydrophobicContact CG-CD1 4Å; E615-I619 WeakPolarHBondContact O-CG1 3.42Å; E615-I619 PolarHBondContact O-N 3.36Å
616	L	94.7	Very high	94.3	Very high	16 Å²	16	44.8 Å²	44.8	8%	0.084	24%	0.238	C	C	.	.	H	α-helix	trans	-62.4	-49.7	-179.7	-172.4	159.6	0	0	0	111	W573 V576 G612 L613 K618 I619 Q620	W573-L616 HydrophobicContact CD2-CD1 3.77Å; W573-L616 HydrophobicContact CD2-CD2 4.08Å; W573-L616 HydrophobicContact CE3-CD1 3.97Å; W573-L616 HydrophobicContact CE3-CD2 4.24Å; W573-L616 HydrophobicContact CG-CD1 4.11Å; W573-L616 HydrophobicContact CH2-CD2 3.49Å; W573-L616 VanDerWaalsContact CH2-CD2 3.49Å; W573-L616 HydrophobicContact CZ2-CD2 3.29Å; W573-L616 HydrophobicContact CZ3-CD1 4.42Å; W573-L616 HydrophobicContact CZ3-CD2 3.97Å; V576-L616 HydrophobicContact CG2-CB 4.48Å; V576-L616 HydrophobicContact CG2-CD1 3.93Å; G612-L616 WeakPolarHBondContact O-CB 3.34Å; G612-L616 PolarHBondContact O-N 2.85Å; L613-L616 PolarHBondContact O-N 3.23Å; L616-K618 VanDerWaalsContact C-N 3.28Å; L616-K618 PolarHBondContact O-N 2.91Å; L616-I619 PolarHBondContact O-N 3.24Å; L616-Q620 HydrophobicContact CD2-CB 4.46Å; L616-Q620 HydrophobicContact CD2-CG 3.91Å; L616-Q620 HydrophobicContact CG-CG 4.34Å; L616-Q620 WeakPolarHBondContact O-CB 3.4Å; L616-Q620 WeakPolarHBondContact O-CG 3.36Å; L616-Q620 PolarHBondContact O-N 3.4Å
617	C	93.4	Very high	94.4	Very high	13 Å²	13	46.3 Å²	46.3	9%	0.088	25%	0.246	C	C	.	.	H	α-helix	trans	-62	-37	178.2	-74.3	0	0	0	0	112	L613 K621 M676 L680	L613-C617 VanDerWaalsContact O-CB 3.31Å; L613-C617 WeakPolarHBondContact O-CB 3.4Å; L613-C617 PolarHBondContact O-N 3.27Å; L613-C617 PolarHBondContact O-SG 2.91Å; L613-C617 VanDerWaalsContact O-SG 3.39Å; C617-K621 WeakPolarHBondContact O-CB 3.38Å; C617-K621 PolarHBondContact O-N 2.71Å; C617-M676 HydrophobicContact CB-CE 4.19Å; C617-L680 HydrophobicContact CB-CD2 4.11Å
618	K	93.3	Very high	94.5	Very high	176 Å²	176	47.2 Å²	47.2	77%	0.765	25%	0.25	S	C	*	.	H	α-helix	trans	-63.4	-42.4	176.6	-178	-176.8	177.3	-173	0	112	E614 E615 L616	E614-K618 WeakPolarHBondContact O-CB 3.34Å; E614-K618 PolarHBondContact O-N 3.32Å; E615-K618 PolarHBondContact O-N 3.48Å; L616-K618 VanDerWaalsContact C-N 3.28Å; L616-K618 PolarHBondContact O-N 2.91Å
619	I	93	Very high	94.5	Very high	80 Å²	80	52.6 Å²	52.6	41%	0.41	27%	0.271	S	S	.	.	H	α-helix	trans	-69.5	-53.5	178.6	-66.3	166.4	0	0	0	110.1	E615 L616 K621 G622 W623	E615-I619 HydrophobicContact CG-CD1 4Å; E615-I619 WeakPolarHBondContact O-CG1 3.42Å; E615-I619 PolarHBondContact O-N 3.36Å; L616-I619 PolarHBondContact O-N 3.24Å; I619-K621 VanDerWaalsContact C-N 3.27Å; I619-K621 PolarHBondContact O-N 2.81Å; I619-G622 PolarHBondContact O-N 3.25Å; I619-W623 HydrophobicContact CG2-CZ2 3.65Å
620	Q	94.2	Very high	94.5	Very high	4 Å²	4	54.5 Å²	54.5	2%	0.019	28%	0.28	C	S	.	.	H	α-helix	trans	-73.6	-15.7	-171.7	-62.9	-168.2	3.5	0	0	114	Y569 S572 L616 G622 W623 L680	Y569-Q620 PolarHBondContact OH-OE1 2.88Å; Y569-Q620 VanDerWaalsContact OH-OE1 3.14Å; S572-Q620 PolarHBondContact OG-NE2 3.45Å; L616-Q620 HydrophobicContact CD2-CB 4.46Å; L616-Q620 HydrophobicContact CD2-CG 3.91Å; L616-Q620 HydrophobicContact CG-CG 4.34Å; L616-Q620 WeakPolarHBondContact O-CB 3.4Å; L616-Q620 WeakPolarHBondContact O-CG 3.36Å; L616-Q620 PolarHBondContact O-N 3.4Å; Q620-G622 PolarHBondContact O-N 3.35Å; Q620-W623 HydrophobicContact CB-CD2 4.25Å; Q620-W623 HydrophobicContact CB-CE3 4.13Å; Q620-W623 HydrophobicContact CB-CZ3 4.45Å; Q620-W623 HydrophobicContact CG-CD2 4.1Å; Q620-W623 HydrophobicContact CG-CE3 3.74Å; Q620-W623 HydrophobicContact CG-CH2 3.76Å; Q620-W623 HydrophobicContact CG-CZ2 4.12Å; Q620-W623 HydrophobicContact CG-CZ3 3.57Å; Q620-W623 WeakPolarHBondContact O-CB 3.46Å; Q620-W623 PolarHBondContact O-N 2.85Å; Q620-W623 VanDerWaalsContact O-N 3.12Å; Q620-L680 HydrophobicContact CB-CD2 4.13Å
621	K	91.1	Very high	94.6	Very high	112 Å²	112	55.5 Å²	55.5	49%	0.487	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-26.7	172.6	-172	175.3	-176.6	-172.1	0	112.7	C617 I619 W623 A685	C617-K621 WeakPolarHBondContact O-CB 3.38Å; C617-K621 PolarHBondContact O-N 2.71Å; I619-K621 VanDerWaalsContact C-N 3.27Å; I619-K621 PolarHBondContact O-N 2.81Å; K621-W623 VanDerWaalsContact C-N 3.3Å; K621-A685 HydrophobicContact CG-CB 4.37Å
622	G	91.2	Very high	94.6	Very high	51 Å²	51	54.7 Å²	54.7	53%	0.526	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	2.3	176	0	0	0	0	0	114.7	D447 I619 Q620	D447-G622 WeakPolarHBondContact CA-O 3.35Å; D447-G622 VanDerWaalsContact CB-O 3.3Å; D447-G622 WeakPolarHBondContact CB-O 3.22Å; I619-G622 PolarHBondContact O-N 3.25Å; Q620-G622 PolarHBondContact O-N 3.35Å
623	W	95.7	Very high	94.7	Very high	16 Å²	16	60.1 Å²	60.1	6%	0.061	30%	0.296	C	S	.	.			trans	-96.5	154.8	-179.4	-58.1	-6	0	0	0	110.6	D447 D519 A521 L522 I525 Y569 I619 Q620 K621 F681	D447-W623 CarbonylContact O-C 3.57Å; D447-W623 WeakPolarHBondContact O-CA 3.14Å; D519-W623 HydrophobicContact CB-CZ2 4.39Å; D519-W623 WeakPolarHBondContact OD2-CZ2 3.3Å; A521-W623 HydrophobicContact CB-CH2 3.76Å; A521-W623 HydrophobicContact CB-CZ3 3.86Å; L522-W623 HydrophobicContact CB-CD2 4.34Å; L522-W623 HydrophobicContact CB-CH2 4.06Å; L522-W623 HydrophobicContact CB-CZ2 3.72Å; L522-W623 HydrophobicContact CB-CZ3 4.48Å; L522-W623 HydrophobicContact CD1-CB 4.39Å; L522-W623 HydrophobicContact CD1-CD2 3.82Å; L522-W623 HydrophobicContact CD1-CE3 4.44Å; L522-W623 HydrophobicContact CD1-CG 3.75Å; I525-W623 HydrophobicContact CG1-CE3 4.04Å; I525-W623 HydrophobicContact CG1-CZ3 4.38Å; Y569-W623 HydrophobicContact CD2-CZ3 4.3Å; Y569-W623 HydrophobicContact CE2-CZ3 4.28Å; I619-W623 HydrophobicContact CG2-CZ2 3.65Å; Q620-W623 HydrophobicContact CB-CD2 4.25Å; Q620-W623 HydrophobicContact CB-CE3 4.13Å; Q620-W623 HydrophobicContact CB-CZ3 4.45Å; Q620-W623 HydrophobicContact CG-CD2 4.1Å; Q620-W623 HydrophobicContact CG-CE3 3.74Å; Q620-W623 HydrophobicContact CG-CH2 3.76Å; Q620-W623 HydrophobicContact CG-CZ2 4.12Å; Q620-W623 HydrophobicContact CG-CZ3 3.57Å; Q620-W623 WeakPolarHBondContact O-CB 3.46Å; Q620-W623 PolarHBondContact O-N 2.85Å; Q620-W623 VanDerWaalsContact O-N 3.12Å; K621-W623 VanDerWaalsContact C-N 3.3Å; W623-F681 HydrophobicContact CB-CD1 3.89Å; W623-F681 HydrophobicContact CB-CE1 3.87Å; W623-F681 HydrophobicContact CE3-CE1 4.08Å; W623-F681 WeakPolarHBondContact O-CA 3.45Å
