A0A077ZF23_TRITR Loading...

Protein phosphatase PP2A regulatory subunit A

AlphaFold DB , UniProt , Accession A0A077ZF23, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 621 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	36.9	Very low	240 Å²	240	139.8 Å²	139.8	100%	1.182	84%	0.835	S	S	*	*				0	123.5	0	-78.1	-173	-107.1	0	0	107.7
2	S	35.3	Very low	37	Very low	111 Å²	111	137.5 Å²	137.5	78%	0.776	82%	0.823	S	S	*	*			trans	52.6	99.1	165.7	-159.9	0	0	0	0	117
3	V	33.7	Very low	37	Very low	137 Å²	137	139.2 Å²	139.2	83%	0.83	82%	0.817	S	S	*	*				51.4	117.9	73.7	-166.5	0	0	0	0	113.6
4	G	37.8	Very low	37	Very low	79 Å²	79	139.9 Å²	139.9	81%	0.814	81%	0.811	S	S	*	*			trans	-168.8	89.6	166.7	0	0	0	0	0	110
5	T	36.2	Very low	37	Very low	135 Å²	135	139.7 Å²	139.7	83%	0.828	80%	0.799	S	S	*	*			trans	-87.4	130.3	172	33.8	0	0	0	0	110.8
6	M	38.1	Very low	36.9	Very low	187 Å²	187	139.9 Å²	139.9	92%	0.921	79%	0.791	S	S	*	*			trans	-142.3	157.3	157.4	-70	-169.8	-152.9	0	0	107.5
7	S	35.2	Very low	36.8	Very low	93 Å²	93	139.6 Å²	139.6	65%	0.65	79%	0.787	S	S	*	*				-171.8	109.2	-55.1	47.6	0	0	0	0	105	M9	S7-M9 VanDerWaalsContact C-N 3.27Å; S7-M9 PolarHBondContact O-N 3.32Å
8	A	37.2	Very low	36.7	Very low	107 Å²	107	140.3 Å²	140.3	88%	0.884	78%	0.783	S	S	*	*	S	Bend	trans	24.2	17.8	154.5	0	0	0	0	0	124
9	M	40	Very low	36.6	Very low	162 Å²	162	140.5 Å²	140.5	80%	0.798	78%	0.777	S	S	*	*			trans	-107.1	-1.9	-178.8	-89	-178.1	73.8	0	0	115.8	S7	S7-M9 VanDerWaalsContact C-N 3.27Å; S7-M9 PolarHBondContact O-N 3.32Å
10	E	37.9	Very low	36.7	Very low	172 Å²	172	140.8 Å²	140.8	80%	0.804	77%	0.772	S	S	*	*	S	Bend	trans	-97.7	6.3	-175.6	-72	176.5	157.2	0	0	114.8
11	V	37.5	Very low	36.9	Very low	115 Å²	115	136.1 Å²	136.1	70%	0.697	76%	0.756	S	S	*	*	S	Bend	trans	-94.7	-6.9	-176.9	-172.5	0	0	0	0	112.8
12	T	38.2	Very low	37.5	Very low	112 Å²	112	130.4 Å²	130.4	69%	0.687	73%	0.731	S	S	*	*	S	Bend	trans	-97.8	-13.5	-176	-2.5	0	0	0	0	115
13	E	37.4	Very low	38.3	Very low	159 Å²	159	131.1 Å²	131.1	74%	0.743	73%	0.725	S	S	*	*	S	Bend	trans	-90.9	-10.8	179	-75.8	-179	165.4	0	0	113.6
14	M	36.2	Very low	39.5	Very low	149 Å²	149	128.1 Å²	128.1	73%	0.734	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-3.9	179.5	-74.3	-173.7	61.6	0	0	114.7
15	H	37.4	Very low	40.9	Very low	137 Å²	137	128.5 Å²	128.5	63%	0.634	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104	-3.6	-178.3	-81	-49.3	0	0	0	114.9
16	E	34.7	Very low	42.7	Very low	143 Å²	143	129.8 Å²	129.8	67%	0.668	69%	0.689	S	S	*	*	S	Bend	trans	-94.2	-24.8	179.2	-69.6	-174.8	160.8	0	0	113.4
17	D	35.6	Very low	44.4	Very low	136 Å²	136	124.4 Å²	124.4	73%	0.727	67%	0.668	S	S	*	*	H	α-helix	trans	-77.1	-23	180	-84.3	-25.8	0	0	0	114.5	Q19	D17-Q19 VanDerWaalsContact C-N 3.35Å
18	E	35.4	Very low	46.3	Very low	152 Å²	152	120.6 Å²	120.6	71%	0.71	64%	0.641	S	S	*	*	H	α-helix	trans	-76.3	-20.3	176.5	-77.3	-171.9	158.6	0	0	113.2
19	Q	35	Very low	48.3	Very low	143 Å²	143	117.8 Å²	117.8	67%	0.668	62%	0.617	S	S	*	*	H	α-helix	trans	-82.5	-28.6	178.8	-78.4	-177.8	-15.8	0	0	113	D17 G21 N22	D17-Q19 VanDerWaalsContact C-N 3.35Å; Q19-G21 VanDerWaalsContact C-N 3.35Å; Q19-G21 PolarHBondContact O-N 3.49Å; Q19-N22 PolarHBondContact O-N 3Å
20	H	38.2	Very low	50.2	Low	146 Å²	146	112.3 Å²	112.3	68%	0.676	59%	0.593	S	S	*	*	H	α-helix	trans	-75.1	-18.7	178.3	-80.8	-2.9	0	0	0	114.6
21	G	41.1	Very low	52.2	Low	43 Å²	43	104.9 Å²	104.9	44%	0.443	56%	0.559	S	S	.	*	H	α-helix	trans	-73.9	-27.5	173.8	0	0	0	0	0	114.3	Q19	Q19-G21 VanDerWaalsContact C-N 3.35Å; Q19-G21 PolarHBondContact O-N 3.49Å
22	N	48.5	Very low	54.2	Low	121 Å²	121	102.1 Å²	102.1	65%	0.647	54%	0.54	S	S	*	.	H	α-helix	trans	-81.1	-33.3	-176.5	-98.2	-15.4	0	0	0	113.4	Q19 A24 L25 Y26	Q19-N22 PolarHBondContact O-N 3Å; N22-A24 VanDerWaalsContact C-N 3.31Å; N22-A24 PolarHBondContact O-N 2.75Å; N22-L25 PolarHBondContact O-N 3.2Å; N22-Y26 PolarHBondContact O-N 3.12Å
23	D	52.2	Low	56.4	Low	125 Å²	125	102.4 Å²	102.4	67%	0.668	54%	0.537	S	S	*	.	H	α-helix	trans	-69.1	-28.6	178.5	-86.8	-14.6	0	0	0	112.7	L25 P27	D23-L25 VanDerWaalsContact C-N 3.31Å; D23-L25 PolarHBondContact O-N 3.43Å; D23-P27 WeakPolarHBondContact O-CD 3.41Å
24	A	59.4	Low	58.8	Low	74 Å²	74	97 Å²	97	61%	0.612	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-24.5	177.6	0	0	0	0	0	113.5	N22	N22-A24 VanDerWaalsContact C-N 3.31Å; N22-A24 PolarHBondContact O-N 2.75Å
25	L	67	Low	61.2	Low	88 Å²	88	90.2 Å²	90.2	46%	0.461	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-19.2	-179.5	-79	157.6	0	0	0	113	N22 D23 V28 A29	N22-L25 PolarHBondContact O-N 3.2Å; D23-L25 VanDerWaalsContact C-N 3.31Å; D23-L25 PolarHBondContact O-N 3.43Å; L25-V28 WeakPolarHBondContact O-CB 3.33Å; L25-V28 PolarHBondContact O-N 3.02Å; L25-V28 VanDerWaalsContact O-N 3.12Å; L25-A29 PolarHBondContact O-N 3.02Å
26	Y	73.7	Confident	63.5	Low	161 Å²	161	92.4 Å²	92.4	63%	0.631	48%	0.481	S	S	*	.	H	α-helix	trans	-58.6	-46.2	-178.8	-175.8	-98.8	0	0	0	113.5	N22 V28 A29 V30	N22-Y26 PolarHBondContact O-N 3.12Å; Y26-V28 PolarHBondContact O-N 3.43Å; Y26-A29 PolarHBondContact O-N 3.04Å; Y26-V30 HydrophobicContact CD1-CG2 4.24Å; Y26-V30 HydrophobicContact CE1-CG2 3.85Å; Y26-V30 WeakPolarHBondContact O-CG2 3.36Å; Y26-V30 PolarHBondContact O-N 2.86Å
27	P	74.7	Confident	66.1	Low	74 Å²	74	88.5 Å²	88.5	48%	0.481	47%	0.465	S	S	.	.	H	α-helix	trans	-61.3	-30.3	176.7	-23	34.3	0	0	0	113.3	D23 L31	D23-P27 WeakPolarHBondContact O-CD 3.41Å; P27-L31 VanDerWaalsContact O-CG 3.29Å; P27-L31 WeakPolarHBondContact O-CG 3.35Å; P27-L31 PolarHBondContact O-N 3.33Å; P27-L31 VanDerWaalsContact O-N 3.09Å
28	V	75	Confident	68.7	Low	14 Å²	14	91 Å²	91	9%	0.085	47%	0.472	C	S	.	.	H	α-helix	trans	-75.9	-40.8	178.8	177.8	0	0	0	0	110.5	L25 Y26 V30 L31 I32 I53 A56	L25-V28 WeakPolarHBondContact O-CB 3.33Å; L25-V28 PolarHBondContact O-N 3.02Å; L25-V28 VanDerWaalsContact O-N 3.12Å; Y26-V28 PolarHBondContact O-N 3.43Å; V28-V30 VanDerWaalsContact C-N 3.3Å; V28-V30 PolarHBondContact O-N 2.9Å; V28-L31 PolarHBondContact O-N 3.46Å; V28-I32 HydrophobicContact CG1-CD1 4Å; V28-I32 VanDerWaalsContact O-CG1 3.31Å; V28-I32 WeakPolarHBondContact O-CG1 3.44Å; V28-I32 PolarHBondContact O-N 3.4Å; V28-I53 HydrophobicContact CG1-CG2 4.39Å; V28-A56 HydrophobicContact CB-CB 4.11Å; V28-A56 HydrophobicContact CG1-CB 3.7Å; V28-A56 HydrophobicContact CG2-CB 3.47Å; V28-A56 VanDerWaalsContact CG2-CB 3.47Å
29	A	79.3	Confident	71.3	Confident	47 Å²	47	87.5 Å²	87.5	39%	0.388	46%	0.458	S	S	.	.	H	α-helix	trans	-59.2	-43.4	173.4	0	0	0	0	0	111.2	L25 Y26 L31 I32 D33	L25-A29 PolarHBondContact O-N 3.02Å; Y26-A29 PolarHBondContact O-N 3.04Å; A29-L31 PolarHBondContact O-N 2.88Å; A29-I32 PolarHBondContact O-N 3.03Å; A29-D33 PolarHBondContact O-N 3.05Å
30	V	80.1	Confident	74	Confident	48 Å²	48	82.8 Å²	82.8	29%	0.291	44%	0.439	S	S	.	.	H	α-helix	trans	-59.7	-47.1	174	174.8	0	0	0	0	111.2	Y26 V28 I32 D33 E34	Y26-V30 HydrophobicContact CD1-CG2 4.24Å; Y26-V30 HydrophobicContact CE1-CG2 3.85Å; Y26-V30 WeakPolarHBondContact O-CG2 3.36Å; Y26-V30 PolarHBondContact O-N 2.86Å; V28-V30 VanDerWaalsContact C-N 3.3Å; V28-V30 PolarHBondContact O-N 2.9Å; V30-I32 VanDerWaalsContact C-N 3.29Å; V30-I32 PolarHBondContact O-N 3.08Å; V30-D33 PolarHBondContact O-N 3.36Å; V30-E34 HydrophobicContact CG1-CG 4.19Å; V30-E34 WeakPolarHBondContact O-CB 3.11Å; V30-E34 VanDerWaalsContact O-CG 3.26Å; V30-E34 WeakPolarHBondContact O-CG 3.3Å; V30-E34 PolarHBondContact O-N 3.14Å
31	L	79.5	Confident	76.6	Confident	16 Å²	16	80.7 Å²	80.7	8%	0.084	43%	0.43	C	S	.	.	H	α-helix	trans	-62.4	-34.7	177.7	-72.1	169.9	0	0	0	112.9	P27 V28 A29 E34 L35 S46 K49 I53	P27-L31 VanDerWaalsContact O-CG 3.29Å; P27-L31 WeakPolarHBondContact O-CG 3.35Å; P27-L31 PolarHBondContact O-N 3.33Å; P27-L31 VanDerWaalsContact O-N 3.09Å; V28-L31 PolarHBondContact O-N 3.46Å; A29-L31 PolarHBondContact O-N 2.88Å; L31-E34 WeakPolarHBondContact CD2-OE2 3.4Å; L31-L35 PolarHBondContact O-N 2.91Å; L31-S46 WeakPolarHBondContact O-CB 3.28Å; L31-K49 HydrophobicContact CD1-CB 4.26Å; L31-K49 HydrophobicContact CD1-CD 4.31Å; L31-K49 HydrophobicContact CD2-CB 4.29Å; L31-K49 HydrophobicContact CD2-CD 3.79Å; L31-I53 HydrophobicContact CB-CD1 3.81Å; L31-I53 HydrophobicContact CB-CG1 3.85Å; L31-I53 HydrophobicContact CD1-CG1 4.2Å
32	I	79.5	Confident	79	Confident	57 Å²	57	81.2 Å²	81.2	29%	0.292	42%	0.422	S	S	.	.	H	α-helix	trans	-69.6	-41.8	176.1	-68.8	167.7	0	0	0	110.7	V28 A29 V30 E34 L35 I53 L57	V28-I32 HydrophobicContact CG1-CD1 4Å; V28-I32 VanDerWaalsContact O-CG1 3.31Å; V28-I32 WeakPolarHBondContact O-CG1 3.44Å; V28-I32 PolarHBondContact O-N 3.4Å; A29-I32 PolarHBondContact O-N 3.03Å; V30-I32 VanDerWaalsContact C-N 3.29Å; V30-I32 PolarHBondContact O-N 3.08Å; I32-E34 VanDerWaalsContact C-N 3.34Å; I32-L35 WeakPolarHBondContact O-CB 3.46Å; I32-L35 PolarHBondContact O-N 3.06Å; I32-I53 HydrophobicContact CD1-CG2 3.99Å; I32-I53 HydrophobicContact CG1-CG2 3.62Å; I32-L57 HydrophobicContact CD1-CD2 4.32Å
33	D	84	Confident	81.1	Confident	118 Å²	118	76.8 Å²	76.8	63%	0.631	40%	0.396	S	S	*	.	H	α-helix	trans	-66.4	-37.9	175.7	-76.9	-16.9	0	0	0	111.5	A29 V30 L35 R36	A29-D33 PolarHBondContact O-N 3.05Å; V30-D33 PolarHBondContact O-N 3.36Å; D33-L35 PolarHBondContact O-N 3.22Å; D33-R36 PolarHBondContact O-N 3.34Å
34	E	88.3	Confident	83.1	Confident	44 Å²	44	71.1 Å²	71.1	21%	0.206	37%	0.366	C	S	.	.	H	α-helix	trans	-63.5	-26.6	177.6	-77.3	176	174.2	0	0	112.9	V30 L31 I32 R36 N37 L42 R43 S46	V30-E34 HydrophobicContact CG1-CG 4.19Å; V30-E34 WeakPolarHBondContact O-CB 3.11Å; V30-E34 VanDerWaalsContact O-CG 3.26Å; V30-E34 WeakPolarHBondContact O-CG 3.3Å; V30-E34 PolarHBondContact O-N 3.14Å; L31-E34 WeakPolarHBondContact CD2-OE2 3.4Å; I32-E34 VanDerWaalsContact C-N 3.34Å; E34-R36 PolarHBondContact O-N 2.91Å; E34-R36 VanDerWaalsContact O-N 3.14Å; E34-N37 WeakPolarHBondContact O-CB 3.43Å; E34-N37 PolarHBondContact O-N 3.27Å; E34-L42 HydrophobicContact CG-CB 4.46Å; E34-R43 WeakPolarHBondContact O-CG 3.47Å; E34-S46 WeakPolarHBondContact CB-OG 3.5Å; E34-S46 PolarHBondContact OE2-OG 3.04Å; E34-S46 VanDerWaalsContact OE2-OG 3.05Å
35	L	86.3	Confident	84.6	Confident	8 Å²	8	70.6 Å²	70.6	4%	0.042	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-19.1	173.6	-70.9	168.5	0	0	0	113.1	L31 I32 D33 R43 I47 I53 L66 F69	L31-L35 PolarHBondContact O-N 2.91Å; I32-L35 WeakPolarHBondContact O-CB 3.46Å; I32-L35 PolarHBondContact O-N 3.06Å; D33-L35 PolarHBondContact O-N 3.22Å; L35-R43 WeakPolarHBondContact O-CD 3.46Å; L35-I47 HydrophobicContact CD2-CD1 3.49Å; L35-I47 VanDerWaalsContact CD2-CD1 3.49Å; L35-I47 HydrophobicContact CD2-CG1 3.83Å; L35-I53 HydrophobicContact CD1-CD1 3.98Å; L35-L66 HydrophobicContact CD1-CD1 4.4Å; L35-F69 HydrophobicContact CB-CE1 3.75Å; L35-F69 HydrophobicContact CB-CZ 4.11Å; L35-F69 HydrophobicContact CD1-CD1 4.37Å; L35-F69 HydrophobicContact CD1-CE1 3.86Å; L35-F69 HydrophobicContact CG-CE1 4.38Å
36	R	86.6	Confident	85.8	Confident	182 Å²	182	66.4 Å²	66.4	69%	0.687	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	8.1	176.3	-61.8	-179.5	-178.5	-171.4	-3.5	112.7	D33 E34 F69	D33-R36 PolarHBondContact O-N 3.34Å; E34-R36 PolarHBondContact O-N 2.91Å; E34-R36 VanDerWaalsContact O-N 3.14Å; R36-F69 HydrophobicContact CG-CE2 3.95Å; R36-F69 HydrophobicContact CG-CZ 3.65Å
37	N	88.8	Confident	86.8	Confident	61 Å²	61	58.9 Å²	58.9	33%	0.326	30%	0.301	S	S	.	.			trans	-67.3	151.8	-177.7	-158.7	-71.9	0	0	0	111	E34 D39 L42 R43	E34-N37 WeakPolarHBondContact O-CB 3.43Å; E34-N37 PolarHBondContact O-N 3.27Å; N37-D39 VanDerWaalsContact C-N 3.3Å; N37-D39 WeakPolarHBondContact OD1-CB 3.48Å; N37-D39 PolarHBondContact OD1-N 3.09Å; N37-L42 HydrophobicContact CB-CB 4.15Å; N37-L42 HydrophobicContact CB-CD1 4.43Å; N37-L42 WeakPolarHBondContact ND2-CD1 3.46Å; N37-R43 HydrophobicContact CB-CG 4.41Å; N37-R43 VanDerWaalsContact O-CD 3.23Å; N37-R43 WeakPolarHBondContact O-CD 3.39Å; N37-R43 WeakPolarHBondContact O-CG 3.49Å; N37-R43 PolarHBondContact O-NH1 3.2Å
38	E	89.3	Confident	87.7	Confident	189 Å²	189	62.3 Å²	62.3	88%	0.883	31%	0.305	S	S	*	.	S	Bend	trans	-69.3	-29.6	173.9	-63.1	-178	174.7	0	0	111.9	V40 R43	E38-V40 PolarHBondContact O-N 3.29Å; E38-R43 VanDerWaalsContact C-NH1 3.26Å; E38-R43 PolarHBondContact O-NH1 2.89Å
39	D	91.3	Very high	88.5	Confident	79 Å²	79	66.9 Å²	66.9	42%	0.422	32%	0.324	S	S	.	.			trans	-76.1	118	177.9	-170.4	-15.8	0	0	0	111.9	N37 Q41 L42 R43	N37-D39 VanDerWaalsContact C-N 3.3Å; N37-D39 WeakPolarHBondContact OD1-CB 3.48Å; N37-D39 PolarHBondContact OD1-N 3.09Å; D39-Q41 VanDerWaalsContact C-N 3.27Å; D39-Q41 PolarHBondContact O-N 3.01Å; D39-Q41 WeakPolarHBondContact OD1-CB 3.49Å; D39-Q41 PolarHBondContact OD1-N 2.9Å; D39-L42 HydrophobicContact CB-CB 4.24Å; D39-L42 HydrophobicContact CB-CD1 4.03Å; D39-L42 HydrophobicContact CB-CG 4.04Å; D39-L42 PolarHBondContact O-N 2.78Å; D39-R43 PolarHBondContact O-N 2.59Å; D39-R43 VanDerWaalsContact O-N 3.12Å
40	V	91.9	Very high	89.2	Confident	43 Å²	43	64.7 Å²	64.7	26%	0.261	31%	0.305	S	S	.	.	H	α-helix	trans	-57.6	-38.1	177.2	-173.9	0	0	0	0	111.8	E38 L42 R43 L44 E77 V80	E38-V40 PolarHBondContact O-N 3.29Å; V40-L42 VanDerWaalsContact C-N 3.33Å; V40-L42 PolarHBondContact O-N 3.17Å; V40-R43 PolarHBondContact O-N 3.07Å; V40-L44 VanDerWaalsContact O-CB 3.24Å; V40-L44 WeakPolarHBondContact O-CB 3.36Å; V40-L44 PolarHBondContact O-N 2.95Å; V40-E77 HydrophobicContact CG1-CB 4.14Å; V40-E77 HydrophobicContact CG1-CG 4.17Å; V40-E77 HydrophobicContact CG2-CG 3.9Å; V40-V80 HydrophobicContact CG1-CG2 3.92Å
41	Q	92.3	Very high	89.9	Confident	103 Å²	103	63.9 Å²	63.9	48%	0.481	30%	0.302	S	S	.	.	H	α-helix	trans	-66.5	-37.1	-179.7	-73.4	-70.8	-35.7	0	0	111.6	D39 N45	D39-Q41 VanDerWaalsContact C-N 3.27Å; D39-Q41 PolarHBondContact O-N 3.01Å; D39-Q41 WeakPolarHBondContact OD1-CB 3.49Å; D39-Q41 PolarHBondContact OD1-N 2.9Å; Q41-N45 VanDerWaalsContact O-CB 3.31Å; Q41-N45 WeakPolarHBondContact O-CB 3.41Å; Q41-N45 PolarHBondContact O-N 3.12Å; Q41-N45 PolarHBondContact O-ND2 3.48Å
42	L	91.4	Very high	90.5	Very high	54 Å²	54	66.3 Å²	66.3	28%	0.283	32%	0.317	S	S	.	.	H	α-helix	trans	-67.2	-50.5	175.4	-67	179.8	0	0	0	110.1	E34 N37 D39 V40 L44 N45 S46	E34-L42 HydrophobicContact CG-CB 4.46Å; N37-L42 HydrophobicContact CB-CB 4.15Å; N37-L42 HydrophobicContact CB-CD1 4.43Å; N37-L42 WeakPolarHBondContact ND2-CD1 3.46Å; D39-L42 HydrophobicContact CB-CB 4.24Å; D39-L42 HydrophobicContact CB-CD1 4.03Å; D39-L42 HydrophobicContact CB-CG 4.04Å; D39-L42 PolarHBondContact O-N 2.78Å; V40-L42 VanDerWaalsContact C-N 3.33Å; V40-L42 PolarHBondContact O-N 3.17Å; L42-L44 VanDerWaalsContact C-N 3.32Å; L42-L44 PolarHBondContact O-N 2.85Å; L42-N45 PolarHBondContact O-N 3.35Å; L42-N45 VanDerWaalsContact O-N 3.11Å; L42-S46 PolarHBondContact O-N 2.85Å; L42-S46 PolarHBondContact O-OG 3.21Å
43	R	93.1	Very high	91.1	Very high	27 Å²	27	63.6 Å²	63.6	10%	0.102	30%	0.303	C	S	.	.	H	α-helix	trans	-54.8	-47	175.6	-65.2	-160.2	-58	-76.4	4.1	112.1	E34 L35 N37 E38 D39 V40 N45 S46 I47 D76 V80	E34-R43 WeakPolarHBondContact O-CG 3.47Å; L35-R43 WeakPolarHBondContact O-CD 3.46Å; N37-R43 HydrophobicContact CB-CG 4.41Å; N37-R43 VanDerWaalsContact O-CD 3.23Å; N37-R43 WeakPolarHBondContact O-CD 3.39Å; N37-R43 WeakPolarHBondContact O-CG 3.49Å; N37-R43 PolarHBondContact O-NH1 3.2Å; E38-R43 VanDerWaalsContact C-NH1 3.26Å; E38-R43 PolarHBondContact O-NH1 2.89Å; D39-R43 PolarHBondContact O-N 2.59Å; D39-R43 VanDerWaalsContact O-N 3.12Å; V40-R43 PolarHBondContact O-N 3.07Å; R43-N45 PolarHBondContact O-N 3.26Å; R43-S46 PolarHBondContact O-N 3.48Å; R43-I47 WeakPolarHBondContact O-CG1 3.4Å; R43-I47 PolarHBondContact O-N 3.3Å; R43-D76 WeakPolarHBondContact CD-OD2 3.5Å; R43-D76 IonicContact CZ-OD1 2.71Å; R43-D76 VanDerWaalsContact CZ-OD1 3.24Å; R43-D76 IonicContact CZ-OD2 3.79Å; R43-D76 VanDerWaalsContact NE-CG 3.33Å; R43-D76 IonicContact NE-OD1 3.47Å; R43-D76 PolarHBondContact NE-OD1 2.96Å; R43-D76 IonicContact NE-OD2 2.78Å; R43-D76 PolarHBondContact NE-OD2 2.93Å; R43-D76 IonicContact NH2-OD1 3.39Å; R43-D76 PolarHBondContact NH2-OD1 3.33Å; R43-V80 HydrophobicContact CB-CG1 4.44Å; R43-V80 HydrophobicContact CB-CG2 4.32Å
44	L	93	Very high	91.5	Very high	6 Å²	6	58 Å²	58	3%	0.031	27%	0.274	C	S	.	.	H	α-helix	trans	-60.7	-42.8	178.1	-176.9	65.5	0	0	0	112.2	V40 L42 S46 I47 R48 E79 V80 A83	V40-L44 VanDerWaalsContact O-CB 3.24Å; V40-L44 WeakPolarHBondContact O-CB 3.36Å; V40-L44 PolarHBondContact O-N 2.95Å; L42-L44 VanDerWaalsContact C-N 3.32Å; L42-L44 PolarHBondContact O-N 2.85Å; L44-S46 VanDerWaalsContact C-N 3.34Å; L44-I47 PolarHBondContact O-N 2.99Å; L44-R48 WeakPolarHBondContact O-CG 3.4Å; L44-R48 PolarHBondContact O-N 3Å; L44-E79 WeakPolarHBondContact CD1-O 3.43Å; L44-V80 HydrophobicContact CB-CG2 4.43Å; L44-A83 HydrophobicContact CD1-CB 3.67Å
45	N	92.1	Very high	91.8	Very high	63 Å²	63	61.6 Å²	61.6	34%	0.337	29%	0.294	S	S	.	.	H	α-helix	trans	-64.6	-38.6	176.8	-75.6	-32.5	0	0	0	112	Q41 L42 R43 R48 K49	Q41-N45 VanDerWaalsContact O-CB 3.31Å; Q41-N45 WeakPolarHBondContact O-CB 3.41Å; Q41-N45 PolarHBondContact O-N 3.12Å; Q41-N45 PolarHBondContact O-ND2 3.48Å; L42-N45 PolarHBondContact O-N 3.35Å; L42-N45 VanDerWaalsContact O-N 3.11Å; R43-N45 PolarHBondContact O-N 3.26Å; N45-R48 PolarHBondContact O-N 3.21Å; N45-K49 WeakPolarHBondContact O-CG 3.43Å; N45-K49 PolarHBondContact O-N 3.3Å
46	S	92.1	Very high	92	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-67.5	-42	175.6	-42.6	0	0	0	0	111.6	L31 E34 L42 R43 L44 R48 K49 L50	L31-S46 WeakPolarHBondContact O-CB 3.28Å; E34-S46 WeakPolarHBondContact CB-OG 3.5Å; E34-S46 PolarHBondContact OE2-OG 3.04Å; E34-S46 VanDerWaalsContact OE2-OG 3.05Å; L42-S46 PolarHBondContact O-N 2.85Å; L42-S46 PolarHBondContact O-OG 3.21Å; R43-S46 PolarHBondContact O-N 3.48Å; L44-S46 VanDerWaalsContact C-N 3.34Å; S46-R48 PolarHBondContact O-N 2.73Å; S46-K49 CarbonylContact O-C 3.54Å; S46-K49 VanDerWaalsContact O-C 3.26Å; S46-K49 WeakPolarHBondContact O-CA 3.45Å; S46-K49 PolarHBondContact O-N 3.28Å; S46-L50 PolarHBondContact O-N 3Å; S46-L50 VanDerWaalsContact O-N 3.08Å
47	I	93.5	Very high	92.2	Very high	3 Å²	3	55.7 Å²	55.7	2%	0.015	28%	0.281	C	S	.	.	H	α-helix	trans	-60.7	-43.2	173.5	-70.1	-63.9	0	0	0	111.3	L35 R43 L44 K49 L50 L70 V80 A83 L84 Q87	L35-I47 HydrophobicContact CD2-CD1 3.49Å; L35-I47 VanDerWaalsContact CD2-CD1 3.49Å; L35-I47 HydrophobicContact CD2-CG1 3.83Å; R43-I47 WeakPolarHBondContact O-CG1 3.4Å; R43-I47 PolarHBondContact O-N 3.3Å; L44-I47 PolarHBondContact O-N 2.99Å; I47-K49 PolarHBondContact O-N 3.28Å; I47-K49 VanDerWaalsContact O-N 3.14Å; I47-L50 WeakPolarHBondContact O-CB 3.23Å; I47-L50 PolarHBondContact O-N 3.32Å; I47-L70 HydrophobicContact CD1-CD2 4.02Å; I47-V80 HydrophobicContact CG1-CG1 3.71Å; I47-A83 HydrophobicContact CG2-CB 3.66Å; I47-L84 HydrophobicContact CD1-CB 4.34Å; I47-L84 HydrophobicContact CD1-CD1 4.13Å; I47-L84 HydrophobicContact CG2-CB 4.05Å; I47-Q87 HydrophobicContact CG2-CG 4.46Å; I47-Q87 WeakPolarHBondContact O-CG 3.3Å
48	R	93.4	Very high	92.4	Very high	147 Å²	147	54.2 Å²	54.2	56%	0.555	28%	0.281	S	S	*	.	H	α-helix	trans	-62.2	-22.6	175.2	-73.8	173.7	177.1	170.7	0.9	113.4	L44 N45 S46	L44-R48 WeakPolarHBondContact O-CG 3.4Å; L44-R48 PolarHBondContact O-N 3Å; N45-R48 PolarHBondContact O-N 3.21Å; S46-R48 PolarHBondContact O-N 2.73Å
49	K	93.1	Very high	92.7	Very high	110 Å²	110	46.9 Å²	46.9	48%	0.478	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	17.6	177.3	-66.3	177	-179.7	174.7	0	112.8	L31 N45 S46 I47 S51 T52 I53	L31-K49 HydrophobicContact CD1-CB 4.26Å; L31-K49 HydrophobicContact CD1-CD 4.31Å; L31-K49 HydrophobicContact CD2-CB 4.29Å; L31-K49 HydrophobicContact CD2-CD 3.79Å; N45-K49 WeakPolarHBondContact O-CG 3.43Å; N45-K49 PolarHBondContact O-N 3.3Å; S46-K49 CarbonylContact O-C 3.54Å; S46-K49 VanDerWaalsContact O-C 3.26Å; S46-K49 WeakPolarHBondContact O-CA 3.45Å; S46-K49 PolarHBondContact O-N 3.28Å; I47-K49 PolarHBondContact O-N 3.28Å; I47-K49 VanDerWaalsContact O-N 3.14Å; K49-S51 PolarHBondContact O-N 3.12Å; K49-T52 WeakPolarHBondContact O-CB 3.33Å; K49-T52 PolarHBondContact O-N 3.1Å; K49-I53 PolarHBondContact O-N 3.32Å
50	L	93.8	Very high	92.9	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-58.3	-32.9	-178.3	-165.9	69.4	0	0	0	112.4	S46 I47 T52 I53 A54 L66 L70 L84 Q87 F91	S46-L50 PolarHBondContact O-N 3Å; S46-L50 VanDerWaalsContact O-N 3.08Å; I47-L50 WeakPolarHBondContact O-CB 3.23Å; I47-L50 PolarHBondContact O-N 3.32Å; L50-T52 PolarHBondContact O-N 2.97Å; L50-I53 HydrophobicContact CD1-CD1 4.35Å; L50-I53 PolarHBondContact O-N 3.11Å; L50-A54 PolarHBondContact O-N 3.06Å; L50-L66 HydrophobicContact CD1-CD1 4.09Å; L50-L66 HydrophobicContact CD1-CD2 3.96Å; L50-L66 HydrophobicContact CD1-CG 4.37Å; L50-L66 HydrophobicContact CG-CD2 4.36Å; L50-L70 HydrophobicContact CD1-CD1 4.02Å; L50-L70 HydrophobicContact CD1-CD2 4.08Å; L50-L70 HydrophobicContact CD2-CD1 3.66Å; L50-L70 HydrophobicContact CG-CD1 4.35Å; L50-L84 HydrophobicContact CD2-CD1 4Å; L50-Q87 HydrophobicContact CB-CG 4.38Å; L50-Q87 HydrophobicContact CD2-CB 4.05Å; L50-F91 HydrophobicContact CB-CE2 4.19Å; L50-F91 HydrophobicContact CB-CZ 4.43Å; L50-F91 HydrophobicContact CD2-CE2 3.92Å; L50-F91 HydrophobicContact CD2-CZ 3.95Å; L50-F91 HydrophobicContact CG-CE2 3.88Å; L50-F91 HydrophobicContact CG-CZ 3.72Å
51	S	94	Very high	92.9	Very high	32 Å²	32	53.5 Å²	53.5	22%	0.224	27%	0.273	C	S	.	.	H	α-helix	trans	-55.8	-46.1	170.8	46.1	0	0	0	0	112.9	K49 A54 L55 F94	K49-S51 PolarHBondContact O-N 3.12Å; S51-A54 PolarHBondContact O-N 3.31Å; S51-L55 VanDerWaalsContact O-CG 3.31Å; S51-L55 WeakPolarHBondContact O-CG 3.49Å; S51-L55 PolarHBondContact O-N 3.33Å; S51-F94 VanDerWaalsContact CB-CE2 3.47Å
52	T	92.6	Very high	93	Very high	66 Å²	66	48.6 Å²	48.6	41%	0.405	25%	0.25	S	S	.	.	H	α-helix	trans	-63.2	-41.6	176.6	-51.6	0	0	0	0	111.6	K49 L50 L55 A56	K49-T52 WeakPolarHBondContact O-CB 3.33Å; K49-T52 PolarHBondContact O-N 3.1Å; L50-T52 PolarHBondContact O-N 2.97Å; T52-L55 PolarHBondContact O-N 3.08Å; T52-A56 PolarHBondContact O-N 3.21Å
53	I	91.7	Very high	93.3	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62	-48	177.3	-58	175	0	0	0	110.1	V28 L31 I32 L35 K49 L50 L55 A56 L57 L66	V28-I53 HydrophobicContact CG1-CG2 4.39Å; L31-I53 HydrophobicContact CB-CD1 3.81Å; L31-I53 HydrophobicContact CB-CG1 3.85Å; L31-I53 HydrophobicContact CD1-CG1 4.2Å; I32-I53 HydrophobicContact CD1-CG2 3.99Å; I32-I53 HydrophobicContact CG1-CG2 3.62Å; L35-I53 HydrophobicContact CD1-CD1 3.98Å; K49-I53 PolarHBondContact O-N 3.32Å; L50-I53 HydrophobicContact CD1-CD1 4.35Å; L50-I53 PolarHBondContact O-N 3.11Å; I53-L55 PolarHBondContact O-N 3.39Å; I53-A56 PolarHBondContact O-N 3.26Å; I53-L57 HydrophobicContact CG2-CD1 3.94Å; I53-L57 HydrophobicContact CG2-CG 4.4Å; I53-L57 WeakPolarHBondContact O-CG 3.5Å; I53-L57 PolarHBondContact O-N 3.33Å; I53-L66 HydrophobicContact CG2-CD1 4.4Å; I53-L66 HydrophobicContact CG2-CD2 4.17Å
54	A	93.7	Very high	93.3	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.008	27%	0.268	C	S	.	.	H	α-helix	trans	-68.8	-33.7	-178.9	0	0	0	0	0	113.6	L50 S51 A56 L57 G58 T62 L66 F91 F94	L50-A54 PolarHBondContact O-N 3.06Å; S51-A54 PolarHBondContact O-N 3.31Å; A54-A56 VanDerWaalsContact C-N 3.31Å; A54-A56 PolarHBondContact O-N 3.44Å; A54-L57 PolarHBondContact O-N 2.82Å; A54-G58 PolarHBondContact O-N 3.17Å; A54-T62 WeakPolarHBondContact CA-OG1 3.45Å; A54-T62 HydrophobicContact CB-CG2 3.84Å; A54-T62 WeakPolarHBondContact CB-OG1 3.28Å; A54-T62 PolarHBondContact O-OG1 3.31Å; A54-L66 HydrophobicContact CB-CD2 4.13Å; A54-F91 HydrophobicContact CB-CE1 3.71Å; A54-F91 HydrophobicContact CB-CE2 4.37Å; A54-F91 HydrophobicContact CB-CZ 3.37Å; A54-F94 HydrophobicContact CB-CB 3.81Å; A54-F94 HydrophobicContact CB-CD1 4.3Å; A54-F94 HydrophobicContact CB-CG 4.11Å
55	L	93	Very high	93.3	Very high	120 Å²	120	55.1 Å²	55.1	63%	0.628	29%	0.286	S	S	*	.	H	α-helix	trans	-59.6	-43	171.8	-77.4	168.5	0	0	0	111.9	S51 T52 I53 F94	S51-L55 VanDerWaalsContact O-CG 3.31Å; S51-L55 WeakPolarHBondContact O-CG 3.49Å; S51-L55 PolarHBondContact O-N 3.33Å; T52-L55 PolarHBondContact O-N 3.08Å; I53-L55 PolarHBondContact O-N 3.39Å; L55-F94 HydrophobicContact CD1-CE1 3.89Å; L55-F94 HydrophobicContact CD2-CD1 3.93Å; L55-F94 HydrophobicContact CD2-CE1 3.69Å; L55-F94 HydrophobicContact CG-CD1 3.87Å; L55-F94 HydrophobicContact CG-CE1 3.45Å; L55-F94 VanDerWaalsContact CG-CE1 3.45Å
56	A	91.1	Very high	93.3	Very high	43 Å²	43	52.5 Å²	52.5	36%	0.355	27%	0.272	S	S	.	.	H	α-helix	trans	-74.2	-35.5	-179.3	0	0	0	0	0	113.4	V28 T52 I53 A54 G58	V28-A56 HydrophobicContact CB-CB 4.11Å; V28-A56 HydrophobicContact CG1-CB 3.7Å; V28-A56 HydrophobicContact CG2-CB 3.47Å; V28-A56 VanDerWaalsContact CG2-CB 3.47Å; T52-A56 PolarHBondContact O-N 3.21Å; I53-A56 PolarHBondContact O-N 3.26Å; A54-A56 VanDerWaalsContact C-N 3.31Å; A54-A56 PolarHBondContact O-N 3.44Å; A56-G58 VanDerWaalsContact C-N 3.35Å
57	L	91.1	Very high	93.4	Very high	22 Å²	22	52.8 Å²	52.8	12%	0.115	27%	0.273	C	S	.	.	H	α-helix	trans	-71.3	-30.7	174.6	-71.4	176.6	0	0	0	112.6	I32 I53 A54 R61 L66	I32-L57 HydrophobicContact CD1-CD2 4.32Å; I53-L57 HydrophobicContact CG2-CD1 3.94Å; I53-L57 HydrophobicContact CG2-CG 4.4Å; I53-L57 WeakPolarHBondContact O-CG 3.5Å; I53-L57 PolarHBondContact O-N 3.33Å; A54-L57 PolarHBondContact O-N 2.82Å; L57-R61 HydrophobicContact CB-CB 4.08Å; L57-R61 WeakPolarHBondContact O-CB 3.08Å; L57-L66 HydrophobicContact CD1-CB 4.01Å; L57-L66 HydrophobicContact CD1-CD2 4.3Å
58	G	93.2	Very high	93.4	Very high	30 Å²	30	55.3 Å²	55.3	31%	0.309	29%	0.29	S	S	.	.	H	α-helix	trans	79	164	-169.2	0	0	0	0	0	112.6	A54 A56 E60 T62	A54-G58 PolarHBondContact O-N 3.17Å; A56-G58 VanDerWaalsContact C-N 3.35Å; G58-E60 PolarHBondContact O-N 3.48Å; G58-T62 VanDerWaalsContact O-CB 3.27Å; G58-T62 WeakPolarHBondContact O-CB 3.2Å; G58-T62 PolarHBondContact O-N 3.28Å; G58-T62 PolarHBondContact O-OG1 3.05Å
59	A	95.2	Very high	93.3	Very high	35 Å²	35	50.2 Å²	50.2	29%	0.289	27%	0.272	S	S	.	.	H	α-helix	trans	-64	-35.2	-169.1	0	0	0	0	0	114.6	R63 F94	A59-R63 WeakPolarHBondContact O-CG 3.26Å; A59-R63 PolarHBondContact O-N 2.89Å; A59-F94 VanDerWaalsContact CA-O 3.27Å; A59-F94 WeakPolarHBondContact CA-O 3.46Å
60	E	94.8	Very high	93.3	Very high	146 Å²	146	45 Å²	45	68%	0.682	25%	0.25	S	C	*	.	H	α-helix	trans	-68.1	-53.6	-179	-173.6	174.9	-176.9	0	0	111.8	G58 T62 R63 S64	G58-E60 PolarHBondContact O-N 3.48Å; E60-T62 VanDerWaalsContact C-N 3.29Å; E60-T62 PolarHBondContact O-N 3.47Å; E60-R63 WeakPolarHBondContact O-CB 3.39Å; E60-R63 PolarHBondContact O-N 3.27Å; E60-S64 PolarHBondContact O-N 3.17Å; E60-S64 PolarHBondContact O-OG 3.08Å
61	R	93	Very high	93.2	Very high	115 Å²	115	45.4 Å²	45.4	43%	0.434	25%	0.252	S	S	.	.	H	α-helix	trans	-65.4	-33.7	177.6	-64	-174.6	64.5	-156.7	-6.2	112.4	L57 R63 S64 E65 L66	L57-R61 HydrophobicContact CB-CB 4.08Å; L57-R61 WeakPolarHBondContact O-CB 3.08Å; R61-R63 VanDerWaalsContact C-N 3.27Å; R61-R63 PolarHBondContact O-N 3Å; R61-S64 WeakPolarHBondContact CA-OG 3.46Å; R61-S64 PolarHBondContact O-N 2.99Å; R61-E65 WeakPolarHBondContact CG-OE1 3.44Å; R61-E65 IonicContact CZ-OE1 2.77Å; R61-E65 IonicContact CZ-OE2 3.64Å; R61-E65 IonicContact NE-OE1 3.65Å; R61-E65 PolarHBondContact NE-OE1 3.41Å; R61-E65 IonicContact NE-OE2 2.69Å; R61-E65 IonicContact NH2-OE1 3.66Å; R61-E65 IonicContact NH2-OE2 3.64Å; R61-E65 PolarHBondContact NH2-OE2 3.25Å; R61-E65 WeakPolarHBondContact O-CA 3.35Å; R61-E65 VanDerWaalsContact O-CB 3.31Å; R61-E65 WeakPolarHBondContact O-CB 3.5Å; R61-E65 PolarHBondContact O-N 3.4Å; R61-L66 PolarHBondContact O-N 3.38Å
62	T	95	Very high	92.9	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.272	C	S	.	.	I	π-helix	trans	-54.8	-46.5	170.9	-65	0	0	0	0	110.6	A54 G58 E60 L66 I67 F91 V95	A54-T62 WeakPolarHBondContact CA-OG1 3.45Å; A54-T62 HydrophobicContact CB-CG2 3.84Å; A54-T62 WeakPolarHBondContact CB-OG1 3.28Å; A54-T62 PolarHBondContact O-OG1 3.31Å; G58-T62 VanDerWaalsContact O-CB 3.27Å; G58-T62 WeakPolarHBondContact O-CB 3.2Å; G58-T62 PolarHBondContact O-N 3.28Å; G58-T62 PolarHBondContact O-OG1 3.05Å; E60-T62 VanDerWaalsContact C-N 3.29Å; E60-T62 PolarHBondContact O-N 3.47Å; T62-L66 HydrophobicContact CG2-CD2 4.29Å; T62-L66 WeakPolarHBondContact O-CB 3.41Å; T62-L66 PolarHBondContact O-N 3Å; T62-I67 WeakPolarHBondContact O-CG1 3.2Å; T62-I67 PolarHBondContact O-N 3.44Å; T62-F91 HydrophobicContact CG2-CD1 4.39Å; T62-F91 HydrophobicContact CG2-CE1 3.7Å; T62-V95 HydrophobicContact CG2-CG1 4.13Å
63	R	95.9	Very high	92.3	Very high	59 Å²	59	47.9 Å²	47.9	22%	0.223	26%	0.261	C	S	.	.	I	π-helix	trans	-71.7	-39.7	178.7	-67.1	-178.7	-59	-135	10.7	113.7	A59 E60 R61 P68 V95	A59-R63 WeakPolarHBondContact O-CG 3.26Å; A59-R63 PolarHBondContact O-N 2.89Å; E60-R63 WeakPolarHBondContact O-CB 3.39Å; E60-R63 PolarHBondContact O-N 3.27Å; R61-R63 VanDerWaalsContact C-N 3.27Å; R61-R63 PolarHBondContact O-N 3Å; R63-P68 VanDerWaalsContact O-CD 3.3Å; R63-P68 WeakPolarHBondContact O-CD 3.35Å; R63-V95 VanDerWaalsContact CD-O 3.32Å; R63-V95 WeakPolarHBondContact CD-O 3.36Å; R63-V95 HydrophobicContact CG-CB 3.99Å; R63-V95 HydrophobicContact CG-CG1 4.33Å; R63-V95 PolarHBondContact NH1-O 2.87Å
64	S	94.5	Very high	91.6	Very high	76 Å²	76	49.5 Å²	49.5	53%	0.531	27%	0.269	S	S	.	.	I	π-helix	trans	-87.5	-22.4	-172.9	60	0	0	0	0	114.4	E60 R61	E60-S64 PolarHBondContact O-N 3.17Å; E60-S64 PolarHBondContact O-OG 3.08Å; R61-S64 WeakPolarHBondContact CA-OG 3.46Å; R61-S64 PolarHBondContact O-N 2.99Å
65	E	92.2	Very high	91	Very high	89 Å²	89	59.4 Å²	59.4	42%	0.416	31%	0.308	S	S	.	.	I	π-helix	trans	-120.1	-56.6	-175.4	-61.5	169.2	-129.5	0	0	111.5	R61 P68 F69	R61-E65 WeakPolarHBondContact CG-OE1 3.44Å; R61-E65 IonicContact CZ-OE1 2.77Å; R61-E65 IonicContact CZ-OE2 3.64Å; R61-E65 IonicContact NE-OE1 3.65Å; R61-E65 PolarHBondContact NE-OE1 3.41Å; R61-E65 IonicContact NE-OE2 2.69Å; R61-E65 IonicContact NH2-OE1 3.66Å; R61-E65 IonicContact NH2-OE2 3.64Å; R61-E65 PolarHBondContact NH2-OE2 3.25Å; R61-E65 WeakPolarHBondContact O-CA 3.35Å; R61-E65 VanDerWaalsContact O-CB 3.31Å; R61-E65 WeakPolarHBondContact O-CB 3.5Å; R61-E65 PolarHBondContact O-N 3.4Å; E65-P68 WeakPolarHBondContact O-CD 3.41Å; E65-F69 WeakPolarHBondContact O-CB 3.3Å; E65-F69 PolarHBondContact O-N 3.46Å; E65-F69 VanDerWaalsContact O-N 3.16Å
66	L	93	Very high	90.5	Very high	8 Å²	8	55.1 Å²	55.1	4%	0.042	29%	0.286	C	S	.	.	I	π-helix	trans	-69.9	-48.3	-172.1	-175.4	61.7	0	0	0	112.4	L35 L50 I53 A54 L57 R61 T62 F69 L70 F91	L35-L66 HydrophobicContact CD1-CD1 4.4Å; L50-L66 HydrophobicContact CD1-CD1 4.09Å; L50-L66 HydrophobicContact CD1-CD2 3.96Å; L50-L66 HydrophobicContact CD1-CG 4.37Å; L50-L66 HydrophobicContact CG-CD2 4.36Å; I53-L66 HydrophobicContact CG2-CD1 4.4Å; I53-L66 HydrophobicContact CG2-CD2 4.17Å; A54-L66 HydrophobicContact CB-CD2 4.13Å; L57-L66 HydrophobicContact CD1-CB 4.01Å; L57-L66 HydrophobicContact CD1-CD2 4.3Å; R61-L66 PolarHBondContact O-N 3.38Å; T62-L66 HydrophobicContact CG2-CD2 4.29Å; T62-L66 WeakPolarHBondContact O-CB 3.41Å; T62-L66 PolarHBondContact O-N 3Å; L66-F69 WeakPolarHBondContact O-CB 3.44Å; L66-F69 PolarHBondContact O-N 3.45Å; L66-L70 HydrophobicContact CD1-CD1 4.31Å; L66-L70 HydrophobicContact CD1-CG 4.22Å; L66-L70 HydrophobicContact CG-CD1 3.99Å; L66-L70 HydrophobicContact CG-CG 4.34Å; L66-L70 VanDerWaalsContact O-CG 3.29Å; L66-L70 WeakPolarHBondContact O-CG 3.4Å; L66-L70 PolarHBondContact O-N 3.48Å; L66-F91 HydrophobicContact CD2-CE1 4.43Å; L66-F91 HydrophobicContact CD2-CZ 4.37Å
67	I	94.2	Very high	90.5	Very high	6 Å²	6	58.3 Å²	58.3	3%	0.031	29%	0.293	C	S	.	.	H	α-helix	trans	-61.6	-45.8	-179.5	-63.6	-51.4	0	0	0	112.4	T62 F69 L70 T71 L88 F91 V95 C103 L104 P107	T62-I67 WeakPolarHBondContact O-CG1 3.2Å; T62-I67 PolarHBondContact O-N 3.44Å; I67-F69 VanDerWaalsContact C-N 3.33Å; I67-F69 PolarHBondContact O-N 3.29Å; I67-L70 HydrophobicContact CD1-CD1 4.28Å; I67-L70 PolarHBondContact O-N 3.4Å; I67-T71 PolarHBondContact O-N 3.12Å; I67-T71 PolarHBondContact O-OG1 3.18Å; I67-L88 HydrophobicContact CD1-CD2 4.16Å; I67-F91 HydrophobicContact CD1-CD1 4.27Å; I67-F91 HydrophobicContact CD1-CE1 4.38Å; I67-V95 HydrophobicContact CG1-CG1 4.41Å; I67-C103 WeakPolarHBondContact CG2-O 3.35Å; I67-L104 HydrophobicContact CD1-CD2 3.59Å; I67-L104 HydrophobicContact CG1-CD2 4.32Å; I67-P107 HydrophobicContact CG2-CG 4.28Å
68	P	93.1	Very high	90.7	Very high	56 Å²	56	60.9 Å²	60.9	36%	0.364	31%	0.307	S	S	.	.	H	α-helix	trans	-57.1	-44.4	172.2	-28.9	37.3	0	0	0	112.9	R63 E65 L70 T71 D72	R63-P68 VanDerWaalsContact O-CD 3.3Å; R63-P68 WeakPolarHBondContact O-CD 3.35Å; E65-P68 WeakPolarHBondContact O-CD 3.41Å; P68-L70 PolarHBondContact O-N 3.29Å; P68-T71 WeakPolarHBondContact O-CB 3.21Å; P68-T71 PolarHBondContact O-N 3.17Å; P68-T71 VanDerWaalsContact O-N 3.13Å; P68-D72 PolarHBondContact O-N 3.13Å; P68-D72 VanDerWaalsContact O-N 3.17Å