624	A	95.3	Very high	94.7	Very high	13 Å²	13	60.1 Å²	60.1	11%	0.107	30%	0.296	C	S	.	.			trans	-117.5	141.5	-177.2	0	0	0	0	0	112.1	D447 I525 N529	D447-A624 HydrophobicContact CB-CB 3.97Å; D447-A624 PolarHBondContact O-N 3.49Å; D447-A624 WeakPolarHBondContact OD2-CB 3.34Å; I525-A624 WeakPolarHBondContact CG2-O 3.4Å; N529-A624 PolarHBondContact ND2-O 3.42Å
625	I	96.9	Very high	94.7	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.288	C	S	.	.			trans	-129.5	96	163.2	-57.2	177.9	0	0	0	106.5	I525 D627 Q630 R631 I634 F681	I525-I625 HydrophobicContact CD1-CD1 3.93Å; I525-I625 HydrophobicContact CD1-CG1 4.38Å; I525-I625 HydrophobicContact CG2-CG1 4.21Å; I625-D627 VanDerWaalsContact C-N 3.32Å; I625-D627 PolarHBondContact O-N 2.82Å; I625-Q630 HydrophobicContact CG2-CB 4.29Å; I625-R631 HydrophobicContact CB-CB 3.92Å; I625-R631 HydrophobicContact CB-CG 4.15Å; I625-R631 HydrophobicContact CG2-CB 3.76Å; I625-R631 PolarHBondContact O-NH1 2.96Å; I625-I634 HydrophobicContact CD1-CD1 3.73Å; I625-I634 HydrophobicContact CD1-CG2 4.5Å; I625-F681 HydrophobicContact CB-CB 4.25Å; I625-F681 HydrophobicContact CB-CG 4.49Å; I625-F681 HydrophobicContact CD1-CB 4.33Å; I625-F681 HydrophobicContact CD1-CD1 3.95Å; I625-F681 HydrophobicContact CD1-CD2 3.67Å; I625-F681 HydrophobicContact CD1-CE1 4.16Å; I625-F681 HydrophobicContact CD1-CE2 3.9Å; I625-F681 HydrophobicContact CD1-CG 3.7Å; I625-F681 HydrophobicContact CD1-CZ 4.15Å; I625-F681 HydrophobicContact CG1-CB 4.1Å; I625-F681 HydrophobicContact CG1-CD1 3.87Å; I625-F681 HydrophobicContact CG1-CD2 4.32Å; I625-F681 HydrophobicContact CG1-CE1 4.4Å; I625-F681 HydrophobicContact CG1-CG 3.83Å
626	P	95.1	Very high	94.7	Very high	62 Å²	62	59.1 Å²	59.1	40%	0.403	29%	0.29	S	S	.	.			trans	-62.8	-38.4	-172.8	-25.8	35.5	0	0	0	112.9	T449 V450 N529 K628	T449-P626 WeakPolarHBondContact OG1-CG 3.35Å; V450-P626 HydrophobicContact CG2-CG 4.44Å; N529-P626 WeakPolarHBondContact OD1-CD 3.34Å; P626-K628 PolarHBondContact O-N 3.41Å
627	D	95.6	Very high	94.7	Very high	32 Å²	32	59.8 Å²	59.8	17%	0.171	30%	0.296	C	S	.	.			trans	-72.3	114.9	179.9	-171	-85.9	0	0	0	111.1	N532 K536 I625 E629 Q630 R631	N532-D627 VanDerWaalsContact ND2-CB 3.33Å; N532-D627 WeakPolarHBondContact ND2-CB 3.25Å; K536-D627 VanDerWaalsContact CD-OD2 3.27Å; K536-D627 WeakPolarHBondContact CD-OD2 3.43Å; K536-D627 VanDerWaalsContact CE-OD2 3.24Å; K536-D627 WeakPolarHBondContact CE-OD2 3.21Å; K536-D627 VanDerWaalsContact NZ-CG 3.3Å; K536-D627 IonicContact NZ-OD1 3.12Å; K536-D627 PolarHBondContact NZ-OD1 2.8Å; K536-D627 IonicContact NZ-OD2 2.83Å; K536-D627 PolarHBondContact NZ-OD2 3.41Å; I625-D627 VanDerWaalsContact C-N 3.32Å; I625-D627 PolarHBondContact O-N 2.82Å; D627-E629 PolarHBondContact O-N 3.48Å; D627-E629 PolarHBondContact OD1-N 3.11Å; D627-E629 VanDerWaalsContact OD1-N 3.16Å; D627-Q630 HydrophobicContact CB-CB 4.11Å; D627-Q630 HydrophobicContact CB-CG 4.14Å; D627-Q630 PolarHBondContact O-N 2.99Å; D627-Q630 WeakPolarHBondContact OD1-CG 3.37Å; D627-Q630 PolarHBondContact OD1-N 2.9Å; D627-R631 VanDerWaalsContact O-CB 3.29Å; D627-R631 WeakPolarHBondContact O-CB 3.3Å; D627-R631 PolarHBondContact O-N 3.34Å
628	K	94.6	Very high	94.8	Very high	136 Å²	136	59.2 Å²	59.2	59%	0.591	29%	0.292	S	S	*	.	H	α-helix	trans	-60.7	-43.1	-176	178.8	174.5	179.4	-174.7	0	112.8	P626 R631 D632	P626-K628 PolarHBondContact O-N 3.41Å; K628-R631 PolarHBondContact O-N 2.8Å; K628-D632 WeakPolarHBondContact CG-OD2 3.43Å; K628-D632 WeakPolarHBondContact O-CB 3.32Å; K628-D632 PolarHBondContact O-N 2.75Å
629	E	95.2	Very high	94.8	Very high	130 Å²	130	54.5 Å²	54.5	61%	0.607	27%	0.27	S	S	*	.	H	α-helix	trans	-66.2	-43.5	-177.1	-63.8	173	164.8	0	0	111	K536 D627 Y633	K536-E629 IonicContact NZ-OE2 3.15Å; K536-E629 PolarHBondContact NZ-OE2 3.28Å; D627-E629 PolarHBondContact O-N 3.48Å; D627-E629 PolarHBondContact OD1-N 3.11Å; D627-E629 VanDerWaalsContact OD1-N 3.16Å; E629-Y633 VanDerWaalsContact O-CB 3.27Å; E629-Y633 WeakPolarHBondContact O-CB 3.27Å; E629-Y633 PolarHBondContact O-N 2.75Å
630	Q	96.1	Very high	94.9	Very high	39 Å²	39	57.2 Å²	57.2	18%	0.182	28%	0.278	C	S	.	.	H	α-helix	trans	-66.1	-42.1	176.1	-65.7	-63.2	-52.4	0	0	111.8	H528 N532 I625 D627 Y633 I634	H528-Q630 PolarHBondContact CE1-OE1 3.07Å; H528-Q630 PolarHBondContact NE2-OE1 3.5Å; N532-Q630 WeakPolarHBondContact OD1-CG 3.27Å; I625-Q630 HydrophobicContact CG2-CB 4.29Å; D627-Q630 HydrophobicContact CB-CB 4.11Å; D627-Q630 HydrophobicContact CB-CG 4.14Å; D627-Q630 PolarHBondContact O-N 2.99Å; D627-Q630 WeakPolarHBondContact OD1-CG 3.37Å; D627-Q630 PolarHBondContact OD1-N 2.9Å; Q630-Y633 PolarHBondContact O-N 3.3Å; Q630-I634 WeakPolarHBondContact O-CG1 3.44Å; Q630-I634 PolarHBondContact O-N 2.76Å
631	R	96.1	Very high	94.9	Very high	26 Å²	26	60.4 Å²	60.4	10%	0.098	30%	0.295	C	S	.	.	H	α-helix	trans	-59.5	-49.7	176.3	-175.7	176.9	64.9	-119.7	4.2	111.6	I625 D627 K628 Y633 I634 R635 F681	I625-R631 HydrophobicContact CB-CB 3.92Å; I625-R631 HydrophobicContact CB-CG 4.15Å; I625-R631 HydrophobicContact CG2-CB 3.76Å; I625-R631 PolarHBondContact O-NH1 2.96Å; D627-R631 VanDerWaalsContact O-CB 3.29Å; D627-R631 WeakPolarHBondContact O-CB 3.3Å; D627-R631 PolarHBondContact O-N 3.34Å; K628-R631 PolarHBondContact O-N 2.8Å; R631-Y633 VanDerWaalsContact C-N 3.33Å; R631-Y633 PolarHBondContact O-N 2.84Å; R631-I634 PolarHBondContact O-N 3.39Å; R631-R635 WeakPolarHBondContact O-CB 3.34Å; R631-R635 VanDerWaalsContact O-CG 3.27Å; R631-R635 WeakPolarHBondContact O-CG 3.45Å; R631-R635 PolarHBondContact O-N 3.25Å; R631-F681 WeakPolarHBondContact CD-O 3.17Å; R631-F681 HydrophobicContact CG-CB 4.01Å
632	D	95.3	Very high	95.1	Very high	65 Å²	65	55 Å²	55	35%	0.348	27%	0.271	S	S	.	.	H	α-helix	trans	-64.6	-39.8	-179.5	-67.3	-15.4	0	0	0	110.7	K628 Q636	K628-D632 WeakPolarHBondContact CG-OD2 3.43Å; K628-D632 WeakPolarHBondContact O-CB 3.32Å; K628-D632 PolarHBondContact O-N 2.75Å; D632-Q636 VanDerWaalsContact O-CB 3.24Å; D632-Q636 WeakPolarHBondContact O-CB 3.42Å; D632-Q636 PolarHBondContact O-N 2.95Å
633	Y	96.1	Very high	95.2	Very high	128 Å²	128	52.7 Å²	52.7	50%	0.502	25%	0.247	S	C	.	.	H	α-helix	trans	-61	-49.1	174.6	174.5	-100.1	0	0	0	112.7	I566 E629 Q630 R631 Q636 S637	I566-Y633 HydrophobicContact CD1-CD1 4.31Å; I566-Y633 HydrophobicContact CD1-CE1 4.06Å; E629-Y633 VanDerWaalsContact O-CB 3.27Å; E629-Y633 WeakPolarHBondContact O-CB 3.27Å; E629-Y633 PolarHBondContact O-N 2.75Å; Q630-Y633 PolarHBondContact O-N 3.3Å; R631-Y633 VanDerWaalsContact C-N 3.33Å; R631-Y633 PolarHBondContact O-N 2.84Å; Y633-Q636 PolarHBondContact O-N 2.84Å; Y633-S637 WeakPolarHBondContact O-CB 3.37Å; Y633-S637 PolarHBondContact O-N 3.1Å
634	I	96.1	Very high	95.2	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-63.8	-46.3	179.2	-71.4	166.9	0	0	0	110.7	H528 I566 Y569 I625 Q630 R631 Q636 S637 Q638 F681	H528-I634 VanDerWaalsContact NE2-CD1 3.3Å; H528-I634 WeakPolarHBondContact NE2-CD1 3.48Å; I566-I634 HydrophobicContact CD1-CD1 4.46Å; I566-I634 HydrophobicContact CD1-CG1 4.36Å; I566-I634 HydrophobicContact CG1-CD1 4.12Å; I566-I634 HydrophobicContact CG1-CG1 4.27Å; I566-I634 HydrophobicContact CG2-CG1 4.37Å; Y569-I634 HydrophobicContact CD1-CG2 3.99Å; Y569-I634 HydrophobicContact CE1-CG2 3.41Å; Y569-I634 VanDerWaalsContact CE1-CG2 3.41Å; I625-I634 HydrophobicContact CD1-CD1 3.73Å; I625-I634 HydrophobicContact CD1-CG2 4.5Å; Q630-I634 WeakPolarHBondContact O-CG1 3.44Å; Q630-I634 PolarHBondContact O-N 2.76Å; R631-I634 PolarHBondContact O-N 3.39Å; I634-Q636 PolarHBondContact O-N 2.77Å; I634-S637 PolarHBondContact O-N 2.93Å; I634-Q638 WeakPolarHBondContact O-CB 3.3Å; I634-Q638 PolarHBondContact O-N 3.26Å; I634-F681 HydrophobicContact CG2-CE2 4.32Å
635	R	95.2	Very high	95.1	Very high	26 Å²	26	56.9 Å²	56.9	10%	0.098	27%	0.273	C	S	.	.	H	α-helix	trans	-57	-50.6	175.9	-76.3	173.1	177.5	177.9	-5.2	110.9	R631 S637 Q638 R639 E678 L680 F681 D682	R631-R635 WeakPolarHBondContact O-CB 3.34Å; R631-R635 VanDerWaalsContact O-CG 3.27Å; R631-R635 WeakPolarHBondContact O-CG 3.45Å; R631-R635 PolarHBondContact O-N 3.25Å; R635-S637 PolarHBondContact O-N 2.81Å; R635-Q638 PolarHBondContact O-N 3.02Å; R635-R639 WeakPolarHBondContact O-CB 3.34Å; R635-R639 PolarHBondContact O-N 3.43Å; R635-E678 PolarHBondContact NE-O 3.36Å; R635-E678 PolarHBondContact NH1-O 2.78Å; R635-E678 PolarHBondContact NH2-O 3.34Å; R635-L680 PolarHBondContact NE-O 2.88Å; R635-L680 PolarHBondContact NH2-O 3.39Å; R635-F681 HydrophobicContact CG-CD2 4.43Å; R635-F681 PolarHBondContact NH2-O 3.45Å; R635-D682 IonicContact CZ-OD1 2.97Å; R635-D682 IonicContact NH1-OD1 2.64Å; R635-D682 PolarHBondContact NH1-OD1 3.46Å; R635-D682 IonicContact NH2-OD1 2.7Å; R635-D682 PolarHBondContact NH2-OD1 3.14Å; R635-D682 IonicContact NH2-OD2 3.66Å
636	Q	95.1	Very high	95	Very high	116 Å²	116	56.9 Å²	56.9	54%	0.542	27%	0.273	S	S	.	.	H	α-helix	trans	-63.3	-41.9	-178.1	-172.8	176.9	31	0	0	112.1	D632 Y633 I634 K640	D632-Q636 VanDerWaalsContact O-CB 3.24Å; D632-Q636 WeakPolarHBondContact O-CB 3.42Å; D632-Q636 PolarHBondContact O-N 2.95Å; Y633-Q636 PolarHBondContact O-N 2.84Å; I634-Q636 PolarHBondContact O-N 2.77Å; Q636-K640 WeakPolarHBondContact O-CB 3.38Å; Q636-K640 PolarHBondContact O-N 3.45Å
637	S	94.8	Very high	94.9	Very high	30 Å²	30	58.3 Å²	58.3	21%	0.21	27%	0.27	C	S	.	.	H	α-helix	trans	-60.3	-49.9	176.4	-172	0	0	0	0	110.9	Q570 Y633 I634 R635 K640 I641	Q570-S637 PolarHBondContact NE2-OG 3.37Å; Q570-S637 VanDerWaalsContact NE2-OG 3.15Å; Y633-S637 WeakPolarHBondContact O-CB 3.37Å; Y633-S637 PolarHBondContact O-N 3.1Å; I634-S637 PolarHBondContact O-N 2.93Å; R635-S637 PolarHBondContact O-N 2.81Å; S637-K640 PolarHBondContact O-N 2.91Å; S637-I641 WeakPolarHBondContact O-CG1 3.49Å; S637-I641 PolarHBondContact O-N 3.09Å; S637-I641 VanDerWaalsContact O-N 3.12Å
638	Q	94.6	Very high	94.8	Very high	2 Å²	2	59.4 Å²	59.4	1%	0.009	28%	0.284	C	S	.	.	H	α-helix	trans	-67.8	-41.3	-178.7	-164.8	57.7	47.9	0	0	112.4	W573 I634 R635 K640 I641 V642 I677	W573-Q638 VanDerWaalsContact CB-NE2 3.32Å; W573-Q638 VanDerWaalsContact CD2-CD 3.41Å; W573-Q638 HydrophobicContact CD2-CG 3.65Å; W573-Q638 HydrophobicContact CE3-CG 4.17Å; W573-Q638 HydrophobicContact CG-CG 4.08Å; W573-Q638 HydrophobicContact CH2-CG 4.13Å; W573-Q638 HydrophobicContact CZ2-CG 3.59Å; W573-Q638 HydrophobicContact CZ3-CG 4.38Å; I634-Q638 WeakPolarHBondContact O-CB 3.3Å; I634-Q638 PolarHBondContact O-N 3.26Å; R635-Q638 PolarHBondContact O-N 3.02Å; Q638-K640 VanDerWaalsContact C-N 3.31Å; Q638-K640 PolarHBondContact O-N 3.32Å; Q638-I641 PolarHBondContact O-N 3.14Å; Q638-V642 HydrophobicContact CG-CG2 4.27Å; Q638-V642 VanDerWaalsContact O-CG2 3.32Å; Q638-V642 WeakPolarHBondContact O-CG2 3.48Å; Q638-V642 PolarHBondContact O-N 2.81Å; Q638-I677 HydrophobicContact CB-CG2 4.2Å; Q638-I677 HydrophobicContact CG-CG2 4.43Å
639	R	94.5	Very high	94.6	Very high	77 Å²	77	53 Å²	53	29%	0.291	26%	0.256	S	S	.	.	H	α-helix	trans	-54.4	-48.8	175.1	-174.3	-173.6	79.6	-174.6	4.7	110.8	R635 S643 E674 I677 E678	R635-R639 WeakPolarHBondContact O-CB 3.34Å; R635-R639 PolarHBondContact O-N 3.43Å; R639-S643 WeakPolarHBondContact O-CB 3.32Å; R639-S643 PolarHBondContact O-N 3.04Å; R639-E674 HydrophobicContact CG-CB 3.82Å; R639-E674 HydrophobicContact CG-CG 3.67Å; R639-I677 HydrophobicContact CB-CG2 4.14Å; R639-E678 WeakPolarHBondContact CD-OE1 3.15Å; R639-E678 IonicContact CZ-OE1 3.22Å; R639-E678 IonicContact NE-OE1 2.72Å; R639-E678 IonicContact NH1-OE1 3.57Å; R639-E678 PolarHBondContact NH1-OE1 2.88Å
640	K	94.3	Very high	94.4	Very high	137 Å²	137	48.1 Å²	48.1	60%	0.596	23%	0.234	S	C	*	.	H	α-helix	trans	-61.9	-51.5	179.1	-174.6	177.9	180	-178.9	0	111.6	Q636 S637 Q638 V642 S643 D644	Q636-K640 WeakPolarHBondContact O-CB 3.38Å; Q636-K640 PolarHBondContact O-N 3.45Å; S637-K640 PolarHBondContact O-N 2.91Å; Q638-K640 VanDerWaalsContact C-N 3.31Å; Q638-K640 PolarHBondContact O-N 3.32Å; K640-V642 PolarHBondContact O-N 3.2Å; K640-S643 PolarHBondContact O-N 3.5Å; K640-D644 WeakPolarHBondContact CG-OD2 3.41Å; K640-D644 VanDerWaalsContact O-CB 3.31Å; K640-D644 WeakPolarHBondContact O-CB 3.41Å; K640-D644 PolarHBondContact O-N 3.01Å