69	F	91.3	Very high	90.7	Very high	41 Å²	41	65.1 Å²	65.1	18%	0.18	32%	0.319	C	S	.	.	H	α-helix	trans	-59.3	-46.8	177.3	174.1	-102.6	0	0	0	112.6	L35 R36 E65 L66 I67 T71 D72 T73	L35-F69 HydrophobicContact CB-CE1 3.75Å; L35-F69 HydrophobicContact CB-CZ 4.11Å; L35-F69 HydrophobicContact CD1-CD1 4.37Å; L35-F69 HydrophobicContact CD1-CE1 3.86Å; L35-F69 HydrophobicContact CG-CE1 4.38Å; R36-F69 HydrophobicContact CG-CE2 3.95Å; R36-F69 HydrophobicContact CG-CZ 3.65Å; E65-F69 WeakPolarHBondContact O-CB 3.3Å; E65-F69 PolarHBondContact O-N 3.46Å; E65-F69 VanDerWaalsContact O-N 3.16Å; L66-F69 WeakPolarHBondContact O-CB 3.44Å; L66-F69 PolarHBondContact O-N 3.45Å; I67-F69 VanDerWaalsContact C-N 3.33Å; I67-F69 PolarHBondContact O-N 3.29Å; F69-T71 VanDerWaalsContact C-N 3.26Å; F69-T71 PolarHBondContact O-N 3.25Å; F69-D72 PolarHBondContact O-N 3.01Å; F69-T73 PolarHBondContact O-N 2.89Å; F69-T73 PolarHBondContact O-OG1 2.9Å
70	L	92.7	Very high	90.6	Very high	1 Å²	1	63.6 Å²	63.6	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-64.8	-31.5	176.7	-64.2	171.9	0	0	0	112.5	I47 L50 L66 I67 P68 D72 T73 L84 L88	I47-L70 HydrophobicContact CD1-CD2 4.02Å; L50-L70 HydrophobicContact CD1-CD1 4.02Å; L50-L70 HydrophobicContact CD1-CD2 4.08Å; L50-L70 HydrophobicContact CD2-CD1 3.66Å; L50-L70 HydrophobicContact CG-CD1 4.35Å; L66-L70 HydrophobicContact CD1-CD1 4.31Å; L66-L70 HydrophobicContact CD1-CG 4.22Å; L66-L70 HydrophobicContact CG-CD1 3.99Å; L66-L70 HydrophobicContact CG-CG 4.34Å; L66-L70 VanDerWaalsContact O-CG 3.29Å; L66-L70 WeakPolarHBondContact O-CG 3.4Å; L66-L70 PolarHBondContact O-N 3.48Å; I67-L70 HydrophobicContact CD1-CD1 4.28Å; I67-L70 PolarHBondContact O-N 3.4Å; P68-L70 PolarHBondContact O-N 3.29Å; L70-D72 VanDerWaalsContact C-N 3.29Å; L70-D72 PolarHBondContact O-N 2.74Å; L70-T73 PolarHBondContact O-N 2.93Å; L70-L84 HydrophobicContact CB-CD1 4.37Å; L70-L84 HydrophobicContact CD1-CD1 3.98Å; L70-L84 HydrophobicContact CD2-CD1 3.94Å; L70-L84 HydrophobicContact CG-CD1 4.31Å; L70-L88 HydrophobicContact CD1-CD2 4.27Å
71	T	91.9	Very high	90.6	Very high	8 Å²	8	56.9 Å²	56.9	5%	0.049	28%	0.275	C	S	.	.	H	α-helix	trans	-66.5	-32.8	176.8	-54.1	0	0	0	0	111.8	I67 P68 F69 T73 I74 K106	I67-T71 PolarHBondContact O-N 3.12Å; I67-T71 PolarHBondContact O-OG1 3.18Å; P68-T71 WeakPolarHBondContact O-CB 3.21Å; P68-T71 PolarHBondContact O-N 3.17Å; P68-T71 VanDerWaalsContact O-N 3.13Å; F69-T71 VanDerWaalsContact C-N 3.26Å; F69-T71 PolarHBondContact O-N 3.25Å; T71-T73 VanDerWaalsContact C-N 3.31Å; T71-I74 WeakPolarHBondContact O-CG2 3.34Å; T71-K106 HydrophobicContact CG2-CD 3.87Å; T71-K106 HydrophobicContact CG2-CG 3.82Å
72	D	87.3	Confident	90.7	Very high	121 Å²	121	54.1 Å²	54.1	65%	0.647	27%	0.268	S	S	*	.	H	α-helix	trans	-82	-13.4	178.2	-63.6	-20.2	0	0	0	112.3	P68 F69 L70 I74	P68-D72 PolarHBondContact O-N 3.13Å; P68-D72 VanDerWaalsContact O-N 3.17Å; F69-D72 PolarHBondContact O-N 3.01Å; L70-D72 VanDerWaalsContact C-N 3.29Å; L70-D72 PolarHBondContact O-N 2.74Å; D72-I74 PolarHBondContact O-N 3.43Å
73	T	80.1	Confident	90.8	Very high	29 Å²	29	54.8 Å²	54.8	18%	0.178	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	20.5	-178	-46.8	0	0	0	0	112.3	F69 L70 T71 Y75 D76	F69-T73 PolarHBondContact O-N 2.89Å; F69-T73 PolarHBondContact O-OG1 2.9Å; L70-T73 PolarHBondContact O-N 2.93Å; T71-T73 VanDerWaalsContact C-N 3.31Å; T73-Y75 PolarHBondContact O-N 2.86Å; T73-Y75 VanDerWaalsContact O-N 3.13Å; T73-D76 HydrophobicContact CG2-CB 4.17Å; T73-D76 PolarHBondContact O-N 2.89Å
74	I	77.9	Confident	90.8	Very high	33 Å²	33	52 Å²	52	17%	0.169	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-10	-178.2	57.9	163	0	0	0	114.2	T71 D72	T71-I74 WeakPolarHBondContact O-CG2 3.34Å; D72-I74 PolarHBondContact O-N 3.43Å
75	Y	79.5	Confident	90.9	Very high	210 Å²	210	48.4 Å²	48.4	82%	0.824	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.3	21.4	-179.4	-59.2	-72.6	0	0	0	113.3	T73	T73-Y75 PolarHBondContact O-N 2.86Å; T73-Y75 VanDerWaalsContact O-N 3.13Å
76	D	84	Confident	91	Very high	30 Å²	30	48.6 Å²	48.6	16%	0.16	24%	0.239	C	C	.	.	S	Bend	trans	-82.6	176.3	176.2	-146	-33.4	0	0	0	111.9	R43 T73 V80 L81	R43-D76 WeakPolarHBondContact CD-OD2 3.5Å; R43-D76 IonicContact CZ-OD1 2.71Å; R43-D76 VanDerWaalsContact CZ-OD1 3.24Å; R43-D76 IonicContact CZ-OD2 3.79Å; R43-D76 VanDerWaalsContact NE-CG 3.33Å; R43-D76 IonicContact NE-OD1 3.47Å; R43-D76 PolarHBondContact NE-OD1 2.96Å; R43-D76 IonicContact NE-OD2 2.78Å; R43-D76 PolarHBondContact NE-OD2 2.93Å; R43-D76 IonicContact NH2-OD1 3.39Å; R43-D76 PolarHBondContact NH2-OD1 3.33Å; T73-D76 HydrophobicContact CG2-CB 4.17Å; T73-D76 PolarHBondContact O-N 2.89Å; D76-V80 HydrophobicContact CB-CB 4.29Å; D76-V80 HydrophobicContact CB-CG1 4.3Å; D76-L81 HydrophobicContact CB-CD2 4.23Å; D76-L81 HydrophobicContact CB-CG 4.41Å; D76-L81 WeakPolarHBondContact O-CD1 3.45Å
77	E	91.5	Very high	91.2	Very high	110 Å²	110	50.1 Å²	50.1	51%	0.514	25%	0.246	S	C	.	.			trans	-62.8	147	175.4	-66.9	-69.2	162.2	0	0	111.9	V40 E79 V80 L81	V40-E77 HydrophobicContact CG1-CB 4.14Å; V40-E77 HydrophobicContact CG1-CG 4.17Å; V40-E77 HydrophobicContact CG2-CG 3.9Å; E77-E79 VanDerWaalsContact C-N 3.26Å; E77-E79 PolarHBondContact O-N 3.14Å; E77-E79 VanDerWaalsContact O-N 3.15Å; E77-V80 HydrophobicContact CB-CG2 4.29Å; E77-V80 WeakPolarHBondContact O-CA 3.45Å; E77-V80 WeakPolarHBondContact O-CB 3.34Å; E77-V80 PolarHBondContact O-N 3Å; E77-L81 PolarHBondContact O-N 3.12Å
78	D	93.6	Very high	91.3	Very high	76 Å²	76	49.8 Å²	49.8	41%	0.406	24%	0.244	S	C	.	.	H	α-helix	trans	-57.4	-35.8	-173.1	-65.3	-36.4	0	0	0	113.3	V80 L81 L82 E116 V119	D78-V80 VanDerWaalsContact C-N 3.32Å; D78-V80 PolarHBondContact O-N 3.27Å; D78-L81 PolarHBondContact O-N 2.62Å; D78-L82 VanDerWaalsContact O-CB 3.23Å; D78-L82 WeakPolarHBondContact O-CB 3.28Å; D78-L82 PolarHBondContact O-N 2.91Å; D78-E116 HydrophobicContact CB-CG 4.2Å; D78-E116 WeakPolarHBondContact OD1-CB 3.38Å; D78-V119 HydrophobicContact CB-CG2 4.23Å
79	E	93.4	Very high	91.4	Very high	119 Å²	119	47.2 Å²	47.2	56%	0.556	23%	0.228	S	C	*	.	H	α-helix	trans	-64.1	-37.1	176.6	-67.8	-170.7	176	0	0	112.4	L44 E77 A83	L44-E79 WeakPolarHBondContact CD1-O 3.43Å; E77-E79 VanDerWaalsContact C-N 3.26Å; E77-E79 PolarHBondContact O-N 3.14Å; E77-E79 VanDerWaalsContact O-N 3.15Å; E79-A83 WeakPolarHBondContact O-CB 3.33Å; E79-A83 PolarHBondContact O-N 2.68Å; E79-A83 VanDerWaalsContact O-N 3.16Å
80	V	94.2	Very high	91.6	Very high	2 Å²	2	50 Å²	50	1%	0.012	25%	0.245	C	C	.	.	H	α-helix	trans	-71.7	-45.4	179.1	-176.2	0	0	0	0	109.4	V40 R43 L44 I47 D76 E77 D78 A83 L84	V40-V80 HydrophobicContact CG1-CG2 3.92Å; R43-V80 HydrophobicContact CB-CG1 4.44Å; R43-V80 HydrophobicContact CB-CG2 4.32Å; L44-V80 HydrophobicContact CB-CG2 4.43Å; I47-V80 HydrophobicContact CG1-CG1 3.71Å; D76-V80 HydrophobicContact CB-CB 4.29Å; D76-V80 HydrophobicContact CB-CG1 4.3Å; E77-V80 HydrophobicContact CB-CG2 4.29Å; E77-V80 WeakPolarHBondContact O-CA 3.45Å; E77-V80 WeakPolarHBondContact O-CB 3.34Å; E77-V80 PolarHBondContact O-N 3Å; D78-V80 VanDerWaalsContact C-N 3.32Å; D78-V80 PolarHBondContact O-N 3.27Å; V80-A83 PolarHBondContact O-N 3.46Å; V80-L84 WeakPolarHBondContact O-CB 3.49Å; V80-L84 PolarHBondContact O-N 3.28Å
81	L	95	Very high	91.8	Very high	5 Å²	5	50 Å²	50	3%	0.026	24%	0.244	C	C	.	.	H	α-helix	trans	-62.7	-42.4	175.9	-63.8	179.9	0	0	0	111.6	D76 E77 D78 A83 L84 G85 M111 V119	D76-L81 HydrophobicContact CB-CD2 4.23Å; D76-L81 HydrophobicContact CB-CG 4.41Å; D76-L81 WeakPolarHBondContact O-CD1 3.45Å; E77-L81 PolarHBondContact O-N 3.12Å; D78-L81 PolarHBondContact O-N 2.62Å; L81-A83 PolarHBondContact O-N 2.95Å; L81-L84 WeakPolarHBondContact O-CB 3.49Å; L81-L84 PolarHBondContact O-N 3.31Å; L81-G85 PolarHBondContact O-N 2.97Å; L81-M111 HydrophobicContact CB-CE 4.37Å; L81-M111 WeakPolarHBondContact O-CE 3.23Å; L81-V119 HydrophobicContact CB-CG1 3.7Å; L81-V119 HydrophobicContact CB-CG2 3.96Å; L81-V119 HydrophobicContact CD1-CG1 4.35Å
82	L	95.6	Very high	92	Very high	58 Å²	58	50.4 Å²	50.4	30%	0.304	25%	0.247	S	C	.	.	H	α-helix	trans	-59.2	-47.5	177.7	-175.9	62.8	0	0	0	111.6	D78 L84 G85 E86 V118 K122	D78-L82 VanDerWaalsContact O-CB 3.23Å; D78-L82 WeakPolarHBondContact O-CB 3.28Å; D78-L82 PolarHBondContact O-N 2.91Å; L82-L84 VanDerWaalsContact C-N 3.35Å; L82-G85 PolarHBondContact O-N 3.28Å; L82-E86 PolarHBondContact O-N 3.26Å; L82-V118 HydrophobicContact CD1-CG1 3.79Å; L82-V118 HydrophobicContact CD2-CG1 4.05Å; L82-K122 HydrophobicContact CD1-CB 3.59Å; L82-K122 HydrophobicContact CD1-CG 3.84Å
83	A	95.3	Very high	92.4	Very high	13 Å²	13	50.3 Å²	50.3	11%	0.107	24%	0.243	C	C	.	.	H	α-helix	trans	-64.8	-39.1	176.8	0	0	0	0	0	111.9	L44 I47 E79 V80 L81 G85 E86 Q87	L44-A83 HydrophobicContact CD1-CB 3.67Å; I47-A83 HydrophobicContact CG2-CB 3.66Å; E79-A83 WeakPolarHBondContact O-CB 3.33Å; E79-A83 PolarHBondContact O-N 2.68Å; E79-A83 VanDerWaalsContact O-N 3.16Å; V80-A83 PolarHBondContact O-N 3.46Å; L81-A83 PolarHBondContact O-N 2.95Å; A83-G85 VanDerWaalsContact C-N 3.35Å; A83-G85 PolarHBondContact O-N 3.48Å; A83-E86 PolarHBondContact O-N 3.43Å; A83-Q87 WeakPolarHBondContact O-CG 3.35Å; A83-Q87 PolarHBondContact O-N 3.09Å; A83-Q87 VanDerWaalsContact O-N 3.09Å
84	L	96	Very high	93.1	Very high	2 Å²	2	50 Å²	50	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-61.5	-44.6	176.8	173.6	58.3	0	0	0	111	I47 L50 L70 V80 L81 L82 E86 Q87 L88 M111	I47-L84 HydrophobicContact CD1-CB 4.34Å; I47-L84 HydrophobicContact CD1-CD1 4.13Å; I47-L84 HydrophobicContact CG2-CB 4.05Å; L50-L84 HydrophobicContact CD2-CD1 4Å; L70-L84 HydrophobicContact CB-CD1 4.37Å; L70-L84 HydrophobicContact CD1-CD1 3.98Å; L70-L84 HydrophobicContact CD2-CD1 3.94Å; L70-L84 HydrophobicContact CG-CD1 4.31Å; V80-L84 WeakPolarHBondContact O-CB 3.49Å; V80-L84 PolarHBondContact O-N 3.28Å; L81-L84 WeakPolarHBondContact O-CB 3.49Å; L81-L84 PolarHBondContact O-N 3.31Å; L82-L84 VanDerWaalsContact C-N 3.35Å; L84-E86 VanDerWaalsContact C-N 3.32Å; L84-E86 PolarHBondContact O-N 3.43Å; L84-Q87 PolarHBondContact O-N 3.21Å; L84-Q87 VanDerWaalsContact O-N 3.16Å; L84-L88 HydrophobicContact CD1-CD1 3.85Å; L84-L88 HydrophobicContact CD1-CD2 4.26Å; L84-L88 HydrophobicContact CD1-CG 3.83Å; L84-L88 HydrophobicContact CG-CD1 3.94Å; L84-L88 HydrophobicContact CG-CG 4.33Å; L84-L88 WeakPolarHBondContact O-CG 3.43Å; L84-L88 PolarHBondContact O-N 3.24Å; L84-M111 HydrophobicContact CB-CE 4.49Å; L84-M111 HydrophobicContact CD2-SD 4.15Å; L84-M111 HydrophobicContact CG-SD 4.14Å
85	G	96.1	Very high	94	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-57.9	-48.1	179.6	0	0	0	0	0	110.8	L81 L82 A83 Q87 L88 G89 M111 S126	L81-G85 PolarHBondContact O-N 2.97Å; L82-G85 PolarHBondContact O-N 3.28Å; A83-G85 VanDerWaalsContact C-N 3.35Å; A83-G85 PolarHBondContact O-N 3.48Å; G85-Q87 VanDerWaalsContact C-N 3.35Å; G85-Q87 PolarHBondContact O-N 3.25Å; G85-L88 PolarHBondContact O-N 3.29Å; G85-G89 PolarHBondContact O-N 3.02Å; G85-G89 VanDerWaalsContact O-N 3.17Å; G85-M111 VanDerWaalsContact CA-CE 3.5Å; G85-S126 PolarHBondContact O-OG 3.5Å
86	E	96.2	Very high	94.7	Very high	93 Å²	93	40.3 Å²	40.3	44%	0.435	21%	0.21	S	C	.	.	H	α-helix	trans	-58.1	-42.9	176.3	-166.6	173.4	-168.1	0	0	113.4	L82 A83 L84 N90 K122	L82-E86 PolarHBondContact O-N 3.26Å; A83-E86 PolarHBondContact O-N 3.43Å; L84-E86 VanDerWaalsContact C-N 3.32Å; L84-E86 PolarHBondContact O-N 3.43Å; E86-N90 PolarHBondContact O-ND2 3.2Å; E86-N90 VanDerWaalsContact O-ND2 3.14Å; E86-K122 HydrophobicContact CB-CD 4.47Å
87	Q	95.9	Very high	95.2	Very high	39 Å²	39	39.5 Å²	39.5	18%	0.182	21%	0.21	C	C	.	.	H	α-helix	trans	-65.2	-44	178.1	-69.3	-58.4	-58.8	0	0	111.5	I47 L50 A83 L84 G85 G89 N90 F91	I47-Q87 HydrophobicContact CG2-CG 4.46Å; I47-Q87 WeakPolarHBondContact O-CG 3.3Å; L50-Q87 HydrophobicContact CB-CG 4.38Å; L50-Q87 HydrophobicContact CD2-CB 4.05Å; A83-Q87 WeakPolarHBondContact O-CG 3.35Å; A83-Q87 PolarHBondContact O-N 3.09Å; A83-Q87 VanDerWaalsContact O-N 3.09Å; L84-Q87 PolarHBondContact O-N 3.21Å; L84-Q87 VanDerWaalsContact O-N 3.16Å; G85-Q87 VanDerWaalsContact C-N 3.35Å; G85-Q87 PolarHBondContact O-N 3.25Å; Q87-G89 VanDerWaalsContact C-N 3.3Å; Q87-G89 PolarHBondContact O-N 3.16Å; Q87-N90 CarbonylContact O-C 3.56Å; Q87-N90 PolarHBondContact O-N 2.95Å; Q87-F91 WeakPolarHBondContact O-CB 3.11Å; Q87-F91 PolarHBondContact O-N 2.88Å
88	L	96.4	Very high	95.3	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-63.3	-34.5	-178.1	-68.7	176.9	0	0	0	112.3	I67 L70 L84 G85 N90 F91 L104 P107 L108 M111	I67-L88 HydrophobicContact CD1-CD2 4.16Å; L70-L88 HydrophobicContact CD1-CD2 4.27Å; L84-L88 HydrophobicContact CD1-CD1 3.85Å; L84-L88 HydrophobicContact CD1-CD2 4.26Å; L84-L88 HydrophobicContact CD1-CG 3.83Å; L84-L88 HydrophobicContact CG-CD1 3.94Å; L84-L88 HydrophobicContact CG-CG 4.33Å; L84-L88 WeakPolarHBondContact O-CG 3.43Å; L84-L88 PolarHBondContact O-N 3.24Å; G85-L88 PolarHBondContact O-N 3.29Å; L88-N90 PolarHBondContact O-N 3.4Å; L88-F91 WeakPolarHBondContact O-CB 3.37Å; L88-F91 PolarHBondContact O-N 2.81Å; L88-L104 HydrophobicContact CD2-CD2 3.93Å; L88-P107 HydrophobicContact CD1-CB 3.83Å; L88-P107 HydrophobicContact CD1-CG 3.86Å; L88-L108 HydrophobicContact CB-CD1 4.21Å; L88-L108 HydrophobicContact CB-CD2 3.92Å; L88-L108 HydrophobicContact CB-CG 4.05Å; L88-L108 HydrophobicContact CD1-CD2 4.09Å; L88-L108 HydrophobicContact CD1-CG 4.11Å; L88-M111 HydrophobicContact CD1-SD 4.2Å
89	G	95.8	Very high	95.3	Very high	2 Å²	2	41.7 Å²	41.7	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-60.8	-28.6	173.3	0	0	0	0	0	114.1	G85 Q87 I129	G85-G89 PolarHBondContact O-N 3.02Å; G85-G89 VanDerWaalsContact O-N 3.17Å; Q87-G89 VanDerWaalsContact C-N 3.3Å; Q87-G89 PolarHBondContact O-N 3.16Å; G89-I129 WeakPolarHBondContact O-CG2 2.62Å
90	N	95.7	Very high	95.4	Very high	99 Å²	99	40.1 Å²	40.1	53%	0.529	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103	8.6	-179	-66.6	-62.4	0	0	0	113.6	E86 Q87 L88 T92	E86-N90 PolarHBondContact O-ND2 3.2Å; E86-N90 VanDerWaalsContact O-ND2 3.14Å; Q87-N90 CarbonylContact O-C 3.56Å; Q87-N90 PolarHBondContact O-N 2.95Å; L88-N90 PolarHBondContact O-N 3.4Å; N90-T92 PolarHBondContact O-N 3.38Å
91	F	96.5	Very high	95.5	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89	1.8	-167.3	-131.8	-117	0	0	0	115.3	L50 A54 T62 L66 I67 Q87 L88 H93 F94 V95 L104	L50-F91 HydrophobicContact CB-CE2 4.19Å; L50-F91 HydrophobicContact CB-CZ 4.43Å; L50-F91 HydrophobicContact CD2-CE2 3.92Å; L50-F91 HydrophobicContact CD2-CZ 3.95Å; L50-F91 HydrophobicContact CG-CE2 3.88Å; L50-F91 HydrophobicContact CG-CZ 3.72Å; A54-F91 HydrophobicContact CB-CE1 3.71Å; A54-F91 HydrophobicContact CB-CE2 4.37Å; A54-F91 HydrophobicContact CB-CZ 3.37Å; T62-F91 HydrophobicContact CG2-CD1 4.39Å; T62-F91 HydrophobicContact CG2-CE1 3.7Å; L66-F91 HydrophobicContact CD2-CE1 4.43Å; L66-F91 HydrophobicContact CD2-CZ 4.37Å; I67-F91 HydrophobicContact CD1-CD1 4.27Å; I67-F91 HydrophobicContact CD1-CE1 4.38Å; Q87-F91 WeakPolarHBondContact O-CB 3.11Å; Q87-F91 PolarHBondContact O-N 2.88Å; L88-F91 WeakPolarHBondContact O-CB 3.37Å; L88-F91 PolarHBondContact O-N 2.81Å; F91-H93 VanDerWaalsContact C-N 3.27Å; F91-H93 PolarHBondContact O-N 3.4Å; F91-H93 VanDerWaalsContact O-N 3.16Å; F91-F94 HydrophobicContact CD1-CB 3.98Å; F91-F94 HydrophobicContact CD1-CD2 4.37Å; F91-F94 AromaticContact CD2-CD2 3.42Å; F91-F94 HydrophobicContact CD2-CD2 3.42Å; F91-F94 VanDerWaalsContact CD2-CD2 3.42Å; F91-F94 HydrophobicContact CD2-CE2 4Å; F91-F94 HydrophobicContact CD2-CG 4.36Å; F91-F94 HydrophobicContact CE1-CB 3.93Å; F91-F94 HydrophobicContact CE1-CD2 4.46Å; F91-F94 HydrophobicContact CE2-CB 4.43Å; F91-F94 AromaticContact CE2-CD2 3.51Å; F91-F94 HydrophobicContact CE2-CD2 3.51Å; F91-F94 HydrophobicContact CE2-CE2 4Å; F91-F94 HydrophobicContact CE2-CG 4.21Å; F91-F94 HydrophobicContact CG-CB 4.27Å; F91-F94 AromaticContact CG-CD2 3.87Å; F91-F94 HydrophobicContact CG-CD2 3.87Å; F91-F94 HydrophobicContact CZ-CB 4.15Å; F91-F94 HydrophobicContact CZ-CD2 4.06Å; F91-F94 HydrophobicContact CZ-CG 4.32Å; F91-F94 PolarHBondContact O-N 3.05Å; F91-F94 VanDerWaalsContact O-N 3.09Å; F91-V95 HydrophobicContact CD1-CG1 4.01Å; F91-V95 PolarHBondContact O-N 2.96Å; F91-L104 HydrophobicContact CB-CD1 3.94Å; F91-L104 HydrophobicContact CB-CD2 3.97Å; F91-L104 HydrophobicContact CD1-CD2 4.12Å; F91-L104 HydrophobicContact CG-CD2 4.5Å
92	T	96.3	Very high	95.6	Very high	17 Å²	17	41.5 Å²	41.5	10%	0.104	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-40.1	-173.6	-51	0	0	0	0	113.2	N90 V95 G97 V101 K133	N90-T92 PolarHBondContact O-N 3.38Å; T92-V95 VanDerWaalsContact O-CG2 3.28Å; T92-V95 WeakPolarHBondContact O-CG2 3.33Å; T92-G97 VanDerWaalsContact O-CA 3.25Å; T92-G97 WeakPolarHBondContact O-CA 3.24Å; T92-G97 PolarHBondContact O-N 3.47Å; T92-V101 HydrophobicContact CG2-CB 4.42Å; T92-V101 HydrophobicContact CG2-CG2 4.24Å; T92-K133 HydrophobicContact CG2-CB 4.36Å; T92-K133 HydrophobicContact CG2-CG 4.38Å
93	H	95.3	Very high	95.6	Very high	120 Å²	120	40.4 Å²	40.4	56%	0.556	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-34.6	-177.9	76.6	-84.6	0	0	0	112.6	F91 V95 G96	F91-H93 VanDerWaalsContact C-N 3.27Å; F91-H93 PolarHBondContact O-N 3.4Å; F91-H93 VanDerWaalsContact O-N 3.16Å; H93-V95 VanDerWaalsContact C-N 3.3Å; H93-V95 PolarHBondContact O-N 2.96Å; H93-G96 PolarHBondContact O-N 3.42Å
94	F	95.9	Very high	95.7	Very high	23 Å²	23	39.8 Å²	39.8	10%	0.101	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-22.8	179.7	-58.9	-63	0	0	0	113.2	S51 A54 L55 A59 F91 G96	S51-F94 VanDerWaalsContact CB-CE2 3.47Å; A54-F94 HydrophobicContact CB-CB 3.81Å; A54-F94 HydrophobicContact CB-CD1 4.3Å; A54-F94 HydrophobicContact CB-CG 4.11Å; L55-F94 HydrophobicContact CD1-CE1 3.89Å; L55-F94 HydrophobicContact CD2-CD1 3.93Å; L55-F94 HydrophobicContact CD2-CE1 3.69Å; L55-F94 HydrophobicContact CG-CD1 3.87Å; L55-F94 HydrophobicContact CG-CE1 3.45Å; L55-F94 VanDerWaalsContact CG-CE1 3.45Å; A59-F94 VanDerWaalsContact CA-O 3.27Å; A59-F94 WeakPolarHBondContact CA-O 3.46Å; F91-F94 HydrophobicContact CD1-CB 3.98Å; F91-F94 HydrophobicContact CD1-CD2 4.37Å; F91-F94 AromaticContact CD2-CD2 3.42Å; F91-F94 HydrophobicContact CD2-CD2 3.42Å; F91-F94 VanDerWaalsContact CD2-CD2 3.42Å; F91-F94 HydrophobicContact CD2-CE2 4Å; F91-F94 HydrophobicContact CD2-CG 4.36Å; F91-F94 HydrophobicContact CE1-CB 3.93Å; F91-F94 HydrophobicContact CE1-CD2 4.46Å; F91-F94 HydrophobicContact CE2-CB 4.43Å; F91-F94 AromaticContact CE2-CD2 3.51Å; F91-F94 HydrophobicContact CE2-CD2 3.51Å; F91-F94 HydrophobicContact CE2-CE2 4Å; F91-F94 HydrophobicContact CE2-CG 4.21Å; F91-F94 HydrophobicContact CG-CB 4.27Å; F91-F94 AromaticContact CG-CD2 3.87Å; F91-F94 HydrophobicContact CG-CD2 3.87Å; F91-F94 HydrophobicContact CZ-CB 4.15Å; F91-F94 HydrophobicContact CZ-CD2 4.06Å; F91-F94 HydrophobicContact CZ-CG 4.32Å; F91-F94 PolarHBondContact O-N 3.05Å; F91-F94 VanDerWaalsContact O-N 3.09Å; F94-G96 VanDerWaalsContact C-N 3.33Å
95	V	96.6	Very high	95.7	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	6.8	174.5	-60	0	0	0	0	113.8	T62 R63 I67 F91 T92 H93 Y100 L104	T62-V95 HydrophobicContact CG2-CG1 4.13Å; R63-V95 VanDerWaalsContact CD-O 3.32Å; R63-V95 WeakPolarHBondContact CD-O 3.36Å; R63-V95 HydrophobicContact CG-CB 3.99Å; R63-V95 HydrophobicContact CG-CG1 4.33Å; R63-V95 PolarHBondContact NH1-O 2.87Å; I67-V95 HydrophobicContact CG1-CG1 4.41Å; F91-V95 HydrophobicContact CD1-CG1 4.01Å; F91-V95 PolarHBondContact O-N 2.96Å; T92-V95 VanDerWaalsContact O-CG2 3.28Å; T92-V95 WeakPolarHBondContact O-CG2 3.33Å; H93-V95 VanDerWaalsContact C-N 3.3Å; H93-V95 PolarHBondContact O-N 2.96Å; V95-Y100 VanDerWaalsContact O-CB 3.31Å; V95-Y100 WeakPolarHBondContact O-CB 3.24Å; V95-L104 HydrophobicContact CG1-CD1 4.46Å; V95-L104 HydrophobicContact CG1-CD2 3.8Å; V95-L104 HydrophobicContact CG1-CG 4.18Å; V95-L104 HydrophobicContact CG2-CD1 4.15Å; V95-L104 HydrophobicContact CG2-CG 4.42Å
96	G	94.2	Very high	95.7	Very high	38 Å²	38	46.1 Å²	46.1	39%	0.392	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	92.1	21.8	179	0	0	0	0	0	114.5	H93 F94	H93-G96 PolarHBondContact O-N 3.42Å; F94-G96 VanDerWaalsContact C-N 3.33Å
97	G	93.9	Very high	95.7	Very high	14 Å²	14	41.7 Å²	41.7	14%	0.144	22%	0.22	C	C	.	.	S	Bend	trans	91.1	-173.7	171.2	0	0	0	0	0	115.2	T92 K99 Y100	T92-G97 VanDerWaalsContact O-CA 3.25Å; T92-G97 WeakPolarHBondContact O-CA 3.24Å; T92-G97 PolarHBondContact O-N 3.47Å; G97-K99 PolarHBondContact O-N 2.74Å; G97-K99 VanDerWaalsContact O-N 3.08Å; G97-Y100 PolarHBondContact O-N 3.42Å
98	P	93.5	Very high	95.8	Very high	76 Å²	76	39.9 Å²	39.9	49%	0.494	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-51.2	-34.1	-173.8	-33.3	39.1	0	0	0	115.7	Y100 V101 K133	P98-Y100 PolarHBondContact O-N 3.16Å; P98-Y100 VanDerWaalsContact O-N 3.12Å; P98-V101 WeakPolarHBondContact O-CG1 3.48Å; P98-V101 PolarHBondContact O-N 2.85Å; P98-K133 WeakPolarHBondContact CB-O 3.46Å
99	K	93.9	Very high	95.8	Very high	155 Å²	155	41.5 Å²	41.5	67%	0.674	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-61	-22.6	-179.7	-174.5	177.8	178.2	-174.8	0	113.6	G97	G97-K99 PolarHBondContact O-N 2.74Å; G97-K99 VanDerWaalsContact O-N 3.08Å
100	Y	95.8	Very high	95.8	Very high	86 Å²	86	43.2 Å²	43.2	34%	0.337	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-120.4	9.7	-174	-59.5	-81.8	0	0	0	113	V95 G97 P98 S102 C103	V95-Y100 VanDerWaalsContact O-CB 3.31Å; V95-Y100 WeakPolarHBondContact O-CB 3.24Å; G97-Y100 PolarHBondContact O-N 3.42Å; P98-Y100 PolarHBondContact O-N 3.16Å; P98-Y100 VanDerWaalsContact O-N 3.12Å; Y100-S102 PolarHBondContact O-N 3.43Å; Y100-S102 VanDerWaalsContact O-N 3.14Å; Y100-C103 PolarHBondContact O-N 3.43Å; Y100-C103 PolarHBondContact O-SG 3.23Å
101	V	95.7	Very high	95.8	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.006	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-62.1	-23.2	-177.6	72.1	0	0	0	0	112.7	T92 P98 C103 L104 L130 K133 H134	T92-V101 HydrophobicContact CG2-CB 4.42Å; T92-V101 HydrophobicContact CG2-CG2 4.24Å; P98-V101 WeakPolarHBondContact O-CG1 3.48Å; P98-V101 PolarHBondContact O-N 2.85Å; V101-C103 PolarHBondContact O-N 3.12Å; V101-L104 HydrophobicContact CG2-CD1 4.23Å; V101-L104 WeakPolarHBondContact O-CB 3.49Å; V101-L104 PolarHBondContact O-N 2.92Å; V101-L104 VanDerWaalsContact O-N 3.11Å; V101-L130 HydrophobicContact CG2-CB 4.22Å; V101-L130 HydrophobicContact CG2-CD1 4.33Å; V101-L130 HydrophobicContact CG2-CD2 3.67Å; V101-L130 HydrophobicContact CG2-CG 4.28Å; V101-K133 HydrophobicContact CG2-CB 4.1Å; V101-H134 VanDerWaalsContact CG1-CE1 3.45Å; V101-H134 WeakPolarHBondContact CG1-CE1 3.46Å
102	S	96.2	Very high	95.8	Very high	35 Å²	35	38.5 Å²	38.5	25%	0.245	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-60.7	-24.8	178.8	57.3	0	0	0	0	113.7	Y100 L104 L105	Y100-S102 PolarHBondContact O-N 3.43Å; Y100-S102 VanDerWaalsContact O-N 3.14Å; S102-L104 PolarHBondContact O-N 3.17Å; S102-L105 WeakPolarHBondContact O-CB 3.07Å; S102-L105 WeakPolarHBondContact O-CG 3.38Å; S102-L105 PolarHBondContact O-N 3.27Å
103	C	95.9	Very high	95.8	Very high	35 Å²	35	39.6 Å²	39.6	24%	0.236	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-67.4	-24.5	177.3	72.4	0	0	0	0	112.9	I67 Y100 V101 L105	I67-C103 WeakPolarHBondContact CG2-O 3.35Å; Y100-C103 PolarHBondContact O-N 3.43Å; Y100-C103 PolarHBondContact O-SG 3.23Å; V101-C103 PolarHBondContact O-N 3.12Å; C103-L105 VanDerWaalsContact C-N 3.26Å; C103-L105 PolarHBondContact O-N 3.33Å
104	L	97.1	Very high	95.7	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-76.5	-14.4	178.4	-60.4	173.1	0	0	0	112.6	I67 L88 F91 V95 V101 S102 P107 L108 L130	I67-L104 HydrophobicContact CD1-CD2 3.59Å; I67-L104 HydrophobicContact CG1-CD2 4.32Å; L88-L104 HydrophobicContact CD2-CD2 3.93Å; F91-L104 HydrophobicContact CB-CD1 3.94Å; F91-L104 HydrophobicContact CB-CD2 3.97Å; F91-L104 HydrophobicContact CD1-CD2 4.12Å; F91-L104 HydrophobicContact CG-CD2 4.5Å; V95-L104 HydrophobicContact CG1-CD1 4.46Å; V95-L104 HydrophobicContact CG1-CD2 3.8Å; V95-L104 HydrophobicContact CG1-CG 4.18Å; V95-L104 HydrophobicContact CG2-CD1 4.15Å; V95-L104 HydrophobicContact CG2-CG 4.42Å; V101-L104 HydrophobicContact CG2-CD1 4.23Å; V101-L104 WeakPolarHBondContact O-CB 3.49Å; V101-L104 PolarHBondContact O-N 2.92Å; V101-L104 VanDerWaalsContact O-N 3.11Å; S102-L104 PolarHBondContact O-N 3.17Å; L104-P107 WeakPolarHBondContact O-CD 3.48Å; L104-P107 WeakPolarHBondContact O-CG 3.35Å; L104-L108 WeakPolarHBondContact O-CG 3.2Å; L104-L130 HydrophobicContact CB-CD1 3.56Å; L104-L130 HydrophobicContact CD1-CD1 4.05Å; L104-L130 HydrophobicContact CD1-CD2 4.06Å; L104-L130 HydrophobicContact CG-CD1 4.46Å
105	L	97.3	Very high	95.6	Very high	6 Å²	6	42.3 Å²	42.3	3%	0.031	23%	0.231	C	C	.	.	H	α-helix	trans	-67.5	-39.2	-177.2	-63.4	178.8	0	0	0	112.4	S102 C103 L108 E109 L127 F142 F143 V146	S102-L105 WeakPolarHBondContact O-CB 3.07Å; S102-L105 WeakPolarHBondContact O-CG 3.38Å; S102-L105 PolarHBondContact O-N 3.27Å; C103-L105 VanDerWaalsContact C-N 3.26Å; C103-L105 PolarHBondContact O-N 3.33Å; L105-L108 PolarHBondContact O-N 2.65Å; L105-E109 WeakPolarHBondContact O-CB 3.18Å; L105-E109 PolarHBondContact O-N 2.83Å; L105-L127 HydrophobicContact CD2-CD2 3.71Å; L105-F142 HydrophobicContact CD1-CB 3.83Å; L105-F143 HydrophobicContact CD2-CD2 3.79Å; L105-F143 HydrophobicContact CD2-CE2 4.22Å; L105-V146 HydrophobicContact CB-CG2 4.08Å; L105-V146 HydrophobicContact CD1-CG2 4.11Å
106	K	95.9	Very high	95.5	Very high	130 Å²	130	45.7 Å²	45.7	57%	0.565	25%	0.247	S	C	*	.	H	α-helix	trans	-61.1	-52.9	-175.8	-168	-176.1	176.1	-164.8	0	113.2	T71 L108 E109 S110	T71-K106 HydrophobicContact CG2-CD 3.87Å; T71-K106 HydrophobicContact CG2-CG 3.82Å; K106-L108 VanDerWaalsContact C-N 3.34Å; K106-L108 PolarHBondContact O-N 3.28Å; K106-E109 PolarHBondContact O-N 2.88Å; K106-S110 PolarHBondContact O-N 2.78Å; K106-S110 VanDerWaalsContact O-N 3.15Å; K106-S110 PolarHBondContact O-OG 2.91Å
107	P	95.6	Very high	95.6	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62.6	-41.6	177.2	23.2	-33.2	0	0	0	111.9	I67 L88 L104 E109 S110 M111	I67-P107 HydrophobicContact CG2-CG 4.28Å; L88-P107 HydrophobicContact CD1-CB 3.83Å; L88-P107 HydrophobicContact CD1-CG 3.86Å; L104-P107 WeakPolarHBondContact O-CD 3.48Å; L104-P107 WeakPolarHBondContact O-CG 3.35Å; P107-E109 PolarHBondContact O-N 3.08Å; P107-S110 PolarHBondContact O-N 3.02Å; P107-M111 VanDerWaalsContact O-CG 3.23Å; P107-M111 WeakPolarHBondContact O-CG 3.32Å; P107-M111 PolarHBondContact O-N 3.09Å
108	L	97.5	Very high	95.7	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-66.2	-34.7	178.4	-73	173.2	0	0	0	113.1	L88 L104 L105 K106 M111 A112 A123 L127 L130	L88-L108 HydrophobicContact CB-CD1 4.21Å; L88-L108 HydrophobicContact CB-CD2 3.92Å; L88-L108 HydrophobicContact CB-CG 4.05Å; L88-L108 HydrophobicContact CD1-CD2 4.09Å; L88-L108 HydrophobicContact CD1-CG 4.11Å; L104-L108 WeakPolarHBondContact O-CG 3.2Å; L105-L108 PolarHBondContact O-N 2.65Å; K106-L108 VanDerWaalsContact C-N 3.34Å; K106-L108 PolarHBondContact O-N 3.28Å; L108-M111 HydrophobicContact CD2-SD 4.41Å; L108-M111 PolarHBondContact O-N 3.31Å; L108-A112 VanDerWaalsContact O-CB 3.27Å; L108-A112 WeakPolarHBondContact O-CB 3.47Å; L108-A112 PolarHBondContact O-N 3.48Å; L108-A123 HydrophobicContact CD2-CB 4.34Å; L108-L127 HydrophobicContact CB-CD1 4.36Å; L108-L127 HydrophobicContact CB-CD2 3.71Å; L108-L127 HydrophobicContact CB-CG 3.85Å; L108-L127 HydrophobicContact CD1-CD2 4.06Å; L108-L127 HydrophobicContact CD1-CG 4.24Å; L108-L130 HydrophobicContact CD1-CD1 3.51Å; L108-L130 HydrophobicContact CD1-CG 4.39Å
109	E	97.2	Very high	95.9	Very high	35 Å²	35	46.7 Å²	46.7	16%	0.164	24%	0.241	C	C	.	.	H	α-helix	trans	-63.5	-44.4	173.9	178.3	177.5	-175.9	0	0	110.9	L105 K106 P107 A112 A113 V146 R149 L150	L105-E109 WeakPolarHBondContact O-CB 3.18Å; L105-E109 PolarHBondContact O-N 2.83Å; K106-E109 PolarHBondContact O-N 2.88Å; P107-E109 PolarHBondContact O-N 3.08Å; E109-A112 PolarHBondContact O-N 3.3Å; E109-A113 PolarHBondContact O-N 2.95Å; E109-V146 HydrophobicContact CB-CG1 4.04Å; E109-V146 HydrophobicContact CG-CG1 3.99Å; E109-R149 IonicContact OE1-CZ 2.81Å; E109-R149 IonicContact OE1-NE 3.21Å; E109-R149 PolarHBondContact OE1-NE 2.98Å; E109-R149 IonicContact OE1-NH2 2.89Å; E109-R149 PolarHBondContact OE1-NH2 2.88Å; E109-R149 IonicContact OE2-CZ 3.93Å; E109-R149 IonicContact OE2-NE 2.77Å; E109-R149 IonicContact OE2-NH2 3.42Å; E109-R149 PolarHBondContact OE2-NH2 3.46Å; E109-L150 HydrophobicContact CG-CD2 4.13Å; E109-L150 HydrophobicContact CG-CG 4.36Å
110	S	95.2	Very high	96	Very high	37 Å²	37	40 Å²	40	26%	0.259	21%	0.211	S	C	.	.	H	α-helix	trans	-62.2	-44	174.7	-63.8	0	0	0	0	111.7	K106 P107 A112 A113	K106-S110 PolarHBondContact O-N 2.78Å; K106-S110 VanDerWaalsContact O-N 3.15Å; K106-S110 PolarHBondContact O-OG 2.91Å; P107-S110 PolarHBondContact O-N 3.02Å; S110-A112 VanDerWaalsContact C-N 3.31Å; S110-A112 PolarHBondContact O-N 2.92Å; S110-A113 PolarHBondContact O-N 3.29Å; S110-A113 VanDerWaalsContact O-N 3.09Å
111	M	96.3	Very high	96.1	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65.6	-33	176.3	-66.7	173.2	66.8	0	0	112.7	L81 L84 G85 L88 P107 L108 A113 V114 V119 A123	L81-M111 HydrophobicContact CB-CE 4.37Å; L81-M111 WeakPolarHBondContact O-CE 3.23Å; L84-M111 HydrophobicContact CB-CE 4.49Å; L84-M111 HydrophobicContact CD2-SD 4.15Å; L84-M111 HydrophobicContact CG-SD 4.14Å; G85-M111 VanDerWaalsContact CA-CE 3.5Å; L88-M111 HydrophobicContact CD1-SD 4.2Å; P107-M111 VanDerWaalsContact O-CG 3.23Å; P107-M111 WeakPolarHBondContact O-CG 3.32Å; P107-M111 PolarHBondContact O-N 3.09Å; L108-M111 HydrophobicContact CD2-SD 4.41Å; L108-M111 PolarHBondContact O-N 3.31Å; M111-A113 PolarHBondContact O-N 2.92Å; M111-V114 VanDerWaalsContact O-CG2 3.24Å; M111-V114 WeakPolarHBondContact O-CG2 3.35Å; M111-V114 PolarHBondContact O-N 3.14Å; M111-V119 HydrophobicContact CB-CG1 4.43Å; M111-V119 HydrophobicContact CE-CG1 3.98Å; M111-A123 HydrophobicContact CB-CB 3.72Å
112	A	96.7	Very high	96.2	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-9.6	174.7	0	0	0	0	0	112.9	L108 E109 S110 R120 A123 L127 L150 S161	L108-A112 VanDerWaalsContact O-CB 3.27Å; L108-A112 WeakPolarHBondContact O-CB 3.47Å; L108-A112 PolarHBondContact O-N 3.48Å; E109-A112 PolarHBondContact O-N 3.3Å; S110-A112 VanDerWaalsContact C-N 3.31Å; S110-A112 PolarHBondContact O-N 2.92Å; A112-R120 VanDerWaalsContact O-CD 3.25Å; A112-R120 WeakPolarHBondContact O-CD 3.46Å; A112-A123 HydrophobicContact CB-CB 4.12Å; A112-L127 HydrophobicContact CB-CD1 4.25Å; A112-L150 HydrophobicContact CB-CD1 4.26Å; A112-L150 HydrophobicContact CB-CD2 4.33Å; A112-S161 VanDerWaalsContact O-CB 3.27Å; A112-S161 WeakPolarHBondContact O-CB 3.38Å; A112-S161 PolarHBondContact O-OG 2.88Å
113	A	95.3	Very high	96.3	Very high	40 Å²	40	40.2 Å²	40.2	33%	0.331	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-5.4	179	0	0	0	0	0	114.4	E109 S110 M111 T157	E109-A113 PolarHBondContact O-N 2.95Å; S110-A113 PolarHBondContact O-N 3.29Å; S110-A113 VanDerWaalsContact O-N 3.09Å; M111-A113 PolarHBondContact O-N 2.92Å; A113-T157 PolarHBondContact O-OG1 3.38Å
114	V	94.5	Very high	96.4	Very high	26 Å²	26	39 Å²	39	16%	0.158	21%	0.205	C	C	.	.	S	Bend	trans	-67.6	165.6	-176.9	-54.5	0	0	0	0	113	M111 V119 R120	M111-V114 VanDerWaalsContact O-CG2 3.24Å; M111-V114 WeakPolarHBondContact O-CG2 3.35Å; M111-V114 PolarHBondContact O-N 3.14Å; V114-V119 HydrophobicContact CG2-CB 3.82Å; V114-V119 HydrophobicContact CG2-CG1 3.71Å; V114-R120 HydrophobicContact CG2-CG 3.95Å; V114-R120 WeakPolarHBondContact O-CD 3.45Å; V114-R120 WeakPolarHBondContact O-CG 3.46Å; V114-R120 PolarHBondContact O-NH1 3.49Å
115	E	93	Very high	96.5	Very high	175 Å²	175	43.1 Å²	43.1	82%	0.818	23%	0.225	S	C	*	.	S	Bend	trans	-72.5	-35.2	-178.9	-64.5	-170.4	172.2	0	0	113.2	T117 R120	E115-T117 PolarHBondContact O-N 2.93Å; E115-R120 PolarHBondContact O-NH1 3.36Å
116	E	95.3	Very high	96.5	Very high	71 Å²	71	42.9 Å²	42.9	33%	0.332	22%	0.224	S	C	.	.			trans	-73.4	126.1	-177.3	-174.6	44.3	-118.8	0	0	111.9	D78 V118 V119 R120	D78-E116 HydrophobicContact CB-CG 4.2Å; D78-E116 WeakPolarHBondContact OD1-CB 3.38Å; E116-V118 PolarHBondContact OE1-N 2.94Å; E116-V119 HydrophobicContact CB-CB 4.41Å; E116-V119 HydrophobicContact CB-CG2 4.12Å; E116-V119 HydrophobicContact CG-CG2 4.05Å; E116-R120 PolarHBondContact O-N 3.42Å
117	T	96	Very high	96.6	Very high	66 Å²	66	36.7 Å²	36.7	41%	0.405	20%	0.197	S	C	.	.	H	α-helix	trans	-71.4	-39.6	-171.5	-58.4	0	0	0	0	111.6	E115 V119 R120 D121	E115-T117 PolarHBondContact O-N 2.93Å; T117-V119 VanDerWaalsContact C-N 3.29Å; T117-V119 PolarHBondContact O-N 3.4Å; T117-R120 PolarHBondContact O-N 3.26Å; T117-R120 PolarHBondContact OG1-NH2 2.69Å; T117-D121 PolarHBondContact O-N 2.96Å
118	V	96.8	Very high	96.7	Very high	82 Å²	82	38.6 Å²	38.6	50%	0.497	21%	0.206	S	C	.	.	H	α-helix	trans	-64.5	-37.2	-178.5	-172.6	0	0	0	0	111	L82 E116 K122	L82-V118 HydrophobicContact CD1-CG1 3.79Å; L82-V118 HydrophobicContact CD2-CG1 4.05Å; E116-V118 PolarHBondContact OE1-N 2.94Å; V118-K122 PolarHBondContact O-N 3.4Å; V118-K122 VanDerWaalsContact O-N 3.15Å
119	V	96.9	Very high	96.7	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.006	22%	0.22	C	C	.	.	H	α-helix	trans	-67.1	-45.3	175.3	179	0	0	0	0	111	D78 L81 M111 V114 E116 T117 D121 K122 A123	D78-V119 HydrophobicContact CB-CG2 4.23Å; L81-V119 HydrophobicContact CB-CG1 3.7Å; L81-V119 HydrophobicContact CB-CG2 3.96Å; L81-V119 HydrophobicContact CD1-CG1 4.35Å; M111-V119 HydrophobicContact CB-CG1 4.43Å; M111-V119 HydrophobicContact CE-CG1 3.98Å; V114-V119 HydrophobicContact CG2-CB 3.82Å; V114-V119 HydrophobicContact CG2-CG1 3.71Å; E116-V119 HydrophobicContact CB-CB 4.41Å; E116-V119 HydrophobicContact CB-CG2 4.12Å; E116-V119 HydrophobicContact CG-CG2 4.05Å; T117-V119 VanDerWaalsContact C-N 3.29Å; T117-V119 PolarHBondContact O-N 3.4Å; V119-D121 PolarHBondContact O-N 3.49Å; V119-K122 PolarHBondContact O-N 2.94Å; V119-A123 WeakPolarHBondContact O-CB 3.28Å; V119-A123 PolarHBondContact O-N 3.41Å
120	R	96.8	Very high	96.7	Very high	13 Å²	13	39.6 Å²	39.6	5%	0.049	21%	0.212	C	C	.	.	H	α-helix	trans	-59.7	-46.9	176.3	-71.6	-161.8	-54.2	-81.8	-8.9	112.2	A112 V114 E115 E116 T117 K122 A123 V124 S161	A112-R120 VanDerWaalsContact O-CD 3.25Å; A112-R120 WeakPolarHBondContact O-CD 3.46Å; V114-R120 HydrophobicContact CG2-CG 3.95Å; V114-R120 WeakPolarHBondContact O-CD 3.45Å; V114-R120 WeakPolarHBondContact O-CG 3.46Å; V114-R120 PolarHBondContact O-NH1 3.49Å; E115-R120 PolarHBondContact O-NH1 3.36Å; E116-R120 PolarHBondContact O-N 3.42Å; T117-R120 PolarHBondContact O-N 3.26Å; T117-R120 PolarHBondContact OG1-NH2 2.69Å; R120-K122 VanDerWaalsContact C-N 3.26Å; R120-K122 PolarHBondContact O-N 2.93Å; R120-A123 WeakPolarHBondContact O-CB 3.33Å; R120-A123 PolarHBondContact O-N 3.44Å; R120-A123 VanDerWaalsContact O-N 3.16Å; R120-V124 WeakPolarHBondContact O-CG2 3.49Å; R120-V124 PolarHBondContact O-N 3.45Å; R120-S161 WeakPolarHBondContact CD-OG 3.42Å
121	D	97.6	Very high	96.8	Very high	91 Å²	91	37.9 Å²	37.9	49%	0.487	20%	0.199	S	C	.	.	H	α-helix	trans	-60	-40.3	-179.6	-73.4	-17.1	0	0	0	110.9	T117 V119 V124 E125	T117-D121 PolarHBondContact O-N 2.96Å; V119-D121 PolarHBondContact O-N 3.49Å; D121-V124 PolarHBondContact O-N 2.79Å; D121-E125 WeakPolarHBondContact O-CB 3.31Å; D121-E125 PolarHBondContact O-N 3.18Å
122	K	97.9	Very high	96.7	Very high	36 Å²	36	45 Å²	45	16%	0.157	23%	0.227	C	C	.	.	H	α-helix	trans	-69.5	-36.5	176.2	-167.7	53.5	135.8	177.1	0	113.4	L82 E86 V118 V119 R120 E125 S126	L82-K122 HydrophobicContact CD1-CB 3.59Å; L82-K122 HydrophobicContact CD1-CG 3.84Å; E86-K122 HydrophobicContact CB-CD 4.47Å; V118-K122 PolarHBondContact O-N 3.4Å; V118-K122 VanDerWaalsContact O-N 3.15Å; V119-K122 PolarHBondContact O-N 2.94Å; R120-K122 VanDerWaalsContact C-N 3.26Å; R120-K122 PolarHBondContact O-N 2.93Å; K122-E125 WeakPolarHBondContact CD-OE2 3.4Å; K122-E125 IonicContact NZ-OE1 2.81Å; K122-E125 IonicContact NZ-OE2 3.66Å; K122-E125 PolarHBondContact NZ-OE2 3.08Å; K122-S126 WeakPolarHBondContact O-CB 3.43Å; K122-S126 PolarHBondContact O-N 3.1Å; K122-S126 PolarHBondContact O-OG 2.89Å
123	A	97.8	Very high	96.7	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-63.9	-43.5	173	0	0	0	0	0	111.2	L108 M111 A112 V119 R120 S126 L127	L108-A123 HydrophobicContact CD2-CB 4.34Å; M111-A123 HydrophobicContact CB-CB 3.72Å; A112-A123 HydrophobicContact CB-CB 4.12Å; V119-A123 WeakPolarHBondContact O-CB 3.28Å; V119-A123 PolarHBondContact O-N 3.41Å; R120-A123 WeakPolarHBondContact O-CB 3.33Å; R120-A123 PolarHBondContact O-N 3.44Å; R120-A123 VanDerWaalsContact O-N 3.16Å; A123-S126 PolarHBondContact O-N 3.32Å; A123-L127 WeakPolarHBondContact O-CB 3.3Å; A123-L127 VanDerWaalsContact O-CG 3.3Å; A123-L127 WeakPolarHBondContact O-CG 3.45Å; A123-L127 PolarHBondContact O-N 2.87Å
124	V	98.2	Very high	96.7	Very high	9 Å²	9	48 Å²	48	6%	0.055	23%	0.233	C	C	.	.	H	α-helix	trans	-63.4	-45.9	175.7	172.2	0	0	0	0	111.4	R120 D121 S126 L127 Q128 L165	R120-V124 WeakPolarHBondContact O-CG2 3.49Å; R120-V124 PolarHBondContact O-N 3.45Å; D121-V124 PolarHBondContact O-N 2.79Å; V124-S126 VanDerWaalsContact C-N 3.28Å; V124-S126 PolarHBondContact O-N 2.89Å; V124-L127 PolarHBondContact O-N 3.44Å; V124-Q128 HydrophobicContact CG1-CG 4.49Å; V124-Q128 VanDerWaalsContact O-CG 3.31Å; V124-Q128 WeakPolarHBondContact O-CG 3.17Å; V124-Q128 PolarHBondContact O-N 3.31Å; V124-L165 HydrophobicContact CG1-CD2 3.93Å
125	E	98.2	Very high	96.7	Very high	87 Å²	87	49 Å²	49	41%	0.407	24%	0.242	S	C	.	.	H	α-helix	trans	-55	-45.8	174.3	-174.8	-168.4	167.8	0	0	110.9	D121 K122 Q128 I129	D121-E125 WeakPolarHBondContact O-CB 3.31Å; D121-E125 PolarHBondContact O-N 3.18Å; K122-E125 WeakPolarHBondContact CD-OE2 3.4Å; K122-E125 IonicContact NZ-OE1 2.81Å; K122-E125 IonicContact NZ-OE2 3.66Å; K122-E125 PolarHBondContact NZ-OE2 3.08Å; E125-Q128 WeakPolarHBondContact O-CB 3.37Å; E125-Q128 PolarHBondContact O-N 3.37Å; E125-I129 WeakPolarHBondContact O-CG1 3.46Å; E125-I129 PolarHBondContact O-N 3.19Å; E125-I129 VanDerWaalsContact O-N 3.08Å
126	S	98.2	Very high	96.9	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.014	23%	0.226	C	C	.	.	H	α-helix	trans	-66.6	-42.3	179.3	-59.2	0	0	0	0	111.9	G85 K122 A123 V124 Q128 I129 L130	G85-S126 PolarHBondContact O-OG 3.5Å; K122-S126 WeakPolarHBondContact O-CB 3.43Å; K122-S126 PolarHBondContact O-N 3.1Å; K122-S126 PolarHBondContact O-OG 2.89Å; A123-S126 PolarHBondContact O-N 3.32Å; V124-S126 VanDerWaalsContact C-N 3.28Å; V124-S126 PolarHBondContact O-N 2.89Å; S126-Q128 VanDerWaalsContact C-N 3.32Å; S126-Q128 PolarHBondContact O-N 3.14Å; S126-I129 WeakPolarHBondContact O-CB 3.4Å; S126-I129 PolarHBondContact O-N 3Å; S126-L130 WeakPolarHBondContact O-CG 3.48Å; S126-L130 PolarHBondContact O-N 2.96Å
127	L	98.4	Very high	96.9	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.2	-40.8	173.1	-74.1	168.1	0	0	0	111.7	L105 L108 A112 A123 V124 I129 L130 A131 F143 L165	L105-L127 HydrophobicContact CD2-CD2 3.71Å; L108-L127 HydrophobicContact CB-CD1 4.36Å; L108-L127 HydrophobicContact CB-CD2 3.71Å; L108-L127 HydrophobicContact CB-CG 3.85Å; L108-L127 HydrophobicContact CD1-CD2 4.06Å; L108-L127 HydrophobicContact CD1-CG 4.24Å; A112-L127 HydrophobicContact CB-CD1 4.25Å; A123-L127 WeakPolarHBondContact O-CB 3.3Å; A123-L127 VanDerWaalsContact O-CG 3.3Å; A123-L127 WeakPolarHBondContact O-CG 3.45Å; A123-L127 PolarHBondContact O-N 2.87Å; V124-L127 PolarHBondContact O-N 3.44Å; L127-I129 VanDerWaalsContact C-N 3.35Å; L127-I129 PolarHBondContact O-N 3.22Å; L127-L130 PolarHBondContact O-N 2.65Å; L127-A131 PolarHBondContact O-N 3.48Å; L127-F143 HydrophobicContact CB-CE2 4.28Å; L127-F143 HydrophobicContact CB-CZ 4.46Å; L127-F143 HydrophobicContact CD2-CE2 4.38Å; L127-F143 VanDerWaalsContact O-CE2 3.29Å; L127-F143 WeakPolarHBondContact O-CE2 3.43Å; L127-L165 HydrophobicContact CB-CD2 3.66Å; L127-L165 HydrophobicContact CD1-CD1 4.02Å; L127-L165 HydrophobicContact CD1-CD2 4.29Å
128	Q	97.8	Very high	96.9	Very high	39 Å²	39	47.7 Å²	47.7	18%	0.182	23%	0.234	C	C	.	.	H	α-helix	trans	-60	-43.9	175.1	-71.8	174.8	-25.6	0	0	111.6	V124 E125 S126 A131 Y132 G164 L165 V168	V124-Q128 HydrophobicContact CG1-CG 4.49Å; V124-Q128 VanDerWaalsContact O-CG 3.31Å; V124-Q128 WeakPolarHBondContact O-CG 3.17Å; V124-Q128 PolarHBondContact O-N 3.31Å; E125-Q128 WeakPolarHBondContact O-CB 3.37Å; E125-Q128 PolarHBondContact O-N 3.37Å; S126-Q128 VanDerWaalsContact C-N 3.32Å; S126-Q128 PolarHBondContact O-N 3.14Å; Q128-A131 WeakPolarHBondContact O-CB 3.26Å; Q128-A131 PolarHBondContact O-N 2.95Å; Q128-Y132 WeakPolarHBondContact O-CD2 3.39Å; Q128-G164 PolarHBondContact NE2-O 3.01Å; Q128-L165 HydrophobicContact CG-CD2 4.21Å; Q128-V168 HydrophobicContact CB-CG1 4.12Å; Q128-V168 HydrophobicContact CG-CG1 3.99Å; Q128-V168 HydrophobicContact CG-CG2 4.2Å
129	I	97.2	Very high	96.9	Very high	57 Å²	57	43.8 Å²	43.8	29%	0.292	21%	0.21	S	C	.	.	H	α-helix	trans	-60.5	-47.3	175.2	-65.7	166	0	0	0	110.6	G89 E125 S126 L127 A131 Y132	G89-I129 WeakPolarHBondContact O-CG2 2.62Å; E125-I129 WeakPolarHBondContact O-CG1 3.46Å; E125-I129 PolarHBondContact O-N 3.19Å; E125-I129 VanDerWaalsContact O-N 3.08Å; S126-I129 WeakPolarHBondContact O-CB 3.4Å; S126-I129 PolarHBondContact O-N 3Å; L127-I129 VanDerWaalsContact C-N 3.35Å; L127-I129 PolarHBondContact O-N 3.22Å; I129-A131 VanDerWaalsContact C-N 3.3Å; I129-A131 PolarHBondContact O-N 3.37Å; I129-Y132 PolarHBondContact O-N 3.43Å
130	L	96.7	Very high	96.9	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-66	-31.4	-179	-63.8	-170.1	0	0	0	112.5	V101 L104 L108 S126 L127 Y132 K133 H134	V101-L130 HydrophobicContact CG2-CB 4.22Å; V101-L130 HydrophobicContact CG2-CD1 4.33Å; V101-L130 HydrophobicContact CG2-CD2 3.67Å; V101-L130 HydrophobicContact CG2-CG 4.28Å; L104-L130 HydrophobicContact CB-CD1 3.56Å; L104-L130 HydrophobicContact CD1-CD1 4.05Å; L104-L130 HydrophobicContact CD1-CD2 4.06Å; L104-L130 HydrophobicContact CG-CD1 4.46Å; L108-L130 HydrophobicContact CD1-CD1 3.51Å; L108-L130 HydrophobicContact CD1-CG 4.39Å; S126-L130 WeakPolarHBondContact O-CG 3.48Å; S126-L130 PolarHBondContact O-N 2.96Å; L127-L130 PolarHBondContact O-N 2.65Å; L130-Y132 PolarHBondContact O-N 3.34Å; L130-K133 WeakPolarHBondContact O-CA 3.41Å; L130-K133 WeakPolarHBondContact O-CB 3.38Å; L130-K133 PolarHBondContact O-N 3.37Å; L130-H134 PolarHBondContact O-N 3.38Å; L130-H134 PolarHBondContact O-ND1 3.1Å
131	A	96.8	Very high	96.9	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-53.9	-41.3	176	0	0	0	0	0	111.6	L127 Q128 I129 K133 H134 L139 F143 V168 R172	L127-A131 PolarHBondContact O-N 3.48Å; Q128-A131 WeakPolarHBondContact O-CB 3.26Å; Q128-A131 PolarHBondContact O-N 2.95Å; I129-A131 VanDerWaalsContact C-N 3.3Å; I129-A131 PolarHBondContact O-N 3.37Å; A131-K133 VanDerWaalsContact C-N 3.26Å; A131-K133 PolarHBondContact O-N 3.18Å; A131-H134 PolarHBondContact O-N 3.24Å; A131-L139 HydrophobicContact CB-CD1 4.26Å; A131-F143 HydrophobicContact CB-CD2 4.27Å; A131-F143 HydrophobicContact CB-CE1 4.08Å; A131-F143 HydrophobicContact CB-CE2 3.76Å; A131-F143 HydrophobicContact CB-CZ 3.65Å; A131-V168 HydrophobicContact CB-CB 4.12Å; A131-V168 HydrophobicContact CB-CG2 3.83Å; A131-R172 PolarHBondContact O-NH1 3.35Å
132	Y	95.7	Very high	96.9	Very high	150 Å²	150	51 Å²	51	59%	0.588	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-15.6	176.9	-66.6	-73.4	0	0	0	114.3	Q128 I129 L130 V168	Q128-Y132 WeakPolarHBondContact O-CD2 3.39Å; I129-Y132 PolarHBondContact O-N 3.43Å; L130-Y132 PolarHBondContact O-N 3.34Å; Y132-V168 HydrophobicContact CE2-CB 4.31Å; Y132-V168 HydrophobicContact CE2-CG1 3.94Å
133	K	95.2	Very high	96.9	Very high	100 Å²	100	49.3 Å²	49.3	44%	0.435	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-20.3	177.7	-56.1	-58.8	-177.2	-176	0	113.2	T92 P98 V101 L130 A131	T92-K133 HydrophobicContact CG2-CB 4.36Å; T92-K133 HydrophobicContact CG2-CG 4.38Å; P98-K133 WeakPolarHBondContact CB-O 3.46Å; V101-K133 HydrophobicContact CG2-CB 4.1Å; L130-K133 WeakPolarHBondContact O-CA 3.41Å; L130-K133 WeakPolarHBondContact O-CB 3.38Å; L130-K133 PolarHBondContact O-N 3.37Å; A131-K133 VanDerWaalsContact C-N 3.26Å; A131-K133 PolarHBondContact O-N 3.18Å
134	H	95.9	Very high	97	Very high	3 Å²	3	49.4 Å²	49.4	1%	0.014	23%	0.233	C	C	.	.	S	Bend	trans	-68.8	146.4	176.2	-72.6	73.1	0	0	0	110.7	V101 L130 A131 D138 L139 R172	V101-H134 VanDerWaalsContact CG1-CE1 3.45Å; V101-H134 WeakPolarHBondContact CG1-CE1 3.46Å; L130-H134 PolarHBondContact O-N 3.38Å; L130-H134 PolarHBondContact O-ND1 3.1Å; A131-H134 PolarHBondContact O-N 3.24Å; H134-D138 HydrophobicContact CB-CB 4.2Å; H134-L139 HydrophobicContact CB-CB 3.99Å; H134-L139 HydrophobicContact CB-CD1 4.14Å; H134-R172 PolarHBondContact O-NH1 3.26Å; H134-R172 PolarHBondContact O-NH2 3.48Å
135	S	95.4	Very high	97	Very high	48 Å²	48	50.8 Å²	50.8	34%	0.336	24%	0.243	S	C	.	.			trans	-66	167.9	161.3	75.6	0	0	0	0	110	Q137 D138 L139	S135-Q137 VanDerWaalsContact C-N 3.28Å; S135-Q137 PolarHBondContact O-N 3.03Å; S135-D138 WeakPolarHBondContact CB-OD2 3.46Å; S135-D138 PolarHBondContact O-N 3.2Å; S135-D138 WeakPolarHBondContact OG-CB 3.38Å; S135-D138 PolarHBondContact OG-N 3.23Å; S135-D138 PolarHBondContact OG-OD2 3.47Å; S135-L139 VanDerWaalsContact O-CB 3.22Å; S135-L139 WeakPolarHBondContact O-CB 3.49Å; S135-L139 PolarHBondContact O-N 2.85Å
136	I	95.4	Very high	97	Very high	96 Å²	96	46.7 Å²	46.7	49%	0.492	22%	0.224	S	C	.	.	H	α-helix	trans	-60	-43	176.2	-67	170.7	0	0	0	110.4	L139 E140 R172	I136-L139 PolarHBondContact O-N 3.26Å; I136-E140 WeakPolarHBondContact O-CG 3.41Å; I136-E140 PolarHBondContact O-N 3.16Å; I136-E140 VanDerWaalsContact O-N 3.12Å; I136-R172 WeakPolarHBondContact CG2-O 3.29Å
137	Q	95.6	Very high	97	Very high	154 Å²	154	46.6 Å²	46.6	72%	0.72	22%	0.223	S	C	*	.	H	α-helix	trans	-62.2	-49.4	178.3	-68.4	172.7	-11.9	0	0	111.3	S135 L139 E140 E141	S135-Q137 VanDerWaalsContact C-N 3.28Å; S135-Q137 PolarHBondContact O-N 3.03Å; Q137-L139 VanDerWaalsContact C-N 3.29Å; Q137-L139 PolarHBondContact O-N 3.27Å; Q137-E140 PolarHBondContact O-N 3.08Å; Q137-E141 WeakPolarHBondContact O-CB 3.48Å; Q137-E141 PolarHBondContact O-N 2.87Å
138	D	96.2	Very high	96.9	Very high	33 Å²	33	50 Å²	50	18%	0.176	24%	0.238	C	C	.	.	H	α-helix	trans	-67.5	-30.6	-179.7	-59.2	-46.6	0	0	0	112.4	H134 S135 F142 F143	H134-D138 HydrophobicContact CB-CB 4.2Å; S135-D138 WeakPolarHBondContact CB-OD2 3.46Å; S135-D138 PolarHBondContact O-N 3.2Å; S135-D138 WeakPolarHBondContact OG-CB 3.38Å; S135-D138 PolarHBondContact OG-N 3.23Å; S135-D138 PolarHBondContact OG-OD2 3.47Å; D138-F142 HydrophobicContact CB-CD2 3.95Å; D138-F142 HydrophobicContact CB-CE2 4.38Å; D138-F142 WeakPolarHBondContact O-CB 3.28Å; D138-F142 WeakPolarHBondContact O-CD2 3.43Å; D138-F142 PolarHBondContact O-N 3.06Å; D138-F143 PolarHBondContact O-N 3.45Å
139	L	97	Very high	97	Very high	0 Å²	0	54 Å²	54	0%	0	25%	0.251	C	S	.	.	I	π-helix	trans	-64.8	-45.9	175.8	-171.9	76.7	0	0	0	110.1	A131 H134 S135 I136 Q137 F143 V144 R172 V173	A131-L139 HydrophobicContact CB-CD1 4.26Å; H134-L139 HydrophobicContact CB-CB 3.99Å; H134-L139 HydrophobicContact CB-CD1 4.14Å; S135-L139 VanDerWaalsContact O-CB 3.22Å; S135-L139 WeakPolarHBondContact O-CB 3.49Å; S135-L139 PolarHBondContact O-N 2.85Å; I136-L139 PolarHBondContact O-N 3.26Å; Q137-L139 VanDerWaalsContact C-N 3.29Å; Q137-L139 PolarHBondContact O-N 3.27Å; L139-F143 HydrophobicContact CD1-CB 3.64Å; L139-F143 HydrophobicContact CD1-CD1 3.84Å; L139-F143 HydrophobicContact CD1-CD2 4.45Å; L139-F143 HydrophobicContact CD1-CG 3.72Å; L139-F143 HydrophobicContact CG-CB 4.29Å; L139-F143 WeakPolarHBondContact O-CB 3.46Å; L139-F143 PolarHBondContact O-N 3.11Å; L139-V144 WeakPolarHBondContact O-CG2 3.4Å; L139-V144 PolarHBondContact O-N 3.09Å; L139-R172 HydrophobicContact CD2-CB 3.72Å; L139-V173 HydrophobicContact CD2-CG1 3.78Å; L139-V173 HydrophobicContact CG-CG1 4.25Å
140	E	97.6	Very high	97	Very high	60 Å²	60	51.6 Å²	51.6	28%	0.28	24%	0.239	S	C	.	.	I	π-helix	trans	-68.1	-39.7	175.9	-66.4	-169.8	159.4	0	0	112.7	I136 Q137 P145 V173 S174 I177	I136-E140 WeakPolarHBondContact O-CG 3.41Å; I136-E140 PolarHBondContact O-N 3.16Å; I136-E140 VanDerWaalsContact O-N 3.12Å; Q137-E140 PolarHBondContact O-N 3.08Å; E140-P145 WeakPolarHBondContact O-CD 3.42Å; E140-V173 HydrophobicContact CG-CB 4.1Å; E140-V173 HydrophobicContact CG-CG1 3.87Å; E140-S174 WeakPolarHBondContact OE1-CB 3.47Å; E140-S174 PolarHBondContact OE1-N 3.13Å; E140-S174 PolarHBondContact OE1-OG 3.47Å; E140-I177 HydrophobicContact CB-CD1 3.81Å; E140-I177 HydrophobicContact CG-CD1 3.54Å
141	E	97.2	Very high	97.1	Very high	124 Å²	124	52 Å²	52	58%	0.579	24%	0.243	S	C	*	.	I	π-helix	trans	-77.6	-37.7	-175.1	-172.6	175.8	170.7	0	0	113.3	Q137 P145	Q137-E141 WeakPolarHBondContact O-CB 3.48Å; Q137-E141 PolarHBondContact O-N 2.87Å; E141-P145 WeakPolarHBondContact O-CG 3.5Å
142	F	97.5	Very high	97	Very high	73 Å²	73	55.7 Å²	55.7	32%	0.32	27%	0.273	S	S	.	.	I	π-helix	trans	-117	-46	-172	-56.2	-69	0	0	0	113.7	L105 D138 V146	L105-F142 HydrophobicContact CD1-CB 3.83Å; D138-F142 HydrophobicContact CB-CD2 3.95Å; D138-F142 HydrophobicContact CB-CE2 4.38Å; D138-F142 WeakPolarHBondContact O-CB 3.28Å; D138-F142 WeakPolarHBondContact O-CD2 3.43Å; D138-F142 PolarHBondContact O-N 3.06Å; F142-V146 WeakPolarHBondContact O-CG2 3.4Å
143	F	98.1	Very high	97	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.253	C	S	.	.	I	π-helix	trans	-75.1	-45.9	-174.7	-167.3	-87.2	0	0	0	112.5	L105 L127 A131 D138 L139 V146 V147 L165 V168 A169	L105-F143 HydrophobicContact CD2-CD2 3.79Å; L105-F143 HydrophobicContact CD2-CE2 4.22Å; L127-F143 HydrophobicContact CB-CE2 4.28Å; L127-F143 HydrophobicContact CB-CZ 4.46Å; L127-F143 HydrophobicContact CD2-CE2 4.38Å; L127-F143 VanDerWaalsContact O-CE2 3.29Å; L127-F143 WeakPolarHBondContact O-CE2 3.43Å; A131-F143 HydrophobicContact CB-CD2 4.27Å; A131-F143 HydrophobicContact CB-CE1 4.08Å; A131-F143 HydrophobicContact CB-CE2 3.76Å; A131-F143 HydrophobicContact CB-CZ 3.65Å; D138-F143 PolarHBondContact O-N 3.45Å; L139-F143 HydrophobicContact CD1-CB 3.64Å; L139-F143 HydrophobicContact CD1-CD1 3.84Å; L139-F143 HydrophobicContact CD1-CD2 4.45Å; L139-F143 HydrophobicContact CD1-CG 3.72Å; L139-F143 HydrophobicContact CG-CB 4.29Å; L139-F143 WeakPolarHBondContact O-CB 3.46Å; L139-F143 PolarHBondContact O-N 3.11Å; F143-V146 WeakPolarHBondContact O-CB 3.21Å; F143-V146 PolarHBondContact O-N 3.35Å; F143-V147 HydrophobicContact CD1-CG2 3.83Å; F143-V147 HydrophobicContact CE1-CG2 3.6Å; F143-V147 PolarHBondContact O-N 3.19Å; F143-V147 VanDerWaalsContact O-N 3.12Å; F143-L165 HydrophobicContact CE1-CB 4.43Å; F143-L165 HydrophobicContact CZ-CD2 4.27Å; F143-V168 HydrophobicContact CE1-CG2 4.44Å; F143-V168 HydrophobicContact CZ-CG2 4.4Å; F143-A169 HydrophobicContact CD1-CB 4.11Å; F143-A169 HydrophobicContact CE1-CB 4.06Å
144	V	98	Very high	96.9	Very high	2 Å²	2	52 Å²	52	1%	0.012	27%	0.272	C	S	.	.	H	α-helix	trans	-58.2	-42.6	178.9	167.9	0	0	0	0	111.9	L139 V146 V147 K148 V173 I177	L139-V144 WeakPolarHBondContact O-CG2 3.4Å; L139-V144 PolarHBondContact O-N 3.09Å; V144-V146 VanDerWaalsContact C-N 3.3Å; V144-V146 PolarHBondContact O-N 3.21Å; V144-V147 PolarHBondContact O-N 3.41Å; V144-K148 HydrophobicContact CG1-CD 4.11Å; V144-K148 HydrophobicContact CG1-CG 4.39Å; V144-K148 WeakPolarHBondContact O-CG 3.32Å; V144-K148 PolarHBondContact O-N 2.81Å; V144-V173 HydrophobicContact CG2-CG1 3.91Å; V144-I177 HydrophobicContact CG1-CG2 3.85Å; V144-I177 HydrophobicContact CG2-CG2 4.01Å
145	P	98.2	Very high	96.8	Very high	39 Å²	39	60.6 Å²	60.6	25%	0.253	30%	0.304	S	S	.	.	H	α-helix	trans	-58	-35	171.5	-31.9	39.3	0	0	0	115.1	E140 E141 K148 R149	E140-P145 WeakPolarHBondContact O-CD 3.42Å; E141-P145 WeakPolarHBondContact O-CG 3.5Å; P145-K148 PolarHBondContact O-N 2.79Å; P145-R149 WeakPolarHBondContact O-CB 3.46Å; P145-R149 WeakPolarHBondContact O-CG 3.37Å; P145-R149 PolarHBondContact O-N 3.27Å; P145-R149 PolarHBondContact O-NH1 3.17Å
146	V	98.1	Very high	96.9	Very high	1 Å²	1	61.7 Å²	61.7	1%	0.006	30%	0.303	C	S	.	.	H	α-helix	trans	-63.4	-48.5	173.6	175.4	0	0	0	0	110.1	L105 E109 F142 F143 V144 K148 R149 L150	L105-V146 HydrophobicContact CB-CG2 4.08Å; L105-V146 HydrophobicContact CD1-CG2 4.11Å; E109-V146 HydrophobicContact CB-CG1 4.04Å; E109-V146 HydrophobicContact CG-CG1 3.99Å; F142-V146 WeakPolarHBondContact O-CG2 3.4Å; F143-V146 WeakPolarHBondContact O-CB 3.21Å; F143-V146 PolarHBondContact O-N 3.35Å; V144-V146 VanDerWaalsContact C-N 3.3Å; V144-V146 PolarHBondContact O-N 3.21Å; V146-K148 VanDerWaalsContact C-N 3.29Å; V146-K148 PolarHBondContact O-N 3.34Å; V146-R149 VanDerWaalsContact CG2-NH2 3.31Å; V146-R149 PolarHBondContact O-N 3.49Å; V146-L150 HydrophobicContact CG1-CD1 3.89Å; V146-L150 HydrophobicContact CG1-CG 4.34Å; V146-L150 WeakPolarHBondContact O-CG 3.44Å; V146-L150 PolarHBondContact O-N 2.87Å
147	V	98.2	Very high	97	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-57.8	-43.6	177.5	-178.7	0	0	0	0	110.9	F143 V144 A151 L165 F166 L181	F143-V147 HydrophobicContact CD1-CG2 3.83Å; F143-V147 HydrophobicContact CE1-CG2 3.6Å; F143-V147 PolarHBondContact O-N 3.19Å; F143-V147 VanDerWaalsContact O-N 3.12Å; V144-V147 PolarHBondContact O-N 3.41Å; V147-A151 VanDerWaalsContact O-CB 3.24Å; V147-A151 WeakPolarHBondContact O-CB 3.49Å; V147-A151 PolarHBondContact O-N 3.34Å; V147-L165 HydrophobicContact CG1-CB 4.45Å; V147-L165 HydrophobicContact CG2-CB 3.79Å; V147-L165 HydrophobicContact CG2-CD1 4.21Å; V147-F166 HydrophobicContact CG1-CD2 4.34Å; V147-F166 HydrophobicContact CG1-CE1 4.21Å; V147-F166 HydrophobicContact CG1-CE2 4.04Å; V147-F166 HydrophobicContact CG1-CZ 3.97Å; V147-L181 HydrophobicContact CG1-CD2 4.3Å
148	K	98.1	Very high	97.1	Very high	71 Å²	71	50.7 Å²	50.7	31%	0.309	25%	0.251	S	S	.	.	H	α-helix	trans	-63.2	-45.2	177.6	-71.8	177.8	174.2	178.8	0	112.5	V144 P145 V146 A151 A152 E180 L184	V144-K148 HydrophobicContact CG1-CD 4.11Å; V144-K148 HydrophobicContact CG1-CG 4.39Å; V144-K148 WeakPolarHBondContact O-CG 3.32Å; V144-K148 PolarHBondContact O-N 2.81Å; P145-K148 PolarHBondContact O-N 2.79Å; V146-K148 VanDerWaalsContact C-N 3.29Å; V146-K148 PolarHBondContact O-N 3.34Å; K148-A151 PolarHBondContact O-N 3.11Å; K148-A152 WeakPolarHBondContact O-CB 3.37Å; K148-A152 PolarHBondContact O-N 3.23Å; K148-E180 VanDerWaalsContact CE-OE2 3.23Å; K148-E180 WeakPolarHBondContact CE-OE2 3.23Å; K148-E180 IonicContact NZ-OE2 2.6Å; K148-E180 PolarHBondContact NZ-OE2 3.12Å; K148-L184 HydrophobicContact CG-CD1 3.75Å
149	R	98	Very high	97.2	Very high	124 Å²	124	50.5 Å²	50.5	47%	0.468	25%	0.248	S	C	.	.	H	α-helix	trans	-64.9	-44.5	178.6	-75.8	-170.3	-57.8	-88.4	2.7	111.9	E109 P145 V146 A152 G153	E109-R149 IonicContact OE1-CZ 2.81Å; E109-R149 IonicContact OE1-NE 3.21Å; E109-R149 PolarHBondContact OE1-NE 2.98Å; E109-R149 IonicContact OE1-NH2 2.89Å; E109-R149 PolarHBondContact OE1-NH2 2.88Å; E109-R149 IonicContact OE2-CZ 3.93Å; E109-R149 IonicContact OE2-NE 2.77Å; E109-R149 IonicContact OE2-NH2 3.42Å; E109-R149 PolarHBondContact OE2-NH2 3.46Å; P145-R149 WeakPolarHBondContact O-CB 3.46Å; P145-R149 WeakPolarHBondContact O-CG 3.37Å; P145-R149 PolarHBondContact O-N 3.27Å; P145-R149 PolarHBondContact O-NH1 3.17Å; V146-R149 VanDerWaalsContact CG2-NH2 3.31Å; V146-R149 PolarHBondContact O-N 3.49Å; R149-A152 CarbonylContact O-C 3.6Å; R149-A152 PolarHBondContact O-N 2.75Å; R149-G153 PolarHBondContact O-N 3.11Å
150	L	98.2	Very high	97.2	Very high	5 Å²	5	51.9 Å²	51.9	3%	0.026	26%	0.255	C	S	.	.	H	α-helix	trans	-63	-43.2	175.5	-69.7	175	0	0	0	111.5	E109 A112 V146 A152 G153 S158 R159 A162 L165	E109-L150 HydrophobicContact CG-CD2 4.13Å; E109-L150 HydrophobicContact CG-CG 4.36Å; A112-L150 HydrophobicContact CB-CD1 4.26Å; A112-L150 HydrophobicContact CB-CD2 4.33Å; V146-L150 HydrophobicContact CG1-CD1 3.89Å; V146-L150 HydrophobicContact CG1-CG 4.34Å; V146-L150 WeakPolarHBondContact O-CG 3.44Å; V146-L150 PolarHBondContact O-N 2.87Å; L150-A152 VanDerWaalsContact C-N 3.32Å; L150-A152 PolarHBondContact O-N 3.26Å; L150-G153 PolarHBondContact O-N 3.3Å; L150-S158 CarbonylContact O-C 3.26Å; L150-S158 VanDerWaalsContact O-C 3.25Å; L150-S158 PolarHBondContact O-OG 2.89Å; L150-R159 WeakPolarHBondContact O-CA 3.3Å; L150-R159 WeakPolarHBondContact O-CG 3.18Å; L150-R159 PolarHBondContact O-N 2.83Å; L150-A162 HydrophobicContact CB-CB 3.79Å; L150-L165 HydrophobicContact CD1-CD1 3.67Å
151	A	98	Very high	97.3	Very high	10 Å²	10	49.3 Å²	49.3	8%	0.083	24%	0.244	C	C	.	.	H	α-helix	trans	-67.6	-29.7	-179.9	0	0	0	0	0	113.5	V147 K148 R159 A162 F166 L188	V147-A151 VanDerWaalsContact O-CB 3.24Å; V147-A151 WeakPolarHBondContact O-CB 3.49Å; V147-A151 PolarHBondContact O-N 3.34Å; K148-A151 PolarHBondContact O-N 3.11Å; A151-R159 WeakPolarHBondContact O-CD 3.4Å; A151-A162 HydrophobicContact CB-CB 3.89Å; A151-F166 HydrophobicContact CB-CZ 4.29Å; A151-L188 HydrophobicContact CB-CD1 4.17Å; A151-L188 HydrophobicContact CB-CD2 4.46Å
152	A	96.1	Very high	97.3	Very high	76 Å²	76	43.4 Å²	43.4	63%	0.628	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.5	6.6	179	0	0	0	0	0	113.6	K148 R149 L150	K148-A152 WeakPolarHBondContact O-CB 3.37Å; K148-A152 PolarHBondContact O-N 3.23Å; R149-A152 CarbonylContact O-C 3.6Å; R149-A152 PolarHBondContact O-N 2.75Å; L150-A152 VanDerWaalsContact C-N 3.32Å; L150-A152 PolarHBondContact O-N 3.26Å
153	G	94.4	Very high	97.3	Very high	17 Å²	17	40.3 Å²	40.3	18%	0.175	20%	0.203	C	C	.	.			trans	-67.6	145.6	-175.4	0	0	0	0	0	112.9	R149 L150 W155 S158 R159	R149-G153 PolarHBondContact O-N 3.11Å; L150-G153 PolarHBondContact O-N 3.3Å; G153-W155 VanDerWaalsContact C-N 3.27Å; G153-W155 PolarHBondContact O-N 3.12Å; G153-S158 WeakPolarHBondContact CA-OG 3.27Å; G153-R159 WeakPolarHBondContact O-CD 3.21Å; G153-R159 WeakPolarHBondContact O-CG 3.35Å; G153-R159 PolarHBondContact O-NH1 2.72Å
154	D	93.9	Very high	97.3	Very high	156 Å²	156	40.4 Å²	40.4	83%	0.834	21%	0.205	S	C	*	.	S	Bend	trans	-60.5	-39.2	-179	-63.2	-36.5	0	0	0	111.8	R159	D154-R159 PolarHBondContact O-NH1 2.72Å
155	W	94.4	Very high	97.3	Very high	183 Å²	183	40.3 Å²	40.3	69%	0.693	20%	0.204	S	C	*	.	S	Bend	trans	-85.2	132.4	-179.9	-65.8	99.8	0	0	0	112	G153 T157 S158	G153-W155 VanDerWaalsContact C-N 3.27Å; G153-W155 PolarHBondContact O-N 3.12Å; W155-T157 PolarHBondContact O-N 3.23Å; W155-T157 VanDerWaalsContact O-N 3.13Å; W155-S158 PolarHBondContact O-N 3.24Å; W155-S158 PolarHBondContact O-OG 2.93Å
156	F	96.4	Very high	97.3	Very high	71 Å²	71	38.5 Å²	38.5	31%	0.311	19%	0.192	S	C	.	.	H	α-helix	trans	-60.5	-25.9	-179.8	70.3	-93.4	0	0	0	113.1	S158 R159 I160 T193 M195 V196	F156-S158 PolarHBondContact O-N 3.03Å; F156-R159 PolarHBondContact O-N 2.97Å; F156-I160 HydrophobicContact CD2-CD1 3.67Å; F156-I160 HydrophobicContact CE2-CD1 4.15Å; F156-I160 VanDerWaalsContact O-CG1 3.28Å; F156-I160 WeakPolarHBondContact O-CG1 3.18Å; F156-I160 PolarHBondContact O-N 2.61Å; F156-T193 HydrophobicContact CB-CG2 3.81Å; F156-T193 HydrophobicContact CG-CG2 4.1Å; F156-M195 HydrophobicContact CD2-CB 4.35Å; F156-M195 HydrophobicContact CD2-CE 4.37Å; F156-M195 HydrophobicContact CE1-CE 4.49Å; F156-M195 HydrophobicContact CE2-CE 4.13Å; F156-M195 HydrophobicContact CZ-CE 4.2Å; F156-V196 HydrophobicContact CB-CG2 3.86Å
157	T	97.1	Very high	97.3	Very high	10 Å²	10	39.1 Å²	39.1	6%	0.061	20%	0.197	C	C	.	.	H	α-helix	trans	-58.9	-46.2	177	52	0	0	0	0	111.8	A113 W155 I160 S161	A113-T157 PolarHBondContact O-OG1 3.38Å; W155-T157 PolarHBondContact O-N 3.23Å; W155-T157 VanDerWaalsContact O-N 3.13Å; T157-I160 PolarHBondContact O-N 3.47Å; T157-S161 PolarHBondContact O-N 3.1Å; T157-S161 VanDerWaalsContact O-N 3.14Å; T157-S161 PolarHBondContact O-OG 3.27Å
158	S	97.7	Very high	97.2	Very high	9 Å²	9	39.4 Å²	39.4	6%	0.063	20%	0.199	C	C	.	.	H	α-helix	trans	-64	-41.8	176.2	67	0	0	0	0	112.1	L150 G153 W155 F156 S161 A162	L150-S158 CarbonylContact O-C 3.26Å; L150-S158 VanDerWaalsContact O-C 3.25Å; L150-S158 PolarHBondContact O-OG 2.89Å; G153-S158 WeakPolarHBondContact CA-OG 3.27Å; W155-S158 PolarHBondContact O-N 3.24Å; W155-S158 PolarHBondContact O-OG 2.93Å; F156-S158 PolarHBondContact O-N 3.03Å; S158-S161 PolarHBondContact O-N 3.32Å; S158-A162 PolarHBondContact O-N 3.27Å
159	R	98.3	Very high	97.2	Very high	30 Å²	30	36 Å²	36	11%	0.113	18%	0.184	C	C	.	.	H	α-helix	trans	-67.8	-35.6	178.8	-58.9	-160.8	-56.6	-82.6	4.2	112.5	L150 A151 G153 D154 F156 A162 L188 D191 T193 V196	L150-R159 WeakPolarHBondContact O-CA 3.3Å; L150-R159 WeakPolarHBondContact O-CG 3.18Å; L150-R159 PolarHBondContact O-N 2.83Å; A151-R159 WeakPolarHBondContact O-CD 3.4Å; G153-R159 WeakPolarHBondContact O-CD 3.21Å; G153-R159 WeakPolarHBondContact O-CG 3.35Å; G153-R159 PolarHBondContact O-NH1 2.72Å; D154-R159 PolarHBondContact O-NH1 2.72Å; F156-R159 PolarHBondContact O-N 2.97Å; R159-A162 WeakPolarHBondContact O-CB 3.38Å; R159-A162 PolarHBondContact O-N 3.2Å; R159-L188 HydrophobicContact CB-CD2 3.9Å; R159-L188 HydrophobicContact CG-CD2 4.47Å; R159-D191 IonicContact CZ-OD1 3.78Å; R159-D191 IonicContact CZ-OD2 3.46Å; R159-D191 IonicContact NE-OD1 3.71Å; R159-D191 IonicContact NE-OD2 2.7Å; R159-D191 PolarHBondContact NE-OD2 3.26Å; R159-D191 IonicContact NH2-OD1 2.95Å; R159-D191 PolarHBondContact NH2-OD1 3.15Å; R159-D191 IonicContact NH2-OD2 3.41Å; R159-D191 PolarHBondContact NH2-OD2 3.3Å; R159-T193 PolarHBondContact NH2-OG1 3.31Å; R159-V196 HydrophobicContact CB-CG1 4.02Å; R159-V196 HydrophobicContact CB-CG2 3.9Å
160	I	98.2	Very high	97.2	Very high	28 Å²	28	30.3 Å²	30.3	14%	0.144	16%	0.162	C	C	.	.	H	α-helix	trans	-58.3	-52.9	169.7	-73.3	168.3	0	0	0	109.8	F156 T157 A162 T163 M195 V196 A199	F156-I160 HydrophobicContact CD2-CD1 3.67Å; F156-I160 HydrophobicContact CE2-CD1 4.15Å; F156-I160 VanDerWaalsContact O-CG1 3.28Å; F156-I160 WeakPolarHBondContact O-CG1 3.18Å; F156-I160 PolarHBondContact O-N 2.61Å; T157-I160 PolarHBondContact O-N 3.47Å; I160-A162 VanDerWaalsContact C-N 3.26Å; I160-A162 PolarHBondContact O-N 3.3Å; I160-T163 WeakPolarHBondContact O-CB 3.29Å; I160-T163 PolarHBondContact O-N 3.46Å; I160-T163 VanDerWaalsContact O-N 3.11Å; I160-T163 PolarHBondContact O-OG1 3.41Å; I160-M195 HydrophobicContact CD1-CB 3.82Å; I160-V196 HydrophobicContact CG1-CG2 4.11Å; I160-A199 HydrophobicContact CB-CB 4.28Å; I160-A199 HydrophobicContact CG1-CB 4.19Å; I160-A199 HydrophobicContact CG2-CB 3.88Å
161	S	98.3	Very high	97.1	Very high	6 Å²	6	33.8 Å²	33.8	4%	0.042	19%	0.185	C	C	.	.	H	α-helix	trans	-60.2	-36.6	-178.6	-64.3	0	0	0	0	112.8	A112 R120 T157 S158 T163 G164	A112-S161 VanDerWaalsContact O-CB 3.27Å; A112-S161 WeakPolarHBondContact O-CB 3.38Å; A112-S161 PolarHBondContact O-OG 2.88Å; R120-S161 WeakPolarHBondContact CD-OG 3.42Å; T157-S161 PolarHBondContact O-N 3.1Å; T157-S161 VanDerWaalsContact O-N 3.14Å; T157-S161 PolarHBondContact O-OG 3.27Å; S158-S161 PolarHBondContact O-N 3.32Å; S161-T163 PolarHBondContact O-N 2.76Å; S161-G164 PolarHBondContact O-N 3.47Å
162	A	98.4	Very high	97	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-54.8	-38.8	176.8	0	0	0	0	0	112.4	L150 A151 S158 R159 I160 G164 L165 F166 L188	L150-A162 HydrophobicContact CB-CB 3.79Å; A151-A162 HydrophobicContact CB-CB 3.89Å; S158-A162 PolarHBondContact O-N 3.27Å; R159-A162 WeakPolarHBondContact O-CB 3.38Å; R159-A162 PolarHBondContact O-N 3.2Å; I160-A162 VanDerWaalsContact C-N 3.26Å; I160-A162 PolarHBondContact O-N 3.3Å; A162-G164 PolarHBondContact O-N 3.1Å; A162-G164 VanDerWaalsContact O-N 3.09Å; A162-L165 PolarHBondContact O-N 3.14Å; A162-F166 HydrophobicContact CB-CE2 4.25Å; A162-F166 WeakPolarHBondContact O-CD2 3.44Å; A162-F166 WeakPolarHBondContact O-CE2 3.47Å; A162-L188 HydrophobicContact CB-CD1 4.2Å
163	T	98.1	Very high	97.1	Very high	8 Å²	8	33.5 Å²	33.5	5%	0.049	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-29.9	-176.6	66.5	0	0	0	0	113.4	I160 S161 L165 L188 A199 A200	I160-T163 WeakPolarHBondContact O-CB 3.29Å; I160-T163 PolarHBondContact O-N 3.46Å; I160-T163 VanDerWaalsContact O-N 3.11Å; I160-T163 PolarHBondContact O-OG1 3.41Å; S161-T163 PolarHBondContact O-N 2.76Å; T163-L165 VanDerWaalsContact C-N 3.35Å; T163-L188 HydrophobicContact CG2-CB 4.49Å; T163-L188 HydrophobicContact CG2-CD1 4.01Å; T163-A199 HydrophobicContact CG2-CB 3.97Å; T163-A200 HydrophobicContact CG2-CB 4.28Å
164	G	97.6	Very high	97.2	Very high	3 Å²	3	34.6 Å²	34.6	3%	0.031	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-5.5	179.6	0	0	0	0	0	115.1	Q128 S161 A162	Q128-G164 PolarHBondContact NE2-O 3.01Å; S161-G164 PolarHBondContact O-N 3.47Å; A162-G164 PolarHBondContact O-N 3.1Å; A162-G164 VanDerWaalsContact O-N 3.09Å
165	L	98.4	Very high	97.3	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-10.3	-171.5	-56.7	177.8	0	0	0	114.1	V124 L127 Q128 F143 V147 L150 A162 T163 V168 A169	V124-L165 HydrophobicContact CG1-CD2 3.93Å; L127-L165 HydrophobicContact CB-CD2 3.66Å; L127-L165 HydrophobicContact CD1-CD1 4.02Å; L127-L165 HydrophobicContact CD1-CD2 4.29Å; Q128-L165 HydrophobicContact CG-CD2 4.21Å; F143-L165 HydrophobicContact CE1-CB 4.43Å; F143-L165 HydrophobicContact CZ-CD2 4.27Å; V147-L165 HydrophobicContact CG1-CB 4.45Å; V147-L165 HydrophobicContact CG2-CB 3.79Å; V147-L165 HydrophobicContact CG2-CD1 4.21Å; L150-L165 HydrophobicContact CD1-CD1 3.67Å; A162-L165 PolarHBondContact O-N 3.14Å; T163-L165 VanDerWaalsContact C-N 3.35Å; L165-V168 VanDerWaalsContact O-CG2 3.24Å; L165-V168 WeakPolarHBondContact O-CG2 3.49Å; L165-A169 PolarHBondContact O-N 3.17Å