641	I	94.3	Very high	93.9	Very high	70 Å²	70	53.7 Å²	53.7	36%	0.359	26%	0.26	S	S	.	.	H	α-helix	trans	-60	-46.7	-176.7	-67.3	166.7	0	0	0	111.4	L577 S637 Q638 A645	L577-I641 HydrophobicContact CD1-CG2 3.85Å; S637-I641 WeakPolarHBondContact O-CG1 3.49Å; S637-I641 PolarHBondContact O-N 3.09Å; S637-I641 VanDerWaalsContact O-N 3.12Å; Q638-I641 PolarHBondContact O-N 3.14Å; I641-A645 WeakPolarHBondContact O-CB 3.27Å; I641-A645 PolarHBondContact O-N 2.84Å
642	V	95.1	Very high	93.4	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-72.7	-44.1	-177.5	179.8	0	0	0	0	111.2	W573 L577 F609 Q638 K640 A645 Y646 V673 I677	W573-V642 HydrophobicContact CD2-CG2 4.39Å; W573-V642 HydrophobicContact CE3-CG2 3.62Å; W573-V642 HydrophobicContact CZ3-CG2 3.91Å; L577-V642 HydrophobicContact CD2-CG2 4.14Å; F609-V642 HydrophobicContact CE2-CG1 4.29Å; F609-V642 HydrophobicContact CZ-CG1 4.36Å; Q638-V642 HydrophobicContact CG-CG2 4.27Å; Q638-V642 VanDerWaalsContact O-CG2 3.32Å; Q638-V642 WeakPolarHBondContact O-CG2 3.48Å; Q638-V642 PolarHBondContact O-N 2.81Å; K640-V642 PolarHBondContact O-N 3.2Å; V642-A645 PolarHBondContact O-N 3.36Å; V642-Y646 VanDerWaalsContact O-CB 3.27Å; V642-Y646 WeakPolarHBondContact O-CB 3.46Å; V642-Y646 PolarHBondContact O-N 2.95Å; V642-V673 HydrophobicContact CG1-CG1 3.76Å; V642-I677 HydrophobicContact CB-CD1 3.77Å; V642-I677 HydrophobicContact CG1-CD1 4.08Å; V642-I677 HydrophobicContact CG2-CD1 4.02Å
643	S	93.9	Very high	92.8	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.007	26%	0.255	C	S	.	.	H	α-helix	trans	-64.6	-44.6	-178.8	-175.2	0	0	0	0	112	R639 K640 A645 Y646 R647 E674	R639-S643 WeakPolarHBondContact O-CB 3.32Å; R639-S643 PolarHBondContact O-N 3.04Å; K640-S643 PolarHBondContact O-N 3.5Å; S643-A645 PolarHBondContact O-N 3.37Å; S643-Y646 PolarHBondContact O-N 2.9Å; S643-R647 WeakPolarHBondContact O-CB 3.48Å; S643-R647 WeakPolarHBondContact O-CG 3.38Å; S643-R647 PolarHBondContact O-N 3.28Å; S643-R647 VanDerWaalsContact OG-CZ 3.31Å; S643-R647 PolarHBondContact OG-NH1 2.87Å; S643-E674 VanDerWaalsContact CB-OE1 3.27Å; S643-E674 WeakPolarHBondContact CB-OE1 3.48Å; S643-E674 PolarHBondContact OG-OE1 3.31Å
644	D	94.1	Very high	91.9	Very high	84 Å²	84	50.8 Å²	50.8	45%	0.449	26%	0.258	S	S	.	.	H	α-helix	trans	-61.9	-44.4	178.7	-70.8	-16	0	0	0	111.1	K640 A648	K640-D644 WeakPolarHBondContact CG-OD2 3.41Å; K640-D644 VanDerWaalsContact O-CB 3.31Å; K640-D644 WeakPolarHBondContact O-CB 3.41Å; K640-D644 PolarHBondContact O-N 3.01Å; D644-A648 VanDerWaalsContact O-CB 3.32Å; D644-A648 WeakPolarHBondContact O-CB 3.35Å; D644-A648 PolarHBondContact O-N 3.19Å
645	A	94.4	Very high	90.8	Very high	33 Å²	33	58.5 Å²	58.5	27%	0.273	30%	0.299	S	S	.	.	H	α-helix	trans	-63.6	-42.7	176	0	0	0	0	0	112.1	L577 L580 I641 V642 S643 F649	L577-A645 HydrophobicContact CD2-CB 3.97Å; L580-A645 HydrophobicContact CD1-CB 3.88Å; I641-A645 WeakPolarHBondContact O-CB 3.27Å; I641-A645 PolarHBondContact O-N 2.84Å; V642-A645 PolarHBondContact O-N 3.36Å; S643-A645 PolarHBondContact O-N 3.37Å; A645-F649 WeakPolarHBondContact O-CB 3.38Å; A645-F649 PolarHBondContact O-N 3.07Å
646	Y	95	Very high	90.1	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-70.4	-43	-178.4	-172.3	-123.7	0	0	0	112.2	L580 F606 F609 V642 S643 A648 F649 L650 Y668 P670 V673	L580-Y646 HydrophobicContact CD1-CD2 4.33Å; L580-Y646 HydrophobicContact CD2-CD2 3.78Å; L580-Y646 HydrophobicContact CD2-CE2 4.43Å; F606-Y646 HydrophobicContact CE1-CE2 4.45Å; F609-Y646 AromaticContact CD1-CD2 3.91Å; F609-Y646 HydrophobicContact CD1-CD2 3.91Å; F609-Y646 AromaticContact CD1-CE2 3.58Å; F609-Y646 HydrophobicContact CD1-CE2 3.58Å; F609-Y646 HydrophobicContact CE1-CD1 4.5Å; F609-Y646 AromaticContact CE1-CD2 3.44Å; F609-Y646 HydrophobicContact CE1-CD2 3.44Å; F609-Y646 VanDerWaalsContact CE1-CD2 3.44Å; F609-Y646 HydrophobicContact CE1-CE1 4.39Å; F609-Y646 AromaticContact CE1-CE2 3.31Å; F609-Y646 HydrophobicContact CE1-CE2 3.31Å; F609-Y646 HydrophobicContact CE1-CG 4.06Å; F609-Y646 AromaticContact CE1-CZ 3.83Å; F609-Y646 HydrophobicContact CE2-CD2 4.33Å; F609-Y646 HydrophobicContact CG-CE2 4.48Å; F609-Y646 AromaticContact CZ-CD2 3.67Å; F609-Y646 HydrophobicContact CZ-CD2 3.67Å; F609-Y646 HydrophobicContact CZ-CE2 4.05Å; F609-Y646 AromaticContact CZ-CG 3.99Å; F609-Y646 HydrophobicContact CZ-CG 3.99Å; V642-Y646 VanDerWaalsContact O-CB 3.27Å; V642-Y646 WeakPolarHBondContact O-CB 3.46Å; V642-Y646 PolarHBondContact O-N 2.95Å; S643-Y646 PolarHBondContact O-N 2.9Å; Y646-A648 PolarHBondContact O-N 2.84Å; Y646-F649 PolarHBondContact O-N 3.24Å; Y646-L650 HydrophobicContact CD1-CD1 3.69Å; Y646-L650 HydrophobicContact CD1-CG 4.37Å; Y646-L650 HydrophobicContact CD2-CG 4.43Å; Y646-L650 HydrophobicContact CE1-CD1 3.37Å; Y646-L650 HydrophobicContact CE1-CG 4.07Å; Y646-L650 HydrophobicContact CE2-CD1 4.33Å; Y646-L650 HydrophobicContact CE2-CD2 4.46Å; Y646-L650 HydrophobicContact CE2-CG 4.12Å; Y646-L650 HydrophobicContact CG-CD1 4.3Å; Y646-L650 WeakPolarHBondContact O-CB 3.33Å; Y646-L650 WeakPolarHBondContact O-CG 3.39Å; Y646-L650 PolarHBondContact O-N 3.45Å; Y646-Y668 PolarHBondContact OH-O 2.83Å; Y646-P670 HydrophobicContact CD1-CG 4.39Å; Y646-V673 HydrophobicContact CD1-CG2 3.94Å; Y646-V673 HydrophobicContact CE1-CG2 3.88Å
647	R	93.8	Very high	89.4	Confident	92 Å²	92	58.2 Å²	58.2	35%	0.347	31%	0.311	S	S	.	.	H	α-helix	trans	-59.6	-45.5	174	-76.3	-177.4	172.7	127.1	6	111.4	S643 F649 L650 H651 P670 E671 E674	S643-R647 WeakPolarHBondContact O-CB 3.48Å; S643-R647 WeakPolarHBondContact O-CG 3.38Å; S643-R647 PolarHBondContact O-N 3.28Å; S643-R647 VanDerWaalsContact OG-CZ 3.31Å; S643-R647 PolarHBondContact OG-NH1 2.87Å; R647-F649 VanDerWaalsContact C-N 3.34Å; R647-F649 PolarHBondContact O-N 2.91Å; R647-L650 PolarHBondContact O-N 2.9Å; R647-H651 WeakPolarHBondContact O-CB 3.2Å; R647-H651 PolarHBondContact O-N 2.87Å; R647-P670 HydrophobicContact CG-CB 3.69Å; R647-P670 HydrophobicContact CG-CG 3.72Å; R647-E671 IonicContact CZ-OE1 3Å; R647-E671 IonicContact NH2-OE1 3.2Å; R647-E671 PolarHBondContact NH2-OE1 3.35Å; R647-E674 IonicContact CZ-OE1 2.87Å; R647-E674 IonicContact NH1-OE1 2.87Å; R647-E674 PolarHBondContact NH1-OE1 2.9Å; R647-E674 IonicContact NH2-OE1 2.73Å; R647-E674 PolarHBondContact NH2-OE1 2.89Å; R647-E674 IonicContact NH2-OE2 2.83Å
648	A	91.8	Very high	88.9	Confident	55 Å²	55	57 Å²	57	46%	0.455	30%	0.302	S	S	.	.	H	α-helix	trans	-61.3	-43.5	176.8	0	0	0	0	0	111.8	D644 Y646 R652	D644-A648 VanDerWaalsContact O-CB 3.32Å; D644-A648 WeakPolarHBondContact O-CB 3.35Å; D644-A648 PolarHBondContact O-N 3.19Å; Y646-A648 PolarHBondContact O-N 2.84Å; A648-R652 PolarHBondContact O-N 3.41Å; A648-R652 VanDerWaalsContact O-N 3.12Å
649	F	91.6	Very high	88.4	Confident	1 Å²	1	58.2 Å²	58.2	0%	0.004	31%	0.309	C	S	.	.	H	α-helix	trans	-65.1	-44.9	177.5	-175.5	-102.5	0	0	0	112.5	L580 M585 K605 F606 A645 Y646 R647 R652 C653	L580-F649 HydrophobicContact CB-CB 4.32Å; L580-F649 HydrophobicContact CB-CG 4.47Å; L580-F649 HydrophobicContact CD2-CB 4.06Å; L580-F649 HydrophobicContact CD2-CD1 3.79Å; L580-F649 HydrophobicContact CD2-CE1 4.43Å; L580-F649 HydrophobicContact CD2-CG 3.91Å; L580-F649 WeakPolarHBondContact O-CD2 3.49Å; M585-F649 HydrophobicContact CE-CE2 3.94Å; M585-F649 HydrophobicContact SD-CE2 3.96Å; M585-F649 HydrophobicContact SD-CZ 4.48Å; K605-F649 HydrophobicContact CB-CZ 3.84Å; K605-F649 HydrophobicContact CD-CE2 4.04Å; K605-F649 HydrophobicContact CD-CZ 4.13Å; F606-F649 HydrophobicContact CD1-CE1 4.03Å; F606-F649 AromaticContact CD2-CE1 4Å; F606-F649 HydrophobicContact CD2-CE1 4Å; F606-F649 AromaticContact CE1-CD1 4Å; F606-F649 HydrophobicContact CE1-CD1 4Å; F606-F649 AromaticContact CE1-CE1 3.72Å; F606-F649 HydrophobicContact CE1-CE1 3.72Å; F606-F649 AromaticContact CE2-CE1 3.68Å; F606-F649 HydrophobicContact CE2-CE1 3.68Å; F606-F649 HydrophobicContact CE2-CZ 4.32Å; F606-F649 HydrophobicContact CG-CE1 4.15Å; F606-F649 AromaticContact CZ-CD1 3.97Å; F606-F649 HydrophobicContact CZ-CD1 3.97Å; F606-F649 AromaticContact CZ-CE1 3.53Å; F606-F649 HydrophobicContact CZ-CE1 3.53Å; A645-F649 WeakPolarHBondContact O-CB 3.38Å; A645-F649 PolarHBondContact O-N 3.07Å; Y646-F649 PolarHBondContact O-N 3.24Å; R647-F649 VanDerWaalsContact C-N 3.34Å; R647-F649 PolarHBondContact O-N 2.91Å; F649-R652 PolarHBondContact O-N 2.9Å; F649-C653 PolarHBondContact O-N 3.44Å; F649-C653 VanDerWaalsContact O-N 3.13Å; F649-C653 PolarHBondContact O-SG 3.46Å
650	L	89.4	Confident	87.9	Confident	29 Å²	29	64.2 Å²	64.2	15%	0.152	34%	0.338	C	S	.	.	H	α-helix	trans	-60.1	-49.3	175.5	-81.6	173.9	0	0	0	111.8	F606 Y646 R647 R652 C653 A654 P670	F606-L650 HydrophobicContact CE1-CD2 3.75Å; F606-L650 HydrophobicContact CZ-CD2 4.04Å; Y646-L650 HydrophobicContact CD1-CD1 3.69Å; Y646-L650 HydrophobicContact CD1-CG 4.37Å; Y646-L650 HydrophobicContact CD2-CG 4.43Å; Y646-L650 HydrophobicContact CE1-CD1 3.37Å; Y646-L650 HydrophobicContact CE1-CG 4.07Å; Y646-L650 HydrophobicContact CE2-CD1 4.33Å; Y646-L650 HydrophobicContact CE2-CD2 4.46Å; Y646-L650 HydrophobicContact CE2-CG 4.12Å; Y646-L650 HydrophobicContact CG-CD1 4.3Å; Y646-L650 WeakPolarHBondContact O-CB 3.33Å; Y646-L650 WeakPolarHBondContact O-CG 3.39Å; Y646-L650 PolarHBondContact O-N 3.45Å; R647-L650 PolarHBondContact O-N 2.9Å; L650-R652 PolarHBondContact O-N 3.4Å; L650-C653 CarbonylContact O-C 3.51Å; L650-C653 PolarHBondContact O-N 2.85Å; L650-A654 PolarHBondContact O-N 2.89Å; L650-P670 HydrophobicContact CD1-CG 3.79Å
651	H	87.4	Confident	87.5	Confident	155 Å²	155	62.8 Å²	62.8	72%	0.718	34%	0.336	S	S	*	.	H	α-helix	trans	-58.4	-39.5	179.3	-177.9	-91.4	0	0	0	111.5	R647 C653 A654	R647-H651 WeakPolarHBondContact O-CB 3.2Å; R647-H651 PolarHBondContact O-N 2.87Å; H651-C653 VanDerWaalsContact C-N 3.31Å; H651-C653 PolarHBondContact O-N 2.7Å; H651-A654 PolarHBondContact O-N 3.47Å
652	R	83.9	Confident	86.9	Confident	92 Å²	92	62.6 Å²	62.6	35%	0.347	34%	0.34	S	S	.	.	H	α-helix	trans	-65.8	-34	176.5	-165.7	176.8	-64.3	140.4	-20.5	112.8	D582 F588 A648 F649 L650 I656	D582-R652 VanDerWaalsContact CG-NH1 3.28Å; D582-R652 IonicContact OD1-CZ 3.98Å; D582-R652 IonicContact OD1-NH1 3.97Å; D582-R652 PolarHBondContact OD1-NH1 2.7Å; D582-R652 IonicContact OD1-NH2 2.68Å; D582-R652 PolarHBondContact OD1-NH2 3.31Å; D582-R652 VanDerWaalsContact OD1-NH2 3.1Å; D582-R652 IonicContact OD2-CZ 2.65Å; D582-R652 IonicContact OD2-NH1 3.69Å; D582-R652 IonicContact OD2-NH2 3.03Å; D582-R652 PolarHBondContact OD2-NH2 2.88Å; F588-R652 HydrophobicContact CD2-CG 4.32Å; F588-R652 HydrophobicContact CE2-CG 3.85Å; A648-R652 PolarHBondContact O-N 3.41Å; A648-R652 VanDerWaalsContact O-N 3.12Å; F649-R652 PolarHBondContact O-N 2.9Å; L650-R652 PolarHBondContact O-N 3.4Å; R652-I656 VanDerWaalsContact O-CD1 3.28Å; R652-I656 WeakPolarHBondContact O-CD1 3.09Å
653	C	82.8	Confident	86.4	Confident	1 Å²	1	70.9 Å²	70.9	1%	0.007	38%	0.378	C	S	.	.	H	α-helix	trans	-89	-11.2	-179.9	-60.7	0	0	0	0	114	F606 F649 L650 H651 N655 I656	F606-C653 HydrophobicContact CE2-CB 4.06Å; F606-C653 HydrophobicContact CZ-CB 4.06Å; F649-C653 PolarHBondContact O-N 3.44Å; F649-C653 VanDerWaalsContact O-N 3.13Å; F649-C653 PolarHBondContact O-SG 3.46Å; L650-C653 CarbonylContact O-C 3.51Å; L650-C653 PolarHBondContact O-N 2.85Å; H651-C653 VanDerWaalsContact C-N 3.31Å; H651-C653 PolarHBondContact O-N 2.7Å; C653-N655 VanDerWaalsContact C-N 3.31Å; C653-N655 PolarHBondContact O-N 3.38Å; C653-I656 WeakPolarHBondContact O-CB 3.07Å; C653-I656 PolarHBondContact O-N 2.85Å; C653-I656 VanDerWaalsContact O-N 3.14Å
654	A	77.4	Confident	85.9	Confident	66 Å²	66	77.9 Å²	77.9	55%	0.545	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-37	-169.8	0	0	0	0	0	114.2	L650 H651 I656	L650-A654 PolarHBondContact O-N 2.89Å; H651-A654 PolarHBondContact O-N 3.47Å; A654-I656 VanDerWaalsContact C-N 3.35Å
655	N	74.5	Confident	85.5	Confident	162 Å²	162	75.2 Å²	75.2	87%	0.866	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	17.8	-176.7	-65.6	-32.3	0	0	0	113.4	C653	C653-N655 VanDerWaalsContact C-N 3.31Å; C653-N655 PolarHBondContact O-N 3.38Å