166	F	98.3	Very high	97.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-70.2	-46	-174.8	-73.8	-98.1	0	0	0	112.9	V147 A151 A162 V168 A169 Y170 L181 L184 F185 L188 F207	V147-F166 HydrophobicContact CG1-CD2 4.34Å; V147-F166 HydrophobicContact CG1-CE1 4.21Å; V147-F166 HydrophobicContact CG1-CE2 4.04Å; V147-F166 HydrophobicContact CG1-CZ 3.97Å; A151-F166 HydrophobicContact CB-CZ 4.29Å; A162-F166 HydrophobicContact CB-CE2 4.25Å; A162-F166 WeakPolarHBondContact O-CD2 3.44Å; A162-F166 WeakPolarHBondContact O-CE2 3.47Å; F166-V168 VanDerWaalsContact C-N 3.3Å; F166-V168 PolarHBondContact O-N 3.01Å; F166-A169 PolarHBondContact O-N 3.38Å; F166-Y170 VanDerWaalsContact O-CB 3.24Å; F166-Y170 WeakPolarHBondContact O-CB 3.33Å; F166-Y170 PolarHBondContact O-N 2.87Å; F166-L181 HydrophobicContact CD1-CB 4.12Å; F166-L181 HydrophobicContact CD1-CD2 4.11Å; F166-L181 HydrophobicContact CE1-CB 4.39Å; F166-L181 HydrophobicContact CE1-CD2 4.05Å; F166-L181 VanDerWaalsContact CE1-O 3.31Å; F166-L181 WeakPolarHBondContact CE1-O 3.41Å; F166-L184 HydrophobicContact CE1-CB 3.91Å; F166-L184 HydrophobicContact CZ-CB 4.08Å; F166-F185 HydrophobicContact CB-CD2 4.09Å; F166-F185 HydrophobicContact CD1-CB 3.98Å; F166-F185 HydrophobicContact CD1-CD2 4.07Å; F166-F185 AromaticContact CD2-CD2 3.62Å; F166-F185 HydrophobicContact CD2-CD2 3.62Å; F166-F185 HydrophobicContact CD2-CE2 4.25Å; F166-F185 HydrophobicContact CE1-CB 3.93Å; F166-F185 HydrophobicContact CE1-CD2 4.43Å; F166-F185 HydrophobicContact CE2-CD2 4.02Å; F166-F185 HydrophobicContact CG-CB 4.44Å; F166-F185 AromaticContact CG-CD2 3.66Å; F166-F185 HydrophobicContact CG-CD2 3.66Å; F166-F185 HydrophobicContact CG-CE2 4.47Å; F166-F185 HydrophobicContact CZ-CB 4.34Å; F166-F185 HydrophobicContact CZ-CD2 4.4Å; F166-L188 HydrophobicContact CE2-CD1 3.52Å; F166-L188 HydrophobicContact CZ-CD1 3.75Å; F166-F207 HydrophobicContact CB-CD2 3.8Å; F166-F207 HydrophobicContact CB-CE2 3.78Å; F166-F207 HydrophobicContact CB-CG 4.23Å; F166-F207 HydrophobicContact CB-CZ 4.16Å; F166-F207 HydrophobicContact CD1-CZ 4.25Å
167	S	97.4	Very high	97.5	Very high	14 Å²	14	27.1 Å²	27.1	10%	0.098	15%	0.148	C	C	.	.	H	α-helix	trans	-61.1	-34.8	-176.4	55.2	0	0	0	0	113.3	P171 E206	S167-P171 WeakPolarHBondContact O-CD 3.27Å; S167-E206 VanDerWaalsContact CB-OE1 3.29Å; S167-E206 WeakPolarHBondContact CB-OE1 3.46Å; S167-E206 PolarHBondContact OG-OE1 3.48Å
168	V	96.9	Very high	97.5	Very high	7 Å²	7	28.4 Å²	28.4	4%	0.042	15%	0.154	C	C	.	.	H	α-helix	trans	-80.9	-30	-179.1	-62.1	0	0	0	0	113.2	Q128 A131 Y132 F143 L165 F166	Q128-V168 HydrophobicContact CB-CG1 4.12Å; Q128-V168 HydrophobicContact CG-CG1 3.99Å; Q128-V168 HydrophobicContact CG-CG2 4.2Å; A131-V168 HydrophobicContact CB-CB 4.12Å; A131-V168 HydrophobicContact CB-CG2 3.83Å; Y132-V168 HydrophobicContact CE2-CB 4.31Å; Y132-V168 HydrophobicContact CE2-CG1 3.94Å; F143-V168 HydrophobicContact CE1-CG2 4.44Å; F143-V168 HydrophobicContact CZ-CG2 4.4Å; L165-V168 VanDerWaalsContact O-CG2 3.24Å; L165-V168 WeakPolarHBondContact O-CG2 3.49Å; F166-V168 VanDerWaalsContact C-N 3.3Å; F166-V168 PolarHBondContact O-N 3.01Å
169	A	96.9	Very high	97.5	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-84.1	-42.6	179.9	0	0	0	0	0	112.2	F143 L165 F166 P171 R172 L181	F143-A169 HydrophobicContact CD1-CB 4.11Å; F143-A169 HydrophobicContact CE1-CB 4.06Å; L165-A169 PolarHBondContact O-N 3.17Å; F166-A169 PolarHBondContact O-N 3.38Å; A169-P171 VanDerWaalsContact C-CD 3.49Å; A169-R172 PolarHBondContact O-N 2.8Å; A169-L181 HydrophobicContact CB-CD1 4.44Å
170	Y	98	Very high	97.5	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.016	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-54.3	-44	-168.5	-176.7	-84.8	0	0	0	116.2	F166 R172 V173 Q178 L181 R182 F207 A210 V211 D215	F166-Y170 VanDerWaalsContact O-CB 3.24Å; F166-Y170 WeakPolarHBondContact O-CB 3.33Å; F166-Y170 PolarHBondContact O-N 2.87Å; Y170-R172 PolarHBondContact O-N 3.36Å; Y170-R172 VanDerWaalsContact O-N 3.09Å; Y170-V173 WeakPolarHBondContact O-CG2 3.38Å; Y170-Q178 HydrophobicContact CD1-CG 4.46Å; Y170-Q178 HydrophobicContact CD2-CB 4.12Å; Y170-Q178 HydrophobicContact CD2-CG 4.02Å; Y170-Q178 HydrophobicContact CE1-CG 4.16Å; Y170-Q178 HydrophobicContact CE2-CB 3.47Å; Y170-Q178 VanDerWaalsContact CE2-CB 3.47Å; Y170-Q178 HydrophobicContact CE2-CG 3.72Å; Y170-Q178 WeakPolarHBondContact CE2-O 3.48Å; Y170-Q178 HydrophobicContact CG-CG 4.39Å; Y170-Q178 PolarHBondContact O-NE2 3.07Å; Y170-L181 HydrophobicContact CD2-CB 4.2Å; Y170-L181 HydrophobicContact CD2-CD1 4.28Å; Y170-R182 HydrophobicContact CE2-CG 3.75Å; Y170-R182 PolarHBondContact OH-NH1 3.5Å; Y170-F207 AromaticContact CD2-CE2 3.75Å; Y170-F207 HydrophobicContact CD2-CE2 3.75Å; Y170-F207 AromaticContact CD2-CZ 3.96Å; Y170-F207 HydrophobicContact CD2-CZ 3.96Å; Y170-F207 HydrophobicContact CE2-CE2 4.5Å; Y170-F207 HydrophobicContact CE2-CZ 4.42Å; Y170-F207 AromaticContact CG-CE2 3.85Å; Y170-F207 HydrophobicContact CG-CE2 3.85Å; Y170-A210 WeakPolarHBondContact CD1-O 3.24Å; Y170-A210 WeakPolarHBondContact CE1-O 3.43Å; Y170-V211 HydrophobicContact CD1-CG2 4.2Å; Y170-V211 HydrophobicContact CD2-CG2 4.22Å; Y170-V211 HydrophobicContact CE1-CB 4.21Å; Y170-V211 HydrophobicContact CE1-CG2 3.95Å; Y170-V211 HydrophobicContact CE2-CG2 3.93Å; Y170-V211 HydrophobicContact CG-CG2 4.34Å; Y170-D215 PolarHBondContact OH-OD2 2.99Å; Y170-D215 VanDerWaalsContact OH-OD2 3.05Å
171	P	96.3	Very high	97.5	Very high	78 Å²	78	32.3 Å²	32.3	51%	0.506	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-67	-16.9	-172.4	-23.4	35.2	0	0	0	114.7	S167 A169 A210	S167-P171 WeakPolarHBondContact O-CD 3.27Å; A169-P171 VanDerWaalsContact C-CD 3.49Å; P171-A210 HydrophobicContact CG-CB 4.23Å
172	R	96	Very high	97.4	Very high	70 Å²	70	32.7 Å²	32.7	26%	0.264	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-111.2	-9.8	-167.9	-62.9	177.6	63.7	-153.3	-2.5	114.1	A131 H134 I136 L139 A169 Y170	A131-R172 PolarHBondContact O-NH1 3.35Å; H134-R172 PolarHBondContact O-NH1 3.26Å; H134-R172 PolarHBondContact O-NH2 3.48Å; I136-R172 WeakPolarHBondContact CG2-O 3.29Å; L139-R172 HydrophobicContact CD2-CB 3.72Å; A169-R172 PolarHBondContact O-N 2.8Å; Y170-R172 PolarHBondContact O-N 3.36Å; Y170-R172 VanDerWaalsContact O-N 3.09Å
173	V	97.3	Very high	97.4	Very high	10 Å²	10	35.3 Å²	35.3	6%	0.061	19%	0.193	C	C	.	.	S	Bend	trans	-95.9	162.6	-177	-60.1	0	0	0	0	111.3	L139 E140 V144 Y170 I177 Q178 L181	L139-V173 HydrophobicContact CD2-CG1 3.78Å; L139-V173 HydrophobicContact CG-CG1 4.25Å; E140-V173 HydrophobicContact CG-CB 4.1Å; E140-V173 HydrophobicContact CG-CG1 3.87Å; V144-V173 HydrophobicContact CG2-CG1 3.91Å; Y170-V173 WeakPolarHBondContact O-CG2 3.38Å; V173-I177 HydrophobicContact CB-CB 4.08Å; V173-I177 HydrophobicContact CB-CG2 3.9Å; V173-I177 HydrophobicContact CG1-CG2 4.36Å; V173-I177 HydrophobicContact CG2-CB 3.99Å; V173-I177 HydrophobicContact CG2-CG2 3.65Å; V173-Q178 HydrophobicContact CG2-CG 3.85Å; V173-Q178 PolarHBondContact O-NE2 3.24Å; V173-L181 HydrophobicContact CG2-CD1 4.05Å
174	S	97.3	Very high	97.4	Very high	40 Å²	40	36.8 Å²	36.8	28%	0.28	20%	0.2	S	C	.	.			trans	-62.8	154.2	-179	54.9	0	0	0	0	112.9	E140 Q176 I177 Q178	E140-S174 WeakPolarHBondContact OE1-CB 3.47Å; E140-S174 PolarHBondContact OE1-N 3.13Å; E140-S174 PolarHBondContact OE1-OG 3.47Å; S174-Q176 PolarHBondContact O-N 2.75Å; S174-Q176 VanDerWaalsContact O-N 3.15Å; S174-I177 PolarHBondContact O-N 3.35Å; S174-Q178 WeakPolarHBondContact O-CG 3.38Å; S174-Q178 PolarHBondContact O-N 3.38Å
175	P	96.4	Very high	97.4	Very high	88 Å²	88	36.7 Å²	36.7	57%	0.571	20%	0.199	S	C	*	.	H	α-helix	trans	-55.6	-32.9	-179.6	-28.6	36.2	0	0	0	114.8	Q178 T179	P175-Q178 PolarHBondContact O-N 3.5Å; P175-T179 PolarHBondContact O-N 2.94Å; P175-T179 VanDerWaalsContact O-N 3.11Å; P175-T179 PolarHBondContact O-OG1 2.96Å
176	Q	96.7	Very high	97.4	Very high	143 Å²	143	39.9 Å²	39.9	67%	0.668	21%	0.211	S	C	*	.	H	α-helix	trans	-59.8	-52.3	172.8	-108.8	73.8	13.3	0	0	111	S174 Q178 T179 E180	S174-Q176 PolarHBondContact O-N 2.75Å; S174-Q176 VanDerWaalsContact O-N 3.15Å; Q176-Q178 VanDerWaalsContact C-N 3.34Å; Q176-Q178 PolarHBondContact O-N 2.71Å; Q176-T179 WeakPolarHBondContact O-CB 3.44Å; Q176-T179 PolarHBondContact O-N 3.46Å; Q176-E180 PolarHBondContact O-N 3.35Å
177	I	97.4	Very high	97.4	Very high	21 Å²	21	44.2 Å²	44.2	11%	0.108	23%	0.234	C	C	.	.	H	α-helix	trans	-66.8	-37.4	-179.9	-64.2	175.6	0	0	0	110.7	E140 V144 V173 S174 T179 E180 L181	E140-I177 HydrophobicContact CB-CD1 3.81Å; E140-I177 HydrophobicContact CG-CD1 3.54Å; V144-I177 HydrophobicContact CG1-CG2 3.85Å; V144-I177 HydrophobicContact CG2-CG2 4.01Å; V173-I177 HydrophobicContact CB-CB 4.08Å; V173-I177 HydrophobicContact CB-CG2 3.9Å; V173-I177 HydrophobicContact CG1-CG2 4.36Å; V173-I177 HydrophobicContact CG2-CB 3.99Å; V173-I177 HydrophobicContact CG2-CG2 3.65Å; S174-I177 PolarHBondContact O-N 3.35Å; I177-T179 VanDerWaalsContact C-N 3.28Å; I177-T179 PolarHBondContact O-N 3.36Å; I177-E180 WeakPolarHBondContact O-CB 3.23Å; I177-E180 PolarHBondContact O-N 2.95Å; I177-E180 VanDerWaalsContact O-N 3.13Å; I177-L181 HydrophobicContact CG2-CD1 4.14Å; I177-L181 HydrophobicContact CG2-CG 4.1Å; I177-L181 WeakPolarHBondContact O-CG 3.43Å; I177-L181 PolarHBondContact O-N 3.21Å
178	Q	97.9	Very high	97.4	Very high	38 Å²	38	43.7 Å²	43.7	18%	0.178	23%	0.23	C	C	.	.	H	α-helix	trans	-54.9	-45.2	173.9	-73.7	-176.8	-20.4	0	0	111.7	Y170 V173 S174 P175 Q176 E180 L181 R182	Y170-Q178 HydrophobicContact CD1-CG 4.46Å; Y170-Q178 HydrophobicContact CD2-CB 4.12Å; Y170-Q178 HydrophobicContact CD2-CG 4.02Å; Y170-Q178 HydrophobicContact CE1-CG 4.16Å; Y170-Q178 HydrophobicContact CE2-CB 3.47Å; Y170-Q178 VanDerWaalsContact CE2-CB 3.47Å; Y170-Q178 HydrophobicContact CE2-CG 3.72Å; Y170-Q178 WeakPolarHBondContact CE2-O 3.48Å; Y170-Q178 HydrophobicContact CG-CG 4.39Å; Y170-Q178 PolarHBondContact O-NE2 3.07Å; V173-Q178 HydrophobicContact CG2-CG 3.85Å; V173-Q178 PolarHBondContact O-NE2 3.24Å; S174-Q178 WeakPolarHBondContact O-CG 3.38Å; S174-Q178 PolarHBondContact O-N 3.38Å; P175-Q178 PolarHBondContact O-N 3.5Å; Q176-Q178 VanDerWaalsContact C-N 3.34Å; Q176-Q178 PolarHBondContact O-N 2.71Å; Q178-E180 VanDerWaalsContact C-N 3.34Å; Q178-E180 PolarHBondContact O-N 2.9Å; Q178-L181 PolarHBondContact O-N 3.33Å; Q178-R182 WeakPolarHBondContact O-CG 3.38Å; Q178-R182 PolarHBondContact O-N 2.85Å
179	T	97.4	Very high	97.5	Very high	65 Å²	65	43.5 Å²	43.5	40%	0.399	23%	0.23	S	C	.	.	H	α-helix	trans	-63.2	-40.3	177.5	-55	0	0	0	0	112.1	P175 Q176 I177 R182 T183	P175-T179 PolarHBondContact O-N 2.94Å; P175-T179 VanDerWaalsContact O-N 3.11Å; P175-T179 PolarHBondContact O-OG1 2.96Å; Q176-T179 WeakPolarHBondContact O-CB 3.44Å; Q176-T179 PolarHBondContact O-N 3.46Å; I177-T179 VanDerWaalsContact C-N 3.28Å; I177-T179 PolarHBondContact O-N 3.36Å; T179-R182 PolarHBondContact O-N 3.24Å; T179-R182 PolarHBondContact OG1-NH2 2.89Å; T179-T183 PolarHBondContact O-N 2.94Å; T179-T183 VanDerWaalsContact O-N 3.1Å; T179-T183 PolarHBondContact O-OG1 2.75Å
180	E	97.3	Very high	97.5	Very high	83 Å²	83	48.5 Å²	48.5	39%	0.388	25%	0.251	S	S	.	.	H	α-helix	trans	-64.3	-43.8	174.9	-66.6	175.6	-161.8	0	0	111.9	K148 Q176 I177 Q178 R182 T183 L184	K148-E180 VanDerWaalsContact CE-OE2 3.23Å; K148-E180 WeakPolarHBondContact CE-OE2 3.23Å; K148-E180 IonicContact NZ-OE2 2.6Å; K148-E180 PolarHBondContact NZ-OE2 3.12Å; Q176-E180 PolarHBondContact O-N 3.35Å; I177-E180 WeakPolarHBondContact O-CB 3.23Å; I177-E180 PolarHBondContact O-N 2.95Å; I177-E180 VanDerWaalsContact O-N 3.13Å; Q178-E180 VanDerWaalsContact C-N 3.34Å; Q178-E180 PolarHBondContact O-N 2.9Å; E180-R182 PolarHBondContact O-N 3.46Å; E180-T183 WeakPolarHBondContact O-CB 3.32Å; E180-T183 PolarHBondContact O-N 3.27Å; E180-L184 WeakPolarHBondContact O-CG 3.31Å; E180-L184 PolarHBondContact O-N 3.42Å
181	L	98.1	Very high	97.5	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63	-40.8	177.9	-70.5	-178.8	0	0	0	111.8	V147 F166 A169 Y170 V173 I177 Q178 T183 L184 F185	V147-L181 HydrophobicContact CG1-CD2 4.3Å; F166-L181 HydrophobicContact CD1-CB 4.12Å; F166-L181 HydrophobicContact CD1-CD2 4.11Å; F166-L181 HydrophobicContact CE1-CB 4.39Å; F166-L181 HydrophobicContact CE1-CD2 4.05Å; F166-L181 VanDerWaalsContact CE1-O 3.31Å; F166-L181 WeakPolarHBondContact CE1-O 3.41Å; A169-L181 HydrophobicContact CB-CD1 4.44Å; Y170-L181 HydrophobicContact CD2-CB 4.2Å; Y170-L181 HydrophobicContact CD2-CD1 4.28Å; V173-L181 HydrophobicContact CG2-CD1 4.05Å; I177-L181 HydrophobicContact CG2-CD1 4.14Å; I177-L181 HydrophobicContact CG2-CG 4.1Å; I177-L181 WeakPolarHBondContact O-CG 3.43Å; I177-L181 PolarHBondContact O-N 3.21Å; Q178-L181 PolarHBondContact O-N 3.33Å; L181-T183 VanDerWaalsContact C-N 3.32Å; L181-T183 PolarHBondContact O-N 3.49Å; L181-L184 PolarHBondContact O-N 3.02Å; L181-F185 WeakPolarHBondContact O-CB 3.22Å; L181-F185 PolarHBondContact O-N 3.34Å
182	R	98.2	Very high	97.5	Very high	14 Å²	14	53.1 Å²	53.1	5%	0.053	27%	0.272	C	S	.	.	H	α-helix	trans	-62.5	-40.3	173.9	-66.5	-172.8	-51.5	-98.4	2.9	111.7	Y170 Q178 T179 E180 R186 F207 V211 D215 D219	Y170-R182 HydrophobicContact CE2-CG 3.75Å; Y170-R182 PolarHBondContact OH-NH1 3.5Å; Q178-R182 WeakPolarHBondContact O-CG 3.38Å; Q178-R182 PolarHBondContact O-N 2.85Å; T179-R182 PolarHBondContact O-N 3.24Å; T179-R182 PolarHBondContact OG1-NH2 2.89Å; E180-R182 PolarHBondContact O-N 3.46Å; R182-R186 WeakPolarHBondContact O-CB 3.32Å; R182-R186 PolarHBondContact O-N 2.71Å; R182-F207 HydrophobicContact CG-CZ 4.31Å; R182-V211 HydrophobicContact CG-CG2 4.35Å; R182-D215 IonicContact CZ-OD2 2.73Å; R182-D215 IonicContact NH1-OD2 2.68Å; R182-D215 PolarHBondContact NH1-OD2 3.25Å; R182-D219 HydrophobicContact CB-CB 4.22Å; R182-D219 IonicContact CZ-OD2 2.61Å; R182-D219 VanDerWaalsContact CZ-OD2 3.29Å; R182-D219 IonicContact NE-OD2 2.92Å; R182-D219 PolarHBondContact NE-OD2 3.13Å; R182-D219 IonicContact NH2-OD2 3.24Å; R182-D219 PolarHBondContact NH2-OD2 3.3Å
183	T	97.8	Very high	97.6	Very high	55 Å²	55	51.3 Å²	51.3	34%	0.337	27%	0.269	S	S	.	.	H	α-helix	trans	-65.3	-45	177.3	-57.1	0	0	0	0	111.7	T179 E180 L181 R186 N187	T179-T183 PolarHBondContact O-N 2.94Å; T179-T183 VanDerWaalsContact O-N 3.1Å; T179-T183 PolarHBondContact O-OG1 2.75Å; E180-T183 WeakPolarHBondContact O-CB 3.32Å; E180-T183 PolarHBondContact O-N 3.27Å; L181-T183 VanDerWaalsContact C-N 3.32Å; L181-T183 PolarHBondContact O-N 3.49Å; T183-R186 WeakPolarHBondContact O-CB 3.38Å; T183-R186 PolarHBondContact O-N 3.06Å; T183-N187 VanDerWaalsContact O-CG 3.29Å; T183-N187 PolarHBondContact O-N 3.25Å; T183-N187 VanDerWaalsContact O-N 3.07Å; T183-N187 PolarHBondContact O-OD1 2.97Å
184	L	98	Very high	97.6	Very high	40 Å²	40	52.3 Å²	52.3	21%	0.209	28%	0.275	C	S	.	.	H	α-helix	trans	-64.6	-44.1	178.2	-73.2	167.9	0	0	0	112	K148 F166 E180 L181 R186 N187 L188	K148-L184 HydrophobicContact CG-CD1 3.75Å; F166-L184 HydrophobicContact CE1-CB 3.91Å; F166-L184 HydrophobicContact CZ-CB 4.08Å; E180-L184 WeakPolarHBondContact O-CG 3.31Å; E180-L184 PolarHBondContact O-N 3.42Å; L181-L184 PolarHBondContact O-N 3.02Å; L184-R186 VanDerWaalsContact C-N 3.32Å; L184-R186 PolarHBondContact O-N 3.34Å; L184-N187 WeakPolarHBondContact O-CB 3.4Å; L184-N187 PolarHBondContact O-N 2.96Å; L184-N187 VanDerWaalsContact O-N 3.13Å; L184-L188 PolarHBondContact O-N 2.66Å; L184-L188 VanDerWaalsContact O-N 3.08Å
185	F	98.4	Very high	97.6	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-62.7	-40.9	176.5	-165.5	-88.2	0	0	0	111.6	F166 L181 N187 L188 C189 A200 R203 I204 F207 L220	F166-F185 HydrophobicContact CB-CD2 4.09Å; F166-F185 HydrophobicContact CD1-CB 3.98Å; F166-F185 HydrophobicContact CD1-CD2 4.07Å; F166-F185 AromaticContact CD2-CD2 3.62Å; F166-F185 HydrophobicContact CD2-CD2 3.62Å; F166-F185 HydrophobicContact CD2-CE2 4.25Å; F166-F185 HydrophobicContact CE1-CB 3.93Å; F166-F185 HydrophobicContact CE1-CD2 4.43Å; F166-F185 HydrophobicContact CE2-CD2 4.02Å; F166-F185 HydrophobicContact CG-CB 4.44Å; F166-F185 AromaticContact CG-CD2 3.66Å; F166-F185 HydrophobicContact CG-CD2 3.66Å; F166-F185 HydrophobicContact CG-CE2 4.47Å; F166-F185 HydrophobicContact CZ-CB 4.34Å; F166-F185 HydrophobicContact CZ-CD2 4.4Å; L181-F185 WeakPolarHBondContact O-CB 3.22Å; L181-F185 PolarHBondContact O-N 3.34Å; F185-N187 VanDerWaalsContact C-N 3.25Å; F185-N187 PolarHBondContact O-N 2.85Å; F185-L188 WeakPolarHBondContact O-CB 3.49Å; F185-L188 PolarHBondContact O-N 3.5Å; F185-L188 VanDerWaalsContact O-N 3.11Å; F185-C189 VanDerWaalsContact CE1-SG 3.53Å; F185-C189 PolarHBondContact O-N 3.07Å; F185-C189 PolarHBondContact O-SG 3.22Å; F185-A200 HydrophobicContact CZ-CB 4.49Å; F185-R203 HydrophobicContact CE2-CB 4.25Å; F185-R203 HydrophobicContact CZ-CB 4.18Å; F185-I204 HydrophobicContact CE1-CB 3.86Å; F185-I204 HydrophobicContact CE1-CD1 4.26Å; F185-I204 HydrophobicContact CE1-CG1 3.87Å; F185-I204 HydrophobicContact CZ-CB 4.12Å; F185-F207 HydrophobicContact CB-CD1 4Å; F185-F207 HydrophobicContact CB-CE1 3.51Å; F185-F207 HydrophobicContact CB-CZ 4.39Å; F185-F207 AromaticContact CD1-CD1 3.6Å; F185-F207 HydrophobicContact CD1-CD1 3.6Å; F185-F207 AromaticContact CD1-CE1 3.96Å; F185-F207 HydrophobicContact CD1-CE1 3.96Å; F185-F207 AromaticContact CD2-CD1 3.74Å; F185-F207 HydrophobicContact CD2-CD1 3.74Å; F185-F207 HydrophobicContact CD2-CE1 4.05Å; F185-F207 HydrophobicContact CD2-CG 4.38Å; F185-F207 AromaticContact CE1-CD1 3.96Å; F185-F207 HydrophobicContact CE1-CD1 3.96Å; F185-F207 HydrophobicContact CE2-CB 4.41Å; F185-F207 HydrophobicContact CE2-CD1 4.08Å; F185-F207 HydrophobicContact CE2-CG 4.45Å; F185-F207 AromaticContact CG-CD1 3.48Å; F185-F207 HydrophobicContact CG-CD1 3.48Å; F185-F207 VanDerWaalsContact CG-CD1 3.48Å; F185-F207 AromaticContact CG-CE1 3.56Å; F185-F207 HydrophobicContact CG-CE1 3.56Å; F185-F207 HydrophobicContact CZ-CB 4.35Å; F185-F207 HydrophobicContact CZ-CD1 4.19Å; F185-L220 HydrophobicContact CD1-CD2 4.19Å
186	R	98	Very high	97.7	Very high	67 Å²	67	50.1 Å²	50.1	25%	0.253	25%	0.254	S	S	.	.	H	α-helix	trans	-56.7	-39.7	173.4	-175.1	-168.2	-64.4	153.2	1	111.8	R182 T183 L184 C189 K190 D219 L220 A223	R182-R186 WeakPolarHBondContact O-CB 3.32Å; R182-R186 PolarHBondContact O-N 2.71Å; T183-R186 WeakPolarHBondContact O-CB 3.38Å; T183-R186 PolarHBondContact O-N 3.06Å; L184-R186 VanDerWaalsContact C-N 3.32Å; L184-R186 PolarHBondContact O-N 3.34Å; R186-C189 WeakPolarHBondContact O-CB 3.2Å; R186-C189 PolarHBondContact O-N 3.27Å; R186-K190 PolarHBondContact O-N 3.1Å; R186-D219 VanDerWaalsContact CZ-O 3.23Å; R186-D219 PolarHBondContact NE-O 3.35Å; R186-D219 VanDerWaalsContact NH2-C 3.34Å; R186-D219 PolarHBondContact NH2-O 3.43Å; R186-D219 IonicContact NH2-OD1 3.84Å; R186-D219 PolarHBondContact NH2-OD1 3.37Å; R186-L220 HydrophobicContact CB-CD2 4.37Å; R186-A223 HydrophobicContact CG-CB 4.14Å
187	N	97.6	Very high	97.7	Very high	91 Å²	91	44.5 Å²	44.5	49%	0.487	23%	0.227	S	C	.	.	H	α-helix	trans	-66.2	-40.9	176.5	-64.7	-15.3	0	0	0	111.6	T183 L184 F185 C189 K190 D191	T183-N187 VanDerWaalsContact O-CG 3.29Å; T183-N187 PolarHBondContact O-N 3.25Å; T183-N187 VanDerWaalsContact O-N 3.07Å; T183-N187 PolarHBondContact O-OD1 2.97Å; L184-N187 WeakPolarHBondContact O-CB 3.4Å; L184-N187 PolarHBondContact O-N 2.96Å; L184-N187 VanDerWaalsContact O-N 3.13Å; F185-N187 VanDerWaalsContact C-N 3.25Å; F185-N187 PolarHBondContact O-N 2.85Å; N187-C189 VanDerWaalsContact C-N 3.3Å; N187-C189 PolarHBondContact O-N 3.07Å; N187-K190 CarbonylContact O-C 3.53Å; N187-K190 VanDerWaalsContact O-C 3.32Å; N187-K190 WeakPolarHBondContact O-CA 3.35Å; N187-K190 PolarHBondContact O-N 3.33Å; N187-D191 PolarHBondContact O-N 2.72Å
188	L	98.3	Very high	97.8	Very high	3 Å²	3	48.8 Å²	48.8	2%	0.016	24%	0.242	C	C	.	.	H	α-helix	trans	-63.1	-35.1	175.1	-64.9	172.9	0	0	0	112.4	A151 R159 A162 T163 F166 L184 F185 K190 D191 V196	A151-L188 HydrophobicContact CB-CD1 4.17Å; A151-L188 HydrophobicContact CB-CD2 4.46Å; R159-L188 HydrophobicContact CB-CD2 3.9Å; R159-L188 HydrophobicContact CG-CD2 4.47Å; A162-L188 HydrophobicContact CB-CD1 4.2Å; T163-L188 HydrophobicContact CG2-CB 4.49Å; T163-L188 HydrophobicContact CG2-CD1 4.01Å; F166-L188 HydrophobicContact CE2-CD1 3.52Å; F166-L188 HydrophobicContact CZ-CD1 3.75Å; L184-L188 PolarHBondContact O-N 2.66Å; L184-L188 VanDerWaalsContact O-N 3.08Å; F185-L188 WeakPolarHBondContact O-CB 3.49Å; F185-L188 PolarHBondContact O-N 3.5Å; F185-L188 VanDerWaalsContact O-N 3.11Å; L188-K190 PolarHBondContact O-N 3.49Å; L188-D191 WeakPolarHBondContact O-CB 3.18Å; L188-D191 PolarHBondContact O-N 3Å; L188-V196 HydrophobicContact CB-CG1 4.28Å; L188-V196 HydrophobicContact CD2-CG1 3.8Å
189	C	98.2	Very high	97.8	Very high	4 Å²	4	47.6 Å²	47.6	3%	0.027	24%	0.238	C	C	.	.	H	α-helix	trans	-64	-22.5	172	-61.3	0	0	0	0	113.2	F185 R186 N187 R197 A223 L227	F185-C189 VanDerWaalsContact CE1-SG 3.53Å; F185-C189 PolarHBondContact O-N 3.07Å; F185-C189 PolarHBondContact O-SG 3.22Å; R186-C189 WeakPolarHBondContact O-CB 3.2Å; R186-C189 PolarHBondContact O-N 3.27Å; N187-C189 VanDerWaalsContact C-N 3.3Å; N187-C189 PolarHBondContact O-N 3.07Å; C189-R197 WeakPolarHBondContact O-CD 3.37Å; C189-A223 HydrophobicContact CB-CB 3.83Å; C189-L227 HydrophobicContact CB-CD1 3.97Å; C189-L227 HydrophobicContact CB-CD2 4.38Å; C189-L227 HydrophobicContact CB-CG 4.16Å; C189-L227 WeakPolarHBondContact O-CD2 3.27Å
190	K	97	Very high	97.8	Very high	104 Å²	104	44.5 Å²	44.5	45%	0.452	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.6	15.3	-178.8	-61.2	-172.7	-178.1	-146.3	0	112.8	R186 N187 L188 D226	R186-K190 PolarHBondContact O-N 3.1Å; N187-K190 CarbonylContact O-C 3.53Å; N187-K190 VanDerWaalsContact O-C 3.32Å; N187-K190 WeakPolarHBondContact O-CA 3.35Å; N187-K190 PolarHBondContact O-N 3.33Å; L188-K190 PolarHBondContact O-N 3.49Å; K190-D226 WeakPolarHBondContact CE-OD2 3.27Å; K190-D226 IonicContact NZ-OD2 3.23Å; K190-D226 PolarHBondContact NZ-OD2 2.89Å
191	D	98	Very high	97.9	Very high	22 Å²	22	40.6 Å²	40.6	12%	0.118	20%	0.201	C	C	.	.			trans	-60.8	141.5	-178.3	-162.8	-82.6	0	0	0	111.3	R159 N187 L188 T193 V196 R197	R159-D191 IonicContact CZ-OD1 3.78Å; R159-D191 IonicContact CZ-OD2 3.46Å; R159-D191 IonicContact NE-OD1 3.71Å; R159-D191 IonicContact NE-OD2 2.7Å; R159-D191 PolarHBondContact NE-OD2 3.26Å; R159-D191 IonicContact NH2-OD1 2.95Å; R159-D191 PolarHBondContact NH2-OD1 3.15Å; R159-D191 IonicContact NH2-OD2 3.41Å; R159-D191 PolarHBondContact NH2-OD2 3.3Å; N187-D191 PolarHBondContact O-N 2.72Å; L188-D191 WeakPolarHBondContact O-CB 3.18Å; L188-D191 PolarHBondContact O-N 3Å; D191-T193 PolarHBondContact O-N 3.07Å; D191-T193 WeakPolarHBondContact OD1-CA 2.99Å; D191-T193 WeakPolarHBondContact OD1-CB 3.27Å; D191-T193 PolarHBondContact OD1-N 3.03Å; D191-T193 PolarHBondContact OD1-OG1 3.32Å; D191-V196 HydrophobicContact CB-CB 3.72Å; D191-V196 HydrophobicContact CB-CG1 3.63Å; D191-V196 HydrophobicContact CB-CG2 4.49Å; D191-R197 HydrophobicContact CB-CG 4.14Å; D191-R197 WeakPolarHBondContact O-CD 3.42Å; D191-R197 VanDerWaalsContact O-CG 3.23Å; D191-R197 WeakPolarHBondContact O-CG 3.26Å; D191-R197 PolarHBondContact O-NH1 2.61Å
192	D	97	Very high	97.8	Very high	157 Å²	157	44 Å²	44	84%	0.84	22%	0.222	S	C	*	.	S	Bend	trans	-61.3	-28	178.1	-65.6	-36.4	0	0	0	112	P194 R197	D192-P194 WeakPolarHBondContact O-CD 3.41Å; D192-R197 PolarHBondContact O-NH1 2.85Å
193	T	97	Very high	97.8	Very high	32 Å²	32	47.1 Å²	47.1	20%	0.196	23%	0.234	C	C	.	.	S	Bend	trans	-85.8	118.5	-178	-51	0	0	0	0	111.3	F156 R159 D191 M195 V196 R197	F156-T193 HydrophobicContact CB-CG2 3.81Å; F156-T193 HydrophobicContact CG-CG2 4.1Å; R159-T193 PolarHBondContact NH2-OG1 3.31Å; D191-T193 PolarHBondContact O-N 3.07Å; D191-T193 WeakPolarHBondContact OD1-CA 2.99Å; D191-T193 WeakPolarHBondContact OD1-CB 3.27Å; D191-T193 PolarHBondContact OD1-N 3.03Å; D191-T193 PolarHBondContact OD1-OG1 3.32Å; T193-M195 HydrophobicContact CG2-CB 4.23Å; T193-M195 HydrophobicContact CG2-CE 3.87Å; T193-M195 HydrophobicContact CG2-SD 3.82Å; T193-M195 PolarHBondContact O-N 3.48Å; T193-M195 VanDerWaalsContact O-N 3.13Å; T193-V196 HydrophobicContact CG2-CG2 4.42Å; T193-V196 PolarHBondContact O-N 3.08Å; T193-R197 PolarHBondContact O-N 3.17Å
194	P	97.3	Very high	97.8	Very high	31 Å²	31	44.5 Å²	44.5	20%	0.201	22%	0.218	C	C	.	.	H	α-helix	trans	-56.9	-33.8	-179.2	-26.5	35.2	0	0	0	113.8	D192 V196 R197 R198	D192-P194 WeakPolarHBondContact O-CD 3.41Å; P194-V196 VanDerWaalsContact C-N 3.29Å; P194-V196 PolarHBondContact O-N 3.49Å; P194-R197 PolarHBondContact O-N 3.1Å; P194-R198 VanDerWaalsContact O-CG 3.29Å; P194-R198 WeakPolarHBondContact O-CG 3.47Å; P194-R198 PolarHBondContact O-N 3.45Å
195	M	97.2	Very high	97.7	Very high	82 Å²	82	42.7 Å²	42.7	40%	0.404	21%	0.209	S	C	.	.	H	α-helix	trans	-62.8	-34.3	179	-60.6	78.8	97.8	0	0	112.7	F156 I160 T193 A199	F156-M195 HydrophobicContact CD2-CB 4.35Å; F156-M195 HydrophobicContact CD2-CE 4.37Å; F156-M195 HydrophobicContact CE1-CE 4.49Å; F156-M195 HydrophobicContact CE2-CE 4.13Å; F156-M195 HydrophobicContact CZ-CE 4.2Å; I160-M195 HydrophobicContact CD1-CB 3.82Å; T193-M195 HydrophobicContact CG2-CB 4.23Å; T193-M195 HydrophobicContact CG2-CE 3.87Å; T193-M195 HydrophobicContact CG2-SD 3.82Å; T193-M195 PolarHBondContact O-N 3.48Å; T193-M195 VanDerWaalsContact O-N 3.13Å; M195-A199 PolarHBondContact O-N 3.14Å
196	V	98.2	Very high	97.6	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-71.9	-44.5	175.6	-179.1	0	0	0	0	110.1	F156 R159 I160 L188 D191 T193 P194 R198 A199 A200	F156-V196 HydrophobicContact CB-CG2 3.86Å; R159-V196 HydrophobicContact CB-CG1 4.02Å; R159-V196 HydrophobicContact CB-CG2 3.9Å; I160-V196 HydrophobicContact CG1-CG2 4.11Å; L188-V196 HydrophobicContact CB-CG1 4.28Å; L188-V196 HydrophobicContact CD2-CG1 3.8Å; D191-V196 HydrophobicContact CB-CB 3.72Å; D191-V196 HydrophobicContact CB-CG1 3.63Å; D191-V196 HydrophobicContact CB-CG2 4.49Å; T193-V196 HydrophobicContact CG2-CG2 4.42Å; T193-V196 PolarHBondContact O-N 3.08Å; P194-V196 VanDerWaalsContact C-N 3.29Å; P194-V196 PolarHBondContact O-N 3.49Å; V196-R198 VanDerWaalsContact C-N 3.31Å; V196-R198 PolarHBondContact O-N 2.92Å; V196-A199 WeakPolarHBondContact O-CB 3.39Å; V196-A199 PolarHBondContact O-N 3.18Å; V196-A199 VanDerWaalsContact O-N 3.12Å; V196-A200 PolarHBondContact O-N 3.4Å
197	R	98.4	Very high	97.6	Very high	25 Å²	25	43.2 Å²	43.2	9%	0.094	21%	0.214	C	C	.	.	H	α-helix	trans	-62.9	-36.6	176.6	-58.7	-160.8	-54.7	-82.5	3.1	112.6	C189 D191 D192 T193 P194 A200 A201 L227 D230 H232 V235	C189-R197 WeakPolarHBondContact O-CD 3.37Å; D191-R197 HydrophobicContact CB-CG 4.14Å; D191-R197 WeakPolarHBondContact O-CD 3.42Å; D191-R197 VanDerWaalsContact O-CG 3.23Å; D191-R197 WeakPolarHBondContact O-CG 3.26Å; D191-R197 PolarHBondContact O-NH1 2.61Å; D192-R197 PolarHBondContact O-NH1 2.85Å; T193-R197 PolarHBondContact O-N 3.17Å; P194-R197 PolarHBondContact O-N 3.1Å; R197-A200 PolarHBondContact O-N 2.94Å; R197-A201 WeakPolarHBondContact O-CB 3.35Å; R197-A201 PolarHBondContact O-N 2.87Å; R197-L227 HydrophobicContact CB-CD2 4.02Å; R197-D230 IonicContact CZ-OD1 3.85Å; R197-D230 IonicContact CZ-OD2 3.42Å; R197-D230 IonicContact NE-OD1 2.96Å; R197-D230 IonicContact NE-OD2 3.48Å; R197-D230 PolarHBondContact NE-OD2 2.94Å; R197-D230 IonicContact NH2-OD1 2.95Å; R197-D230 PolarHBondContact NH2-OD1 3.48Å; R197-D230 IonicContact NH2-OD2 3.28Å; R197-D230 PolarHBondContact NH2-OD2 2.88Å; R197-H232 PolarHBondContact NH2-ND1 2.9Å; R197-H232 VanDerWaalsContact NH2-ND1 3.13Å; R197-V235 HydrophobicContact CB-CG1 4.32Å; R197-V235 HydrophobicContact CB-CG2 4.14Å
198	R	98	Very high	97.6	Very high	112 Å²	112	38.9 Å²	38.9	42%	0.423	19%	0.191	S	C	.	.	H	α-helix	trans	-59	-47.9	171	-73.8	179.4	68.3	-151.4	-6.5	111.4	P194 V196 A200 A201 T202 V235 L238	P194-R198 VanDerWaalsContact O-CG 3.29Å; P194-R198 WeakPolarHBondContact O-CG 3.47Å; P194-R198 PolarHBondContact O-N 3.45Å; V196-R198 VanDerWaalsContact C-N 3.31Å; V196-R198 PolarHBondContact O-N 2.92Å; R198-A200 VanDerWaalsContact C-N 3.34Å; R198-A201 PolarHBondContact O-N 2.81Å; R198-T202 PolarHBondContact O-N 3.3Å; R198-T202 VanDerWaalsContact O-N 3.16Å; R198-V235 HydrophobicContact CG-CB 4.44Å; R198-V235 HydrophobicContact CG-CG2 3.59Å; R198-L238 HydrophobicContact CB-CD1 3.8Å; R198-L238 HydrophobicContact CG-CD1 4.04Å
199	A	97.9	Very high	97.5	Very high	13 Å²	13	42.8 Å²	42.8	11%	0.107	22%	0.215	C	C	.	.	H	α-helix	trans	-64.1	-38.5	177.3	0	0	0	0	0	112.1	I160 T163 M195 V196 A201 T202 R203	I160-A199 HydrophobicContact CB-CB 4.28Å; I160-A199 HydrophobicContact CG1-CB 4.19Å; I160-A199 HydrophobicContact CG2-CB 3.88Å; T163-A199 HydrophobicContact CG2-CB 3.97Å; M195-A199 PolarHBondContact O-N 3.14Å; V196-A199 WeakPolarHBondContact O-CB 3.39Å; V196-A199 PolarHBondContact O-N 3.18Å; V196-A199 VanDerWaalsContact O-N 3.12Å; A199-A201 PolarHBondContact O-N 3Å; A199-T202 PolarHBondContact O-N 3.19Å; A199-T202 PolarHBondContact O-OG1 3.18Å; A199-R203 WeakPolarHBondContact O-CG 3.01Å; A199-R203 PolarHBondContact O-N 3.37Å
200	A	98.4	Very high	97.4	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64.3	-40.5	173.8	0	0	0	0	0	111.7	T163 F185 V196 R197 R198 T202 R203 I204	T163-A200 HydrophobicContact CG2-CB 4.28Å; F185-A200 HydrophobicContact CZ-CB 4.49Å; V196-A200 PolarHBondContact O-N 3.4Å; R197-A200 PolarHBondContact O-N 2.94Å; R198-A200 VanDerWaalsContact C-N 3.34Å; A200-T202 VanDerWaalsContact C-N 3.33Å; A200-T202 PolarHBondContact O-N 3.44Å; A200-R203 PolarHBondContact O-N 3.41Å; A200-R203 VanDerWaalsContact O-N 3.16Å; A200-I204 WeakPolarHBondContact O-CB 3.07Å; A200-I204 PolarHBondContact O-N 2.72Å
201	A	98.2	Very high	97.4	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64.5	-31.8	178.3	0	0	0	0	0	113.8	R197 R198 A199 L227 V235 L238 V239 S242	R197-A201 WeakPolarHBondContact O-CB 3.35Å; R197-A201 PolarHBondContact O-N 2.87Å; R198-A201 PolarHBondContact O-N 2.81Å; A199-A201 PolarHBondContact O-N 3Å; A201-L227 HydrophobicContact CB-CD1 4.22Å; A201-L227 HydrophobicContact CB-CD2 4.42Å; A201-V235 HydrophobicContact CB-CG1 4.21Å; A201-L238 HydrophobicContact CB-CB 3.99Å; A201-V239 HydrophobicContact CB-CG2 4.13Å; A201-S242 PolarHBondContact O-OG 3.49Å
202	T	97.3	Very high	97.3	Very high	72 Å²	72	39.6 Å²	39.6	44%	0.442	21%	0.212	S	C	.	.	H	α-helix	trans	-76.3	-24.5	174.1	59.9	0	0	0	0	113.2	R198 A199 A200 L238	R198-T202 PolarHBondContact O-N 3.3Å; R198-T202 VanDerWaalsContact O-N 3.16Å; A199-T202 PolarHBondContact O-N 3.19Å; A199-T202 PolarHBondContact O-OG1 3.18Å; A200-T202 VanDerWaalsContact C-N 3.33Å; A200-T202 PolarHBondContact O-N 3.44Å; T202-L238 HydrophobicContact CG2-CB 4.16Å; T202-L238 HydrophobicContact CG2-CD1 3.87Å; T202-L238 HydrophobicContact CG2-CD2 3.95Å; T202-L238 HydrophobicContact CG2-CG 4.2Å
203	R	97.5	Very high	97.2	Very high	80 Å²	80	33.7 Å²	33.7	30%	0.302	18%	0.181	S	C	.	.	H	α-helix	trans	-100.6	-17.8	-175.8	-61.5	-61.4	-178.8	178.1	-3	114.5	F185 A199 A200 G205 E206 F207	F185-R203 HydrophobicContact CE2-CB 4.25Å; F185-R203 HydrophobicContact CZ-CB 4.18Å; A199-R203 WeakPolarHBondContact O-CG 3.01Å; A199-R203 PolarHBondContact O-N 3.37Å; A200-R203 PolarHBondContact O-N 3.41Å; A200-R203 VanDerWaalsContact O-N 3.16Å; R203-G205 VanDerWaalsContact C-N 3.31Å; R203-G205 PolarHBondContact O-N 2.7Å; R203-E206 IonicContact NH1-OE2 3.71Å; R203-E206 PolarHBondContact NH1-OE2 3.22Å; R203-E206 VanDerWaalsContact NH1-OE2 3.14Å; R203-E206 PolarHBondContact O-N 2.96Å; R203-F207 PolarHBondContact O-N 2.78Å
204	I	97.8	Very high	97	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-62	-35.3	-175	-166.6	164.9	0	0	0	112.9	F185 A200 F207 A208 F216 F224 L227 S242	F185-I204 HydrophobicContact CE1-CB 3.86Å; F185-I204 HydrophobicContact CE1-CD1 4.26Å; F185-I204 HydrophobicContact CE1-CG1 3.87Å; F185-I204 HydrophobicContact CZ-CB 4.12Å; A200-I204 WeakPolarHBondContact O-CB 3.07Å; A200-I204 PolarHBondContact O-N 2.72Å; I204-F207 PolarHBondContact O-N 3.18Å; I204-A208 VanDerWaalsContact O-CB 3.27Å; I204-A208 WeakPolarHBondContact O-CB 3.48Å; I204-A208 PolarHBondContact O-N 3.14Å; I204-F216 HydrophobicContact CG1-CE2 4.34Å; I204-F224 HydrophobicContact CD1-CB 3.72Å; I204-F224 HydrophobicContact CD1-CD2 4.43Å; I204-F224 HydrophobicContact CG2-CD2 4.32Å; I204-L227 HydrophobicContact CD1-CD1 4.06Å; I204-S242 VanDerWaalsContact CG2-OG 3.32Å; I204-S242 WeakPolarHBondContact CG2-OG 3.48Å
205	G	96.6	Very high	96.9	Very high	2 Å²	2	36.9 Å²	36.9	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-64.4	-44.5	175.5	0	0	0	0	0	113	R203 A208 V209 S242	R203-G205 VanDerWaalsContact C-N 3.31Å; R203-G205 PolarHBondContact O-N 2.7Å; G205-A208 PolarHBondContact O-N 3.24Å; G205-V209 PolarHBondContact O-N 3Å; G205-S242 PolarHBondContact N-OG 3.35Å