656	I	79.4	Confident	85.1	Confident	29 Å²	29	77 Å²	77	15%	0.149	40%	0.395	C	S	.	.			trans	-117	116.2	-168.4	-52.2	-169	0	0	0	110.7	F588 L594 I602 R652 C653 A654 F658	F588-I656 HydrophobicContact CD1-CD1 3.4Å; F588-I656 VanDerWaalsContact CD1-CD1 3.4Å; F588-I656 HydrophobicContact CD2-CD1 3.89Å; F588-I656 HydrophobicContact CE1-CD1 3.14Å; F588-I656 HydrophobicContact CE1-CG1 4.47Å; F588-I656 HydrophobicContact CE1-CG2 4.42Å; F588-I656 HydrophobicContact CE2-CD1 3.66Å; F588-I656 HydrophobicContact CG-CD1 3.77Å; F588-I656 HydrophobicContact CZ-CD1 3.26Å; L594-I656 HydrophobicContact CD1-CG2 3.23Å; L594-I656 HydrophobicContact CG-CG2 4.27Å; I602-I656 HydrophobicContact CD1-CG2 4.19Å; R652-I656 VanDerWaalsContact O-CD1 3.28Å; R652-I656 WeakPolarHBondContact O-CD1 3.09Å; C653-I656 WeakPolarHBondContact O-CB 3.07Å; C653-I656 PolarHBondContact O-N 2.85Å; C653-I656 VanDerWaalsContact O-N 3.14Å; A654-I656 VanDerWaalsContact C-N 3.35Å; I656-F658 VanDerWaalsContact C-N 3.35Å; I656-F658 HydrophobicContact CG2-CB 4.4Å; I656-F658 WeakPolarHBondContact O-CD1 3.46Å; I656-F658 PolarHBondContact O-N 3.28Å
657	S	81.1	Confident	84.8	Confident	106 Å²	106	81.7 Å²	81.7	74%	0.741	42%	0.416	S	S	*	.			trans	-79.3	78.1	175.8	176.1	0	0	0	0	111.8
658	F	83.9	Confident	84.8	Confident	5 Å²	5	79.2 Å²	79.2	2%	0.022	41%	0.406	C	S	.	.			trans	-94.8	-14.7	-179.4	71.3	-91.5	0	0	0	115	L594 R599 I602 K603 F606 I656 Y665 H666	L594-F658 HydrophobicContact CD1-CB 4.27Å; R599-F658 HydrophobicContact CB-CB 4.43Å; R599-F658 WeakPolarHBondContact CD-O 3.31Å; R599-F658 HydrophobicContact CG-CB 4.27Å; I602-F658 HydrophobicContact CB-CB 4.36Å; I602-F658 HydrophobicContact CB-CD2 4.27Å; I602-F658 HydrophobicContact CB-CG 4.25Å; I602-F658 HydrophobicContact CD1-CB 4.04Å; I602-F658 HydrophobicContact CG2-CB 4.28Å; I602-F658 HydrophobicContact CG2-CD1 3.86Å; I602-F658 HydrophobicContact CG2-CD2 3.79Å; I602-F658 HydrophobicContact CG2-CE1 4.08Å; I602-F658 HydrophobicContact CG2-CE2 4.01Å; I602-F658 HydrophobicContact CG2-CG 3.71Å; I602-F658 HydrophobicContact CG2-CZ 4.15Å; K603-F658 VanDerWaalsContact CE-O 3.25Å; K603-F658 WeakPolarHBondContact CE-O 3.5Å; K603-F658 HydrophobicContact CG-CD2 3.84Å; K603-F658 HydrophobicContact CG-CE2 4.1Å; F606-F658 HydrophobicContact CD2-CE2 4.2Å; F606-F658 AromaticContact CD2-CZ 3.86Å; F606-F658 HydrophobicContact CD2-CZ 3.86Å; F606-F658 HydrophobicContact CE2-CE1 4.04Å; F606-F658 HydrophobicContact CE2-CE2 4.45Å; F606-F658 AromaticContact CE2-CZ 3.71Å; F606-F658 HydrophobicContact CE2-CZ 3.71Å; I656-F658 VanDerWaalsContact C-N 3.35Å; I656-F658 HydrophobicContact CG2-CB 4.4Å; I656-F658 WeakPolarHBondContact O-CD1 3.46Å; I656-F658 PolarHBondContact O-N 3.28Å; F658-Y665 HydrophobicContact CE2-CD2 4.17Å; F658-Y665 HydrophobicContact CE2-CG 4.05Å; F658-H666 AromaticContact CE1-CE1 3.66Å; F658-H666 AromaticContact CZ-CE1 3.6Å
659	T	84.1	Confident	84.7	Confident	27 Å²	27	84.8 Å²	84.8	17%	0.166	42%	0.416	C	S	.	.			trans	-149.1	154.4	-176.9	-173.4	0	0	0	0	112	N661 P662 Y665	T659-N661 PolarHBondContact OG1-N 2.86Å; T659-P662 HydrophobicContact CG2-CB 4.45Å; T659-P662 HydrophobicContact CG2-CG 4.4Å; T659-Y665 HydrophobicContact CG2-CD2 3.99Å; T659-Y665 HydrophobicContact CG2-CE2 4.47Å
660	K	83.3	Confident	84.7	Confident	204 Å²	204	85.7 Å²	85.7	89%	0.887	42%	0.422	S	S	*	.	S	Bend	trans	-85.2	-15.1	170.2	-64.6	-175.7	-179.9	-178.6	0	112.7	P662	K660-P662 WeakPolarHBondContact O-CD 3.35Å
661	N	86	Confident	85	Confident	106 Å²	106	89.1 Å²	89.1	57%	0.567	44%	0.437	S	S	*	.			trans	-123	80.2	-179.4	-61.3	14.2	0	0	0	109.4	T659 E663 K664	T659-N661 PolarHBondContact OG1-N 2.86Å; N661-E663 VanDerWaalsContact C-N 3.35Å; N661-E663 PolarHBondContact O-N 2.92Å; N661-K664 PolarHBondContact O-N 2.89Å
662	P	82.3	Confident	85.3	Confident	66 Å²	66	85.6 Å²	85.6	43%	0.429	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-63.9	-36.4	-175.4	-23.1	35	0	0	0	113.5	T659 K660 K664 Y665 H666	T659-P662 HydrophobicContact CG2-CB 4.45Å; T659-P662 HydrophobicContact CG2-CG 4.4Å; K660-P662 WeakPolarHBondContact O-CD 3.35Å; P662-K664 PolarHBondContact O-N 3.4Å; P662-Y665 PolarHBondContact O-N 2.81Å; P662-H666 PolarHBondContact O-N 2.66Å; P662-H666 PolarHBondContact O-ND1 2.93Å
663	E	83.3	Confident	85.8	Confident	175 Å²	175	81.2 Å²	81.2	82%	0.818	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-61.4	-28.1	-177.4	-59.8	-175.4	-178.3	0	0	113.3	N661 Y665	N661-E663 VanDerWaalsContact C-N 3.35Å; N661-E663 PolarHBondContact O-N 2.92Å; E663-Y665 PolarHBondContact O-N 3.39Å
664	K	85.3	Confident	86.3	Confident	148 Å²	148	82.9 Å²	82.9	64%	0.643	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-66.4	-26.8	176.5	-176.4	174.3	179.5	177	0	112.8	N661 P662	N661-K664 PolarHBondContact O-N 2.89Å; P662-K664 PolarHBondContact O-N 3.4Å
665	Y	85.4	Confident	87.1	Confident	28 Å²	28	84.3 Å²	84.3	11%	0.11	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109	-38	-173.8	-64	-80.3	0	0	0	112	K603 F606 N610 F658 T659 P662 E663 K667	K603-Y665 HydrophobicContact CB-CD1 4.04Å; K603-Y665 HydrophobicContact CB-CE1 3.39Å; K603-Y665 HydrophobicContact CD-CE1 4.36Å; K603-Y665 HydrophobicContact CD-CE2 4.21Å; K603-Y665 WeakPolarHBondContact CD-OH 3.34Å; K603-Y665 HydrophobicContact CG-CD1 4.19Å; K603-Y665 HydrophobicContact CG-CD2 4.44Å; K603-Y665 HydrophobicContact CG-CE1 3.64Å; K603-Y665 HydrophobicContact CG-CE2 3.92Å; K603-Y665 VanDerWaalsContact CG-CZ 3.47Å; K603-Y665 WeakPolarHBondContact O-CD1 3.47Å; K603-Y665 WeakPolarHBondContact O-CE1 3.44Å; F606-Y665 HydrophobicContact CB-CD1 3.95Å; F606-Y665 HydrophobicContact CB-CG 4.42Å; F606-Y665 WeakPolarHBondContact CD1-O 3.27Å; N610-Y665 PolarHBondContact ND2-O 3.22Å; N610-Y665 VanDerWaalsContact ND2-O 3.14Å; F658-Y665 HydrophobicContact CE2-CD2 4.17Å; F658-Y665 HydrophobicContact CE2-CG 4.05Å; T659-Y665 HydrophobicContact CG2-CD2 3.99Å; T659-Y665 HydrophobicContact CG2-CE2 4.47Å; P662-Y665 PolarHBondContact O-N 2.81Å; E663-Y665 PolarHBondContact O-N 3.39Å; Y665-K667 PolarHBondContact O-N 3.39Å
666	H	86.2	Confident	88	Confident	69 Å²	69	78.7 Å²	78.7	32%	0.319	38%	0.376	S	S	.	.			trans	-83.8	58.3	169	-55.6	89.9	0	0	0	109.9	F606 F658 P662 Y668	F606-H666 AromaticContact CZ-NE2 3.97Å; F658-H666 AromaticContact CE1-CE1 3.66Å; F658-H666 AromaticContact CZ-CE1 3.6Å; P662-H666 PolarHBondContact O-N 2.66Å; P662-H666 PolarHBondContact O-ND1 2.93Å; H666-Y668 VanDerWaalsContact C-N 3.32Å