206	E	96.5	Very high	96.9	Very high	76 Å²	76	33 Å²	33	36%	0.355	18%	0.183	S	C	.	.	H	α-helix	trans	-64.2	-44.1	175.3	-172.6	-167.5	153.7	0	0	111	S167 R203 V209 A210	S167-E206 VanDerWaalsContact CB-OE1 3.29Å; S167-E206 WeakPolarHBondContact CB-OE1 3.46Å; S167-E206 PolarHBondContact OG-OE1 3.48Å; R203-E206 IonicContact NH1-OE2 3.71Å; R203-E206 PolarHBondContact NH1-OE2 3.22Å; R203-E206 VanDerWaalsContact NH1-OE2 3.14Å; R203-E206 PolarHBondContact O-N 2.96Å; E206-V209 PolarHBondContact O-N 3.41Å; E206-A210 PolarHBondContact O-N 3.24Å
207	F	97.9	Very high	96.7	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.009	20%	0.197	C	C	.	.	H	α-helix	trans	-67.7	-36.1	179	-172.6	-137	0	0	0	112.4	F166 Y170 R182 F185 R203 I204 V209 A210 V211 L220	F166-F207 HydrophobicContact CB-CD2 3.8Å; F166-F207 HydrophobicContact CB-CE2 3.78Å; F166-F207 HydrophobicContact CB-CG 4.23Å; F166-F207 HydrophobicContact CB-CZ 4.16Å; F166-F207 HydrophobicContact CD1-CZ 4.25Å; Y170-F207 AromaticContact CD2-CE2 3.75Å; Y170-F207 HydrophobicContact CD2-CE2 3.75Å; Y170-F207 AromaticContact CD2-CZ 3.96Å; Y170-F207 HydrophobicContact CD2-CZ 3.96Å; Y170-F207 HydrophobicContact CE2-CE2 4.5Å; Y170-F207 HydrophobicContact CE2-CZ 4.42Å; Y170-F207 AromaticContact CG-CE2 3.85Å; Y170-F207 HydrophobicContact CG-CE2 3.85Å; R182-F207 HydrophobicContact CG-CZ 4.31Å; F185-F207 HydrophobicContact CB-CD1 4Å; F185-F207 HydrophobicContact CB-CE1 3.51Å; F185-F207 HydrophobicContact CB-CZ 4.39Å; F185-F207 AromaticContact CD1-CD1 3.6Å; F185-F207 HydrophobicContact CD1-CD1 3.6Å; F185-F207 AromaticContact CD1-CE1 3.96Å; F185-F207 HydrophobicContact CD1-CE1 3.96Å; F185-F207 AromaticContact CD2-CD1 3.74Å; F185-F207 HydrophobicContact CD2-CD1 3.74Å; F185-F207 HydrophobicContact CD2-CE1 4.05Å; F185-F207 HydrophobicContact CD2-CG 4.38Å; F185-F207 AromaticContact CE1-CD1 3.96Å; F185-F207 HydrophobicContact CE1-CD1 3.96Å; F185-F207 HydrophobicContact CE2-CB 4.41Å; F185-F207 HydrophobicContact CE2-CD1 4.08Å; F185-F207 HydrophobicContact CE2-CG 4.45Å; F185-F207 AromaticContact CG-CD1 3.48Å; F185-F207 HydrophobicContact CG-CD1 3.48Å; F185-F207 VanDerWaalsContact CG-CD1 3.48Å; F185-F207 AromaticContact CG-CE1 3.56Å; F185-F207 HydrophobicContact CG-CE1 3.56Å; F185-F207 HydrophobicContact CZ-CB 4.35Å; F185-F207 HydrophobicContact CZ-CD1 4.19Å; R203-F207 PolarHBondContact O-N 2.78Å; I204-F207 PolarHBondContact O-N 3.18Å; F207-V209 VanDerWaalsContact C-N 3.27Å; F207-V209 PolarHBondContact O-N 3.13Å; F207-A210 HydrophobicContact CD2-CB 4.46Å; F207-A210 PolarHBondContact O-N 3.13Å; F207-A210 VanDerWaalsContact O-N 3.13Å; F207-V211 HydrophobicContact CD1-CG2 4.23Å; F207-V211 HydrophobicContact CD2-CG2 3.8Å; F207-V211 HydrophobicContact CE1-CG2 3.95Å; F207-V211 HydrophobicContact CE2-CG2 3.46Å; F207-V211 VanDerWaalsContact CE2-CG2 3.46Å; F207-V211 HydrophobicContact CG-CG2 4.17Å; F207-V211 HydrophobicContact CZ-CG2 3.55Å; F207-V211 WeakPolarHBondContact O-CB 3.34Å; F207-V211 VanDerWaalsContact O-CG2 3.24Å; F207-V211 WeakPolarHBondContact O-CG2 3.46Å; F207-V211 PolarHBondContact O-N 3.26Å; F207-L220 HydrophobicContact CD1-CD1 3.68Å; F207-L220 HydrophobicContact CE1-CD1 3.59Å; F207-L220 HydrophobicContact CE1-CD2 4.46Å
208	A	97.2	Very high	96.5	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-56.5	-42.8	174	0	0	0	0	0	111.6	I204 G205 A210 V211 G212 F216 I246 L249	I204-A208 VanDerWaalsContact O-CB 3.27Å; I204-A208 WeakPolarHBondContact O-CB 3.48Å; I204-A208 PolarHBondContact O-N 3.14Å; G205-A208 PolarHBondContact O-N 3.24Å; A208-A210 VanDerWaalsContact C-N 3.35Å; A208-A210 PolarHBondContact O-N 3.2Å; A208-V211 PolarHBondContact O-N 3.33Å; A208-G212 PolarHBondContact O-N 3.33Å; A208-F216 HydrophobicContact CB-CD2 3.38Å; A208-F216 HydrophobicContact CB-CE2 3.53Å; A208-F216 HydrophobicContact CB-CG 4.03Å; A208-F216 HydrophobicContact CB-CZ 4.26Å; A208-I246 HydrophobicContact CB-CG1 3.84Å; A208-L249 VanDerWaalsContact C-CD2 3.5Å; A208-L249 HydrophobicContact CB-CD2 4.02Å; A208-L249 WeakPolarHBondContact O-CD2 3.2Å
209	V	96.2	Very high	96.4	Very high	85 Å²	85	37.5 Å²	37.5	52%	0.515	21%	0.21	S	C	.	.	H	α-helix	trans	-62.9	-41.1	177.2	175.9	0	0	0	0	111.5	G205 E206 F207 V211	G205-V209 PolarHBondContact O-N 3Å; E206-V209 PolarHBondContact O-N 3.41Å; F207-V209 VanDerWaalsContact C-N 3.27Å; F207-V209 PolarHBondContact O-N 3.13Å; V209-V211 VanDerWaalsContact C-N 3.34Å
210	A	96.5	Very high	96.4	Very high	28 Å²	28	36.9 Å²	36.9	23%	0.231	21%	0.205	C	C	.	.	H	α-helix	trans	-68.1	-32.8	176.7	0	0	0	0	0	113.1	Y170 P171 E206 F207 A208	Y170-A210 WeakPolarHBondContact CD1-O 3.24Å; Y170-A210 WeakPolarHBondContact CE1-O 3.43Å; P171-A210 HydrophobicContact CG-CB 4.23Å; E206-A210 PolarHBondContact O-N 3.24Å; F207-A210 HydrophobicContact CD2-CB 4.46Å; F207-A210 PolarHBondContact O-N 3.13Å; F207-A210 VanDerWaalsContact O-N 3.13Å; A208-A210 VanDerWaalsContact C-N 3.35Å; A208-A210 PolarHBondContact O-N 3.2Å
211	V	96.7	Very high	96.2	Very high	12 Å²	12	37.9 Å²	37.9	7%	0.073	21%	0.21	C	C	.	.	H	α-helix	trans	-79.3	-35.1	-178.4	171.2	0	0	0	0	112.6	Y170 R182 F207 A208 V209 D215 F216 L220	Y170-V211 HydrophobicContact CD1-CG2 4.2Å; Y170-V211 HydrophobicContact CD2-CG2 4.22Å; Y170-V211 HydrophobicContact CE1-CB 4.21Å; Y170-V211 HydrophobicContact CE1-CG2 3.95Å; Y170-V211 HydrophobicContact CE2-CG2 3.93Å; Y170-V211 HydrophobicContact CG-CG2 4.34Å; R182-V211 HydrophobicContact CG-CG2 4.35Å; F207-V211 HydrophobicContact CD1-CG2 4.23Å; F207-V211 HydrophobicContact CD2-CG2 3.8Å; F207-V211 HydrophobicContact CE1-CG2 3.95Å; F207-V211 HydrophobicContact CE2-CG2 3.46Å; F207-V211 VanDerWaalsContact CE2-CG2 3.46Å; F207-V211 HydrophobicContact CG-CG2 4.17Å; F207-V211 HydrophobicContact CZ-CG2 3.55Å; F207-V211 WeakPolarHBondContact O-CB 3.34Å; F207-V211 VanDerWaalsContact O-CG2 3.24Å; F207-V211 WeakPolarHBondContact O-CG2 3.46Å; F207-V211 PolarHBondContact O-N 3.26Å; A208-V211 PolarHBondContact O-N 3.33Å; V209-V211 VanDerWaalsContact C-N 3.34Å; V211-D215 HydrophobicContact CG1-CB 3.33Å; V211-F216 HydrophobicContact CG1-CB 4.31Å; V211-L220 HydrophobicContact CG1-CD1 4.43Å; V211-L220 HydrophobicContact CG2-CD1 4.09Å
212	G	95.1	Very high	96.1	Very high	23 Å²	23	41.3 Å²	41.3	24%	0.237	23%	0.234	C	C	.	.			trans	82.4	165.1	-175.3	0	0	0	0	0	113.4	A208 S214 F216	A208-G212 PolarHBondContact O-N 3.33Å; G212-S214 PolarHBondContact O-N 3.45Å; G212-F216 WeakPolarHBondContact O-CB 3.38Å; G212-F216 PolarHBondContact O-N 3.02Å
213	V	94.4	Very high	96.2	Very high	33 Å²	33	37.9 Å²	37.9	20%	0.2	21%	0.213	C	C	.	.	H	α-helix	trans	-61.7	-47.1	-166.5	-175.9	0	0	0	0	113.4	F216 K217 L249 M250 D253	V213-F216 PolarHBondContact O-N 2.79Å; V213-K217 HydrophobicContact CG1-CD 4.12Å; V213-K217 HydrophobicContact CG1-CG 4.33Å; V213-K217 WeakPolarHBondContact O-CB 3.38Å; V213-K217 WeakPolarHBondContact O-CG 3.35Å; V213-K217 PolarHBondContact O-N 2.89Å; V213-L249 HydrophobicContact CG2-CD1 4.09Å; V213-L249 HydrophobicContact CG2-CG 3.86Å; V213-L249 VanDerWaalsContact CG2-O 3.31Å; V213-L249 WeakPolarHBondContact CG2-O 3.44Å; V213-M250 HydrophobicContact CG1-CG 4.38Å; V213-D253 HydrophobicContact CG1-CB 4.39Å; V213-D253 WeakPolarHBondContact CG1-OD2 3.33Å
214	S	94.2	Very high	96.1	Very high	88 Å²	88	34.1 Å²	34.1	62%	0.615	20%	0.199	S	C	*	.	H	α-helix	trans	-61.4	-56.1	-174.8	-177.9	0	0	0	0	111.9	G212 F216 K217 Q218	G212-S214 PolarHBondContact O-N 3.45Å; S214-F216 VanDerWaalsContact C-N 3.32Å; S214-F216 PolarHBondContact O-N 3.37Å; S214-K217 PolarHBondContact O-N 3.23Å; S214-Q218 WeakPolarHBondContact O-CB 3.02Å; S214-Q218 PolarHBondContact O-N 3.41Å
215	D	95.5	Very high	96.1	Very high	42 Å²	42	36.2 Å²	36.2	23%	0.225	21%	0.212	C	C	.	.	H	α-helix	trans	-67.6	-34	-178.9	-74.4	-4	0	0	0	111.3	Y170 R182 V211 Q218 D219	Y170-D215 PolarHBondContact OH-OD2 2.99Å; Y170-D215 VanDerWaalsContact OH-OD2 3.05Å; R182-D215 IonicContact CZ-OD2 2.73Å; R182-D215 IonicContact NH1-OD2 2.68Å; R182-D215 PolarHBondContact NH1-OD2 3.25Å; V211-D215 HydrophobicContact CG1-CB 3.33Å; D215-Q218 PolarHBondContact O-N 2.85Å; D215-D219 WeakPolarHBondContact O-CB 3.21Å; D215-D219 PolarHBondContact O-N 3.26Å
216	F	96.1	Very high	96.2	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63.6	-47.8	174.7	178.4	-98.2	0	0	0	111.4	I204 A208 V211 G212 V213 S214 Q218 L220 M221 F224 I246	I204-F216 HydrophobicContact CG1-CE2 4.34Å; A208-F216 HydrophobicContact CB-CD2 3.38Å; A208-F216 HydrophobicContact CB-CE2 3.53Å; A208-F216 HydrophobicContact CB-CG 4.03Å; A208-F216 HydrophobicContact CB-CZ 4.26Å; V211-F216 HydrophobicContact CG1-CB 4.31Å; G212-F216 WeakPolarHBondContact O-CB 3.38Å; G212-F216 PolarHBondContact O-N 3.02Å; V213-F216 PolarHBondContact O-N 2.79Å; S214-F216 VanDerWaalsContact C-N 3.32Å; S214-F216 PolarHBondContact O-N 3.37Å; F216-Q218 VanDerWaalsContact C-N 3.33Å; F216-Q218 PolarHBondContact O-N 3.07Å; F216-L220 HydrophobicContact CD2-CB 3.59Å; F216-L220 HydrophobicContact CD2-CD1 4.1Å; F216-L220 HydrophobicContact CD2-CG 4.48Å; F216-L220 HydrophobicContact CE2-CB 3.76Å; F216-L220 HydrophobicContact CG-CB 4.42Å; F216-L220 CarbonylContact O-C 3.33Å; F216-L220 WeakPolarHBondContact O-CA 3.35Å; F216-L220 PolarHBondContact O-N 2.89Å; F216-M221 HydrophobicContact CD1-CE 4.17Å; F216-M221 HydrophobicContact CE1-CE 3.68Å; F216-M221 HydrophobicContact CE1-SD 4.13Å; F216-M221 PolarHBondContact O-N 3.1Å; F216-F224 HydrophobicContact CZ-CB 4.15Å; F216-F224 HydrophobicContact CZ-CG 4.36Å; F216-I246 HydrophobicContact CD1-CG2 4.38Å; F216-I246 HydrophobicContact CE1-CD1 4.36Å; F216-I246 HydrophobicContact CE1-CG1 4.4Å; F216-I246 HydrophobicContact CE1-CG2 3.61Å; F216-I246 HydrophobicContact CE2-CD1 4.2Å; F216-I246 HydrophobicContact CE2-CG1 4.45Å; F216-I246 HydrophobicContact CZ-CD1 3.61Å; F216-I246 HydrophobicContact CZ-CG1 3.97Å; F216-I246 HydrophobicContact CZ-CG2 3.99Å
217	K	94.6	Very high	96.3	Very high	66 Å²	66	35.7 Å²	35.7	29%	0.287	21%	0.21	S	C	.	.	H	α-helix	trans	-58.8	-45.5	176.8	-79.9	-173	172.4	-162.5	0	111.7	V213 S214 M221 M250 D253 D254	V213-K217 HydrophobicContact CG1-CD 4.12Å; V213-K217 HydrophobicContact CG1-CG 4.33Å; V213-K217 WeakPolarHBondContact O-CB 3.38Å; V213-K217 WeakPolarHBondContact O-CG 3.35Å; V213-K217 PolarHBondContact O-N 2.89Å; S214-K217 PolarHBondContact O-N 3.23Å; K217-M221 HydrophobicContact CG-CE 4.37Å; K217-M221 WeakPolarHBondContact O-CB 3.3Å; K217-M250 HydrophobicContact CG-CE 4.41Å; K217-D253 IonicContact NZ-OD1 3.06Å; K217-D253 PolarHBondContact NZ-OD1 3.19Å; K217-D253 IonicContact NZ-OD2 2.65Å; K217-D254 WeakPolarHBondContact CE-O 3.27Å; K217-D254 PolarHBondContact NZ-O 2.94Å
218	Q	94.5	Very high	96.3	Very high	142 Å²	142	35.7 Å²	35.7	66%	0.664	21%	0.211	S	C	*	.	H	α-helix	trans	-68.3	-46.8	-178.4	-177.7	176.2	-4	0	0	112.1	S214 D215 F216	S214-Q218 WeakPolarHBondContact O-CB 3.02Å; S214-Q218 PolarHBondContact O-N 3.41Å; D215-Q218 PolarHBondContact O-N 2.85Å; F216-Q218 VanDerWaalsContact C-N 3.33Å; F216-Q218 PolarHBondContact O-N 3.07Å
219	D	95.6	Very high	96.3	Very high	23 Å²	23	37.9 Å²	37.9	12%	0.123	23%	0.226	C	C	.	.	H	α-helix	trans	-110.7	-25.4	-163.4	-76.7	-35.1	0	0	0	115.5	R182 R186 D215	R182-D219 HydrophobicContact CB-CB 4.22Å; R182-D219 IonicContact CZ-OD2 2.61Å; R182-D219 VanDerWaalsContact CZ-OD2 3.29Å; R182-D219 IonicContact NE-OD2 2.92Å; R182-D219 PolarHBondContact NE-OD2 3.13Å; R182-D219 IonicContact NH2-OD2 3.24Å; R182-D219 PolarHBondContact NH2-OD2 3.3Å; R186-D219 VanDerWaalsContact CZ-O 3.23Å; R186-D219 PolarHBondContact NE-O 3.35Å; R186-D219 VanDerWaalsContact NH2-C 3.34Å; R186-D219 PolarHBondContact NH2-O 3.43Å; R186-D219 IonicContact NH2-OD1 3.84Å; R186-D219 PolarHBondContact NH2-OD1 3.37Å; D215-D219 WeakPolarHBondContact O-CB 3.21Å; D215-D219 PolarHBondContact O-N 3.26Å
220	L	97	Very high	96.4	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121	-18.5	-169.7	-65.4	175	0	0	0	114	F185 R186 F207 V211 F216 S222 A223 F224	F185-L220 HydrophobicContact CD1-CD2 4.19Å; R186-L220 HydrophobicContact CB-CD2 4.37Å; F207-L220 HydrophobicContact CD1-CD1 3.68Å; F207-L220 HydrophobicContact CE1-CD1 3.59Å; F207-L220 HydrophobicContact CE1-CD2 4.46Å; V211-L220 HydrophobicContact CG1-CD1 4.43Å; V211-L220 HydrophobicContact CG2-CD1 4.09Å; F216-L220 HydrophobicContact CD2-CB 3.59Å; F216-L220 HydrophobicContact CD2-CD1 4.1Å; F216-L220 HydrophobicContact CD2-CG 4.48Å; F216-L220 HydrophobicContact CE2-CB 3.76Å; F216-L220 HydrophobicContact CG-CB 4.42Å; F216-L220 CarbonylContact O-C 3.33Å; F216-L220 WeakPolarHBondContact O-CA 3.35Å; F216-L220 PolarHBondContact O-N 2.89Å; L220-S222 VanDerWaalsContact C-N 3.31Å; L220-S222 PolarHBondContact O-N 3.05Å; L220-A223 PolarHBondContact O-N 3.1Å; L220-F224 PolarHBondContact O-N 2.82Å
221	M	95.6	Very high	96.4	Very high	21 Å²	21	40 Å²	40	10%	0.103	23%	0.231	C	C	.	.	H	α-helix	trans	-55.3	-43.8	179.4	-177.1	63.7	77.4	0	0	112.5	F216 K217 A223 F224 V225 M250 T257	F216-M221 HydrophobicContact CD1-CE 4.17Å; F216-M221 HydrophobicContact CE1-CE 3.68Å; F216-M221 HydrophobicContact CE1-SD 4.13Å; F216-M221 PolarHBondContact O-N 3.1Å; K217-M221 HydrophobicContact CG-CE 4.37Å; K217-M221 WeakPolarHBondContact O-CB 3.3Å; M221-A223 PolarHBondContact O-N 3.41Å; M221-F224 WeakPolarHBondContact O-CB 3.49Å; M221-F224 PolarHBondContact O-N 3.48Å; M221-F224 HydrophobicContact SD-CD1 4.1Å; M221-V225 WeakPolarHBondContact O-CG2 3.22Å; M221-V225 PolarHBondContact O-N 2.8Å; M221-M250 HydrophobicContact CE-CE 3.82Å; M221-M250 HydrophobicContact CE-SD 3.98Å; M221-T257 HydrophobicContact CG-CG2 4.16Å; M221-T257 HydrophobicContact SD-CG2 3.87Å
222	S	96.5	Very high	96.4	Very high	72 Å²	72	43.1 Å²	43.1	50%	0.503	24%	0.244	S	C	.	.	H	α-helix	trans	-62.3	-42.3	176.8	169.1	0	0	0	0	112	L220 F224 V225 D226	L220-S222 VanDerWaalsContact C-N 3.31Å; L220-S222 PolarHBondContact O-N 3.05Å; S222-F224 VanDerWaalsContact C-N 3.33Å; S222-F224 PolarHBondContact O-N 3.2Å; S222-V225 PolarHBondContact O-N 3.16Å; S222-D226 WeakPolarHBondContact O-CB 3.39Å; S222-D226 PolarHBondContact O-N 3.37Å
223	A	97.3	Very high	96.5	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.008	25%	0.245	C	C	.	.	H	α-helix	trans	-66.4	-36.7	177.9	0	0	0	0	0	112.1	R186 C189 L220 M221 D226 L227	R186-A223 HydrophobicContact CG-CB 4.14Å; C189-A223 HydrophobicContact CB-CB 3.83Å; L220-A223 PolarHBondContact O-N 3.1Å; M221-A223 PolarHBondContact O-N 3.41Å; A223-D226 PolarHBondContact O-N 3.36Å; A223-L227 WeakPolarHBondContact O-CG 3.37Å; A223-L227 PolarHBondContact O-N 3.2Å
224	F	97.5	Very high	96.6	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.6	-45.3	172.7	169	-103.7	0	0	0	112.1	I204 F216 L220 M221 S222 D226 L227 A228 V239 I246 L258 V261	I204-F224 HydrophobicContact CD1-CB 3.72Å; I204-F224 HydrophobicContact CD1-CD2 4.43Å; I204-F224 HydrophobicContact CG2-CD2 4.32Å; F216-F224 HydrophobicContact CZ-CB 4.15Å; F216-F224 HydrophobicContact CZ-CG 4.36Å; L220-F224 PolarHBondContact O-N 2.82Å; M221-F224 WeakPolarHBondContact O-CB 3.49Å; M221-F224 PolarHBondContact O-N 3.48Å; M221-F224 HydrophobicContact SD-CD1 4.1Å; S222-F224 VanDerWaalsContact C-N 3.33Å; S222-F224 PolarHBondContact O-N 3.2Å; F224-D226 VanDerWaalsContact C-N 3.33Å; F224-D226 PolarHBondContact O-N 3.42Å; F224-L227 PolarHBondContact O-N 3.15Å; F224-A228 PolarHBondContact O-N 3.06Å; F224-V239 HydrophobicContact CD2-CG1 3.93Å; F224-V239 HydrophobicContact CE2-CG1 3.32Å; F224-V239 HydrophobicContact CZ-CG1 3.89Å; F224-I246 HydrophobicContact CD2-CD1 3.47Å; F224-I246 VanDerWaalsContact CD2-CD1 3.47Å; F224-I246 HydrophobicContact CE1-CD1 4.5Å; F224-I246 HydrophobicContact CE2-CD1 3.41Å; F224-I246 VanDerWaalsContact CE2-CD1 3.41Å; F224-I246 HydrophobicContact CG-CD1 4.04Å; F224-I246 HydrophobicContact CZ-CD1 3.97Å; F224-L258 HydrophobicContact CE1-CD1 3.48Å; F224-L258 VanDerWaalsContact CE1-CD1 3.48Å; F224-L258 HydrophobicContact CZ-CD1 3.45Å; F224-L258 VanDerWaalsContact CZ-CD1 3.45Å; F224-V261 HydrophobicContact CE1-CB 4.19Å; F224-V261 HydrophobicContact CE1-CG1 3.92Å; F224-V261 HydrophobicContact CE1-CG2 4.02Å; F224-V261 HydrophobicContact CZ-CG1 3.91Å
225	V	97.6	Very high	96.8	Very high	45 Å²	45	39.8 Å²	39.8	27%	0.273	22%	0.215	S	C	.	.	H	α-helix	trans	-64.8	-38	176.4	173.6	0	0	0	0	111.7	M221 S222 A228 S229 T257 V261	M221-V225 WeakPolarHBondContact O-CG2 3.22Å; M221-V225 PolarHBondContact O-N 2.8Å; S222-V225 PolarHBondContact O-N 3.16Å; V225-A228 PolarHBondContact O-N 2.71Å; V225-S229 WeakPolarHBondContact O-CB 3.38Å; V225-S229 PolarHBondContact O-N 3.22Å; V225-S229 VanDerWaalsContact O-N 3.13Å; V225-S229 PolarHBondContact O-OG 3.02Å; V225-T257 HydrophobicContact CG2-CG2 3.66Å; V225-V261 HydrophobicContact CG2-CG2 4Å
226	D	97.4	Very high	97	Very high	66 Å²	66	38.2 Å²	38.2	35%	0.353	21%	0.206	S	C	.	.	H	α-helix	trans	-62.6	-47.1	175.8	-67.5	-18.7	0	0	0	110.5	K190 S222 A223 F224 A228 S229 D230	K190-D226 WeakPolarHBondContact CE-OD2 3.27Å; K190-D226 IonicContact NZ-OD2 3.23Å; K190-D226 PolarHBondContact NZ-OD2 2.89Å; S222-D226 WeakPolarHBondContact O-CB 3.39Å; S222-D226 PolarHBondContact O-N 3.37Å; A223-D226 PolarHBondContact O-N 3.36Å; F224-D226 VanDerWaalsContact C-N 3.33Å; F224-D226 PolarHBondContact O-N 3.42Å; D226-A228 VanDerWaalsContact C-N 3.33Å; D226-A228 PolarHBondContact O-N 2.81Å; D226-S229 CarbonylContact O-C 3.32Å; D226-S229 WeakPolarHBondContact O-CA 3.25Å; D226-S229 PolarHBondContact O-N 3.42Å; D226-D230 PolarHBondContact O-N 3.29Å
227	L	98.2	Very high	97	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.6	-39	175	-71	170.9	0	0	0	112.4	C189 R197 A201 I204 A223 F224 S229 D230 V235 V239	C189-L227 HydrophobicContact CB-CD1 3.97Å; C189-L227 HydrophobicContact CB-CD2 4.38Å; C189-L227 HydrophobicContact CB-CG 4.16Å; C189-L227 WeakPolarHBondContact O-CD2 3.27Å; R197-L227 HydrophobicContact CB-CD2 4.02Å; A201-L227 HydrophobicContact CB-CD1 4.22Å; A201-L227 HydrophobicContact CB-CD2 4.42Å; I204-L227 HydrophobicContact CD1-CD1 4.06Å; A223-L227 WeakPolarHBondContact O-CG 3.37Å; A223-L227 PolarHBondContact O-N 3.2Å; F224-L227 PolarHBondContact O-N 3.15Å; L227-S229 PolarHBondContact O-N 3.25Å; L227-D230 WeakPolarHBondContact O-CB 3.27Å; L227-D230 PolarHBondContact O-N 3.21Å; L227-V235 HydrophobicContact CB-CG1 4.42Å; L227-V235 HydrophobicContact CD2-CG1 3.67Å; L227-V239 HydrophobicContact CB-CG2 3.86Å
228	A	97.9	Very high	97.2	Very high	3 Å²	3	38 Å²	38	3%	0.025	21%	0.208	C	C	.	.	H	α-helix	trans	-65.8	-19.2	175.8	0	0	0	0	0	112.9	F224 V225 D226 R236 V239 V261	F224-A228 PolarHBondContact O-N 3.06Å; V225-A228 PolarHBondContact O-N 2.71Å; D226-A228 VanDerWaalsContact C-N 3.33Å; D226-A228 PolarHBondContact O-N 2.81Å; A228-R236 VanDerWaalsContact O-CD 3.27Å; A228-R236 WeakPolarHBondContact O-CD 3.06Å; A228-V239 HydrophobicContact CB-CG1 3.98Å; A228-V261 HydrophobicContact CB-CG1 3.61Å; A228-V261 HydrophobicContact CB-CG2 4.35Å
229	S	97.3	Very high	97.3	Very high	45 Å²	45	31.2 Å²	31.2	32%	0.315	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.6	11.9	-178	-52.6	0	0	0	0	112.7	V225 D226 L227 K264	V225-S229 WeakPolarHBondContact O-CB 3.38Å; V225-S229 PolarHBondContact O-N 3.22Å; V225-S229 VanDerWaalsContact O-N 3.13Å; V225-S229 PolarHBondContact O-OG 3.02Å; D226-S229 CarbonylContact O-C 3.32Å; D226-S229 WeakPolarHBondContact O-CA 3.25Å; D226-S229 PolarHBondContact O-N 3.42Å; L227-S229 PolarHBondContact O-N 3.25Å; S229-K264 PolarHBondContact OG-NZ 3.12Å
230	D	98.2	Very high	97.4	Very high	16 Å²	16	30.1 Å²	30.1	9%	0.086	17%	0.171	C	C	.	.			trans	-56.1	150	-176.6	-161.7	-75.6	0	0	0	112	R197 D226 L227 H232 V235 R236	R197-D230 IonicContact CZ-OD1 3.85Å; R197-D230 IonicContact CZ-OD2 3.42Å; R197-D230 IonicContact NE-OD1 2.96Å; R197-D230 IonicContact NE-OD2 3.48Å; R197-D230 PolarHBondContact NE-OD2 2.94Å; R197-D230 IonicContact NH2-OD1 2.95Å; R197-D230 PolarHBondContact NH2-OD1 3.48Å; R197-D230 IonicContact NH2-OD2 3.28Å; R197-D230 PolarHBondContact NH2-OD2 2.88Å; D226-D230 PolarHBondContact O-N 3.29Å; L227-D230 WeakPolarHBondContact O-CB 3.27Å; L227-D230 PolarHBondContact O-N 3.21Å; D230-H232 PolarHBondContact O-N 3.43Å; D230-H232 WeakPolarHBondContact OD1-CB 3.45Å; D230-H232 IonicContact OD1-CG 3.76Å; D230-H232 PolarHBondContact OD1-N 3.31Å; D230-H232 IonicContact OD1-ND1 3.03Å; D230-H232 PolarHBondContact OD1-ND1 3.46Å; D230-V235 HydrophobicContact CB-CB 3.83Å; D230-V235 HydrophobicContact CB-CG1 3.8Å; D230-R236 HydrophobicContact CB-CG 3.94Å; D230-R236 WeakPolarHBondContact O-CD 3.04Å; D230-R236 WeakPolarHBondContact O-CG 3.34Å; D230-R236 PolarHBondContact O-NH1 2.72Å
231	D	97	Very high	97.3	Very high	141 Å²	141	35.6 Å²	35.6	75%	0.754	20%	0.196	S	C	*	.	S	Bend	trans	-61.5	-30.4	175.8	-68.6	-36.5	0	0	0	112.6	R236	D231-R236 PolarHBondContact O-NH1 3.26Å
232	H	97.4	Very high	97.3	Very high	78 Å²	78	34.8 Å²	34.8	36%	0.361	19%	0.192	S	C	.	.			trans	-93.3	122.7	-177.1	-59.5	73.7	0	0	0	111.2	R197 D230 S234 V235 R236	R197-H232 PolarHBondContact NH2-ND1 2.9Å; R197-H232 VanDerWaalsContact NH2-ND1 3.13Å; D230-H232 PolarHBondContact O-N 3.43Å; D230-H232 WeakPolarHBondContact OD1-CB 3.45Å; D230-H232 IonicContact OD1-CG 3.76Å; D230-H232 PolarHBondContact OD1-N 3.31Å; D230-H232 IonicContact OD1-ND1 3.03Å; D230-H232 PolarHBondContact OD1-ND1 3.46Å; H232-S234 PolarHBondContact O-N 3.02Å; H232-V235 HydrophobicContact CB-CG2 4.07Å; H232-V235 PolarHBondContact O-N 2.88Å; H232-R236 VanDerWaalsContact C-NH1 3.33Å; H232-R236 PolarHBondContact O-N 3.06Å
233	D	97.1	Very high	97.3	Very high	47 Å²	47	31.5 Å²	31.5	25%	0.251	17%	0.169	S	C	.	.	H	α-helix	trans	-60.3	-34.3	176	68.4	-21.9	0	0	0	112.3	V235 R236 L237 S270 V273	D233-V235 PolarHBondContact O-N 2.89Å; D233-V235 VanDerWaalsContact O-N 3.16Å; D233-R236 PolarHBondContact O-N 3.36Å; D233-L237 WeakPolarHBondContact O-CB 3.18Å; D233-L237 WeakPolarHBondContact O-CD2 3.48Å; D233-L237 WeakPolarHBondContact O-CG 3.19Å; D233-L237 PolarHBondContact O-N 3.28Å; D233-S270 PolarHBondContact OD2-OG 3.25Å; D233-V273 HydrophobicContact CB-CG2 4.18Å
234	S	97.3	Very high	97.1	Very high	27 Å²	27	31.8 Å²	31.8	19%	0.189	17%	0.171	C	C	.	.	H	α-helix	trans	-59.4	-21.2	175	67.6	0	0	0	0	114.8	H232 L238	H232-S234 PolarHBondContact O-N 3.02Å; S234-L238 WeakPolarHBondContact O-CD1 3.36Å; S234-L238 WeakPolarHBondContact O-CG 3.06Å
235	V	98.2	Very high	96.9	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-88	-53.7	171	178.9	0	0	0	0	109.3	R197 R198 A201 L227 D230 H232 D233 L237 L238	R197-V235 HydrophobicContact CB-CG1 4.32Å; R197-V235 HydrophobicContact CB-CG2 4.14Å; R198-V235 HydrophobicContact CG-CB 4.44Å; R198-V235 HydrophobicContact CG-CG2 3.59Å; A201-V235 HydrophobicContact CB-CG1 4.21Å; L227-V235 HydrophobicContact CB-CG1 4.42Å; L227-V235 HydrophobicContact CD2-CG1 3.67Å; D230-V235 HydrophobicContact CB-CB 3.83Å; D230-V235 HydrophobicContact CB-CG1 3.8Å; H232-V235 HydrophobicContact CB-CG2 4.07Å; H232-V235 PolarHBondContact O-N 2.88Å; D233-V235 PolarHBondContact O-N 2.89Å; D233-V235 VanDerWaalsContact O-N 3.16Å; V235-L237 VanDerWaalsContact C-N 3.27Å; V235-L237 PolarHBondContact O-N 3.18Å; V235-L238 WeakPolarHBondContact O-CB 3.45Å; V235-L238 PolarHBondContact O-N 2.94Å
236	R	98.3	Very high	96.9	Very high	9 Å²	9	31.8 Å²	31.8	3%	0.034	17%	0.173	C	C	.	.	H	α-helix	trans	-55.5	-39.6	-176.6	-60.5	-162	-57.5	-72.4	-2.9	113	A228 D230 D231 H232 D233 L238 V239 L265 D268 V273	A228-R236 VanDerWaalsContact O-CD 3.27Å; A228-R236 WeakPolarHBondContact O-CD 3.06Å; D230-R236 HydrophobicContact CB-CG 3.94Å; D230-R236 WeakPolarHBondContact O-CD 3.04Å; D230-R236 WeakPolarHBondContact O-CG 3.34Å; D230-R236 PolarHBondContact O-NH1 2.72Å; D231-R236 PolarHBondContact O-NH1 3.26Å; H232-R236 VanDerWaalsContact C-NH1 3.33Å; H232-R236 PolarHBondContact O-N 3.06Å; D233-R236 PolarHBondContact O-N 3.36Å; R236-L238 VanDerWaalsContact C-N 3.25Å; R236-L238 PolarHBondContact O-N 3.21Å; R236-V239 WeakPolarHBondContact O-CB 3.48Å; R236-V239 PolarHBondContact O-N 3.32Å; R236-V239 VanDerWaalsContact O-N 3.16Å; R236-L265 HydrophobicContact CB-CD2 4.26Å; R236-D268 IonicContact CZ-OD1 3.57Å; R236-D268 IonicContact CZ-OD2 3.39Å; R236-D268 IonicContact NE-OD1 2.75Å; R236-D268 IonicContact NE-OD2 3.58Å; R236-D268 PolarHBondContact NE-OD2 2.88Å; R236-D268 IonicContact NH2-OD1 2.88Å; R236-D268 PolarHBondContact NH2-OD1 3.33Å; R236-D268 IonicContact NH2-OD2 2.73Å; R236-D268 PolarHBondContact NH2-OD2 3.38Å; R236-V273 HydrophobicContact CB-CG2 4Å
237	L	97.5	Very high	96.7	Very high	22 Å²	22	28.7 Å²	28.7	12%	0.115	16%	0.156	C	C	.	.	H	α-helix	trans	-64.9	-28.2	-178.5	76.3	88.5	0	0	0	113.1	D233 V235 V239 R272 V273 M276	D233-L237 WeakPolarHBondContact O-CB 3.18Å; D233-L237 WeakPolarHBondContact O-CD2 3.48Å; D233-L237 WeakPolarHBondContact O-CG 3.19Å; D233-L237 PolarHBondContact O-N 3.28Å; V235-L237 VanDerWaalsContact C-N 3.27Å; V235-L237 PolarHBondContact O-N 3.18Å; L237-V239 VanDerWaalsContact C-N 3.31Å; L237-R272 HydrophobicContact CD2-CB 4.44Å; L237-V273 HydrophobicContact CB-CG2 4.05Å; L237-M276 HydrophobicContact CB-CG 3.89Å; L237-M276 HydrophobicContact CD1-CG 4Å; L237-M276 HydrophobicContact CD1-SD 4.5Å
238	L	97.4	Very high	96.4	Very high	39 Å²	39	34.1 Å²	34.1	20%	0.204	18%	0.18	C	C	.	.	H	α-helix	trans	-77.6	-21.3	179.5	-61.5	169.7	0	0	0	111.9	R198 A201 T202 S234 V235 R236 V240	R198-L238 HydrophobicContact CB-CD1 3.8Å; R198-L238 HydrophobicContact CG-CD1 4.04Å; A201-L238 HydrophobicContact CB-CB 3.99Å; T202-L238 HydrophobicContact CG2-CB 4.16Å; T202-L238 HydrophobicContact CG2-CD1 3.87Å; T202-L238 HydrophobicContact CG2-CD2 3.95Å; T202-L238 HydrophobicContact CG2-CG 4.2Å; S234-L238 WeakPolarHBondContact O-CD1 3.36Å; S234-L238 WeakPolarHBondContact O-CG 3.06Å; V235-L238 WeakPolarHBondContact O-CB 3.45Å; V235-L238 PolarHBondContact O-N 2.94Å; R236-L238 VanDerWaalsContact C-N 3.25Å; R236-L238 PolarHBondContact O-N 3.21Å; L238-V240 VanDerWaalsContact C-N 3.25Å; L238-V240 PolarHBondContact O-N 2.77Å
239	V	97.5	Very high	96.2	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-67.6	-27.4	179.1	-176.9	0	0	0	0	111.8	A201 F224 L227 A228 R236 L237 E241 S242 C243 L265	A201-V239 HydrophobicContact CB-CG2 4.13Å; F224-V239 HydrophobicContact CD2-CG1 3.93Å; F224-V239 HydrophobicContact CE2-CG1 3.32Å; F224-V239 HydrophobicContact CZ-CG1 3.89Å; L227-V239 HydrophobicContact CB-CG2 3.86Å; A228-V239 HydrophobicContact CB-CG1 3.98Å; R236-V239 WeakPolarHBondContact O-CB 3.48Å; R236-V239 PolarHBondContact O-N 3.32Å; R236-V239 VanDerWaalsContact O-N 3.16Å; L237-V239 VanDerWaalsContact C-N 3.31Å; V239-E241 VanDerWaalsContact C-N 3.28Å; V239-E241 PolarHBondContact O-N 2.87Å; V239-S242 CarbonylContact O-C 3.25Å; V239-S242 WeakPolarHBondContact O-CA 3.45Å; V239-S242 WeakPolarHBondContact O-CB 3.3Å; V239-S242 PolarHBondContact O-N 3.28Å; V239-C243 PolarHBondContact O-N 3.47Å; V239-C243 PolarHBondContact O-SG 2.96Å; V239-L265 HydrophobicContact CG1-CD1 4.4Å
240	V	97	Very high	95.9	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.006	18%	0.175	C	C	.	.	H	α-helix	trans	-55.5	-41.6	-178.5	-179.3	0	0	0	0	112.1	L238 C243 L265 M276 V277 K280 I284	L238-V240 VanDerWaalsContact C-N 3.25Å; L238-V240 PolarHBondContact O-N 2.77Å; V240-C243 WeakPolarHBondContact O-CB 3.3Å; V240-C243 PolarHBondContact O-N 2.92Å; V240-L265 HydrophobicContact CG2-CD1 4.12Å; V240-M276 HydrophobicContact CB-CB 4.31Å; V240-M276 HydrophobicContact CG2-CB 3.97Å; V240-V277 HydrophobicContact CG1-CG2 4.26Å; V240-V277 HydrophobicContact CG2-CG2 3.9Å; V240-K280 HydrophobicContact CG1-CB 4.06Å; V240-K280 HydrophobicContact CG1-CG 4.27Å; V240-I284 HydrophobicContact CG1-CD1 3.97Å
241	E	94.4	Very high	95.3	Very high	115 Å²	115	38.8 Å²	38.8	54%	0.537	20%	0.2	S	C	.	.	H	α-helix	trans	-71.2	-38.1	177.7	-175	162.5	-161.3	0	0	111.8	V239 C243 V244 S245	V239-E241 VanDerWaalsContact C-N 3.28Å; V239-E241 PolarHBondContact O-N 2.87Å; E241-C243 VanDerWaalsContact C-N 3.28Å; E241-C243 PolarHBondContact O-N 3.4Å; E241-V244 WeakPolarHBondContact O-CB 3.27Å; E241-V244 PolarHBondContact O-N 3.03Å; E241-V244 VanDerWaalsContact O-N 3.15Å; E241-S245 PolarHBondContact O-N 2.66Å
242	S	95.8	Very high	94.5	Very high	4 Å²	4	36.6 Å²	36.6	3%	0.028	21%	0.211	C	C	.	.	H	α-helix	trans	-62	-34.5	172.6	-73.4	0	0	0	0	112.3	A201 I204 G205 V239 V244 S245 I246	A201-S242 PolarHBondContact O-OG 3.49Å; I204-S242 VanDerWaalsContact CG2-OG 3.32Å; I204-S242 WeakPolarHBondContact CG2-OG 3.48Å; G205-S242 PolarHBondContact N-OG 3.35Å; V239-S242 CarbonylContact O-C 3.25Å; V239-S242 WeakPolarHBondContact O-CA 3.45Å; V239-S242 WeakPolarHBondContact O-CB 3.3Å; V239-S242 PolarHBondContact O-N 3.28Å; S242-V244 VanDerWaalsContact C-N 3.25Å; S242-V244 PolarHBondContact O-N 3.16Å; S242-S245 PolarHBondContact O-N 3.24Å; S242-I246 WeakPolarHBondContact O-CB 3.35Å; S242-I246 WeakPolarHBondContact O-CD1 3.34Å; S242-I246 VanDerWaalsContact O-CG1 3.26Å; S242-I246 WeakPolarHBondContact O-CG1 3.4Å; S242-I246 PolarHBondContact O-N 2.97Å
243	C	95.8	Very high	94.1	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.014	21%	0.213	C	C	.	.	H	α-helix	trans	-56.1	-40.1	174	-64	0	0	0	0	112	V239 V240 E241 A247 L258 V262	V239-C243 PolarHBondContact O-N 3.47Å; V239-C243 PolarHBondContact O-SG 2.96Å; V240-C243 WeakPolarHBondContact O-CB 3.3Å; V240-C243 PolarHBondContact O-N 2.92Å; E241-C243 VanDerWaalsContact C-N 3.28Å; E241-C243 PolarHBondContact O-N 3.4Å; C243-A247 WeakPolarHBondContact O-CB 3.37Å; C243-A247 PolarHBondContact O-N 3.05Å; C243-L258 HydrophobicContact CB-CD1 4.2Å; C243-V262 HydrophobicContact CB-CG2 4.05Å
244	V	94.4	Very high	93.6	Very high	8 Å²	8	38.7 Å²	38.7	5%	0.048	23%	0.225	C	C	.	.	H	α-helix	trans	-65.5	-46.6	-179.6	177.7	0	0	0	0	110.8	E241 S242 A247 K248 M283 I284 A287	E241-V244 WeakPolarHBondContact O-CB 3.27Å; E241-V244 PolarHBondContact O-N 3.03Å; E241-V244 VanDerWaalsContact O-N 3.15Å; S242-V244 VanDerWaalsContact C-N 3.25Å; S242-V244 PolarHBondContact O-N 3.16Å; V244-A247 PolarHBondContact O-N 3.48Å; V244-K248 HydrophobicContact CG1-CD 4.43Å; V244-K248 WeakPolarHBondContact O-CG 3.47Å; V244-K248 PolarHBondContact O-N 3.33Å; V244-K248 VanDerWaalsContact O-N 3.1Å; V244-M283 HydrophobicContact CG1-CB 4.08Å; V244-M283 HydrophobicContact CG2-CB 3.88Å; V244-I284 HydrophobicContact CG2-CG1 4.06Å; V244-A287 HydrophobicContact CG1-CB 4.32Å
245	S	94.1	Very high	93.2	Very high	44 Å²	44	38.1 Å²	38.1	31%	0.308	22%	0.221	S	C	.	.	H	α-helix	trans	-65.4	-42.6	179.9	-61.5	0	0	0	0	111.8	E241 S242 K248 L249	E241-S245 PolarHBondContact O-N 2.66Å; S242-S245 PolarHBondContact O-N 3.24Å; S245-K248 PolarHBondContact O-N 2.92Å; S245-L249 PolarHBondContact O-N 3.23Å; S245-L249 VanDerWaalsContact O-N 3.1Å
246	I	95.8	Very high	92.9	Very high	0 Å²	0	43 Å²	43	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-68.8	-40.2	178.2	-64.7	161.3	0	0	0	110.8	A208 F216 F224 S242 K248 L249 M250 L258	A208-I246 HydrophobicContact CB-CG1 3.84Å; F216-I246 HydrophobicContact CD1-CG2 4.38Å; F216-I246 HydrophobicContact CE1-CD1 4.36Å; F216-I246 HydrophobicContact CE1-CG1 4.4Å; F216-I246 HydrophobicContact CE1-CG2 3.61Å; F216-I246 HydrophobicContact CE2-CD1 4.2Å; F216-I246 HydrophobicContact CE2-CG1 4.45Å; F216-I246 HydrophobicContact CZ-CD1 3.61Å; F216-I246 HydrophobicContact CZ-CG1 3.97Å; F216-I246 HydrophobicContact CZ-CG2 3.99Å; F224-I246 HydrophobicContact CD2-CD1 3.47Å; F224-I246 VanDerWaalsContact CD2-CD1 3.47Å; F224-I246 HydrophobicContact CE1-CD1 4.5Å; F224-I246 HydrophobicContact CE2-CD1 3.41Å; F224-I246 VanDerWaalsContact CE2-CD1 3.41Å; F224-I246 HydrophobicContact CG-CD1 4.04Å; F224-I246 HydrophobicContact CZ-CD1 3.97Å; S242-I246 WeakPolarHBondContact O-CB 3.35Å; S242-I246 WeakPolarHBondContact O-CD1 3.34Å; S242-I246 VanDerWaalsContact O-CG1 3.26Å; S242-I246 WeakPolarHBondContact O-CG1 3.4Å; S242-I246 PolarHBondContact O-N 2.97Å; I246-K248 VanDerWaalsContact C-N 3.35Å; I246-K248 PolarHBondContact O-N 3.39Å; I246-L249 WeakPolarHBondContact O-CB 3.44Å; I246-L249 PolarHBondContact O-N 2.94Å; I246-M250 HydrophobicContact CG2-CG 4.24Å; I246-M250 HydrophobicContact CG2-SD 3.49Å; I246-M250 WeakPolarHBondContact CG2-SD 3.12Å; I246-M250 WeakPolarHBondContact O-CB 3.48Å; I246-M250 VanDerWaalsContact O-CG 3.27Å; I246-M250 WeakPolarHBondContact O-CG 3.2Å; I246-M250 PolarHBondContact O-N 3.39Å; I246-L258 HydrophobicContact CB-CD2 4.38Å; I246-L258 HydrophobicContact CG2-CD1 4.27Å; I246-L258 HydrophobicContact CG2-CD2 3.99Å
247	A	93.9	Very high	92.7	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.008	27%	0.265	C	S	.	.	H	α-helix	trans	-60.8	-44.1	176.7	0	0	0	0	0	111.6	C243 V244 L249 M250 L251 L258 A287 F288	C243-A247 WeakPolarHBondContact O-CB 3.37Å; C243-A247 PolarHBondContact O-N 3.05Å; V244-A247 PolarHBondContact O-N 3.48Å; A247-L249 VanDerWaalsContact C-N 3.33Å; A247-L249 PolarHBondContact O-N 3.39Å; A247-M250 CarbonylContact O-C 3.55Å; A247-M250 PolarHBondContact O-N 3.4Å; A247-L251 PolarHBondContact O-N 2.88Å; A247-L258 HydrophobicContact CB-CD2 3.57Å; A247-A287 HydrophobicContact CB-CB 3.62Å; A247-F288 HydrophobicContact CB-CD2 4.43Å; A247-F288 HydrophobicContact CB-CE1 4.23Å; A247-F288 HydrophobicContact CB-CE2 3.98Å; A247-F288 HydrophobicContact CB-CZ 3.89Å
248	K	92.8	Very high	92.6	Very high	114 Å²	114	44.9 Å²	44.9	50%	0.496	26%	0.26	S	S	.	.	H	α-helix	trans	-62.2	-38.7	174.9	-72.9	175.7	-179.2	177.4	0	112.7	V244 S245 I246 M250 L251 A287	V244-K248 HydrophobicContact CG1-CD 4.43Å; V244-K248 WeakPolarHBondContact O-CG 3.47Å; V244-K248 PolarHBondContact O-N 3.33Å; V244-K248 VanDerWaalsContact O-N 3.1Å; S245-K248 PolarHBondContact O-N 2.92Å; I246-K248 VanDerWaalsContact C-N 3.35Å; I246-K248 PolarHBondContact O-N 3.39Å; K248-M250 VanDerWaalsContact C-N 3.32Å; K248-L251 WeakPolarHBondContact O-CD1 3.47Å; K248-L251 WeakPolarHBondContact O-CG 3.24Å; K248-A287 HydrophobicContact CG-CB 4.07Å
249	L	92.6	Very high	92.5	Very high	42 Å²	42	44.8 Å²	44.8	22%	0.22	26%	0.258	C	S	.	.	H	α-helix	trans	-65	-37	175.9	176.5	66.1	0	0	0	112	A208 V213 S245 I246 A247 L251	A208-L249 VanDerWaalsContact C-CD2 3.5Å; A208-L249 HydrophobicContact CB-CD2 4.02Å; A208-L249 WeakPolarHBondContact O-CD2 3.2Å; V213-L249 HydrophobicContact CG2-CD1 4.09Å; V213-L249 HydrophobicContact CG2-CG 3.86Å; V213-L249 VanDerWaalsContact CG2-O 3.31Å; V213-L249 WeakPolarHBondContact CG2-O 3.44Å; S245-L249 PolarHBondContact O-N 3.23Å; S245-L249 VanDerWaalsContact O-N 3.1Å; I246-L249 WeakPolarHBondContact O-CB 3.44Å; I246-L249 PolarHBondContact O-N 2.94Å; A247-L249 VanDerWaalsContact C-N 3.33Å; A247-L249 PolarHBondContact O-N 3.39Å; L249-L251 VanDerWaalsContact C-N 3.35Å
250	M	91.9	Very high	92.4	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.01	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	14.9	-175.3	-60.7	175	70.9	0	0	113.6	V213 K217 M221 I246 A247 K248 G252 D253 D254 C255 L258	V213-M250 HydrophobicContact CG1-CG 4.38Å; K217-M250 HydrophobicContact CG-CE 4.41Å; M221-M250 HydrophobicContact CE-CE 3.82Å; M221-M250 HydrophobicContact CE-SD 3.98Å; I246-M250 HydrophobicContact CG2-CG 4.24Å; I246-M250 HydrophobicContact CG2-SD 3.49Å; I246-M250 WeakPolarHBondContact CG2-SD 3.12Å; I246-M250 WeakPolarHBondContact O-CB 3.48Å; I246-M250 VanDerWaalsContact O-CG 3.27Å; I246-M250 WeakPolarHBondContact O-CG 3.2Å; I246-M250 PolarHBondContact O-N 3.39Å; A247-M250 CarbonylContact O-C 3.55Å; A247-M250 PolarHBondContact O-N 3.4Å; K248-M250 VanDerWaalsContact C-N 3.32Å; M250-G252 PolarHBondContact O-N 3.3Å; M250-G252 VanDerWaalsContact O-N 3.11Å; M250-D253 PolarHBondContact O-N 3.48Å; M250-D254 WeakPolarHBondContact CE-O 3.28Å; M250-C255 WeakPolarHBondContact CB-SG 3.37Å; M250-C255 PolarHBondContact O-SG 3.29Å; M250-C255 VanDerWaalsContact O-SG 3.35Å; M250-L258 HydrophobicContact SD-CD2 4.38Å
251	L	84.2	Confident	92.4	Very high	119 Å²	119	48.7 Å²	48.7	62%	0.623	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	118.2	177.3	-75.9	171.4	0	0	0	111	A247 K248 L249	A247-L251 PolarHBondContact O-N 2.88Å; K248-L251 WeakPolarHBondContact O-CD1 3.47Å; K248-L251 WeakPolarHBondContact O-CG 3.24Å; L249-L251 VanDerWaalsContact C-N 3.35Å
252	G	81.4	Confident	92.5	Very high	94 Å²	94	43.3 Å²	43.3	97%	0.969	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.8	-2	-178.2	0	0	0	0	0	115.1	M250	M250-G252 PolarHBondContact O-N 3.3Å; M250-G252 VanDerWaalsContact O-N 3.11Å
253	D	88.4	Confident	92.6	Very high	78 Å²	78	45.3 Å²	45.3	42%	0.417	27%	0.27	S	S	.	.	S	Bend	trans	-103.5	171.8	172.4	-149.9	-38.3	0	0	0	110.7	V213 K217 M250 C255	V213-D253 HydrophobicContact CG1-CB 4.39Å; V213-D253 WeakPolarHBondContact CG1-OD2 3.33Å; K217-D253 IonicContact NZ-OD1 3.06Å; K217-D253 PolarHBondContact NZ-OD1 3.19Å; K217-D253 IonicContact NZ-OD2 2.65Å; M250-D253 PolarHBondContact O-N 3.48Å; D253-C255 PolarHBondContact O-N 2.94Å
254	D	87	Confident	92.7	Very high	92 Å²	92	50.4 Å²	50.4	49%	0.492	29%	0.292	S	S	.	.			trans	-66.2	116.4	172.1	175	14.2	0	0	0	110.5	K217 M250 D256	K217-D254 WeakPolarHBondContact CE-O 3.27Å; K217-D254 PolarHBondContact NZ-O 2.94Å; M250-D254 WeakPolarHBondContact CE-O 3.28Å; D254-D256 WeakPolarHBondContact OD1-CB 3.44Å; D254-D256 VanDerWaalsContact OD1-CG 3.31Å; D254-D256 PolarHBondContact OD1-N 2.79Å
255	C	88.9	Confident	92.9	Very high	15 Å²	15	50.1 Å²	50.1	10%	0.101	29%	0.29	C	S	.	.			trans	-112.7	14.5	-178.4	-70.7	0	0	0	0	112.9	M250 D253 T257 L258 K259	M250-C255 WeakPolarHBondContact CB-SG 3.37Å; M250-C255 PolarHBondContact O-SG 3.29Å; M250-C255 VanDerWaalsContact O-SG 3.35Å; D253-C255 PolarHBondContact O-N 2.94Å; C255-T257 VanDerWaalsContact C-N 3.33Å; C255-T257 PolarHBondContact O-N 3.11Å; C255-L258 WeakPolarHBondContact O-CB 3.27Å; C255-L258 PolarHBondContact O-N 3.36Å; C255-K259 WeakPolarHBondContact O-CG 3.34Å; C255-K259 PolarHBondContact O-N 3.04Å
256	D	92.5	Very high	93	Very high	103 Å²	103	48.4 Å²	48.4	55%	0.551	28%	0.278	S	S	*	.	H	α-helix	trans	-61.4	-38.9	-171.9	-76.4	-11.7	0	0	0	113.1	D254 L258 K259 S260	D254-D256 WeakPolarHBondContact OD1-CB 3.44Å; D254-D256 VanDerWaalsContact OD1-CG 3.31Å; D254-D256 PolarHBondContact OD1-N 2.79Å; D256-L258 VanDerWaalsContact C-N 3.33Å; D256-L258 PolarHBondContact O-N 3.44Å; D256-K259 PolarHBondContact O-N 3.46Å; D256-S260 WeakPolarHBondContact O-CB 3.31Å; D256-S260 PolarHBondContact O-N 3.47Å
257	T	94	Very high	93.1	Very high	69 Å²	69	55.8 Å²	55.8	42%	0.423	31%	0.313	S	S	.	.	H	α-helix	trans	-62.2	-42.3	173.7	-57.1	0	0	0	0	111.4	M221 V225 C255 S260 V261	M221-T257 HydrophobicContact CG-CG2 4.16Å; M221-T257 HydrophobicContact SD-CG2 3.87Å; V225-T257 HydrophobicContact CG2-CG2 3.66Å; C255-T257 VanDerWaalsContact C-N 3.33Å; C255-T257 PolarHBondContact O-N 3.11Å; T257-S260 WeakPolarHBondContact O-CB 3.45Å; T257-S260 PolarHBondContact O-N 3.46Å; T257-V261 WeakPolarHBondContact O-CG2 3.49Å; T257-V261 PolarHBondContact O-N 2.93Å
258	L	94.3	Very high	93.3	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-69.4	-40.3	179.9	-176.1	64.3	0	0	0	111.8	F224 C243 I246 A247 M250 C255 D256 S260 V261 V262 F288	F224-L258 HydrophobicContact CE1-CD1 3.48Å; F224-L258 VanDerWaalsContact CE1-CD1 3.48Å; F224-L258 HydrophobicContact CZ-CD1 3.45Å; F224-L258 VanDerWaalsContact CZ-CD1 3.45Å; C243-L258 HydrophobicContact CB-CD1 4.2Å; I246-L258 HydrophobicContact CB-CD2 4.38Å; I246-L258 HydrophobicContact CG2-CD1 4.27Å; I246-L258 HydrophobicContact CG2-CD2 3.99Å; A247-L258 HydrophobicContact CB-CD2 3.57Å; M250-L258 HydrophobicContact SD-CD2 4.38Å; C255-L258 WeakPolarHBondContact O-CB 3.27Å; C255-L258 PolarHBondContact O-N 3.36Å; D256-L258 VanDerWaalsContact C-N 3.33Å; D256-L258 PolarHBondContact O-N 3.44Å; L258-S260 VanDerWaalsContact C-N 3.34Å; L258-S260 PolarHBondContact O-N 2.94Å; L258-V261 PolarHBondContact O-N 2.82Å; L258-V262 WeakPolarHBondContact O-CG2 3.31Å; L258-V262 PolarHBondContact O-N 2.85Å; L258-F288 HydrophobicContact CD2-CE1 4.01Å; L258-F288 HydrophobicContact CD2-CZ 3.88Å; L258-F288 HydrophobicContact CG-CE1 4.1Å; L258-F288 HydrophobicContact CG-CZ 3.83Å
259	K	95	Very high	93.6	Very high	38 Å²	38	59.2 Å²	59.2	17%	0.165	33%	0.328	C	S	.	.	H	α-helix	trans	-56.5	-48.8	172.3	-72.2	174.8	176.9	178.3	0	110.5	C255 D256 V261 V262 L263 F288 D289 F292	C255-K259 WeakPolarHBondContact O-CG 3.34Å; C255-K259 PolarHBondContact O-N 3.04Å; D256-K259 PolarHBondContact O-N 3.46Å; K259-V261 VanDerWaalsContact C-N 3.34Å; K259-V261 PolarHBondContact O-N 3.38Å; K259-V262 PolarHBondContact O-N 2.89Å; K259-L263 WeakPolarHBondContact O-CG 3.46Å; K259-L263 PolarHBondContact O-N 2.99Å; K259-F288 HydrophobicContact CG-CD1 3.92Å; K259-F288 HydrophobicContact CG-CE1 3.71Å; K259-D289 WeakPolarHBondContact CE-OD2 3.45Å; K259-D289 IonicContact NZ-OD2 3.22Å; K259-D289 PolarHBondContact NZ-OD2 2.94Å; K259-F292 HydrophobicContact CB-CD2 4.28Å; K259-F292 HydrophobicContact CB-CE2 3.65Å; K259-F292 HydrophobicContact CB-CZ 3.93Å; K259-F292 HydrophobicContact CD-CD2 3.77Å; K259-F292 HydrophobicContact CD-CE2 4.05Å; K259-F292 HydrophobicContact CD-CG 4.19Å; K259-F292 HydrophobicContact CG-CD1 4.45Å; K259-F292 HydrophobicContact CG-CD2 3.86Å; K259-F292 HydrophobicContact CG-CE1 4.27Å; K259-F292 HydrophobicContact CG-CE2 3.66Å; K259-F292 HydrophobicContact CG-CG 4.25Å; K259-F292 HydrophobicContact CG-CZ 3.89Å
260	S	96.2	Very high	93.8	Very high	75 Å²	75	58.1 Å²	58.1	52%	0.524	32%	0.324	S	S	.	.	H	α-helix	trans	-58.8	-42.1	176.6	-176.8	0	0	0	0	112.9	D256 T257 L258 L263 K264	D256-S260 WeakPolarHBondContact O-CB 3.31Å; D256-S260 PolarHBondContact O-N 3.47Å; T257-S260 WeakPolarHBondContact O-CB 3.45Å; T257-S260 PolarHBondContact O-N 3.46Å; L258-S260 VanDerWaalsContact C-N 3.34Å; L258-S260 PolarHBondContact O-N 2.94Å; S260-L263 PolarHBondContact O-N 3.08Å; S260-K264 WeakPolarHBondContact O-CB 3.47Å; S260-K264 PolarHBondContact O-N 3.4Å
261	V	97.3	Very high	94.1	Very high	7 Å²	7	62.3 Å²	62.3	4%	0.042	34%	0.34	C	S	.	.	H	α-helix	trans	-60.4	-46.7	175	166.9	0	0	0	0	111.4	F224 V225 A228 T257 L258 K259 L263 K264 L265	F224-V261 HydrophobicContact CE1-CB 4.19Å; F224-V261 HydrophobicContact CE1-CG1 3.92Å; F224-V261 HydrophobicContact CE1-CG2 4.02Å; F224-V261 HydrophobicContact CZ-CG1 3.91Å; V225-V261 HydrophobicContact CG2-CG2 4Å; A228-V261 HydrophobicContact CB-CG1 3.61Å; A228-V261 HydrophobicContact CB-CG2 4.35Å; T257-V261 WeakPolarHBondContact O-CG2 3.49Å; T257-V261 PolarHBondContact O-N 2.93Å; L258-V261 PolarHBondContact O-N 2.82Å; K259-V261 VanDerWaalsContact C-N 3.34Å; K259-V261 PolarHBondContact O-N 3.38Å; V261-L263 PolarHBondContact O-N 3.08Å; V261-K264 PolarHBondContact O-N 3.16Å; V261-L265 HydrophobicContact CG1-CD1 3.78Å; V261-L265 HydrophobicContact CG1-CG 4.34Å; V261-L265 VanDerWaalsContact O-CG 3.3Å; V261-L265 WeakPolarHBondContact O-CG 3.44Å; V261-L265 PolarHBondContact O-N 3.38Å
262	V	97.1	Very high	94.8	Very high	3 Å²	3	62.3 Å²	62.3	2%	0.018	33%	0.332	C	S	.	.	H	α-helix	trans	-60.4	-44.5	178.5	170.4	0	0	0	0	111.5	C243 L258 K259 L265 A266 I284 F288 L297	C243-V262 HydrophobicContact CB-CG2 4.05Å; L258-V262 WeakPolarHBondContact O-CG2 3.31Å; L258-V262 PolarHBondContact O-N 2.85Å; K259-V262 PolarHBondContact O-N 2.89Å; V262-L265 PolarHBondContact O-N 3.17Å; V262-A266 PolarHBondContact O-N 3.44Å; V262-I284 HydrophobicContact CG1-CG2 3.85Å; V262-F288 HydrophobicContact CG2-CE2 3.95Å; V262-F288 HydrophobicContact CG2-CZ 3.8Å; V262-L297 HydrophobicContact CG1-CD2 4.24Å
263	L	97.4	Very high	95.6	Very high	45 Å²	45	57.9 Å²	57.9	24%	0.236	29%	0.286	C	S	.	.	H	α-helix	trans	-62.1	-44.8	177.2	-61.9	-178.9	0	0	0	111.8	K259 S260 V261 L265 A266 E267 F292 Q296 V300	K259-L263 WeakPolarHBondContact O-CG 3.46Å; K259-L263 PolarHBondContact O-N 2.99Å; S260-L263 PolarHBondContact O-N 3.08Å; V261-L263 PolarHBondContact O-N 3.08Å; L263-L265 VanDerWaalsContact C-N 3.35Å; L263-L265 PolarHBondContact O-N 3.25Å; L263-A266 WeakPolarHBondContact O-CB 3.44Å; L263-A266 PolarHBondContact O-N 3.26Å; L263-A266 VanDerWaalsContact O-N 3.16Å; L263-E267 PolarHBondContact O-N 3.31Å; L263-E267 VanDerWaalsContact O-N 3.16Å; L263-F292 HydrophobicContact CD2-CE2 4.35Å; L263-F292 HydrophobicContact CD2-CZ 4.31Å; L263-Q296 HydrophobicContact CD2-CB 4.06Å; L263-V300 HydrophobicContact CD2-CG2 3.56Å
264	K	97.3	Very high	96.1	Very high	109 Å²	109	55.5 Å²	55.5	47%	0.474	27%	0.271	S	S	.	.	H	α-helix	trans	-61.7	-41.4	178.4	-175.7	179.9	178.6	-179.2	0	112.3	S229 S260 V261 A266 E267 D268	S229-K264 PolarHBondContact OG-NZ 3.12Å; S260-K264 WeakPolarHBondContact O-CB 3.47Å; S260-K264 PolarHBondContact O-N 3.4Å; V261-K264 PolarHBondContact O-N 3.16Å; K264-A266 VanDerWaalsContact C-N 3.3Å; K264-E267 CarbonylContact O-C 3.56Å; K264-E267 PolarHBondContact O-N 3.04Å; K264-D268 PolarHBondContact O-N 2.98Å
265	L	98.2	Very high	96.7	Very high	2 Å²	2	55.1 Å²	55.1	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-66.7	-33.4	176.8	-68.9	169.5	0	0	0	111.6	R236 V239 V240 V261 V262 L263 E267 D268 V273 V277	R236-L265 HydrophobicContact CB-CD2 4.26Å; V239-L265 HydrophobicContact CG1-CD1 4.4Å; V240-L265 HydrophobicContact CG2-CD1 4.12Å; V261-L265 HydrophobicContact CG1-CD1 3.78Å; V261-L265 HydrophobicContact CG1-CG 4.34Å; V261-L265 VanDerWaalsContact O-CG 3.3Å; V261-L265 WeakPolarHBondContact O-CG 3.44Å; V261-L265 PolarHBondContact O-N 3.38Å; V262-L265 PolarHBondContact O-N 3.17Å; L263-L265 VanDerWaalsContact C-N 3.35Å; L263-L265 PolarHBondContact O-N 3.25Å; L265-E267 VanDerWaalsContact C-N 3.32Å; L265-D268 VanDerWaalsContact O-CB 3.3Å; L265-D268 WeakPolarHBondContact O-CB 3.46Å; L265-D268 PolarHBondContact O-N 3.02Å; L265-V273 HydrophobicContact CB-CG1 4.12Å; L265-V273 HydrophobicContact CD2-CG1 3.65Å; L265-V273 HydrophobicContact CG-CG1 4.49Å; L265-V277 HydrophobicContact CB-CG2 3.93Å
266	A	97.9	Very high	97.1	Very high	8 Å²	8	56.2 Å²	56.2	7%	0.066	27%	0.267	C	S	.	.	H	α-helix	trans	-71.1	-27.6	178.1	0	0	0	0	0	113.4	V262 L263 K264 R274 V277 V300	V262-A266 PolarHBondContact O-N 3.44Å; L263-A266 WeakPolarHBondContact O-CB 3.44Å; L263-A266 PolarHBondContact O-N 3.26Å; L263-A266 VanDerWaalsContact O-N 3.16Å; K264-A266 VanDerWaalsContact C-N 3.3Å; A266-R274 VanDerWaalsContact O-CD 3.23Å; A266-R274 WeakPolarHBondContact O-CD 3.44Å; A266-R274 WeakPolarHBondContact O-CG 3.42Å; A266-V277 HydrophobicContact CB-CG1 3.94Å; A266-V300 HydrophobicContact CB-CB 4.48Å; A266-V300 HydrophobicContact CB-CG1 3.36Å; A266-V300 HydrophobicContact CB-CG2 4.26Å
267	E	97.4	Very high	97.4	Very high	156 Å²	156	51.4 Å²	51.4	73%	0.729	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.5	15	175.9	-64	-178.3	175.1	0	0	112.8	L263 K264 L265	L263-E267 PolarHBondContact O-N 3.31Å; L263-E267 VanDerWaalsContact O-N 3.16Å; K264-E267 CarbonylContact O-C 3.56Å; K264-E267 PolarHBondContact O-N 3.04Å; L265-E267 VanDerWaalsContact C-N 3.32Å
268	D	98.4	Very high	97.6	Very high	13 Å²	13	48.1 Å²	48.1	7%	0.07	22%	0.221	C	C	.	.			trans	-61.3	144.3	-174.8	-165.1	-75	0	0	0	112.5	R236 K264 L265 S270 V273 R274	R236-D268 IonicContact CZ-OD1 3.57Å; R236-D268 IonicContact CZ-OD2 3.39Å; R236-D268 IonicContact NE-OD1 2.75Å; R236-D268 IonicContact NE-OD2 3.58Å; R236-D268 PolarHBondContact NE-OD2 2.88Å; R236-D268 IonicContact NH2-OD1 2.88Å; R236-D268 PolarHBondContact NH2-OD1 3.33Å; R236-D268 IonicContact NH2-OD2 2.73Å; R236-D268 PolarHBondContact NH2-OD2 3.38Å; K264-D268 PolarHBondContact O-N 2.98Å; L265-D268 VanDerWaalsContact O-CB 3.3Å; L265-D268 WeakPolarHBondContact O-CB 3.46Å; L265-D268 PolarHBondContact O-N 3.02Å; D268-S270 PolarHBondContact O-N 3.07Å; D268-S270 WeakPolarHBondContact OD1-CB 3.32Å; D268-S270 PolarHBondContact OD1-N 3.23Å; D268-V273 HydrophobicContact CB-CB 3.71Å; D268-V273 HydrophobicContact CB-CG1 3.67Å; D268-V273 HydrophobicContact CB-CG2 4.4Å; D268-R274 HydrophobicContact CB-CG 4.24Å; D268-R274 WeakPolarHBondContact O-CD 3.38Å; D268-R274 WeakPolarHBondContact O-CG 3.43Å; D268-R274 PolarHBondContact O-NH1 2.69Å
269	K	97.6	Very high	97.8	Very high	174 Å²	174	50.5 Å²	50.5	76%	0.757	23%	0.234	S	C	*	.	S	Bend	trans	-57.7	-34.2	176	66.1	-176.9	-179.5	-176.2	0	113.1	R274	K269-R274 PolarHBondContact O-NH1 3.22Å
270	S	98.2	Very high	97.9	Very high	19 Å²	19	50.8 Å²	50.8	13%	0.133	24%	0.235	C	C	.	.	S	Bend	trans	-85.3	121.2	178	-180	0	0	0	0	110	D233 D268 R272 V273 R274	D233-S270 PolarHBondContact OD2-OG 3.25Å; D268-S270 PolarHBondContact O-N 3.07Å; D268-S270 WeakPolarHBondContact OD1-CB 3.32Å; D268-S270 PolarHBondContact OD1-N 3.23Å; S270-R272 PolarHBondContact O-N 3.15Å; S270-R272 VanDerWaalsContact O-N 3.16Å; S270-R272 PolarHBondContact OG-N 3.42Å; S270-V273 PolarHBondContact O-N 3.27Å; S270-R274 PolarHBondContact O-N 2.87Å
271	W	98.4	Very high	97.9	Very high	90 Å²	90	47.3 Å²	47.3	34%	0.341	21%	0.211	S	C	.	.	H	α-helix	trans	-60.3	-25.6	175.9	73.3	-99.2	0	0	0	112.7	V273 R274 Y275 E309 E311 V312	W271-V273 VanDerWaalsContact C-N 3.3Å; W271-V273 PolarHBondContact O-N 3.48Å; W271-R274 PolarHBondContact O-N 3.34Å; W271-Y275 HydrophobicContact CZ3-CD2 4.28Å; W271-Y275 HydrophobicContact CZ3-CG 4.33Å; W271-Y275 WeakPolarHBondContact O-CB 3.44Å; W271-Y275 PolarHBondContact O-N 2.97Å; W271-E309 HydrophobicContact CB-CB 4.11Å; W271-E309 HydrophobicContact CB-CG 3.53Å; W271-E309 HydrophobicContact CG-CG 3.94Å; W271-E311 HydrophobicContact CE3-CB 4.16Å; W271-E311 HydrophobicContact CH2-CB 4.39Å; W271-E311 HydrophobicContact CH2-CG 4.31Å; W271-E311 HydrophobicContact CZ3-CB 3.7Å; W271-E311 HydrophobicContact CZ3-CG 4.1Å; W271-V312 HydrophobicContact CB-CG2 4.11Å; W271-V312 HydrophobicContact CE3-CG2 4.3Å
272	R	98.3	Very high	97.8	Very high	119 Å²	119	48.1 Å²	48.1	45%	0.449	22%	0.215	S	C	.	.	H	α-helix	trans	-65.7	-35.3	177.1	-61.7	177.2	71.3	-175.6	6.5	111.6	L237 S270 M276	L237-R272 HydrophobicContact CD2-CB 4.44Å; S270-R272 PolarHBondContact O-N 3.15Å; S270-R272 VanDerWaalsContact O-N 3.16Å; S270-R272 PolarHBondContact OG-N 3.42Å; R272-M276 WeakPolarHBondContact O-CG 3.48Å; R272-M276 PolarHBondContact O-N 3.31Å; R272-M276 VanDerWaalsContact O-N 3.1Å
273	V	98.4	Very high	97.7	Very high	0 Å²	0	52 Å²	52	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-71.6	-46.9	176	-178.2	0	0	0	0	109.6	D233 R236 L237 L265 D268 S270 W271 Y275 M276 V277	D233-V273 HydrophobicContact CB-CG2 4.18Å; R236-V273 HydrophobicContact CB-CG2 4Å; L237-V273 HydrophobicContact CB-CG2 4.05Å; L265-V273 HydrophobicContact CB-CG1 4.12Å; L265-V273 HydrophobicContact CD2-CG1 3.65Å; L265-V273 HydrophobicContact CG-CG1 4.49Å; D268-V273 HydrophobicContact CB-CB 3.71Å; D268-V273 HydrophobicContact CB-CG1 3.67Å; D268-V273 HydrophobicContact CB-CG2 4.4Å; S270-V273 PolarHBondContact O-N 3.27Å; W271-V273 VanDerWaalsContact C-N 3.3Å; W271-V273 PolarHBondContact O-N 3.48Å; V273-Y275 VanDerWaalsContact C-N 3.3Å; V273-Y275 PolarHBondContact O-N 2.96Å; V273-M276 WeakPolarHBondContact O-CB 3.47Å; V273-M276 PolarHBondContact O-N 3.06Å; V273-M276 VanDerWaalsContact O-N 3.11Å; V273-V277 PolarHBondContact O-N 3.17Å; V273-V277 VanDerWaalsContact O-N 3.08Å
274	R	98.6	Very high	97.6	Very high	29 Å²	29	50 Å²	50	11%	0.109	22%	0.223	C	C	.	.	H	α-helix	trans	-61.2	-38.5	175.7	-54.4	-163	-55.3	-83.3	1.6	112.5	A266 D268 K269 S270 W271 V277 A278 L304 D307 V312	A266-R274 VanDerWaalsContact O-CD 3.23Å; A266-R274 WeakPolarHBondContact O-CD 3.44Å; A266-R274 WeakPolarHBondContact O-CG 3.42Å; D268-R274 HydrophobicContact CB-CG 4.24Å; D268-R274 WeakPolarHBondContact O-CD 3.38Å; D268-R274 WeakPolarHBondContact O-CG 3.43Å; D268-R274 PolarHBondContact O-NH1 2.69Å; K269-R274 PolarHBondContact O-NH1 3.22Å; S270-R274 PolarHBondContact O-N 2.87Å; W271-R274 PolarHBondContact O-N 3.34Å; R274-V277 WeakPolarHBondContact O-CB 3.37Å; R274-V277 PolarHBondContact O-N 3.33Å; R274-A278 PolarHBondContact O-N 3.5Å; R274-L304 HydrophobicContact CB-CD2 4.13Å; R274-D307 IonicContact CZ-OD1 2.72Å; R274-D307 IonicContact CZ-OD2 3.29Å; R274-D307 IonicContact NE-OD1 3Å; R274-D307 IonicContact NE-OD2 3Å; R274-D307 PolarHBondContact NE-OD2 2.89Å; R274-D307 IonicContact NH2-OD1 3.48Å; R274-D307 PolarHBondContact NH2-OD1 3.02Å; R274-D307 IonicContact NH2-OD2 2.71Å; R274-D307 PolarHBondContact NH2-OD2 3.37Å; R274-V312 HydrophobicContact CB-CG1 4.25Å; R274-V312 HydrophobicContact CB-CG2 4.33Å
275	Y	98.6	Very high	97.5	Very high	83 Å²	83	45.4 Å²	45.4	33%	0.325	20%	0.203	S	C	.	.	H	α-helix	trans	-58.5	-47	172.6	175.1	-83.9	0	0	0	111	W271 V273 V277 A278 D279 E311 A315	W271-Y275 HydrophobicContact CZ3-CD2 4.28Å; W271-Y275 HydrophobicContact CZ3-CG 4.33Å; W271-Y275 WeakPolarHBondContact O-CB 3.44Å; W271-Y275 PolarHBondContact O-N 2.97Å; V273-Y275 VanDerWaalsContact C-N 3.3Å; V273-Y275 PolarHBondContact O-N 2.96Å; Y275-V277 VanDerWaalsContact C-N 3.29Å; Y275-V277 PolarHBondContact O-N 2.98Å; Y275-A278 CarbonylContact O-C 3.59Å; Y275-A278 WeakPolarHBondContact O-CB 3.18Å; Y275-A278 PolarHBondContact O-N 2.93Å; Y275-A278 VanDerWaalsContact O-N 3.13Å; Y275-D279 HydrophobicContact CE1-CB 4.24Å; Y275-D279 WeakPolarHBondContact O-CB 3.39Å; Y275-D279 PolarHBondContact O-N 2.99Å; Y275-E311 HydrophobicContact CD2-CB 4.16Å; Y275-E311 WeakPolarHBondContact CD2-O 3.34Å; Y275-E311 HydrophobicContact CE2-CB 4.47Å; Y275-A315 HydrophobicContact CD2-CB 3.93Å; Y275-A315 HydrophobicContact CE2-CB 3.76Å
276	M	98.2	Very high	97.3	Very high	39 Å²	39	47.8 Å²	47.8	19%	0.192	22%	0.221	C	C	.	.	H	α-helix	trans	-62.3	-37.5	177.5	-73.4	-53.8	-57.4	0	0	112	L237 V240 R272 V273 D279 K280	L237-M276 HydrophobicContact CB-CG 3.89Å; L237-M276 HydrophobicContact CD1-CG 4Å; L237-M276 HydrophobicContact CD1-SD 4.5Å; V240-M276 HydrophobicContact CB-CB 4.31Å; V240-M276 HydrophobicContact CG2-CB 3.97Å; R272-M276 WeakPolarHBondContact O-CG 3.48Å; R272-M276 PolarHBondContact O-N 3.31Å; R272-M276 VanDerWaalsContact O-N 3.1Å; V273-M276 WeakPolarHBondContact O-CB 3.47Å; V273-M276 PolarHBondContact O-N 3.06Å; V273-M276 VanDerWaalsContact O-N 3.11Å; M276-D279 PolarHBondContact O-N 3.25Å; M276-K280 HydrophobicContact CE-CG 4.37Å; M276-K280 WeakPolarHBondContact O-CB 3.44Å; M276-K280 WeakPolarHBondContact O-CG 3.26Å; M276-K280 PolarHBondContact O-N 3.43Å
277	V	98.4	Very high	97.1	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.006	22%	0.218	C	C	.	.	H	α-helix	trans	-62.8	-44.1	172.9	177.4	0	0	0	0	110.9	V240 L265 A266 V273 R274 Y275 K280 F281 I284 L304	V240-V277 HydrophobicContact CG1-CG2 4.26Å; V240-V277 HydrophobicContact CG2-CG2 3.9Å; L265-V277 HydrophobicContact CB-CG2 3.93Å; A266-V277 HydrophobicContact CB-CG1 3.94Å; V273-V277 PolarHBondContact O-N 3.17Å; V273-V277 VanDerWaalsContact O-N 3.08Å; R274-V277 WeakPolarHBondContact O-CB 3.37Å; R274-V277 PolarHBondContact O-N 3.33Å; Y275-V277 VanDerWaalsContact C-N 3.29Å; Y275-V277 PolarHBondContact O-N 2.98Å; V277-K280 CarbonylContact O-C 3.54Å; V277-K280 PolarHBondContact O-N 3.47Å; V277-F281 HydrophobicContact CG1-CD2 4.13Å; V277-F281 HydrophobicContact CG1-CE2 4.37Å; V277-F281 VanDerWaalsContact O-CA 3.3Å; V277-F281 WeakPolarHBondContact O-CA 3.4Å; V277-F281 WeakPolarHBondContact O-CB 3.38Å; V277-F281 PolarHBondContact O-N 3.19Å; V277-I284 HydrophobicContact CG1-CD1 3.99Å; V277-L304 HydrophobicContact CG1-CD1 4.12Å
278	A	98.5	Very high	96.8	Very high	0 Å²	0	41 Å²	41	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-64.2	-43.4	176.5	0	0	0	0	0	112.6	R274 Y275 K280 F281 L304 V312 A315 A316 K319	R274-A278 PolarHBondContact O-N 3.5Å; Y275-A278 CarbonylContact O-C 3.59Å; Y275-A278 WeakPolarHBondContact O-CB 3.18Å; Y275-A278 PolarHBondContact O-N 2.93Å; Y275-A278 VanDerWaalsContact O-N 3.13Å; A278-K280 VanDerWaalsContact C-N 3.33Å; A278-K280 PolarHBondContact O-N 2.95Å; A278-F281 WeakPolarHBondContact O-CB 3.33Å; A278-F281 PolarHBondContact O-N 3.12Å; A278-L304 HydrophobicContact CB-CD1 4.16Å; A278-V312 HydrophobicContact CB-CG1 4.44Å; A278-A315 HydrophobicContact CB-CB 3.81Å; A278-A316 HydrophobicContact CB-CB 4.29Å; A278-K319 WeakPolarHBondContact O-CG 3.46Å
279	D	97.9	Very high	96.4	Very high	50 Å²	50	43.8 Å²	43.8	27%	0.267	20%	0.203	S	C	.	.	H	α-helix	trans	-63	-38.8	178.3	-178.3	65.1	0	0	0	112.3	Y275 M276 K319	Y275-D279 HydrophobicContact CE1-CB 4.24Å; Y275-D279 WeakPolarHBondContact O-CB 3.39Å; Y275-D279 PolarHBondContact O-N 2.99Å; M276-D279 PolarHBondContact O-N 3.25Å; D279-K319 WeakPolarHBondContact O-CE 3.22Å
280	K	96.8	Very high	96	Very high	45 Å²	45	38.3 Å²	38.3	20%	0.196	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	12.9	-179.6	-55.7	-58.9	179.7	-175.9	0	113.6	V240 M276 V277 A278 N282 M283 I284	V240-K280 HydrophobicContact CG1-CB 4.06Å; V240-K280 HydrophobicContact CG1-CG 4.27Å; M276-K280 HydrophobicContact CE-CG 4.37Å; M276-K280 WeakPolarHBondContact O-CB 3.44Å; M276-K280 WeakPolarHBondContact O-CG 3.26Å; M276-K280 PolarHBondContact O-N 3.43Å; V277-K280 CarbonylContact O-C 3.54Å; V277-K280 PolarHBondContact O-N 3.47Å; A278-K280 VanDerWaalsContact C-N 3.33Å; A278-K280 PolarHBondContact O-N 2.95Å; K280-N282 PolarHBondContact O-N 3.35Å; K280-M283 HydrophobicContact CD-SD 4.04Å; K280-M283 WeakPolarHBondContact O-CB 3.47Å; K280-M283 PolarHBondContact O-N 3.22Å; K280-I284 HydrophobicContact CB-CD1 4.46Å; K280-I284 WeakPolarHBondContact O-CG1 3.49Å; K280-I284 PolarHBondContact O-N 3.09Å
281	F	97.6	Very high	95.7	Very high	1 Å²	1	42.6 Å²	42.6	0%	0.004	21%	0.207	C	C	.	.	H	α-helix	trans	-60.7	-41.6	-167.6	-156.1	-91.7	0	0	0	113.8	V277 A278 I284 Q285 L297 V300 F301 L304 F323	V277-F281 HydrophobicContact CG1-CD2 4.13Å; V277-F281 HydrophobicContact CG1-CE2 4.37Å; V277-F281 VanDerWaalsContact O-CA 3.3Å; V277-F281 WeakPolarHBondContact O-CA 3.4Å; V277-F281 WeakPolarHBondContact O-CB 3.38Å; V277-F281 PolarHBondContact O-N 3.19Å; A278-F281 WeakPolarHBondContact O-CB 3.33Å; A278-F281 PolarHBondContact O-N 3.12Å; F281-I284 PolarHBondContact O-N 3.02Å; F281-Q285 WeakPolarHBondContact O-CB 3.31Å; F281-Q285 PolarHBondContact O-N 3.2Å; F281-L297 HydrophobicContact CE1-CB 4.44Å; F281-L297 HydrophobicContact CZ-CB 4.06Å; F281-L297 HydrophobicContact CZ-CD2 4.23Å; F281-L297 VanDerWaalsContact CZ-O 3.32Å; F281-L297 WeakPolarHBondContact CZ-O 3.28Å; F281-V300 HydrophobicContact CE2-CB 4.37Å; F281-V300 HydrophobicContact CE2-CG1 3.75Å; F281-V300 HydrophobicContact CZ-CB 4.46Å; F281-V300 HydrophobicContact CZ-CG1 4.31Å; F281-F301 AromaticContact CD1-CD2 3.43Å; F281-F301 HydrophobicContact CD1-CD2 3.43Å; F281-F301 VanDerWaalsContact CD1-CD2 3.43Å; F281-F301 AromaticContact CD1-CE2 3.92Å; F281-F301 HydrophobicContact CD1-CE2 3.92Å; F281-F301 HydrophobicContact CD1-CG 4.18Å; F281-F301 HydrophobicContact CD2-CD2 4.08Å; F281-F301 HydrophobicContact CE1-CB 3.7Å; F281-F301 AromaticContact CE1-CD2 3.5Å; F281-F301 HydrophobicContact CE1-CD2 3.5Å; F281-F301 VanDerWaalsContact CE1-CD2 3.5Å; F281-F301 HydrophobicContact CE1-CE2 4.4Å; F281-F301 AromaticContact CE1-CG 3.82Å; F281-F301 HydrophobicContact CE1-CG 3.82Å; F281-F301 HydrophobicContact CE2-CB 4.36Å; F281-F301 HydrophobicContact CE2-CD2 4.15Å; F281-F301 AromaticContact CG-CD2 3.74Å; F281-F301 HydrophobicContact CG-CD2 3.74Å; F281-F301 HydrophobicContact CG-CE2 4.13Å; F281-F301 HydrophobicContact CZ-CB 3.63Å; F281-F301 AromaticContact CZ-CD2 3.88Å; F281-F301 HydrophobicContact CZ-CD2 3.88Å; F281-F301 HydrophobicContact CZ-CG 4.15Å; F281-L304 HydrophobicContact CD2-CD1 3.72Å; F281-L304 HydrophobicContact CE2-CD1 3.77Å; F281-F323 AromaticContact CD1-CD2 3.93Å; F281-F323 HydrophobicContact CD1-CD2 3.93Å; F281-F323 AromaticContact CE1-CD2 3.55Å; F281-F323 HydrophobicContact CE1-CD2 3.55Å; F281-F323 AromaticContact CE1-CE2 3.78Å; F281-F323 HydrophobicContact CE1-CE2 3.78Å
282	N	94.4	Very high	95.4	Very high	24 Å²	24	38.6 Å²	38.6	13%	0.128	19%	0.192	C	C	.	.	H	α-helix	trans	-64.8	-38.2	176.2	63	-30.5	0	0	0	112.1	K280 Q285 S286 E322	K280-N282 PolarHBondContact O-N 3.35Å; N282-Q285 PolarHBondContact O-N 3.49Å; N282-S286 WeakPolarHBondContact O-CB 3.42Å; N282-S286 PolarHBondContact O-N 3Å; N282-S286 PolarHBondContact O-OG 3.41Å; N282-S286 VanDerWaalsContact O-OG 3.11Å; N282-E322 HydrophobicContact CB-CB 4.12Å; N282-E322 PolarHBondContact ND2-OE1 3.38Å; N282-E322 PolarHBondContact ND2-OE2 3.45Å
283	M	95.3	Very high	94.9	Very high	86 Å²	86	33.1 Å²	33.1	42%	0.424	17%	0.174	S	C	.	.	H	α-helix	trans	-66.5	-40.4	174.6	-68.8	-176.8	154.4	0	0	111.8	V244 K280 S286 A287	V244-M283 HydrophobicContact CG1-CB 4.08Å; V244-M283 HydrophobicContact CG2-CB 3.88Å; K280-M283 HydrophobicContact CD-SD 4.04Å; K280-M283 WeakPolarHBondContact O-CB 3.47Å; K280-M283 PolarHBondContact O-N 3.22Å; M283-S286 PolarHBondContact O-OG 3.25Å; M283-S286 VanDerWaalsContact O-OG 3.05Å; M283-A287 WeakPolarHBondContact O-CB 3.46Å; M283-A287 PolarHBondContact O-N 2.96Å
284	I	95.9	Very high	94.6	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.01	18%	0.176	C	C	.	.	H	α-helix	trans	-61.1	-55	172.8	-67.5	166.7	0	0	0	109.2	V240 V244 V262 V277 K280 F281 S286 A287 F288 L297	V240-I284 HydrophobicContact CG1-CD1 3.97Å; V244-I284 HydrophobicContact CG2-CG1 4.06Å; V262-I284 HydrophobicContact CG1-CG2 3.85Å; V277-I284 HydrophobicContact CG1-CD1 3.99Å; K280-I284 HydrophobicContact CB-CD1 4.46Å; K280-I284 WeakPolarHBondContact O-CG1 3.49Å; K280-I284 PolarHBondContact O-N 3.09Å; F281-I284 PolarHBondContact O-N 3.02Å; I284-S286 VanDerWaalsContact C-N 3.29Å; I284-S286 PolarHBondContact O-N 2.99Å; I284-A287 PolarHBondContact O-N 2.89Å; I284-F288 HydrophobicContact CG2-CD2 4.09Å; I284-F288 HydrophobicContact CG2-CE2 3.96Å; I284-F288 VanDerWaalsContact O-CD2 3.26Å; I284-F288 WeakPolarHBondContact O-CD2 3.5Å; I284-F288 PolarHBondContact O-N 3.35Å; I284-L297 HydrophobicContact CG2-CD1 4.21Å; I284-L297 HydrophobicContact CG2-CD2 4.1Å
285	Q	95.2	Very high	94.4	Very high	12 Å²	12	34.6 Å²	34.6	6%	0.056	19%	0.186	C	C	.	.	H	α-helix	trans	-55.5	-41.9	-178	-173.1	-177.1	13.7	0	0	113	F281 N282 A287 L297 F323 Y326	F281-Q285 WeakPolarHBondContact O-CB 3.31Å; F281-Q285 PolarHBondContact O-N 3.2Å; N282-Q285 PolarHBondContact O-N 3.49Å; Q285-A287 VanDerWaalsContact C-N 3.27Å; Q285-A287 PolarHBondContact O-N 2.89Å; Q285-L297 HydrophobicContact CB-CD1 4.24Å; Q285-L297 HydrophobicContact CG-CD1 4.46Å; Q285-F323 PolarHBondContact NE2-O 3.24Å; Q285-Y326 VanDerWaalsContact CD-CB 3.41Å
286	S	93.1	Very high	94.2	Very high	53 Å²	53	34.8 Å²	34.8	37%	0.371	19%	0.19	S	C	.	.	H	α-helix	trans	-72.4	-15.5	178.9	63.7	0	0	0	0	114.6	N282 M283 I284	N282-S286 WeakPolarHBondContact O-CB 3.42Å; N282-S286 PolarHBondContact O-N 3Å; N282-S286 PolarHBondContact O-OG 3.41Å; N282-S286 VanDerWaalsContact O-OG 3.11Å; M283-S286 PolarHBondContact O-OG 3.25Å; M283-S286 VanDerWaalsContact O-OG 3.05Å; I284-S286 VanDerWaalsContact C-N 3.29Å; I284-S286 PolarHBondContact O-N 2.99Å
287	A	93	Very high	94.2	Very high	2 Å²	2	33 Å²	33	2%	0.017	18%	0.181	C	C	.	.	H	α-helix	trans	-93.1	-13.6	-178.3	0	0	0	0	0	113.8	V244 A247 K248 M283 I284 Q285	V244-A287 HydrophobicContact CG1-CB 4.32Å; A247-A287 HydrophobicContact CB-CB 3.62Å; K248-A287 HydrophobicContact CG-CB 4.07Å; M283-A287 WeakPolarHBondContact O-CB 3.46Å; M283-A287 PolarHBondContact O-N 2.96Å; I284-A287 PolarHBondContact O-N 2.89Å; Q285-A287 VanDerWaalsContact C-N 3.27Å; Q285-A287 PolarHBondContact O-N 2.89Å
288	F	91.9	Very high	94.1	Very high	19 Å²	19	33.5 Å²	33.5	8%	0.083	18%	0.184	C	C	.	.	S	Bend	trans	-108.6	168.4	177.9	-70.4	-85.6	0	0	0	112.3	A247 L258 K259 V262 I284 F292	A247-F288 HydrophobicContact CB-CD2 4.43Å; A247-F288 HydrophobicContact CB-CE1 4.23Å; A247-F288 HydrophobicContact CB-CE2 3.98Å; A247-F288 HydrophobicContact CB-CZ 3.89Å; L258-F288 HydrophobicContact CD2-CE1 4.01Å; L258-F288 HydrophobicContact CD2-CZ 3.88Å; L258-F288 HydrophobicContact CG-CE1 4.1Å; L258-F288 HydrophobicContact CG-CZ 3.83Å; K259-F288 HydrophobicContact CG-CD1 3.92Å; K259-F288 HydrophobicContact CG-CE1 3.71Å; V262-F288 HydrophobicContact CG2-CE2 3.95Å; V262-F288 HydrophobicContact CG2-CZ 3.8Å; I284-F288 HydrophobicContact CG2-CD2 4.09Å; I284-F288 HydrophobicContact CG2-CE2 3.96Å; I284-F288 VanDerWaalsContact O-CD2 3.26Å; I284-F288 WeakPolarHBondContact O-CD2 3.5Å; I284-F288 PolarHBondContact O-N 3.35Å; F288-F292 HydrophobicContact CB-CB 4.48Å; F288-F292 HydrophobicContact CB-CD1 3.51Å; F288-F292 HydrophobicContact CB-CE1 4.17Å; F288-F292 HydrophobicContact CB-CG 4.4Å; F288-F292 AromaticContact CD1-CD1 3.88Å; F288-F292 HydrophobicContact CD1-CD1 3.88Å; F288-F292 AromaticContact CD1-CE1 3.95Å; F288-F292 HydrophobicContact CD1-CE1 3.95Å; F288-F292 HydrophobicContact CD2-CD1 4.06Å; F288-F292 AromaticContact CD2-CE1 3.82Å; F288-F292 HydrophobicContact CD2-CE1 3.82Å; F288-F292 HydrophobicContact CE1-CE1 4.28Å; F288-F292 HydrophobicContact CE2-CE1 4.2Å; F288-F292 AromaticContact CG-CD1 3.55Å; F288-F292 HydrophobicContact CG-CD1 3.55Å; F288-F292 AromaticContact CG-CE1 3.71Å; F288-F292 HydrophobicContact CG-CE1 3.71Å; F288-F292 HydrophobicContact CZ-CE1 4.39Å
289	D	90	Very high	94.1	Very high	72 Å²	72	38.2 Å²	38.2	39%	0.385	21%	0.213	S	C	.	.			trans	-65.3	154.7	174.1	67.5	79	0	0	0	112.6	K259 E291 F292 G293	K259-D289 WeakPolarHBondContact CE-OD2 3.45Å; K259-D289 IonicContact NZ-OD2 3.22Å; K259-D289 PolarHBondContact NZ-OD2 2.94Å; D289-E291 PolarHBondContact O-N 3.4Å; D289-E291 WeakPolarHBondContact OD1-CB 3.47Å; D289-E291 PolarHBondContact OD1-N 2.91Å; D289-E291 VanDerWaalsContact OD1-N 3.1Å; D289-F292 PolarHBondContact O-N 3.48Å; D289-F292 PolarHBondContact OD1-N 3.31Å; D289-G293 PolarHBondContact O-N 3.4Å; D289-G293 VanDerWaalsContact O-N 3.12Å