667	K	88.4	Confident	88.7	Confident	100 Å²	100	77.3 Å²	77.3	44%	0.435	37%	0.369	S	S	.	.			trans	-69.6	-31.3	-175.7	-173.4	175.2	177.2	-176.6	0	112.3	E614 Y665	E614-K667 WeakPolarHBondContact OE1-CD 3.36Å; E614-K667 VanDerWaalsContact OE1-CE 3.31Å; E614-K667 WeakPolarHBondContact OE1-CE 3.5Å; E614-K667 IonicContact OE1-NZ 2.65Å; E614-K667 PolarHBondContact OE1-NZ 3.26Å; E614-K667 IonicContact OE2-NZ 3.06Å; E614-K667 PolarHBondContact OE2-NZ 3.48Å; Y665-K667 PolarHBondContact O-N 3.39Å
668	Y	92.3	Very high	89.2	Confident	39 Å²	39	76.2 Å²	76.2	15%	0.153	35%	0.352	C	S	.	.			trans	-125.3	143	-176.1	-58.8	-69.5	0	0	0	111.7	N610 L613 E614 Y646 H666 E672 V673 M676	N610-Y668 HydrophobicContact CB-CE2 4.32Å; L613-Y668 HydrophobicContact CD2-CD2 4.42Å; E614-Y668 HydrophobicContact CG-CE2 4.39Å; E614-Y668 VanDerWaalsContact CG-OH 3.28Å; E614-Y668 WeakPolarHBondContact CG-OH 3.34Å; E614-Y668 WeakPolarHBondContact OE1-CE2 3.35Å; E614-Y668 PolarHBondContact OE1-OH 3.4Å; Y646-Y668 PolarHBondContact OH-O 2.83Å; H666-Y668 VanDerWaalsContact C-N 3.32Å; Y668-E672 VanDerWaalsContact CA-OE2 3.29Å; Y668-E672 WeakPolarHBondContact CA-OE2 3.32Å; Y668-E672 HydrophobicContact CD1-CB 4.44Å; Y668-V673 HydrophobicContact CG-CG2 4.42Å; Y668-M676 HydrophobicContact CD1-SD 4.09Å; Y668-M676 HydrophobicContact CE1-SD 3.82Å
669	R	91.2	Very high	89.6	Confident	173 Å²	173	80.9 Å²	80.9	65%	0.653	37%	0.373	S	S	*	.			trans	-81.3	154.2	162.7	-61.2	-176.7	177.8	-150.8	-0.4	109.8	E671 E672 V673	R669-E671 PolarHBondContact O-N 2.95Å; R669-E672 HydrophobicContact CB-CB 4.49Å; R669-E672 HydrophobicContact CB-CG 4.11Å; R669-E672 PolarHBondContact N-OE2 3.44Å; R669-E672 WeakPolarHBondContact O-CB 3.38Å; R669-E672 PolarHBondContact O-N 2.89Å; R669-V673 PolarHBondContact O-N 2.69Å; R669-V673 VanDerWaalsContact O-N 3.08Å
670	P	91.8	Very high	90	Very high	20 Å²	20	79.8 Å²	79.8	13%	0.13	37%	0.366	C	S	.	.	H	α-helix	trans	-50.3	-40.9	173.4	-27.2	35.1	0	0	0	113.1	Y646 R647 L650 E672 V673 E674	Y646-P670 HydrophobicContact CD1-CG 4.39Å; R647-P670 HydrophobicContact CG-CB 3.69Å; R647-P670 HydrophobicContact CG-CG 3.72Å; L650-P670 HydrophobicContact CD1-CG 3.79Å; P670-E672 VanDerWaalsContact C-N 3.33Å; P670-E672 PolarHBondContact O-N 2.68Å; P670-V673 PolarHBondContact O-N 3.24Å; P670-E674 WeakPolarHBondContact O-CG 3.32Å; P670-E674 PolarHBondContact O-N 3.5Å
671	E	94.2	Very high	90.4	Very high	101 Å²	101	70.2 Å²	70.2	47%	0.472	32%	0.324	S	S	.	.	H	α-helix	trans	-66.3	-33.9	179.7	-62.6	66.2	-136.1	0	0	112.1	R647 R669 E674 E675	R647-E671 IonicContact CZ-OE1 3Å; R647-E671 IonicContact NH2-OE1 3.2Å; R647-E671 PolarHBondContact NH2-OE1 3.35Å; R669-E671 PolarHBondContact O-N 2.95Å; E671-E674 PolarHBondContact O-N 3.31Å; E671-E675 PolarHBondContact O-N 2.93Å
672	E	93.9	Very high	90	Very high	80 Å²	80	67.9 Å²	67.9	37%	0.374	31%	0.312	S	S	.	.	H	α-helix	trans	-71.8	-37.5	176.2	-66	170.6	155.6	0	0	111.2	Y668 R669 P670 E674 E675 M676	Y668-E672 VanDerWaalsContact CA-OE2 3.29Å; Y668-E672 WeakPolarHBondContact CA-OE2 3.32Å; Y668-E672 HydrophobicContact CD1-CB 4.44Å; R669-E672 HydrophobicContact CB-CB 4.49Å; R669-E672 HydrophobicContact CB-CG 4.11Å; R669-E672 PolarHBondContact N-OE2 3.44Å; R669-E672 WeakPolarHBondContact O-CB 3.38Å; R669-E672 PolarHBondContact O-N 2.89Å; P670-E672 VanDerWaalsContact C-N 3.33Å; P670-E672 PolarHBondContact O-N 2.68Å; E672-E674 VanDerWaalsContact C-N 3.33Å; E672-E675 PolarHBondContact O-N 3.23Å; E672-M676 VanDerWaalsContact O-CG 3.29Å; E672-M676 WeakPolarHBondContact O-CG 3.46Å; E672-M676 PolarHBondContact O-N 2.9Å
673	V	94.1	Very high	88.9	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-63.7	-41.8	172.7	177.4	0	0	0	0	110.6	F609 L613 V642 Y646 Y668 R669 P670 M676 I677	F609-V673 HydrophobicContact CE1-CG2 4.39Å; F609-V673 HydrophobicContact CZ-CG1 4.36Å; F609-V673 HydrophobicContact CZ-CG2 4.42Å; L613-V673 HydrophobicContact CD1-CG1 4.49Å; L613-V673 HydrophobicContact CD2-CB 4.46Å; L613-V673 HydrophobicContact CD2-CG1 4Å; L613-V673 HydrophobicContact CD2-CG2 3.96Å; V642-V673 HydrophobicContact CG1-CG1 3.76Å; Y646-V673 HydrophobicContact CD1-CG2 3.94Å; Y646-V673 HydrophobicContact CE1-CG2 3.88Å; Y668-V673 HydrophobicContact CG-CG2 4.42Å; R669-V673 PolarHBondContact O-N 2.69Å; R669-V673 VanDerWaalsContact O-N 3.08Å; P670-V673 PolarHBondContact O-N 3.24Å; V673-M676 PolarHBondContact O-N 3.5Å; V673-I677 HydrophobicContact CG1-CD1 4.3Å; V673-I677 WeakPolarHBondContact O-CG1 3.09Å; V673-I677 PolarHBondContact O-N 2.92Å
674	E	94.6	Very high	87.2	Confident	37 Å²	37	67 Å²	67	17%	0.173	32%	0.322	C	S	.	.	H	α-helix	trans	-59.7	-46	174.7	-71	176.3	-176	0	0	111.3	R639 S643 R647 P670 E671 E672 M676 I677 E678	R639-E674 HydrophobicContact CG-CB 3.82Å; R639-E674 HydrophobicContact CG-CG 3.67Å; S643-E674 VanDerWaalsContact CB-OE1 3.27Å; S643-E674 WeakPolarHBondContact CB-OE1 3.48Å; S643-E674 PolarHBondContact OG-OE1 3.31Å; R647-E674 IonicContact CZ-OE1 2.87Å; R647-E674 IonicContact NH1-OE1 2.87Å; R647-E674 PolarHBondContact NH1-OE1 2.9Å; R647-E674 IonicContact NH2-OE1 2.73Å; R647-E674 PolarHBondContact NH2-OE1 2.89Å; R647-E674 IonicContact NH2-OE2 2.83Å; P670-E674 WeakPolarHBondContact O-CG 3.32Å; P670-E674 PolarHBondContact O-N 3.5Å; E671-E674 PolarHBondContact O-N 3.31Å; E672-E674 VanDerWaalsContact C-N 3.33Å; E674-M676 PolarHBondContact O-N 2.77Å; E674-I677 PolarHBondContact O-N 2.78Å; E674-E678 WeakPolarHBondContact O-CG 3.35Å; E674-E678 PolarHBondContact O-N 2.97Å
675	E	93.7	Very high	84.9	Confident	96 Å²	96	65.4 Å²	65.4	45%	0.449	34%	0.337	S	S	.	.	H	α-helix	trans	-64.2	-37.2	177.8	-166.7	-170.5	161.3	0	0	112.7	E671 E672 I677 E678 K679	E671-E675 PolarHBondContact O-N 2.93Å; E672-E675 PolarHBondContact O-N 3.23Å; E675-I677 VanDerWaalsContact C-N 3.3Å; E675-I677 PolarHBondContact O-N 2.8Å; E675-E678 PolarHBondContact O-N 3.4Å; E675-K679 WeakPolarHBondContact O-CG 3.4Å; E675-K679 PolarHBondContact O-N 2.91Å; E675-K679 VanDerWaalsContact OE1-CE 3.25Å; E675-K679 WeakPolarHBondContact OE1-CE 3.42Å; E675-K679 IonicContact OE1-NZ 3.43Å; E675-K679 PolarHBondContact OE1-NZ 2.83Å