290	A	90	Very high	94.1	Very high	59 Å²	59	36.4 Å²	36.4	49%	0.488	20%	0.204	S	C	.	.	H	α-helix	trans	-61.3	-28.9	-176.7	0	0	0	0	0	113.6	G293 C294 P328	A290-G293 PolarHBondContact O-N 3.4Å; A290-C294 PolarHBondContact O-N 3.37Å; A290-C294 PolarHBondContact O-SG 3.19Å; A290-C294 VanDerWaalsContact O-SG 3.41Å; A290-P328 HydrophobicContact CB-CG 3.76Å
291	E	91.7	Very high	94.1	Very high	108 Å²	108	34.2 Å²	34.2	51%	0.505	19%	0.194	S	C	.	.	H	α-helix	trans	-73.7	-43.4	-177.8	-172.2	56.3	-148.3	0	0	111	D289 G293 C294 T295 R331	D289-E291 PolarHBondContact O-N 3.4Å; D289-E291 WeakPolarHBondContact OD1-CB 3.47Å; D289-E291 PolarHBondContact OD1-N 2.91Å; D289-E291 VanDerWaalsContact OD1-N 3.1Å; E291-G293 PolarHBondContact O-N 3.06Å; E291-C294 PolarHBondContact O-N 3.26Å; E291-T295 WeakPolarHBondContact O-CB 3.4Å; E291-T295 PolarHBondContact O-N 3.24Å; E291-T295 PolarHBondContact O-OG1 3.07Å; E291-T295 WeakPolarHBondContact OE1-CG2 3.29Å; E291-R331 IonicContact OE1-NH1 3.36Å; E291-R331 PolarHBondContact OE1-NH1 3.05Å; E291-R331 IonicContact OE2-NH1 3.42Å; E291-R331 PolarHBondContact OE2-NH1 2.91Å; E291-R331 VanDerWaalsContact OE2-NH1 3.09Å
292	F	92.1	Very high	94.2	Very high	6 Å²	6	35.9 Å²	35.9	3%	0.026	20%	0.204	C	C	.	.	H	α-helix	trans	-59	-39.6	169.7	-178.1	-110	0	0	0	111.3	K259 L263 F288 D289 Q296 L297	K259-F292 HydrophobicContact CB-CD2 4.28Å; K259-F292 HydrophobicContact CB-CE2 3.65Å; K259-F292 HydrophobicContact CB-CZ 3.93Å; K259-F292 HydrophobicContact CD-CD2 3.77Å; K259-F292 HydrophobicContact CD-CE2 4.05Å; K259-F292 HydrophobicContact CD-CG 4.19Å; K259-F292 HydrophobicContact CG-CD1 4.45Å; K259-F292 HydrophobicContact CG-CD2 3.86Å; K259-F292 HydrophobicContact CG-CE1 4.27Å; K259-F292 HydrophobicContact CG-CE2 3.66Å; K259-F292 HydrophobicContact CG-CG 4.25Å; K259-F292 HydrophobicContact CG-CZ 3.89Å; L263-F292 HydrophobicContact CD2-CE2 4.35Å; L263-F292 HydrophobicContact CD2-CZ 4.31Å; F288-F292 HydrophobicContact CB-CB 4.48Å; F288-F292 HydrophobicContact CB-CD1 3.51Å; F288-F292 HydrophobicContact CB-CE1 4.17Å; F288-F292 HydrophobicContact CB-CG 4.4Å; F288-F292 AromaticContact CD1-CD1 3.88Å; F288-F292 HydrophobicContact CD1-CD1 3.88Å; F288-F292 AromaticContact CD1-CE1 3.95Å; F288-F292 HydrophobicContact CD1-CE1 3.95Å; F288-F292 HydrophobicContact CD2-CD1 4.06Å; F288-F292 AromaticContact CD2-CE1 3.82Å; F288-F292 HydrophobicContact CD2-CE1 3.82Å; F288-F292 HydrophobicContact CE1-CE1 4.28Å; F288-F292 HydrophobicContact CE2-CE1 4.2Å; F288-F292 AromaticContact CG-CD1 3.55Å; F288-F292 HydrophobicContact CG-CD1 3.55Å; F288-F292 AromaticContact CG-CE1 3.71Å; F288-F292 HydrophobicContact CG-CE1 3.71Å; F288-F292 HydrophobicContact CZ-CE1 4.39Å; D289-F292 PolarHBondContact O-N 3.48Å; D289-F292 PolarHBondContact OD1-N 3.31Å; F292-Q296 HydrophobicContact CD2-CB 3.95Å; F292-Q296 HydrophobicContact CD2-CG 4.36Å; F292-Q296 VanDerWaalsContact CD2-OE1 3.31Å; F292-Q296 HydrophobicContact CE2-CB 3.87Å; F292-Q296 HydrophobicContact CE2-CG 4.48Å; F292-Q296 PolarHBondContact O-N 2.82Å; F292-L297 HydrophobicContact CD1-CD1 3.71Å; F292-L297 HydrophobicContact CD1-CD2 4.24Å; F292-L297 HydrophobicContact CD1-CG 3.64Å; F292-L297 HydrophobicContact CE1-CD1 3.75Å; F292-L297 HydrophobicContact CE1-CD2 3.54Å; F292-L297 HydrophobicContact CE1-CG 3.48Å; F292-L297 VanDerWaalsContact CE1-CG 3.48Å; F292-L297 HydrophobicContact CG-CG 4.45Å; F292-L297 HydrophobicContact CZ-CD2 3.93Å; F292-L297 HydrophobicContact CZ-CG 4.14Å; F292-L297 PolarHBondContact O-N 3.44Å
293	G	87.6	Confident	94.4	Very high	5 Å²	5	37.4 Å²	37.4	5%	0.052	22%	0.22	C	C	.	.	I	π-helix	trans	-55.8	-54.1	172.1	0	0	0	0	0	114	D289 A290 E291 T295 T298	D289-G293 PolarHBondContact O-N 3.4Å; D289-G293 VanDerWaalsContact O-N 3.12Å; A290-G293 PolarHBondContact O-N 3.4Å; E291-G293 PolarHBondContact O-N 3.06Å; G293-T295 VanDerWaalsContact C-N 3.31Å; G293-T295 PolarHBondContact O-N 2.98Å; G293-T298 PolarHBondContact O-N 3.39Å; G293-T298 PolarHBondContact O-OG1 3.22Å
294	C	91.7	Very high	94.5	Very high	7 Å²	7	33.4 Å²	33.4	5%	0.047	20%	0.201	C	C	.	.	I	π-helix	trans	-74.1	-17.5	-176.4	-72.4	0	0	0	0	114.9	A290 E291 T298 P328 R331 I335	A290-C294 PolarHBondContact O-N 3.37Å; A290-C294 PolarHBondContact O-SG 3.19Å; A290-C294 VanDerWaalsContact O-SG 3.41Å; E291-C294 PolarHBondContact O-N 3.26Å; C294-T298 PolarHBondContact O-OG1 3.39Å; C294-P328 WeakPolarHBondContact SG-CD 3.45Å; C294-R331 VanDerWaalsContact CB-CZ 3.42Å; C294-I335 HydrophobicContact CB-CD1 3.88Å
295	T	94.1	Very high	94.6	Very high	52 Å²	52	33.4 Å²	33.4	32%	0.319	20%	0.201	S	C	.	.	I	π-helix	trans	-107.3	-86.3	-177.3	56.5	0	0	0	0	110.5	E291 G293 T298 T299	E291-T295 WeakPolarHBondContact O-CB 3.4Å; E291-T295 PolarHBondContact O-N 3.24Å; E291-T295 PolarHBondContact O-OG1 3.07Å; E291-T295 WeakPolarHBondContact OE1-CG2 3.29Å; G293-T295 VanDerWaalsContact C-N 3.31Å; G293-T295 PolarHBondContact O-N 2.98Å; T295-T298 WeakPolarHBondContact O-CB 3.28Å; T295-T298 PolarHBondContact O-N 2.91Å; T295-T299 PolarHBondContact O-N 3.48Å; T295-T299 VanDerWaalsContact O-N 3.16Å; T295-T299 PolarHBondContact O-OG1 3.12Å
296	Q	95.8	Very high	94.8	Very high	88 Å²	88	37.4 Å²	37.4	41%	0.411	22%	0.218	S	C	.	.	I	π-helix	trans	-69.4	-42.6	-169.5	-60.9	-180	-1.1	0	0	111.8	L263 F292 T298 T299 V300	L263-Q296 HydrophobicContact CD2-CB 4.06Å; F292-Q296 HydrophobicContact CD2-CB 3.95Å; F292-Q296 HydrophobicContact CD2-CG 4.36Å; F292-Q296 VanDerWaalsContact CD2-OE1 3.31Å; F292-Q296 HydrophobicContact CE2-CB 3.87Å; F292-Q296 HydrophobicContact CE2-CG 4.48Å; F292-Q296 PolarHBondContact O-N 2.82Å; Q296-T298 VanDerWaalsContact C-N 3.29Å; Q296-T298 PolarHBondContact O-N 3.29Å; Q296-T299 WeakPolarHBondContact O-CB 3.24Å; Q296-T299 PolarHBondContact O-N 3.28Å; Q296-V300 WeakPolarHBondContact O-CG2 3.19Å; Q296-V300 PolarHBondContact O-N 3.13Å
297	L	96.3	Very high	95	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.205	C	C	.	.	I	π-helix	trans	-66.5	-31.7	176.1	-67.8	-174.8	0	0	0	112.4	V262 F281 I284 Q285 F292 V300 F301	V262-L297 HydrophobicContact CG1-CD2 4.24Å; F281-L297 HydrophobicContact CE1-CB 4.44Å; F281-L297 HydrophobicContact CZ-CB 4.06Å; F281-L297 HydrophobicContact CZ-CD2 4.23Å; F281-L297 VanDerWaalsContact CZ-O 3.32Å; F281-L297 WeakPolarHBondContact CZ-O 3.28Å; I284-L297 HydrophobicContact CG2-CD1 4.21Å; I284-L297 HydrophobicContact CG2-CD2 4.1Å; Q285-L297 HydrophobicContact CB-CD1 4.24Å; Q285-L297 HydrophobicContact CG-CD1 4.46Å; F292-L297 HydrophobicContact CD1-CD1 3.71Å; F292-L297 HydrophobicContact CD1-CD2 4.24Å; F292-L297 HydrophobicContact CD1-CG 3.64Å; F292-L297 HydrophobicContact CE1-CD1 3.75Å; F292-L297 HydrophobicContact CE1-CD2 3.54Å; F292-L297 HydrophobicContact CE1-CG 3.48Å; F292-L297 VanDerWaalsContact CE1-CG 3.48Å; F292-L297 HydrophobicContact CG-CG 4.45Å; F292-L297 HydrophobicContact CZ-CD2 3.93Å; F292-L297 HydrophobicContact CZ-CG 4.14Å; F292-L297 PolarHBondContact O-N 3.44Å; L297-V300 PolarHBondContact O-N 3.05Å; L297-F301 WeakPolarHBondContact O-CB 3.49Å; L297-F301 PolarHBondContact O-N 3.36Å
298	T	97.2	Very high	95.3	Very high	13 Å²	13	41.3 Å²	41.3	8%	0.08	24%	0.238	C	C	.	.	H	α-helix	trans	-63.6	-44.3	173.3	-62.2	0	0	0	0	110.9	G293 C294 T295 Q296 F301 V302 F323 I335 A339	G293-T298 PolarHBondContact O-N 3.39Å; G293-T298 PolarHBondContact O-OG1 3.22Å; C294-T298 PolarHBondContact O-OG1 3.39Å; T295-T298 WeakPolarHBondContact O-CB 3.28Å; T295-T298 PolarHBondContact O-N 2.91Å; Q296-T298 VanDerWaalsContact C-N 3.29Å; Q296-T298 PolarHBondContact O-N 3.29Å; T298-F301 PolarHBondContact O-N 3.18Å; T298-V302 WeakPolarHBondContact O-CG2 3.22Å; T298-V302 PolarHBondContact O-N 2.91Å; T298-F323 HydrophobicContact CG2-CZ 4.38Å; T298-I335 HydrophobicContact CG2-CG2 3.67Å; T298-A339 HydrophobicContact CG2-CB 4.07Å
299	T	97.7	Very high	95.6	Very high	99 Å²	99	44.2 Å²	44.2	61%	0.607	25%	0.252	S	S	*	.	H	α-helix	trans	-61.1	-45.2	174.6	-59.1	0	0	0	0	111.9	T295 Q296 F301 V302 A303	T295-T299 PolarHBondContact O-N 3.48Å; T295-T299 VanDerWaalsContact O-N 3.16Å; T295-T299 PolarHBondContact O-OG1 3.12Å; Q296-T299 WeakPolarHBondContact O-CB 3.24Å; Q296-T299 PolarHBondContact O-N 3.28Å; T299-F301 PolarHBondContact O-N 3.03Å; T299-V302 PolarHBondContact O-N 3.31Å; T299-A303 PolarHBondContact O-N 3.12Å
300	V	98.1	Very high	96	Very high	11 Å²	11	41.4 Å²	41.4	7%	0.067	24%	0.239	C	C	.	.	H	α-helix	trans	-60.6	-46.1	176.8	172.5	0	0	0	0	111.1	L263 A266 F281 Q296 L297 V302 A303 L304	L263-V300 HydrophobicContact CD2-CG2 3.56Å; A266-V300 HydrophobicContact CB-CB 4.48Å; A266-V300 HydrophobicContact CB-CG1 3.36Å; A266-V300 HydrophobicContact CB-CG2 4.26Å; F281-V300 HydrophobicContact CE2-CB 4.37Å; F281-V300 HydrophobicContact CE2-CG1 3.75Å; F281-V300 HydrophobicContact CZ-CB 4.46Å; F281-V300 HydrophobicContact CZ-CG1 4.31Å; Q296-V300 WeakPolarHBondContact O-CG2 3.19Å; Q296-V300 PolarHBondContact O-N 3.13Å; L297-V300 PolarHBondContact O-N 3.05Å; V300-V302 VanDerWaalsContact C-N 3.32Å; V300-V302 PolarHBondContact O-N 3.27Å; V300-A303 WeakPolarHBondContact O-CB 3.35Å; V300-A303 PolarHBondContact O-N 3.11Å; V300-A303 VanDerWaalsContact O-N 3.08Å; V300-L304 HydrophobicContact CG1-CD1 3.9Å; V300-L304 HydrophobicContact CG1-CG 4.27Å; V300-L304 WeakPolarHBondContact O-CG 3.47Å; V300-L304 PolarHBondContact O-N 3.37Å
301	F	98.4	Very high	96.4	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.6	-40.9	-178.6	-163.8	-118.2	0	0	0	111.7	F281 L297 T298 T299 A303 L304 L305 A316 K319 V320 F323 I340	F281-F301 AromaticContact CD1-CD2 3.43Å; F281-F301 HydrophobicContact CD1-CD2 3.43Å; F281-F301 VanDerWaalsContact CD1-CD2 3.43Å; F281-F301 AromaticContact CD1-CE2 3.92Å; F281-F301 HydrophobicContact CD1-CE2 3.92Å; F281-F301 HydrophobicContact CD1-CG 4.18Å; F281-F301 HydrophobicContact CD2-CD2 4.08Å; F281-F301 HydrophobicContact CE1-CB 3.7Å; F281-F301 AromaticContact CE1-CD2 3.5Å; F281-F301 HydrophobicContact CE1-CD2 3.5Å; F281-F301 VanDerWaalsContact CE1-CD2 3.5Å; F281-F301 HydrophobicContact CE1-CE2 4.4Å; F281-F301 AromaticContact CE1-CG 3.82Å; F281-F301 HydrophobicContact CE1-CG 3.82Å; F281-F301 HydrophobicContact CE2-CB 4.36Å; F281-F301 HydrophobicContact CE2-CD2 4.15Å; F281-F301 AromaticContact CG-CD2 3.74Å; F281-F301 HydrophobicContact CG-CD2 3.74Å; F281-F301 HydrophobicContact CG-CE2 4.13Å; F281-F301 HydrophobicContact CZ-CB 3.63Å; F281-F301 AromaticContact CZ-CD2 3.88Å; F281-F301 HydrophobicContact CZ-CD2 3.88Å; F281-F301 HydrophobicContact CZ-CG 4.15Å; L297-F301 WeakPolarHBondContact O-CB 3.49Å; L297-F301 PolarHBondContact O-N 3.36Å; T298-F301 PolarHBondContact O-N 3.18Å; T299-F301 PolarHBondContact O-N 3.03Å; F301-A303 VanDerWaalsContact C-N 3.32Å; F301-A303 PolarHBondContact O-N 3.46Å; F301-L304 PolarHBondContact O-N 3.11Å; F301-L305 HydrophobicContact CD1-CD1 3.83Å; F301-L305 HydrophobicContact CD1-CG 4.38Å; F301-L305 HydrophobicContact CE1-CD1 3.74Å; F301-L305 HydrophobicContact CE1-CD2 4.39Å; F301-L305 HydrophobicContact CE1-CG 4.21Å; F301-L305 HydrophobicContact CZ-CD1 4.45Å; F301-L305 HydrophobicContact CZ-CD2 4.34Å; F301-L305 HydrophobicContact CZ-CG 4.46Å; F301-L305 VanDerWaalsContact O-CG 3.31Å; F301-L305 WeakPolarHBondContact O-CG 3.42Å; F301-L305 PolarHBondContact O-N 3.42Å; F301-A316 HydrophobicContact CE2-CB 4.37Å; F301-A316 WeakPolarHBondContact CZ-O 3.4Å; F301-K319 HydrophobicContact CE2-CB 4.05Å; F301-K319 HydrophobicContact CZ-CB 4.16Å; F301-V320 HydrophobicContact CE1-CG2 4.14Å; F301-V320 HydrophobicContact CZ-CG2 4.1Å; F301-F323 HydrophobicContact CB-CD2 4.38Å; F301-F323 HydrophobicContact CB-CE2 4.12Å; F301-F323 HydrophobicContact CB-CZ 4.28Å; F301-F323 HydrophobicContact CD1-CB 4.17Å; F301-F323 AromaticContact CD1-CD1 3.47Å; F301-F323 HydrophobicContact CD1-CD1 3.47Å; F301-F323 VanDerWaalsContact CD1-CD1 3.47Å; F301-F323 HydrophobicContact CD1-CD2 4.03Å; F301-F323 AromaticContact CD1-CE1 3.82Å; F301-F323 HydrophobicContact CD1-CE1 3.82Å; F301-F323 HydrophobicContact CD1-CE2 4.32Å; F301-F323 AromaticContact CD1-CG 3.58Å; F301-F323 HydrophobicContact CD1-CG 3.58Å; F301-F323 HydrophobicContact CD1-CZ 4.22Å; F301-F323 HydrophobicContact CD2-CD2 4.44Å; F301-F323 HydrophobicContact CD2-CG 4.49Å; F301-F323 HydrophobicContact CE1-CB 3.74Å; F301-F323 AromaticContact CE1-CD1 3.64Å; F301-F323 HydrophobicContact CE1-CD1 3.64Å; F301-F323 HydrophobicContact CE1-CD2 4.45Å; F301-F323 HydrophobicContact CE1-CE1 4.41Å; F301-F323 AromaticContact CE1-CG 3.66Å; F301-F323 HydrophobicContact CE1-CG 3.66Å; F301-F323 HydrophobicContact CE2-CB 4.34Å; F301-F323 HydrophobicContact CG-CD1 4.28Å; F301-F323 HydrophobicContact CG-CD2 4.03Å; F301-F323 HydrophobicContact CG-CE2 4.24Å; F301-F323 HydrophobicContact CG-CG 4.04Å; F301-F323 HydrophobicContact CG-CZ 4.48Å; F301-F323 HydrophobicContact CZ-CB 3.84Å; F301-F323 HydrophobicContact CZ-CG 4.17Å; F301-I340 HydrophobicContact CD1-CD1 3.89Å; F301-I340 HydrophobicContact CE1-CD1 4.45Å
302	V	98.3	Very high	96.7	Very high	36 Å²	36	37.8 Å²	37.8	22%	0.218	21%	0.212	C	C	.	.	H	α-helix	trans	-59.6	-42.2	172.5	167.4	0	0	0	0	111.5	T298 T299 V300 L305 K306 A339 I340	T298-V302 WeakPolarHBondContact O-CG2 3.22Å; T298-V302 PolarHBondContact O-N 2.91Å; T299-V302 PolarHBondContact O-N 3.31Å; V300-V302 VanDerWaalsContact C-N 3.32Å; V300-V302 PolarHBondContact O-N 3.27Å; V302-L305 PolarHBondContact O-N 2.68Å; V302-K306 WeakPolarHBondContact O-CG 3.31Å; V302-K306 PolarHBondContact O-N 2.97Å; V302-A339 HydrophobicContact CG2-CB 4.1Å; V302-I340 HydrophobicContact CG2-CD1 4.17Å
303	A	98.3	Very high	97	Very high	56 Å²	56	39 Å²	39	46%	0.463	22%	0.216	S	C	.	.	H	α-helix	trans	-64	-42.4	176.8	0	0	0	0	0	112.1	T299 V300 F301 K306 D307	T299-A303 PolarHBondContact O-N 3.12Å; V300-A303 WeakPolarHBondContact O-CB 3.35Å; V300-A303 PolarHBondContact O-N 3.11Å; V300-A303 VanDerWaalsContact O-N 3.08Å; F301-A303 VanDerWaalsContact C-N 3.32Å; F301-A303 PolarHBondContact O-N 3.46Å; A303-K306 CarbonylContact O-C 3.6Å; A303-K306 VanDerWaalsContact O-C 3.28Å; A303-K306 WeakPolarHBondContact O-CA 3.32Å; A303-K306 PolarHBondContact O-N 3.36Å; A303-K306 VanDerWaalsContact O-N 3.07Å; A303-D307 PolarHBondContact O-N 3.35Å
304	L	98.6	Very high	97.5	Very high	2 Å²	2	40 Å²	40	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-66.2	-38.1	177.6	-66.2	170.1	0	0	0	112.6	R274 V277 A278 F281 V300 F301 K306 D307 V312 A316	R274-L304 HydrophobicContact CB-CD2 4.13Å; V277-L304 HydrophobicContact CG1-CD1 4.12Å; A278-L304 HydrophobicContact CB-CD1 4.16Å; F281-L304 HydrophobicContact CD2-CD1 3.72Å; F281-L304 HydrophobicContact CE2-CD1 3.77Å; V300-L304 HydrophobicContact CG1-CD1 3.9Å; V300-L304 HydrophobicContact CG1-CG 4.27Å; V300-L304 WeakPolarHBondContact O-CG 3.47Å; V300-L304 PolarHBondContact O-N 3.37Å; F301-L304 PolarHBondContact O-N 3.11Å; L304-K306 PolarHBondContact O-N 3.37Å; L304-D307 WeakPolarHBondContact O-CB 3.47Å; L304-D307 PolarHBondContact O-N 2.99Å; L304-V312 HydrophobicContact CB-CG1 4.48Å; L304-V312 HydrophobicContact CD2-CG1 3.72Å; L304-A316 HydrophobicContact CB-CB 3.94Å
305	L	98.5	Very high	97.8	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-63.9	-22.9	172.6	-70	169.6	0	0	0	112.3	F301 V302 R313 A316 V320 I340 C343 L347	F301-L305 HydrophobicContact CD1-CD1 3.83Å; F301-L305 HydrophobicContact CD1-CG 4.38Å; F301-L305 HydrophobicContact CE1-CD1 3.74Å; F301-L305 HydrophobicContact CE1-CD2 4.39Å; F301-L305 HydrophobicContact CE1-CG 4.21Å; F301-L305 HydrophobicContact CZ-CD1 4.45Å; F301-L305 HydrophobicContact CZ-CD2 4.34Å; F301-L305 HydrophobicContact CZ-CG 4.46Å; F301-L305 VanDerWaalsContact O-CG 3.31Å; F301-L305 WeakPolarHBondContact O-CG 3.42Å; F301-L305 PolarHBondContact O-N 3.42Å; V302-L305 PolarHBondContact O-N 2.68Å; L305-R313 WeakPolarHBondContact O-CD 3.36Å; L305-A316 HydrophobicContact CD2-CB 3.75Å; L305-A316 HydrophobicContact CG-CB 4.16Å; L305-V320 HydrophobicContact CD1-CG2 4.49Å; L305-V320 HydrophobicContact CD2-CG2 3.68Å; L305-I340 HydrophobicContact CD1-CD1 4.46Å; L305-C343 HydrophobicContact CB-CB 4.16Å; L305-C343 HydrophobicContact CD1-CB 3.91Å; L305-L347 HydrophobicContact CB-CD1 4.22Å; L305-L347 HydrophobicContact CD2-CD1 3.64Å; L305-L347 HydrophobicContact CG-CD1 4.42Å; L305-L347 WeakPolarHBondContact O-CD2 3.31Å
306	K	98.1	Very high	98.1	Very high	96 Å²	96	37.8 Å²	37.8	42%	0.417	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	16.3	179.8	-65.3	-172.7	172	-143.5	0	113.2	V302 A303 L304 C343 E346	V302-K306 WeakPolarHBondContact O-CG 3.31Å; V302-K306 PolarHBondContact O-N 2.97Å; A303-K306 CarbonylContact O-C 3.6Å; A303-K306 VanDerWaalsContact O-C 3.28Å; A303-K306 WeakPolarHBondContact O-CA 3.32Å; A303-K306 PolarHBondContact O-N 3.36Å; A303-K306 VanDerWaalsContact O-N 3.07Å; L304-K306 PolarHBondContact O-N 3.37Å; K306-C343 VanDerWaalsContact CE-SG 3.51Å; K306-E346 VanDerWaalsContact CE-OE2 3.29Å; K306-E346 WeakPolarHBondContact CE-OE2 3.36Å; K306-E346 VanDerWaalsContact NZ-CD 3.28Å; K306-E346 IonicContact NZ-OE1 3.66Å; K306-E346 PolarHBondContact NZ-OE1 3.5Å; K306-E346 IonicContact NZ-OE2 2.79Å; K306-E346 PolarHBondContact NZ-OE2 3.38Å
307	D	98.5	Very high	98.2	Very high	17 Å²	17	33.6 Å²	33.6	9%	0.091	19%	0.19	C	C	.	.			trans	-59.6	149.1	-177.9	-159.9	-72.5	0	0	0	111.4	R274 A303 L304 E309 V312 R313	R274-D307 IonicContact CZ-OD1 2.72Å; R274-D307 IonicContact CZ-OD2 3.29Å; R274-D307 IonicContact NE-OD1 3Å; R274-D307 IonicContact NE-OD2 3Å; R274-D307 PolarHBondContact NE-OD2 2.89Å; R274-D307 IonicContact NH2-OD1 3.48Å; R274-D307 PolarHBondContact NH2-OD1 3.02Å; R274-D307 IonicContact NH2-OD2 2.71Å; R274-D307 PolarHBondContact NH2-OD2 3.37Å; A303-D307 PolarHBondContact O-N 3.35Å; L304-D307 WeakPolarHBondContact O-CB 3.47Å; L304-D307 PolarHBondContact O-N 2.99Å; D307-E309 VanDerWaalsContact C-N 3.27Å; D307-E309 PolarHBondContact O-N 3.32Å; D307-E309 PolarHBondContact OD1-N 3.02Å; D307-V312 HydrophobicContact CB-CB 3.74Å; D307-V312 HydrophobicContact CB-CG1 3.67Å; D307-V312 WeakPolarHBondContact OD2-CG1 3.49Å; D307-R313 HydrophobicContact CB-CG 3.97Å; D307-R313 WeakPolarHBondContact O-CD 3.49Å; D307-R313 WeakPolarHBondContact O-CG 3.2Å; D307-R313 PolarHBondContact O-NH1 2.69Å
308	V	97.7	Very high	98.2	Very high	120 Å²	120	35.3 Å²	35.3	73%	0.727	21%	0.205	S	C	*	.	S	Bend	trans	-66.2	-32.3	176.7	-62.1	0	0	0	0	111.8	R313	V308-R313 PolarHBondContact O-NH1 2.93Å
309	E	98.3	Very high	98.3	Very high	79 Å²	79	36.6 Å²	36.6	37%	0.369	21%	0.209	S	C	.	.	S	Bend	trans	-87.1	129.9	179.9	-62.5	-60.4	168.2	0	0	111.8	W271 D307 E311 V312 R313	W271-E309 HydrophobicContact CB-CB 4.11Å; W271-E309 HydrophobicContact CB-CG 3.53Å; W271-E309 HydrophobicContact CG-CG 3.94Å; D307-E309 VanDerWaalsContact C-N 3.27Å; D307-E309 PolarHBondContact O-N 3.32Å; D307-E309 PolarHBondContact OD1-N 3.02Å; E309-E311 VanDerWaalsContact C-N 3.32Å; E309-E311 PolarHBondContact O-N 2.86Å; E309-V312 HydrophobicContact CB-CG2 4.05Å; E309-V312 PolarHBondContact O-N 3.34Å; E309-R313 PolarHBondContact O-N 3.46Å
310	A	98.3	Very high	98.3	Very high	13 Å²	13	31.9 Å²	31.9	11%	0.107	18%	0.18	C	C	.	.	H	α-helix	trans	-67.7	-32.8	-175.3	0	0	0	0	0	112.7	V312 R313 S314 N352 V355	A310-V312 VanDerWaalsContact C-N 3.31Å; A310-V312 PolarHBondContact O-N 3.38Å; A310-R313 PolarHBondContact O-N 2.79Å; A310-S314 VanDerWaalsContact O-CB 3.27Å; A310-S314 WeakPolarHBondContact O-CB 3.41Å; A310-S314 PolarHBondContact O-N 3.16Å; A310-N352 HydrophobicContact CB-CB 3.76Å; A310-N352 WeakPolarHBondContact CB-ND2 3.42Å; A310-V355 HydrophobicContact CB-CG2 4.19Å; A310-V355 WeakPolarHBondContact O-CG2 3.42Å
311	E	98.4	Very high	98.1	Very high	92 Å²	92	34.4 Å²	34.4	43%	0.43	19%	0.189	S	C	.	.	H	α-helix	trans	-61.1	-40.4	175.9	-72.6	88.6	151	0	0	111.6	W271 Y275 E309 S314 A315	W271-E311 HydrophobicContact CE3-CB 4.16Å; W271-E311 HydrophobicContact CH2-CB 4.39Å; W271-E311 HydrophobicContact CH2-CG 4.31Å; W271-E311 HydrophobicContact CZ3-CB 3.7Å; W271-E311 HydrophobicContact CZ3-CG 4.1Å; Y275-E311 HydrophobicContact CD2-CB 4.16Å; Y275-E311 WeakPolarHBondContact CD2-O 3.34Å; Y275-E311 HydrophobicContact CE2-CB 4.47Å; E309-E311 VanDerWaalsContact C-N 3.32Å; E309-E311 PolarHBondContact O-N 2.86Å; E311-S314 PolarHBondContact O-N 3.43Å; E311-A315 WeakPolarHBondContact O-CB 3.4Å; E311-A315 PolarHBondContact O-N 3.27Å
312	V	98.6	Very high	97.9	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-68.4	-46.3	177.1	-176.8	0	0	0	0	110.1	W271 R274 A278 L304 D307 E309 A310 S314 A315 A316	W271-V312 HydrophobicContact CB-CG2 4.11Å; W271-V312 HydrophobicContact CE3-CG2 4.3Å; R274-V312 HydrophobicContact CB-CG1 4.25Å; R274-V312 HydrophobicContact CB-CG2 4.33Å; A278-V312 HydrophobicContact CB-CG1 4.44Å; L304-V312 HydrophobicContact CB-CG1 4.48Å; L304-V312 HydrophobicContact CD2-CG1 3.72Å; D307-V312 HydrophobicContact CB-CB 3.74Å; D307-V312 HydrophobicContact CB-CG1 3.67Å; D307-V312 WeakPolarHBondContact OD2-CG1 3.49Å; E309-V312 HydrophobicContact CB-CG2 4.05Å; E309-V312 PolarHBondContact O-N 3.34Å; A310-V312 VanDerWaalsContact C-N 3.31Å; A310-V312 PolarHBondContact O-N 3.38Å; V312-S314 VanDerWaalsContact C-N 3.3Å; V312-S314 PolarHBondContact O-N 3.02Å; V312-A315 PolarHBondContact O-N 2.83Å; V312-A316 WeakPolarHBondContact O-CB 3.31Å; V312-A316 PolarHBondContact O-N 3.09Å
313	R	98.6	Very high	97.9	Very high	30 Å²	30	35.7 Å²	35.7	11%	0.113	19%	0.193	C	C	.	.	H	α-helix	trans	-60.1	-40.2	175.5	-65	-159.4	-57	-75.2	1.5	112.1	L305 D307 V308 E309 A310 A316 A317 L347 D350 V355	L305-R313 WeakPolarHBondContact O-CD 3.36Å; D307-R313 HydrophobicContact CB-CG 3.97Å; D307-R313 WeakPolarHBondContact O-CD 3.49Å; D307-R313 WeakPolarHBondContact O-CG 3.2Å; D307-R313 PolarHBondContact O-NH1 2.69Å; V308-R313 PolarHBondContact O-NH1 2.93Å; E309-R313 PolarHBondContact O-N 3.46Å; A310-R313 PolarHBondContact O-N 2.79Å; R313-A316 PolarHBondContact O-N 3.25Å; R313-A317 WeakPolarHBondContact O-CB 3.49Å; R313-A317 PolarHBondContact O-N 3.22Å; R313-L347 HydrophobicContact CB-CD2 4.38Å; R313-D350 IonicContact CZ-OD1 3.63Å; R313-D350 IonicContact CZ-OD2 3.6Å; R313-D350 VanDerWaalsContact CZ-OD2 3.32Å; R313-D350 IonicContact NE-OD1 2.69Å; R313-D350 IonicContact NE-OD2 2.62Å; R313-D350 PolarHBondContact NE-OD2 3.05Å; R313-D350 IonicContact NH2-OD1 3.38Å; R313-D350 PolarHBondContact NH2-OD1 2.94Å; R313-D350 IonicContact NH2-OD2 3.54Å; R313-D350 PolarHBondContact NH2-OD2 3.29Å; R313-V355 HydrophobicContact CB-CG1 4.18Å; R313-V355 HydrophobicContact CB-CG2 3.9Å
314	S	98.5	Very high	97.7	Very high	27 Å²	27	33 Å²	33	19%	0.189	17%	0.17	C	C	.	.	H	α-helix	trans	-64.9	-44.5	178.6	-173.8	0	0	0	0	111.5	A310 E311 V312 A317 A318 H354 A358	A310-S314 VanDerWaalsContact O-CB 3.27Å; A310-S314 WeakPolarHBondContact O-CB 3.41Å; A310-S314 PolarHBondContact O-N 3.16Å; E311-S314 PolarHBondContact O-N 3.43Å; V312-S314 VanDerWaalsContact C-N 3.3Å; V312-S314 PolarHBondContact O-N 3.02Å; S314-A317 PolarHBondContact O-N 3.14Å; S314-A318 PolarHBondContact O-N 3.28Å; S314-A318 VanDerWaalsContact O-N 3.11Å; S314-H354 PolarHBondContact OG-O 3.06Å; S314-A358 WeakPolarHBondContact O-CB 3.39Å
315	A	98.5	Very high	97.5	Very high	12 Å²	12	36.3 Å²	36.3	10%	0.099	19%	0.186	C	C	.	.	H	α-helix	trans	-61.8	-46.9	174.9	0	0	0	0	0	111.2	Y275 A278 E311 V312 A317 A318 K319	Y275-A315 HydrophobicContact CD2-CB 3.93Å; Y275-A315 HydrophobicContact CE2-CB 3.76Å; A278-A315 HydrophobicContact CB-CB 3.81Å; E311-A315 WeakPolarHBondContact O-CB 3.4Å; E311-A315 PolarHBondContact O-N 3.27Å; V312-A315 PolarHBondContact O-N 2.83Å; A315-A317 PolarHBondContact O-N 3.05Å; A315-A318 PolarHBondContact O-N 3.36Å; A315-K319 WeakPolarHBondContact O-CG 3.34Å; A315-K319 PolarHBondContact O-N 3.42Å
316	A	98.6	Very high	97.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-63.2	-43.1	177.5	0	0	0	0	0	112.2	A278 F301 L304 L305 V312 R313 A318 K319 V320	A278-A316 HydrophobicContact CB-CB 4.29Å; F301-A316 HydrophobicContact CE2-CB 4.37Å; F301-A316 WeakPolarHBondContact CZ-O 3.4Å; L304-A316 HydrophobicContact CB-CB 3.94Å; L305-A316 HydrophobicContact CD2-CB 3.75Å; L305-A316 HydrophobicContact CG-CB 4.16Å; V312-A316 WeakPolarHBondContact O-CB 3.31Å; V312-A316 PolarHBondContact O-N 3.09Å; R313-A316 PolarHBondContact O-N 3.25Å; A316-A318 VanDerWaalsContact C-N 3.3Å; A316-A318 PolarHBondContact O-N 3.24Å; A316-K319 PolarHBondContact O-N 3.17Å; A316-V320 PolarHBondContact O-N 3.04Å
317	A	98.4	Very high	97.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-59	-40	178	0	0	0	0	0	112	R313 S314 A315 K319 V320 L347 A358 L359 V362	R313-A317 WeakPolarHBondContact O-CB 3.49Å; R313-A317 PolarHBondContact O-N 3.22Å; S314-A317 PolarHBondContact O-N 3.14Å; A315-A317 PolarHBondContact O-N 3.05Å; A317-K319 PolarHBondContact O-N 3.14Å; A317-V320 WeakPolarHBondContact O-CG2 3.33Å; A317-V320 PolarHBondContact O-N 3.3Å; A317-L347 HydrophobicContact CB-CD1 4.45Å; A317-A358 HydrophobicContact CB-CB 4.13Å; A317-L359 HydrophobicContact CB-CB 4.24Å; A317-V362 VanDerWaalsContact O-CG2 3.29Å; A317-V362 WeakPolarHBondContact O-CG2 3.49Å
318	A	97.8	Very high	96.8	Very high	37 Å²	37	38.8 Å²	38.8	31%	0.306	20%	0.197	S	C	.	.	H	α-helix	trans	-65.1	-20.9	175.5	0	0	0	0	0	113.4	S314 A315 A316 A358	S314-A318 PolarHBondContact O-N 3.28Å; S314-A318 VanDerWaalsContact O-N 3.11Å; A315-A318 PolarHBondContact O-N 3.36Å; A316-A318 VanDerWaalsContact C-N 3.3Å; A316-A318 PolarHBondContact O-N 3.24Å; A318-A358 HydrophobicContact CB-CB 4.27Å
319	K	97.6	Very high	96.6	Very high	39 Å²	39	41.3 Å²	41.3	17%	0.17	20%	0.201	C	C	.	.	H	α-helix	trans	-96.1	-3.8	-179.4	-62.3	-51.3	-173.3	-179.5	0	115	A278 D279 F301 A315 A316 A317 R321 E322 F323	A278-K319 WeakPolarHBondContact O-CG 3.46Å; D279-K319 WeakPolarHBondContact O-CE 3.22Å; F301-K319 HydrophobicContact CE2-CB 4.05Å; F301-K319 HydrophobicContact CZ-CB 4.16Å; A315-K319 WeakPolarHBondContact O-CG 3.34Å; A315-K319 PolarHBondContact O-N 3.42Å; A316-K319 PolarHBondContact O-N 3.17Å; A317-K319 PolarHBondContact O-N 3.14Å; K319-R321 PolarHBondContact O-N 2.95Å; K319-E322 WeakPolarHBondContact CD-OE2 3.37Å; K319-E322 IonicContact NZ-OE2 3.6Å; K319-E322 PolarHBondContact NZ-OE2 2.95Å; K319-E322 PolarHBondContact O-N 2.95Å; K319-F323 WeakPolarHBondContact O-CB 3.32Å; K319-F323 PolarHBondContact O-N 3.27Å
320	V	97.5	Very high	96.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-55.4	-47.1	-173.3	171.6	0	0	0	0	112.6	F301 L305 A316 A317 C324 I340 I344 I366	F301-V320 HydrophobicContact CE1-CG2 4.14Å; F301-V320 HydrophobicContact CZ-CG2 4.1Å; L305-V320 HydrophobicContact CD1-CG2 4.49Å; L305-V320 HydrophobicContact CD2-CG2 3.68Å; A316-V320 PolarHBondContact O-N 3.04Å; A317-V320 WeakPolarHBondContact O-CG2 3.33Å; A317-V320 PolarHBondContact O-N 3.3Å; V320-C324 WeakPolarHBondContact O-CB 3.32Å; V320-C324 PolarHBondContact O-N 3.08Å; V320-C324 VanDerWaalsContact O-N 3.13Å; V320-C324 PolarHBondContact O-SG 3.23Å; V320-I340 HydrophobicContact CG1-CG2 3.96Å; V320-I344 HydrophobicContact CG1-CD1 3.73Å; V320-I344 HydrophobicContact CG1-CG1 4.28Å; V320-I366 HydrophobicContact CG1-CD1 3.43Å; V320-I366 VanDerWaalsContact CG1-CD1 3.43Å; V320-I366 HydrophobicContact CG1-CG1 4.29Å
321	R	94.8	Very high	96.2	Very high	64 Å²	64	45.9 Å²	45.9	24%	0.242	23%	0.229	C	C	.	.	H	α-helix	trans	-58.7	-55.6	178.3	176.1	-170.4	174.6	171.2	-1.2	111	K319 F323 C324 E325 V362 D408	K319-R321 PolarHBondContact O-N 2.95Å; R321-F323 VanDerWaalsContact C-N 3.31Å; R321-F323 PolarHBondContact O-N 3.48Å; R321-C324 WeakPolarHBondContact O-CB 3.46Å; R321-C324 PolarHBondContact O-N 3.47Å; R321-C324 VanDerWaalsContact O-N 3.12Å; R321-E325 HydrophobicContact CG-CG 4.39Å; R321-E325 IonicContact CZ-OE1 3.06Å; R321-E325 IonicContact NE-OE1 3.14Å; R321-E325 PolarHBondContact NE-OE1 2.94Å; R321-E325 IonicContact NH2-OE1 2.73Å; R321-E325 PolarHBondContact NH2-OE1 2.9Å; R321-E325 WeakPolarHBondContact O-CG 3.38Å; R321-E325 PolarHBondContact O-N 3.47Å; R321-V362 HydrophobicContact CB-CB 4.07Å; R321-D408 IonicContact CZ-OD2 3.93Å; R321-D408 IonicContact NH1-OD2 3.24Å; R321-D408 PolarHBondContact NH1-OD2 2.93Å; R321-D408 IonicContact NH2-OD2 2.91Å; R321-D408 PolarHBondContact NH2-OD2 3.08Å
322	E	94.8	Very high	96	Very high	63 Å²	63	44.4 Å²	44.4	29%	0.294	22%	0.219	S	C	.	.	H	α-helix	trans	-58.6	-45.5	-177	-61.2	-176.9	104.5	0	0	110.5	N282 K319 C324 E325 Y326	N282-E322 HydrophobicContact CB-CB 4.12Å; N282-E322 PolarHBondContact ND2-OE1 3.38Å; N282-E322 PolarHBondContact ND2-OE2 3.45Å; K319-E322 WeakPolarHBondContact CD-OE2 3.37Å; K319-E322 IonicContact NZ-OE2 3.6Å; K319-E322 PolarHBondContact NZ-OE2 2.95Å; K319-E322 PolarHBondContact O-N 2.95Å; E322-C324 VanDerWaalsContact C-N 3.28Å; E322-C324 PolarHBondContact O-N 3.49Å; E322-E325 PolarHBondContact O-N 3.44Å; E322-E325 VanDerWaalsContact O-N 3.16Å; E322-Y326 VanDerWaalsContact O-CD2 3.31Å; E322-Y326 WeakPolarHBondContact O-CD2 3.17Å; E322-Y326 PolarHBondContact O-N 3.39Å; E322-Y326 VanDerWaalsContact O-N 3.12Å
323	F	96.8	Very high	95.8	Very high	1 Å²	1	48.9 Å²	48.9	0%	0.004	24%	0.24	C	C	.	.	H	α-helix	trans	-54.4	-45.6	176.8	172	-99.1	0	0	0	112.2	F281 Q285 T298 F301 K319 R321 Y326 L327 I340	F281-F323 AromaticContact CD1-CD2 3.93Å; F281-F323 HydrophobicContact CD1-CD2 3.93Å; F281-F323 AromaticContact CE1-CD2 3.55Å; F281-F323 HydrophobicContact CE1-CD2 3.55Å; F281-F323 AromaticContact CE1-CE2 3.78Å; F281-F323 HydrophobicContact CE1-CE2 3.78Å; Q285-F323 PolarHBondContact NE2-O 3.24Å; T298-F323 HydrophobicContact CG2-CZ 4.38Å; F301-F323 HydrophobicContact CB-CD2 4.38Å; F301-F323 HydrophobicContact CB-CE2 4.12Å; F301-F323 HydrophobicContact CB-CZ 4.28Å; F301-F323 HydrophobicContact CD1-CB 4.17Å; F301-F323 AromaticContact CD1-CD1 3.47Å; F301-F323 HydrophobicContact CD1-CD1 3.47Å; F301-F323 VanDerWaalsContact CD1-CD1 3.47Å; F301-F323 HydrophobicContact CD1-CD2 4.03Å; F301-F323 AromaticContact CD1-CE1 3.82Å; F301-F323 HydrophobicContact CD1-CE1 3.82Å; F301-F323 HydrophobicContact CD1-CE2 4.32Å; F301-F323 AromaticContact CD1-CG 3.58Å; F301-F323 HydrophobicContact CD1-CG 3.58Å; F301-F323 HydrophobicContact CD1-CZ 4.22Å; F301-F323 HydrophobicContact CD2-CD2 4.44Å; F301-F323 HydrophobicContact CD2-CG 4.49Å; F301-F323 HydrophobicContact CE1-CB 3.74Å; F301-F323 AromaticContact CE1-CD1 3.64Å; F301-F323 HydrophobicContact CE1-CD1 3.64Å; F301-F323 HydrophobicContact CE1-CD2 4.45Å; F301-F323 HydrophobicContact CE1-CE1 4.41Å; F301-F323 AromaticContact CE1-CG 3.66Å; F301-F323 HydrophobicContact CE1-CG 3.66Å; F301-F323 HydrophobicContact CE2-CB 4.34Å; F301-F323 HydrophobicContact CG-CD1 4.28Å; F301-F323 HydrophobicContact CG-CD2 4.03Å; F301-F323 HydrophobicContact CG-CE2 4.24Å; F301-F323 HydrophobicContact CG-CG 4.04Å; F301-F323 HydrophobicContact CG-CZ 4.48Å; F301-F323 HydrophobicContact CZ-CB 3.84Å; F301-F323 HydrophobicContact CZ-CG 4.17Å; K319-F323 WeakPolarHBondContact O-CB 3.32Å; K319-F323 PolarHBondContact O-N 3.27Å; R321-F323 VanDerWaalsContact C-N 3.31Å; R321-F323 PolarHBondContact O-N 3.48Å; F323-Y326 PolarHBondContact O-N 3.22Å; F323-L327 HydrophobicContact CE1-CD1 3.98Å; F323-L327 HydrophobicContact CE1-CD2 4.47Å; F323-L327 HydrophobicContact CE1-CG 4.41Å; F323-L327 HydrophobicContact CZ-CD1 4.41Å; F323-L327 HydrophobicContact CZ-CD2 4.09Å; F323-L327 HydrophobicContact CZ-CG 4.48Å; F323-I340 HydrophobicContact CD1-CD1 4.13Å; F323-I340 HydrophobicContact CD1-CG1 4.3Å; F323-I340 HydrophobicContact CE1-CD1 3.64Å; F323-I340 HydrophobicContact CE1-CG1 3.9Å
324	C	95.6	Very high	95.7	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-68.1	-37.4	-179.5	-65.6	0	0	0	0	112.5	V320 R321 E322 L327 R332 I336 L369	V320-C324 WeakPolarHBondContact O-CB 3.32Å; V320-C324 PolarHBondContact O-N 3.08Å; V320-C324 VanDerWaalsContact O-N 3.13Å; V320-C324 PolarHBondContact O-SG 3.23Å; R321-C324 WeakPolarHBondContact O-CB 3.46Å; R321-C324 PolarHBondContact O-N 3.47Å; R321-C324 VanDerWaalsContact O-N 3.12Å; E322-C324 VanDerWaalsContact C-N 3.28Å; E322-C324 PolarHBondContact O-N 3.49Å; C324-L327 PolarHBondContact O-N 3.04Å; C324-R332 WeakPolarHBondContact O-CD 3.37Å; C324-R332 WeakPolarHBondContact O-CG 3.32Å; C324-R332 PolarHBondContact O-NE 3.34Å; C324-I336 HydrophobicContact CB-CD1 3.75Å; C324-I336 HydrophobicContact CB-CG1 3.99Å; C324-L369 HydrophobicContact CB-CD1 3.54Å
325	E	93.3	Very high	95.6	Very high	71 Å²	71	51.8 Å²	51.8	33%	0.332	25%	0.253	S	S	.	.	H	α-helix	trans	-64.8	-37.8	177.8	-72.6	177.6	168.3	0	0	112.1	R321 E322 L327 R332 L369	R321-E325 HydrophobicContact CG-CG 4.39Å; R321-E325 IonicContact CZ-OE1 3.06Å; R321-E325 IonicContact NE-OE1 3.14Å; R321-E325 PolarHBondContact NE-OE1 2.94Å; R321-E325 IonicContact NH2-OE1 2.73Å; R321-E325 PolarHBondContact NH2-OE1 2.9Å; R321-E325 WeakPolarHBondContact O-CG 3.38Å; R321-E325 PolarHBondContact O-N 3.47Å; E322-E325 PolarHBondContact O-N 3.44Å; E322-E325 VanDerWaalsContact O-N 3.16Å; E325-L327 VanDerWaalsContact C-N 3.32Å; E325-L327 PolarHBondContact O-N 2.94Å; E325-R332 PolarHBondContact O-NH2 3.46Å; E325-L369 HydrophobicContact CG-CD1 3.78Å; E325-L369 HydrophobicContact CG-CD2 4.16Å