676	M	93.9	Very high	84.8	Confident	43 Å²	43	67.3 Å²	67.3	21%	0.212	35%	0.348	C	S	.	.	H	α-helix	trans	-61.3	-38.7	175	-74.1	177.1	70.8	0	0	112.1	L613 C617 Y668 E672 V673 E674	L613-M676 HydrophobicContact CD2-CE 4.18Å; L613-M676 HydrophobicContact CD2-SD 4.08Å; L613-M676 HydrophobicContact CG-CE 4.07Å; C617-M676 HydrophobicContact CB-CE 4.19Å; Y668-M676 HydrophobicContact CD1-SD 4.09Å; Y668-M676 HydrophobicContact CE1-SD 3.82Å; E672-M676 VanDerWaalsContact O-CG 3.29Å; E672-M676 WeakPolarHBondContact O-CG 3.46Å; E672-M676 PolarHBondContact O-N 2.9Å; V673-M676 PolarHBondContact O-N 3.5Å; E674-M676 PolarHBondContact O-N 2.77Å
677	I	94.1	Very high	84.8	Confident	1 Å²	1	67.2 Å²	67.2	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-71.2	-38.8	177.9	-65.1	168.4	0	0	0	110.8	W573 Q638 R639 V642 V673 E674 E675 K679 L680	W573-I677 HydrophobicContact CH2-CD1 4.27Å; W573-I677 HydrophobicContact CH2-CG1 3.79Å; W573-I677 HydrophobicContact CZ3-CD1 4.29Å; W573-I677 HydrophobicContact CZ3-CG1 4.24Å; Q638-I677 HydrophobicContact CB-CG2 4.2Å; Q638-I677 HydrophobicContact CG-CG2 4.43Å; R639-I677 HydrophobicContact CB-CG2 4.14Å; V642-I677 HydrophobicContact CB-CD1 3.77Å; V642-I677 HydrophobicContact CG1-CD1 4.08Å; V642-I677 HydrophobicContact CG2-CD1 4.02Å; V673-I677 HydrophobicContact CG1-CD1 4.3Å; V673-I677 WeakPolarHBondContact O-CG1 3.09Å; V673-I677 PolarHBondContact O-N 2.92Å; E674-I677 PolarHBondContact O-N 2.78Å; E675-I677 VanDerWaalsContact C-N 3.3Å; E675-I677 PolarHBondContact O-N 2.8Å; I677-K679 PolarHBondContact O-N 3.42Å; I677-L680 WeakPolarHBondContact O-CB 3.38Å; I677-L680 WeakPolarHBondContact O-CG 3.31Å; I677-L680 PolarHBondContact O-N 2.97Å; I677-L680 VanDerWaalsContact O-N 3.16Å
678	E	92.1	Very high	84.6	Confident	82 Å²	82	65.4 Å²	65.4	38%	0.383	35%	0.345	S	S	.	.	H	α-helix	trans	-62.9	-27.8	178.7	-74.8	-178.8	179.3	0	0	113.3	R635 R639 E674 E675 L680	R635-E678 PolarHBondContact NE-O 3.36Å; R635-E678 PolarHBondContact NH1-O 2.78Å; R635-E678 PolarHBondContact NH2-O 3.34Å; R639-E678 WeakPolarHBondContact CD-OE1 3.15Å; R639-E678 IonicContact CZ-OE1 3.22Å; R639-E678 IonicContact NE-OE1 2.72Å; R639-E678 IonicContact NH1-OE1 3.57Å; R639-E678 PolarHBondContact NH1-OE1 2.88Å; E674-E678 WeakPolarHBondContact O-CG 3.35Å; E674-E678 PolarHBondContact O-N 2.97Å; E675-E678 PolarHBondContact O-N 3.4Å; E678-L680 VanDerWaalsContact C-N 3.35Å
679	K	91.4	Very high	84.1	Confident	104 Å²	104	66.9 Å²	66.9	45%	0.452	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-7.5	177.3	-70.1	171.8	-177.3	166.8	0	114.6	E675 I677	E675-K679 WeakPolarHBondContact O-CG 3.4Å; E675-K679 PolarHBondContact O-N 2.91Å; E675-K679 VanDerWaalsContact OE1-CE 3.25Å; E675-K679 WeakPolarHBondContact OE1-CE 3.42Å; E675-K679 IonicContact OE1-NZ 3.43Å; E675-K679 PolarHBondContact OE1-NZ 2.83Å; I677-K679 PolarHBondContact O-N 3.42Å
680	L	93.2	Very high	83.7	Confident	4 Å²	4	60.3 Å²	60.3	2%	0.021	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	139.6	179.1	-61.8	179.6	0	0	0	110.8	W573 C617 Q620 R635 I677 E678 D682	W573-L680 HydrophobicContact CH2-CD1 3.85Å; W573-L680 HydrophobicContact CZ2-CD1 3.57Å; C617-L680 HydrophobicContact CB-CD2 4.11Å; Q620-L680 HydrophobicContact CB-CD2 4.13Å; R635-L680 PolarHBondContact NE-O 2.88Å; R635-L680 PolarHBondContact NH2-O 3.39Å; I677-L680 WeakPolarHBondContact O-CB 3.38Å; I677-L680 WeakPolarHBondContact O-CG 3.31Å; I677-L680 PolarHBondContact O-N 2.97Å; I677-L680 VanDerWaalsContact O-N 3.16Å; E678-L680 VanDerWaalsContact C-N 3.35Å; L680-D682 VanDerWaalsContact C-N 3.32Å; L680-D682 PolarHBondContact O-N 3.26Å
681	F	91.2	Very high	83.1	Confident	2 Å²	2	63 Å²	63	1%	0.009	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.9	15.9	-179.4	-36.6	-66.9	0	0	0	116.4	Y569 W623 I625 R631 I634 R635	Y569-F681 AromaticContact CE2-CZ 3.74Å; Y569-F681 HydrophobicContact CE2-CZ 3.74Å; Y569-F681 AromaticContact CZ-CZ 3.72Å; Y569-F681 WeakPolarHBondContact OH-CZ 3.32Å; W623-F681 HydrophobicContact CB-CD1 3.89Å; W623-F681 HydrophobicContact CB-CE1 3.87Å; W623-F681 HydrophobicContact CE3-CE1 4.08Å; W623-F681 WeakPolarHBondContact O-CA 3.45Å; I625-F681 HydrophobicContact CB-CB 4.25Å; I625-F681 HydrophobicContact CB-CG 4.49Å; I625-F681 HydrophobicContact CD1-CB 4.33Å; I625-F681 HydrophobicContact CD1-CD1 3.95Å; I625-F681 HydrophobicContact CD1-CD2 3.67Å; I625-F681 HydrophobicContact CD1-CE1 4.16Å; I625-F681 HydrophobicContact CD1-CE2 3.9Å; I625-F681 HydrophobicContact CD1-CG 3.7Å; I625-F681 HydrophobicContact CD1-CZ 4.15Å; I625-F681 HydrophobicContact CG1-CB 4.1Å; I625-F681 HydrophobicContact CG1-CD1 3.87Å; I625-F681 HydrophobicContact CG1-CD2 4.32Å; I625-F681 HydrophobicContact CG1-CE1 4.4Å; I625-F681 HydrophobicContact CG1-CG 3.83Å; R631-F681 WeakPolarHBondContact CD-O 3.17Å; R631-F681 HydrophobicContact CG-CB 4.01Å; I634-F681 HydrophobicContact CG2-CE2 4.32Å; R635-F681 HydrophobicContact CG-CD2 4.43Å; R635-F681 PolarHBondContact NH2-O 3.45Å
682	D	77.7	Confident	82.3	Confident	57 Å²	57	60.3 Å²	60.3	31%	0.305	34%	0.343	S	S	.	.			trans	-73.5	128.5	175.2	-92.2	-21.8	0	0	0	110.7	R635 L680 S684 A685	R635-D682 IonicContact CZ-OD1 2.97Å; R635-D682 IonicContact NH1-OD1 2.64Å; R635-D682 PolarHBondContact NH1-OD1 3.46Å; R635-D682 IonicContact NH2-OD1 2.7Å; R635-D682 PolarHBondContact NH2-OD1 3.14Å; R635-D682 IonicContact NH2-OD2 3.66Å; L680-D682 VanDerWaalsContact C-N 3.32Å; L680-D682 PolarHBondContact O-N 3.26Å; D682-S684 PolarHBondContact O-N 3.25Å; D682-A685 PolarHBondContact O-N 3.23Å
683	T	59.4	Low	81.4	Confident	114 Å²	114	58.8 Å²	58.8	70%	0.699	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	1.4	-179.6	45.8	0	0	0	0	114.4
684	S	47.5	Very low	80.4	Confident	108 Å²	108	63.7 Å²	63.7	76%	0.755	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.5	17.4	-176.5	42.6	0	0	0	0	113.4	D682	D682-S684 PolarHBondContact O-N 3.25Å
685	A	35.9	Very low	79.1	Confident	116 Å²	116	66.1 Å²	66.1	96%	0.959	39%	0.386	S	S	*	.			trans	-102.1	0	-179.7	0	0	0	0	0	113.1	K621 D682	K621-A685 HydrophobicContact CG-CB 4.37Å; D682-A685 PolarHBondContact O-N 3.23Å

Retrieved 685 of 685 residues in 2867.8 ms (Link to these results)

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