326	Y	93.3	Very high	95.6	Very high	126 Å²	126	51.2 Å²	51.2	49%	0.494	25%	0.248	S	C	.	.	H	α-helix	trans	-75.4	-13.3	179.5	-86.3	-79.2	0	0	0	114.5	Q285 E322 F323	Q285-Y326 VanDerWaalsContact CD-CB 3.41Å; E322-Y326 VanDerWaalsContact O-CD2 3.31Å; E322-Y326 WeakPolarHBondContact O-CD2 3.17Å; E322-Y326 PolarHBondContact O-N 3.39Å; E322-Y326 VanDerWaalsContact O-N 3.12Å; F323-Y326 PolarHBondContact O-N 3.22Å
327	L	94.6	Very high	95.5	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.005	26%	0.26	C	S	.	.	S	Bend	trans	-66	139.3	175.5	-68.3	170.3	0	0	0	110.9	F323 C324 E325 Q329 R332 I335 I336	F323-L327 HydrophobicContact CE1-CD1 3.98Å; F323-L327 HydrophobicContact CE1-CD2 4.47Å; F323-L327 HydrophobicContact CE1-CG 4.41Å; F323-L327 HydrophobicContact CZ-CD1 4.41Å; F323-L327 HydrophobicContact CZ-CD2 4.09Å; F323-L327 HydrophobicContact CZ-CG 4.48Å; C324-L327 PolarHBondContact O-N 3.04Å; E325-L327 VanDerWaalsContact C-N 3.32Å; E325-L327 PolarHBondContact O-N 2.94Å; L327-Q329 PolarHBondContact O-N 3.11Å; L327-R332 HydrophobicContact CB-CB 4.01Å; L327-R332 HydrophobicContact CB-CG 4.09Å; L327-R332 PolarHBondContact O-NE 3.19Å; L327-R332 PolarHBondContact O-NH2 2.93Å; L327-I335 HydrophobicContact CD1-CB 3.95Å; L327-I335 HydrophobicContact CD1-CD1 4.46Å; L327-I335 HydrophobicContact CD1-CG2 3.63Å; L327-I335 HydrophobicContact CD2-CD1 4.03Å; L327-I335 HydrophobicContact CD2-CG2 4.48Å; L327-I336 HydrophobicContact CD1-CG1 4.38Å
328	P	93.5	Very high	95.4	Very high	39 Å²	39	59.8 Å²	59.8	25%	0.253	29%	0.289	S	S	.	.			trans	-54.9	135.6	173	-23.8	33	0	0	0	111.8	A290 C294 S330 R331 R332	A290-P328 HydrophobicContact CB-CG 3.76Å; C294-P328 WeakPolarHBondContact SG-CD 3.45Å; P328-S330 PolarHBondContact O-N 3.22Å; P328-R331 PolarHBondContact O-N 2.97Å; P328-R332 WeakPolarHBondContact O-CB 3.1Å; P328-R332 PolarHBondContact O-N 3.44Å
329	Q	92.4	Very high	95.3	Very high	174 Å²	174	59.3 Å²	59.3	81%	0.813	29%	0.285	S	S	*	.	H	α-helix	trans	-52.9	-34.4	-175.7	-172.2	176.6	5.4	0	0	113.3	L327 R331	L327-Q329 PolarHBondContact O-N 3.11Å; Q329-R331 VanDerWaalsContact C-N 3.32Å; Q329-R331 PolarHBondContact O-N 2.98Å
330	S	94	Very high	95.4	Very high	110 Å²	110	57.5 Å²	57.5	77%	0.769	28%	0.277	S	S	*	.	H	α-helix	trans	-66.3	-26.3	-179.8	56	0	0	0	0	114.9	P328	P328-S330 PolarHBondContact O-N 3.22Å
331	R	94.1	Very high	95.3	Very high	77 Å²	77	57.6 Å²	57.6	29%	0.291	28%	0.278	S	S	.	.	H	α-helix	trans	-117.8	-11.2	-177.9	-64.9	179.3	67.6	177.9	-0.9	113.2	E291 C294 P328 Q329 Q334 I335	E291-R331 IonicContact OE1-NH1 3.36Å; E291-R331 PolarHBondContact OE1-NH1 3.05Å; E291-R331 IonicContact OE2-NH1 3.42Å; E291-R331 PolarHBondContact OE2-NH1 2.91Å; E291-R331 VanDerWaalsContact OE2-NH1 3.09Å; C294-R331 VanDerWaalsContact CB-CZ 3.42Å; P328-R331 PolarHBondContact O-N 2.97Å; Q329-R331 VanDerWaalsContact C-N 3.32Å; Q329-R331 PolarHBondContact O-N 2.98Å; R331-Q334 PolarHBondContact O-N 2.93Å; R331-I335 HydrophobicContact CB-CD1 3.88Å; R331-I335 HydrophobicContact CB-CG1 4.46Å; R331-I335 WeakPolarHBondContact O-CG1 3.28Å; R331-I335 PolarHBondContact O-N 3.36Å
332	R	94.9	Very high	95.4	Very high	62 Å²	62	57 Å²	57	23%	0.234	28%	0.282	C	S	.	.	H	α-helix	trans	-53.7	-59.9	-172.3	-179.8	-178.3	-56.8	168.2	-2.4	112.4	C324 E325 L327 P328 Q334 I335 I336	C324-R332 WeakPolarHBondContact O-CD 3.37Å; C324-R332 WeakPolarHBondContact O-CG 3.32Å; C324-R332 PolarHBondContact O-NE 3.34Å; E325-R332 PolarHBondContact O-NH2 3.46Å; L327-R332 HydrophobicContact CB-CB 4.01Å; L327-R332 HydrophobicContact CB-CG 4.09Å; L327-R332 PolarHBondContact O-NE 3.19Å; L327-R332 PolarHBondContact O-NH2 2.93Å; P328-R332 WeakPolarHBondContact O-CB 3.1Å; P328-R332 PolarHBondContact O-N 3.44Å; R332-Q334 VanDerWaalsContact C-N 3.35Å; R332-Q334 PolarHBondContact O-N 2.82Å; R332-I335 PolarHBondContact O-N 3.18Å; R332-I336 HydrophobicContact CG-CD1 3.6Å; R332-I336 HydrophobicContact CG-CG1 4.45Å; R332-I336 WeakPolarHBondContact O-CG1 3.11Å; R332-I336 PolarHBondContact O-N 3.23Å
333	E	94.6	Very high	95.6	Very high	94 Å²	94	54.2 Å²	54.2	44%	0.439	27%	0.269	S	S	.	.	H	α-helix	trans	-59.2	-47.3	-176.5	-174.2	-178.3	162.9	0	0	111.2	I335 I336 L337 N374	E333-I335 PolarHBondContact O-N 3.41Å; E333-I336 PolarHBondContact O-N 3.1Å; E333-L337 HydrophobicContact CG-CD1 3.92Å; E333-L337 HydrophobicContact CG-CG 4.26Å; E333-L337 WeakPolarHBondContact O-CB 3.35Å; E333-L337 VanDerWaalsContact O-CG 3.28Å; E333-L337 WeakPolarHBondContact O-CG 3.28Å; E333-L337 PolarHBondContact O-N 3.49Å; E333-N374 PolarHBondContact OE1-ND2 3.22Å
334	Q	96.2	Very high	95.6	Very high	104 Å²	104	54.1 Å²	54.1	49%	0.486	27%	0.269	S	S	.	.	H	α-helix	trans	-57.1	-49.2	178.9	-175.8	-173.5	-6.9	0	0	112.2	R331 R332 L337 Q338	R331-Q334 PolarHBondContact O-N 2.93Å; R332-Q334 VanDerWaalsContact C-N 3.35Å; R332-Q334 PolarHBondContact O-N 2.82Å; Q334-L337 PolarHBondContact O-N 3.23Å; Q334-Q338 HydrophobicContact CG-CG 4.38Å; Q334-Q338 VanDerWaalsContact O-CB 3.3Å; Q334-Q338 WeakPolarHBondContact O-CB 3.49Å; Q334-Q338 WeakPolarHBondContact O-CG 3.27Å; Q334-Q338 PolarHBondContact O-N 3.09Å
335	I	96.9	Very high	95.7	Very high	14 Å²	14	58.8 Å²	58.8	7%	0.072	29%	0.289	C	S	.	.	H	α-helix	trans	-64.2	-42.7	-179.8	-69.7	169.7	0	0	0	110.6	C294 T298 L327 R331 R332 E333 L337 A339 I340	C294-I335 HydrophobicContact CB-CD1 3.88Å; T298-I335 HydrophobicContact CG2-CG2 3.67Å; L327-I335 HydrophobicContact CD1-CB 3.95Å; L327-I335 HydrophobicContact CD1-CD1 4.46Å; L327-I335 HydrophobicContact CD1-CG2 3.63Å; L327-I335 HydrophobicContact CD2-CD1 4.03Å; L327-I335 HydrophobicContact CD2-CG2 4.48Å; R331-I335 HydrophobicContact CB-CD1 3.88Å; R331-I335 HydrophobicContact CB-CG1 4.46Å; R331-I335 WeakPolarHBondContact O-CG1 3.28Å; R331-I335 PolarHBondContact O-N 3.36Å; R332-I335 PolarHBondContact O-N 3.18Å; E333-I335 PolarHBondContact O-N 3.41Å; I335-L337 PolarHBondContact O-N 3.26Å; I335-A339 HydrophobicContact CG2-CB 4.43Å; I335-A339 WeakPolarHBondContact O-CB 3.25Å; I335-A339 PolarHBondContact O-N 2.9Å; I335-I340 PolarHBondContact O-N 3.32Å
336	I	97.2	Very high	95.9	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.297	C	S	.	.	I	π-helix	trans	-59.8	-49.5	177.8	-66.1	168	0	0	0	110.2	C324 L327 R332 E333 I340 L341 I366 L369 V370	C324-I336 HydrophobicContact CB-CD1 3.75Å; C324-I336 HydrophobicContact CB-CG1 3.99Å; L327-I336 HydrophobicContact CD1-CG1 4.38Å; R332-I336 HydrophobicContact CG-CD1 3.6Å; R332-I336 HydrophobicContact CG-CG1 4.45Å; R332-I336 WeakPolarHBondContact O-CG1 3.11Å; R332-I336 PolarHBondContact O-N 3.23Å; E333-I336 PolarHBondContact O-N 3.1Å; I336-I340 PolarHBondContact O-N 3.36Å; I336-L341 HydrophobicContact CG2-CG 4.25Å; I336-L341 WeakPolarHBondContact O-CG 3.36Å; I336-L341 PolarHBondContact O-N 3.12Å; I336-I366 HydrophobicContact CD1-CG2 4.49Å; I336-I366 HydrophobicContact CG2-CG2 3.88Å; I336-L369 HydrophobicContact CD1-CB 3.89Å; I336-L369 HydrophobicContact CD1-CD1 4.32Å; I336-V370 HydrophobicContact CB-CG1 4.06Å; I336-V370 HydrophobicContact CD1-CG1 4.1Å; I336-V370 HydrophobicContact CG2-CG1 3.45Å; I336-V370 VanDerWaalsContact CG2-CG1 3.45Å
337	L	96.6	Very high	96.1	Very high	47 Å²	47	54.7 Å²	54.7	25%	0.246	28%	0.275	C	S	.	.	I	π-helix	trans	-67	-41.3	-177	-65.4	-179.2	0	0	0	112.8	E333 Q334 I335 L341 V370 N374	E333-L337 HydrophobicContact CG-CD1 3.92Å; E333-L337 HydrophobicContact CG-CG 4.26Å; E333-L337 WeakPolarHBondContact O-CB 3.35Å; E333-L337 VanDerWaalsContact O-CG 3.28Å; E333-L337 WeakPolarHBondContact O-CG 3.28Å; E333-L337 PolarHBondContact O-N 3.49Å; Q334-L337 PolarHBondContact O-N 3.23Å; I335-L337 PolarHBondContact O-N 3.26Å; L337-L341 HydrophobicContact CD2-CD1 3.41Å; L337-L341 VanDerWaalsContact CD2-CD1 3.41Å; L337-L341 HydrophobicContact CD2-CG 4.43Å; L337-V370 HydrophobicContact CD2-CG1 4.45Å; L337-N374 HydrophobicContact CD2-CB 4.13Å
338	Q	96.7	Very high	96.2	Very high	133 Å²	133	54.8 Å²	54.8	62%	0.621	28%	0.276	S	S	*	.	I	π-helix	trans	-89	-34.9	-171.4	-66.4	-179.6	-7.5	0	0	113.8	Q334	Q334-Q338 HydrophobicContact CG-CG 4.38Å; Q334-Q338 VanDerWaalsContact O-CB 3.3Å; Q334-Q338 WeakPolarHBondContact O-CB 3.49Å; Q334-Q338 WeakPolarHBondContact O-CG 3.27Å; Q334-Q338 PolarHBondContact O-N 3.09Å
339	A	97	Very high	96.3	Very high	27 Å²	27	58.5 Å²	58.5	22%	0.223	29%	0.293	C	S	.	.	I	π-helix	trans	-107.7	-44.4	-174.2	0	0	0	0	0	112.7	T298 V302 I335 C343	T298-A339 HydrophobicContact CG2-CB 4.07Å; V302-A339 HydrophobicContact CG2-CB 4.1Å; I335-A339 HydrophobicContact CG2-CB 4.43Å; I335-A339 WeakPolarHBondContact O-CB 3.25Å; I335-A339 PolarHBondContact O-N 2.9Å; A339-C343 PolarHBondContact O-SG 3.03Å
340	I	97.8	Very high	96.6	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.259	C	S	.	.	I	π-helix	trans	-88.2	-46.8	-169.1	-54.5	-52.5	0	0	0	112.5	F301 V302 L305 V320 F323 I335 I336 C343 I344	F301-I340 HydrophobicContact CD1-CD1 3.89Å; F301-I340 HydrophobicContact CE1-CD1 4.45Å; V302-I340 HydrophobicContact CG2-CD1 4.17Å; L305-I340 HydrophobicContact CD1-CD1 4.46Å; V320-I340 HydrophobicContact CG1-CG2 3.96Å; F323-I340 HydrophobicContact CD1-CD1 4.13Å; F323-I340 HydrophobicContact CD1-CG1 4.3Å; F323-I340 HydrophobicContact CE1-CD1 3.64Å; F323-I340 HydrophobicContact CE1-CG1 3.9Å; I335-I340 PolarHBondContact O-N 3.32Å; I336-I340 PolarHBondContact O-N 3.36Å; I340-C343 WeakPolarHBondContact O-CB 3.39Å; I340-C343 PolarHBondContact O-N 3.37Å; I340-I344 HydrophobicContact CG2-CD1 3.83Å; I340-I344 HydrophobicContact CG2-CG1 4.15Å; I340-I344 WeakPolarHBondContact O-CG1 3.41Å; I340-I344 PolarHBondContact O-N 2.95Å
341	L	96.5	Very high	96.7	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.016	26%	0.262	C	S	.	.	H	α-helix	trans	-56.3	-41.4	179.8	-78.5	-170.4	0	0	0	113.8	I336 L337 C343 I344 K345 H378 L379 M382	I336-L341 HydrophobicContact CG2-CG 4.25Å; I336-L341 WeakPolarHBondContact O-CG 3.36Å; I336-L341 PolarHBondContact O-N 3.12Å; L337-L341 HydrophobicContact CD2-CD1 3.41Å; L337-L341 VanDerWaalsContact CD2-CD1 3.41Å; L337-L341 HydrophobicContact CD2-CG 4.43Å; L341-C343 VanDerWaalsContact C-N 3.28Å; L341-C343 PolarHBondContact O-N 3.23Å; L341-I344 HydrophobicContact CD2-CD1 4.27Å; L341-I344 PolarHBondContact O-N 3.42Å; L341-K345 WeakPolarHBondContact O-CG 3.14Å; L341-K345 PolarHBondContact O-N 3.34Å; L341-H378 HydrophobicContact CD1-CB 3.78Å; L341-L379 HydrophobicContact CD2-CD2 3.62Å; L341-M382 HydrophobicContact CD2-CE 3.9Å
342	P	97.2	Very high	96.9	Very high	52 Å²	52	50 Å²	50	34%	0.338	26%	0.26	S	S	.	.	H	α-helix	trans	-57.8	-40.6	173.9	-26.5	36.6	0	0	0	112.9	K345 E346	P342-K345 PolarHBondContact O-N 3.48Å; P342-E346 PolarHBondContact O-N 3.24Å
343	C	97.9	Very high	97	Very high	3 Å²	3	51.4 Å²	51.4	2%	0.02	27%	0.269	C	S	.	.	H	α-helix	trans	-66.7	-42.8	176.6	-56.4	0	0	0	0	111.5	L305 K306 A339 I340 L341 K345 E346 L347	L305-C343 HydrophobicContact CB-CB 4.16Å; L305-C343 HydrophobicContact CD1-CB 3.91Å; K306-C343 VanDerWaalsContact CE-SG 3.51Å; A339-C343 PolarHBondContact O-SG 3.03Å; I340-C343 WeakPolarHBondContact O-CB 3.39Å; I340-C343 PolarHBondContact O-N 3.37Å; L341-C343 VanDerWaalsContact C-N 3.28Å; L341-C343 PolarHBondContact O-N 3.23Å; C343-K345 VanDerWaalsContact C-N 3.29Å; C343-K345 PolarHBondContact O-N 3.39Å; C343-E346 WeakPolarHBondContact O-CB 3.44Å; C343-E346 PolarHBondContact O-N 3.42Å; C343-E346 VanDerWaalsContact O-N 3.16Å; C343-L347 WeakPolarHBondContact O-CG 3.44Å; C343-L347 PolarHBondContact O-N 2.97Å
344	I	97.6	Very high	97.1	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-59.5	-41.4	176.3	-65.1	174.8	0	0	0	110.9	V320 I340 L341 E346 L347 V348 L359 I363 I366 M382	V320-I344 HydrophobicContact CG1-CD1 3.73Å; V320-I344 HydrophobicContact CG1-CG1 4.28Å; I340-I344 HydrophobicContact CG2-CD1 3.83Å; I340-I344 HydrophobicContact CG2-CG1 4.15Å; I340-I344 WeakPolarHBondContact O-CG1 3.41Å; I340-I344 PolarHBondContact O-N 2.95Å; L341-I344 HydrophobicContact CD2-CD1 4.27Å; L341-I344 PolarHBondContact O-N 3.42Å; I344-E346 VanDerWaalsContact C-N 3.27Å; I344-E346 PolarHBondContact O-N 2.97Å; I344-L347 PolarHBondContact O-N 3.33Å; I344-V348 HydrophobicContact CG2-CG2 4.29Å; I344-V348 WeakPolarHBondContact O-CG2 3.42Å; I344-V348 PolarHBondContact O-N 3.16Å; I344-L359 HydrophobicContact CG1-CD1 4.39Å; I344-L359 HydrophobicContact CG2-CD1 4.12Å; I344-L359 HydrophobicContact CG2-CD2 4Å; I344-I363 HydrophobicContact CG2-CD1 3.76Å; I344-I363 HydrophobicContact CG2-CG1 4.25Å; I344-I366 HydrophobicContact CD1-CD1 3.41Å; I344-I366 VanDerWaalsContact CD1-CD1 3.41Å; I344-M382 HydrophobicContact CB-CE 4.4Å; I344-M382 HydrophobicContact CB-SD 4.26Å; I344-M382 HydrophobicContact CG2-CE 3.7Å; I344-M382 HydrophobicContact CG2-SD 3.57Å; I344-M382 VanDerWaalsContact CG2-SD 3.57Å
345	K	96.9	Very high	97.2	Very high	98 Å²	98	46.8 Å²	46.8	43%	0.426	25%	0.247	S	C	.	.	H	α-helix	trans	-59.5	-37.6	177.3	-73.7	175.1	-177.9	177.6	0	112.7	L341 P342 C343 N349 M382	L341-K345 WeakPolarHBondContact O-CG 3.14Å; L341-K345 PolarHBondContact O-N 3.34Å; P342-K345 PolarHBondContact O-N 3.48Å; C343-K345 VanDerWaalsContact C-N 3.29Å; C343-K345 PolarHBondContact O-N 3.39Å; K345-N349 PolarHBondContact O-ND2 2.95Å; K345-M382 HydrophobicContact CB-SD 4.18Å; K345-M382 HydrophobicContact CG-CG 4.34Å; K345-M382 HydrophobicContact CG-SD 3.41Å; K345-M382 WeakPolarHBondContact CG-SD 3.41Å
346	E	97.1	Very high	97.3	Very high	106 Å²	106	47.4 Å²	47.4	50%	0.495	25%	0.25	S	C	.	.	H	α-helix	trans	-68.8	-48.3	173.8	-68.2	172.2	-150	0	0	110.6	K306 P342 C343 I344 V348 N349 D350	K306-E346 VanDerWaalsContact CE-OE2 3.29Å; K306-E346 WeakPolarHBondContact CE-OE2 3.36Å; K306-E346 VanDerWaalsContact NZ-CD 3.28Å; K306-E346 IonicContact NZ-OE1 3.66Å; K306-E346 PolarHBondContact NZ-OE1 3.5Å; K306-E346 IonicContact NZ-OE2 2.79Å; K306-E346 PolarHBondContact NZ-OE2 3.38Å; P342-E346 PolarHBondContact O-N 3.24Å; C343-E346 WeakPolarHBondContact O-CB 3.44Å; C343-E346 PolarHBondContact O-N 3.42Å; C343-E346 VanDerWaalsContact O-N 3.16Å; I344-E346 VanDerWaalsContact C-N 3.27Å; I344-E346 PolarHBondContact O-N 2.97Å; E346-V348 VanDerWaalsContact C-N 3.31Å; E346-V348 PolarHBondContact O-N 3.24Å; E346-N349 CarbonylContact O-C 3.35Å; E346-N349 PolarHBondContact O-N 3Å; E346-D350 PolarHBondContact O-N 2.85Å
347	L	97.8	Very high	97.3	Very high	4 Å²	4	48 Å²	48	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-63.9	-29.4	-178.1	-69.8	170.1	0	0	0	114.5	L305 R313 A317 C343 I344 N349 D350 V355 L359	L305-L347 HydrophobicContact CB-CD1 4.22Å; L305-L347 HydrophobicContact CD2-CD1 3.64Å; L305-L347 HydrophobicContact CG-CD1 4.42Å; L305-L347 WeakPolarHBondContact O-CD2 3.31Å; R313-L347 HydrophobicContact CB-CD2 4.38Å; A317-L347 HydrophobicContact CB-CD1 4.45Å; C343-L347 WeakPolarHBondContact O-CG 3.44Å; C343-L347 PolarHBondContact O-N 2.97Å; I344-L347 PolarHBondContact O-N 3.33Å; L347-N349 PolarHBondContact O-N 3.47Å; L347-D350 WeakPolarHBondContact O-CB 3.45Å; L347-D350 PolarHBondContact O-N 3.32Å; L347-D350 VanDerWaalsContact O-N 3.12Å; L347-V355 HydrophobicContact CD2-CG1 3.39Å; L347-L359 HydrophobicContact CB-CD2 3.72Å
348	V	97.4	Very high	97.3	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.024	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-30.6	173.1	166.2	0	0	0	0	111.6	I344 E346 L359 I363 M382 T385 L386	I344-V348 HydrophobicContact CG2-CG2 4.29Å; I344-V348 WeakPolarHBondContact O-CG2 3.42Å; I344-V348 PolarHBondContact O-N 3.16Å; E346-V348 VanDerWaalsContact C-N 3.31Å; E346-V348 PolarHBondContact O-N 3.24Å; V348-L359 HydrophobicContact CG2-CD2 3.85Å; V348-I363 HydrophobicContact CG2-CD1 4.37Å; V348-M382 HydrophobicContact CG2-CB 3.8Å; V348-M382 HydrophobicContact CG2-CG 4.05Å; V348-M382 HydrophobicContact CG2-SD 4.08Å; V348-T385 HydrophobicContact CG1-CG2 3.58Å; V348-L386 HydrophobicContact CB-CD2 4.44Å; V348-L386 HydrophobicContact CG1-CD2 4.1Å; V348-L386 HydrophobicContact CG1-CG 4.05Å; V348-L386 HydrophobicContact CG2-CD1 4.15Å; V348-L386 HydrophobicContact CG2-CG 4.26Å
349	N	96.5	Very high	97.3	Very high	116 Å²	116	40 Å²	40	62%	0.62	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108	20.8	-179.8	-57.3	-71.9	0	0	0	112.1	K345 E346 L347	K345-N349 PolarHBondContact O-ND2 2.95Å; E346-N349 CarbonylContact O-C 3.35Å; E346-N349 PolarHBondContact O-N 3Å; L347-N349 PolarHBondContact O-N 3.47Å
350	D	97.7	Very high	97.2	Very high	20 Å²	20	38.7 Å²	38.7	11%	0.107	21%	0.206	C	C	.	.			trans	-60.9	140.2	179.3	-159.4	-67.8	0	0	0	110.8	R313 E346 L347 N352 V355 K356	R313-D350 IonicContact CZ-OD1 3.63Å; R313-D350 IonicContact CZ-OD2 3.6Å; R313-D350 VanDerWaalsContact CZ-OD2 3.32Å; R313-D350 IonicContact NE-OD1 2.69Å; R313-D350 IonicContact NE-OD2 2.62Å; R313-D350 PolarHBondContact NE-OD2 3.05Å; R313-D350 IonicContact NH2-OD1 3.38Å; R313-D350 PolarHBondContact NH2-OD1 2.94Å; R313-D350 IonicContact NH2-OD2 3.54Å; R313-D350 PolarHBondContact NH2-OD2 3.29Å; E346-D350 PolarHBondContact O-N 2.85Å; L347-D350 WeakPolarHBondContact O-CB 3.45Å; L347-D350 PolarHBondContact O-N 3.32Å; L347-D350 VanDerWaalsContact O-N 3.12Å; D350-N352 PolarHBondContact O-N 3.5Å; D350-N352 WeakPolarHBondContact OD1-CB 3.24Å; D350-N352 PolarHBondContact OD1-N 3.33Å; D350-V355 HydrophobicContact CB-CB 4.02Å; D350-V355 HydrophobicContact CB-CG1 3.85Å; D350-K356 HydrophobicContact CB-CG 4.12Å; D350-K356 VanDerWaalsContact O-CD 3.28Å; D350-K356 WeakPolarHBondContact O-CD 3.47Å; D350-K356 WeakPolarHBondContact O-CE 2.97Å
351	S	96.8	Very high	97	Very high	118 Å²	118	40.3 Å²	40.3	83%	0.825	22%	0.217	S	C	*	.	S	Bend	trans	-67.9	-25	178.2	58.3	0	0	0	0	112.2
352	N	97.4	Very high	96.8	Very high	46 Å²	46	41.4 Å²	41.4	25%	0.246	22%	0.224	C	C	.	.	S	Bend	trans	-89.4	121	178.8	-167.2	-55.8	0	0	0	111.3	A310 D350 H354 V355 K356	A310-N352 HydrophobicContact CB-CB 3.76Å; A310-N352 WeakPolarHBondContact CB-ND2 3.42Å; D350-N352 PolarHBondContact O-N 3.5Å; D350-N352 WeakPolarHBondContact OD1-CB 3.24Å; D350-N352 PolarHBondContact OD1-N 3.33Å; N352-H354 VanDerWaalsContact C-N 3.27Å; N352-H354 PolarHBondContact O-N 2.93Å; N352-H354 VanDerWaalsContact OD1-CB 3.31Å; N352-H354 WeakPolarHBondContact OD1-CB 3.47Å; N352-H354 PolarHBondContact OD1-CD2 3.46Å; N352-H354 PolarHBondContact OD1-N 3.41Å; N352-V355 HydrophobicContact CB-CG2 3.96Å; N352-V355 PolarHBondContact O-N 2.91Å; N352-K356 PolarHBondContact O-N 3.33Å
353	Q	97	Very high	96.5	Very high	91 Å²	91	38.9 Å²	38.9	43%	0.425	21%	0.208	S	C	.	.	H	α-helix	trans	-59.5	-33.4	179.2	66.8	-176.7	-14	0	0	113.7	V355 K356 T357 T391	Q353-V355 VanDerWaalsContact C-N 3.33Å; Q353-V355 PolarHBondContact O-N 2.79Å; Q353-K356 PolarHBondContact O-N 3.04Å; Q353-T357 WeakPolarHBondContact O-CB 3.44Å; Q353-T357 PolarHBondContact O-N 3.44Å; Q353-T357 PolarHBondContact O-OG1 3.48Å; Q353-T391 HydrophobicContact CB-CG2 4.21Å
354	H	97.3	Very high	96	Very high	101 Å²	101	39.2 Å²	39.2	47%	0.468	21%	0.209	S	C	.	.	H	α-helix	trans	-67.3	-36.7	-178.8	-62.4	-63.9	0	0	0	111.6	S314 N352 T357 A358	S314-H354 PolarHBondContact OG-O 3.06Å; N352-H354 VanDerWaalsContact C-N 3.27Å; N352-H354 PolarHBondContact O-N 2.93Å; N352-H354 VanDerWaalsContact OD1-CB 3.31Å; N352-H354 WeakPolarHBondContact OD1-CB 3.47Å; N352-H354 PolarHBondContact OD1-CD2 3.46Å; N352-H354 PolarHBondContact OD1-N 3.41Å; H354-T357 PolarHBondContact O-N 2.73Å; H354-A358 VanDerWaalsContact O-CB 3.32Å; H354-A358 WeakPolarHBondContact O-CB 3.29Å; H354-A358 PolarHBondContact O-N 2.81Å
355	V	98.2	Very high	95.4	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-62.7	-48	174.7	179.7	0	0	0	0	110.5	A310 R313 L347 D350 N352 Q353 T357 A358 L359	A310-V355 HydrophobicContact CB-CG2 4.19Å; A310-V355 WeakPolarHBondContact O-CG2 3.42Å; R313-V355 HydrophobicContact CB-CG1 4.18Å; R313-V355 HydrophobicContact CB-CG2 3.9Å; L347-V355 HydrophobicContact CD2-CG1 3.39Å; D350-V355 HydrophobicContact CB-CB 4.02Å; D350-V355 HydrophobicContact CB-CG1 3.85Å; N352-V355 HydrophobicContact CB-CG2 3.96Å; N352-V355 PolarHBondContact O-N 2.91Å; Q353-V355 VanDerWaalsContact C-N 3.33Å; Q353-V355 PolarHBondContact O-N 2.79Å; V355-T357 PolarHBondContact O-N 2.84Å; V355-A358 PolarHBondContact O-N 3.37Å; V355-L359 PolarHBondContact O-N 2.8Å
356	K	98	Very high	95	Very high	27 Å²	27	35.2 Å²	35.2	12%	0.117	20%	0.195	C	C	.	.	H	α-helix	trans	-62.7	-42.5	176.5	-64	-171.5	-66.9	170.8	0	112	D350 N352 Q353 L359 A360 L386 D389 V394	D350-K356 HydrophobicContact CB-CG 4.12Å; D350-K356 VanDerWaalsContact O-CD 3.28Å; D350-K356 WeakPolarHBondContact O-CD 3.47Å; D350-K356 WeakPolarHBondContact O-CE 2.97Å; N352-K356 PolarHBondContact O-N 3.33Å; Q353-K356 PolarHBondContact O-N 3.04Å; K356-L359 PolarHBondContact O-N 3.47Å; K356-A360 VanDerWaalsContact O-CB 3.24Å; K356-A360 WeakPolarHBondContact O-CB 3.26Å; K356-A360 PolarHBondContact O-N 3.25Å; K356-L386 HydrophobicContact CB-CD2 4.44Å; K356-D389 WeakPolarHBondContact CD-OD2 3.19Å; K356-D389 WeakPolarHBondContact CE-OD2 3.43Å; K356-D389 IonicContact NZ-OD1 2.71Å; K356-D389 PolarHBondContact NZ-OD1 3.36Å; K356-D389 IonicContact NZ-OD2 2.95Å; K356-D389 PolarHBondContact NZ-OD2 3.21Å; K356-V394 HydrophobicContact CB-CG1 4.44Å; K356-V394 HydrophobicContact CB-CG2 3.77Å
357	T	97	Very high	94.5	Very high	12 Å²	12	30.3 Å²	30.3	7%	0.074	17%	0.173	C	C	.	.	H	α-helix	trans	-60.9	-46.6	176.9	-69.9	0	0	0	0	111.1	Q353 H354 V355 A360 S361 E393 N397	Q353-T357 WeakPolarHBondContact O-CB 3.44Å; Q353-T357 PolarHBondContact O-N 3.44Å; Q353-T357 PolarHBondContact O-OG1 3.48Å; H354-T357 PolarHBondContact O-N 2.73Å; V355-T357 PolarHBondContact O-N 2.84Å; T357-A360 PolarHBondContact O-N 2.84Å; T357-S361 PolarHBondContact O-N 3.42Å; T357-E393 HydrophobicContact CG2-CB 4.46Å; T357-E393 VanDerWaalsContact CG2-CD 3.44Å; T357-E393 HydrophobicContact CG2-CG 3.73Å; T357-E393 WeakPolarHBondContact CG2-OE1 3.5Å; T357-N397 WeakPolarHBondContact CG2-ND2 3.39Å; T357-N397 PolarHBondContact O-ND2 3.02Å
358	A	97.4	Very high	93.8	Very high	12 Å²	12	32.3 Å²	32.3	10%	0.099	19%	0.186	C	C	.	.	H	α-helix	trans	-60.8	-48.9	177.9	0	0	0	0	0	111.1	S314 A317 A318 H354 V355 A360 S361	S314-A358 WeakPolarHBondContact O-CB 3.39Å; A317-A358 HydrophobicContact CB-CB 4.13Å; A318-A358 HydrophobicContact CB-CB 4.27Å; H354-A358 VanDerWaalsContact O-CB 3.32Å; H354-A358 WeakPolarHBondContact O-CB 3.29Å; H354-A358 PolarHBondContact O-N 2.81Å; V355-A358 PolarHBondContact O-N 3.37Å; A358-A360 PolarHBondContact O-N 3.27Å; A358-S361 PolarHBondContact O-N 2.71Å; A358-S361 PolarHBondContact O-OG 3.01Å
359	L	97.3	Very high	93.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61.1	-45.8	177.5	179.6	61.5	0	0	0	112.3	A317 I344 L347 V348 V355 K356 S361 V362 I363	A317-L359 HydrophobicContact CB-CB 4.24Å; I344-L359 HydrophobicContact CG1-CD1 4.39Å; I344-L359 HydrophobicContact CG2-CD1 4.12Å; I344-L359 HydrophobicContact CG2-CD2 4Å; L347-L359 HydrophobicContact CB-CD2 3.72Å; V348-L359 HydrophobicContact CG2-CD2 3.85Å; V355-L359 PolarHBondContact O-N 2.8Å; K356-L359 PolarHBondContact O-N 3.47Å; L359-S361 PolarHBondContact O-N 3.22Å; L359-S361 VanDerWaalsContact O-N 3.15Å; L359-V362 PolarHBondContact O-N 3.43Å; L359-I363 HydrophobicContact CD1-CB 4.17Å; L359-I363 HydrophobicContact CD1-CG1 4.45Å; L359-I363 HydrophobicContact CG-CB 4.32Å; L359-I363 HydrophobicContact CG-CD1 4.42Å; L359-I363 WeakPolarHBondContact O-CB 3.35Å; L359-I363 PolarHBondContact O-N 3.33Å
360	A	95.1	Very high	93	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-57.6	-30.1	-179.9	0	0	0	0	0	113	K356 T357 A358 V362 L386 V394 N397 I398	K356-A360 VanDerWaalsContact O-CB 3.24Å; K356-A360 WeakPolarHBondContact O-CB 3.26Å; K356-A360 PolarHBondContact O-N 3.25Å; T357-A360 PolarHBondContact O-N 2.84Å; A358-A360 PolarHBondContact O-N 3.27Å; A360-V362 VanDerWaalsContact C-N 3.27Å; A360-V362 PolarHBondContact O-N 3.26Å; A360-L386 HydrophobicContact CB-CD1 4.36Å; A360-V394 HydrophobicContact CB-CG1 3.98Å; A360-N397 HydrophobicContact CB-CB 3.75Å; A360-I398 HydrophobicContact CB-CD1 3.68Å; A360-I398 HydrophobicContact CB-CG1 3.87Å
361	S	92.6	Very high	92.3	Very high	34 Å²	34	28.5 Å²	28.5	24%	0.238	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-18	-179.8	77.6	0	0	0	0	114.3	T357 A358 L359	T357-S361 PolarHBondContact O-N 3.42Å; A358-S361 PolarHBondContact O-N 2.71Å; A358-S361 PolarHBondContact O-OG 3.01Å; L359-S361 PolarHBondContact O-N 3.22Å; L359-S361 VanDerWaalsContact O-N 3.15Å
362	V	92.5	Very high	91.3	Very high	25 Å²	25	25.2 Å²	25.2	15%	0.152	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.7	-18.7	-172.7	-61.6	0	0	0	0	115.4	A317 R321 L359 A360 M364 G365	A317-V362 VanDerWaalsContact O-CG2 3.29Å; A317-V362 WeakPolarHBondContact O-CG2 3.49Å; R321-V362 HydrophobicContact CB-CB 4.07Å; L359-V362 PolarHBondContact O-N 3.43Å; A360-V362 VanDerWaalsContact C-N 3.27Å; A360-V362 PolarHBondContact O-N 3.26Å; V362-M364 VanDerWaalsContact C-N 3.31Å; V362-M364 PolarHBondContact O-N 2.9Å; V362-M364 VanDerWaalsContact O-N 3.16Å; V362-G365 WeakPolarHBondContact O-CA 3.3Å; V362-G365 PolarHBondContact O-N 3.3Å
363	I	91.8	Very high	90.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-52.6	-42.8	-170.4	-171.5	172.6	0	0	0	113.7	I344 V348 L359 G365 I366 M382 L386 I398	I344-I363 HydrophobicContact CG2-CD1 3.76Å; I344-I363 HydrophobicContact CG2-CG1 4.25Å; V348-I363 HydrophobicContact CG2-CD1 4.37Å; L359-I363 HydrophobicContact CD1-CB 4.17Å; L359-I363 HydrophobicContact CD1-CG1 4.45Å; L359-I363 HydrophobicContact CG-CB 4.32Å; L359-I363 HydrophobicContact CG-CD1 4.42Å; L359-I363 WeakPolarHBondContact O-CB 3.35Å; L359-I363 PolarHBondContact O-N 3.33Å; I363-G365 PolarHBondContact O-N 3.4Å; I363-I366 WeakPolarHBondContact O-CB 3.39Å; I363-I366 WeakPolarHBondContact O-CG1 3.48Å; I363-I366 PolarHBondContact O-N 3.47Å; I363-M382 HydrophobicContact CD1-CB 3.99Å; I363-M382 HydrophobicContact CD1-CE 4.47Å; I363-L386 HydrophobicContact CD1-CD1 3.98Å; I363-L386 HydrophobicContact CG2-CD1 4.25Å; I363-I398 HydrophobicContact CG2-CD1 3.95Å
364	M	86.6	Confident	90.1	Very high	10 Å²	10	28 Å²	28	5%	0.049	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-73.3	-13.9	179.9	-73.4	-51.6	-59.1	0	0	114.2	V362 I366 A367 T375 Y383 V405 I423	V362-M364 VanDerWaalsContact C-N 3.31Å; V362-M364 PolarHBondContact O-N 2.9Å; V362-M364 VanDerWaalsContact O-N 3.16Å; M364-I366 PolarHBondContact O-N 3.25Å; M364-A367 HydrophobicContact CE-CB 4.04Å; M364-A367 WeakPolarHBondContact O-CB 3.38Å; M364-A367 PolarHBondContact O-N 3.22Å; M364-T375 HydrophobicContact CE-CG2 4.45Å; M364-Y383 HydrophobicContact CG-CD2 3.23Å; M364-Y383 HydrophobicContact CG-CE2 3.31Å; M364-Y383 HydrophobicContact CG-CG 4.27Å; M364-Y383 HydrophobicContact SD-CD2 3.43Å; M364-Y383 WeakPolarHBondContact SD-CD2 3.49Å; M364-Y383 HydrophobicContact SD-CE2 4.04Å; M364-Y383 HydrophobicContact SD-CG 3.92Å; M364-V405 HydrophobicContact CB-CG2 3.96Å; M364-I423 HydrophobicContact CE-CD1 3.81Å; M364-I423 HydrophobicContact CE-CG1 4.24Å
365	G	85.4	Confident	89.5	Confident	14 Å²	14	23.8 Å²	23.8	14%	0.144	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-67.7	-14.5	171.7	0	0	0	0	0	113.6	V362 I363 P368	V362-G365 WeakPolarHBondContact O-CA 3.3Å; V362-G365 PolarHBondContact O-N 3.3Å; I363-G365 PolarHBondContact O-N 3.4Å; G365-P368 WeakPolarHBondContact O-CD 3.5Å
366	I	89	Confident	88.7	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-80.7	-22.3	177	-52.5	168.6	0	0	0	111.3	V320 I336 I344 I363 M364 L369 V370 L379	V320-I366 HydrophobicContact CG1-CD1 3.43Å; V320-I366 VanDerWaalsContact CG1-CD1 3.43Å; V320-I366 HydrophobicContact CG1-CG1 4.29Å; I336-I366 HydrophobicContact CD1-CG2 4.49Å; I336-I366 HydrophobicContact CG2-CG2 3.88Å; I344-I366 HydrophobicContact CD1-CD1 3.41Å; I344-I366 VanDerWaalsContact CD1-CD1 3.41Å; I363-I366 WeakPolarHBondContact O-CB 3.39Å; I363-I366 WeakPolarHBondContact O-CG1 3.48Å; I363-I366 PolarHBondContact O-N 3.47Å; M364-I366 PolarHBondContact O-N 3.25Å; I366-L369 WeakPolarHBondContact O-CA 3.4Å; I366-L369 VanDerWaalsContact O-CB 3.31Å; I366-L369 WeakPolarHBondContact O-CB 3.5Å; I366-L369 PolarHBondContact O-N 3.08Å; I366-V370 HydrophobicContact CG2-CG1 4.09Å; I366-V370 PolarHBondContact O-N 3.27Å; I366-L379 HydrophobicContact CB-CD1 4.25Å; I366-L379 HydrophobicContact CG2-CD1 4.48Å
367	A	85.6	Confident	88.2	Confident	2 Å²	2	29.1 Å²	29.1	2%	0.017	18%	0.176	C	C	.	.	H	α-helix	trans	-53.4	-47.8	-174.2	0	0	0	0	0	113.3	M364 L369 V370 G371 T375 L379 F420	M364-A367 HydrophobicContact CE-CB 4.04Å; M364-A367 WeakPolarHBondContact O-CB 3.38Å; M364-A367 PolarHBondContact O-N 3.22Å; A367-L369 PolarHBondContact O-N 3.34Å; A367-V370 PolarHBondContact O-N 3.12Å; A367-G371 PolarHBondContact O-N 3.34Å; A367-T375 WeakPolarHBondContact CA-OG1 3.46Å; A367-T375 HydrophobicContact CB-CG2 3.7Å; A367-T375 WeakPolarHBondContact CB-OG1 3.43Å; A367-T375 PolarHBondContact O-OG1 3.24Å; A367-L379 HydrophobicContact CB-CD1 3.9Å; A367-F420 HydrophobicContact CB-CE1 4.1Å; A367-F420 WeakPolarHBondContact O-CZ 3.31Å
368	P	83	Confident	87.9	Confident	46 Å²	46	31.4 Å²	31.4	30%	0.299	19%	0.186	S	C	.	.	H	α-helix	trans	-61.5	-19.2	177.2	-21.7	34.7	0	0	0	114.4	G365 W413	G365-P368 WeakPolarHBondContact O-CD 3.5Å; P368-W413 HydrophobicContact CB-CZ2 4.5Å
369	L	88.7	Confident	87.5	Confident	30 Å²	30	30.8 Å²	30.8	16%	0.157	18%	0.181	C	C	.	.	H	α-helix	trans	-89.1	-20.9	-176.2	-51.3	179.1	0	0	0	113.6	C324 E325 I336 I366 A367	C324-L369 HydrophobicContact CB-CD1 3.54Å; E325-L369 HydrophobicContact CG-CD1 3.78Å; E325-L369 HydrophobicContact CG-CD2 4.16Å; I336-L369 HydrophobicContact CD1-CB 3.89Å; I336-L369 HydrophobicContact CD1-CD1 4.32Å; I366-L369 WeakPolarHBondContact O-CA 3.4Å; I366-L369 VanDerWaalsContact O-CB 3.31Å; I366-L369 WeakPolarHBondContact O-CB 3.5Å; I366-L369 PolarHBondContact O-N 3.08Å; A367-L369 PolarHBondContact O-N 3.34Å
370	V	88.7	Confident	86.8	Confident	4 Å²	4	31.7 Å²	31.7	2%	0.024	19%	0.185	C	C	.	.	H	α-helix	trans	-111.5	-8.2	-178	-61.9	0	0	0	0	113.3	I336 L337 I366 A367 N374 L379	I336-V370 HydrophobicContact CB-CG1 4.06Å; I336-V370 HydrophobicContact CD1-CG1 4.1Å; I336-V370 HydrophobicContact CG2-CG1 3.45Å; I336-V370 VanDerWaalsContact CG2-CG1 3.45Å; L337-V370 HydrophobicContact CD2-CG1 4.45Å; I366-V370 HydrophobicContact CG2-CG1 4.09Å; I366-V370 PolarHBondContact O-N 3.27Å; A367-V370 PolarHBondContact O-N 3.12Å; V370-N374 HydrophobicContact CB-CB 3.85Å; V370-N374 HydrophobicContact CG2-CB 3.93Å; V370-N374 WeakPolarHBondContact O-CB 3.39Å; V370-N374 PolarHBondContact O-ND2 3.31Å; V370-L379 HydrophobicContact CG2-CD1 3.93Å
371	G	82.3	Confident	86.5	Confident	26 Å²	26	34.9 Å²	34.9	27%	0.268	21%	0.206	S	C	.	.	H	α-helix	trans	82.8	167.4	-179.6	0	0	0	0	0	114	A367 T375 F420	A367-G371 PolarHBondContact O-N 3.34Å; G371-T375 VanDerWaalsContact O-CB 3.31Å; G371-T375 WeakPolarHBondContact O-CB 3.26Å; G371-T375 PolarHBondContact O-N 3.01Å; G371-T375 PolarHBondContact O-OG1 2.78Å; G371-F420 VanDerWaalsContact C-CZ 3.49Å
372	N	75.6	Confident	86.5	Confident	49 Å²	49	33.8 Å²	33.8	26%	0.262	20%	0.197	S	C	.	.	H	α-helix	trans	-63.1	-45.3	-172.8	-70.7	-26.7	0	0	0	112.6	T375 I376 F419 F420	N372-T375 WeakPolarHBondContact O-CB 3.32Å; N372-T375 PolarHBondContact O-N 2.99Å; N372-I376 WeakPolarHBondContact O-CG1 3.31Å; N372-I376 PolarHBondContact O-N 2.84Å; N372-F419 PolarHBondContact ND2-O 3.46Å; N372-F420 WeakPolarHBondContact OD1-CD1 3.48Å; N372-F420 VanDerWaalsContact OD1-CE1 3.25Å; N372-F420 WeakPolarHBondContact OD1-CE1 3.32Å; N372-F420 WeakPolarHBondContact OD1-CE2 3.43Å; N372-F420 VanDerWaalsContact OD1-CZ 3.27Å; N372-F420 WeakPolarHBondContact OD1-CZ 3.36Å
373	E	82.6	Confident	86.3	Confident	166 Å²	166	32.6 Å²	32.6	78%	0.776	19%	0.19	S	C	*	.	H	α-helix	trans	-60.7	-50.8	-177.1	-65	-176.1	174.8	0	0	111.7	T375 I376 A377	E373-T375 VanDerWaalsContact C-N 3.31Å; E373-T375 PolarHBondContact O-N 3.05Å; E373-I376 PolarHBondContact O-N 2.95Å; E373-A377 VanDerWaalsContact O-CB 3.27Å; E373-A377 WeakPolarHBondContact O-CB 3.35Å; E373-A377 PolarHBondContact O-N 3.16Å
374	N	87.8	Confident	86	Confident	30 Å²	30	34 Å²	34	16%	0.16	20%	0.198	C	C	.	.	H	α-helix	trans	-66.5	-33.4	177.5	-68.1	-46.4	0	0	0	112.3	E333 L337 V370 A377 H378	E333-N374 PolarHBondContact OE1-ND2 3.22Å; L337-N374 HydrophobicContact CD2-CB 4.13Å; V370-N374 HydrophobicContact CB-CB 3.85Å; V370-N374 HydrophobicContact CG2-CB 3.93Å; V370-N374 WeakPolarHBondContact O-CB 3.39Å; V370-N374 PolarHBondContact O-ND2 3.31Å; N374-A377 PolarHBondContact O-N 3.09Å; N374-H378 WeakPolarHBondContact O-CB 3.43Å; N374-H378 PolarHBondContact O-N 2.84Å
375	T	84.9	Confident	86.3	Confident	13 Å²	13	36.6 Å²	36.6	8%	0.08	21%	0.214	C	C	.	.	I	π-helix	trans	-61.3	-49	174.7	-63.8	0	0	0	0	110.6	M364 A367 G371 N372 E373 L379 L380	M364-T375 HydrophobicContact CE-CG2 4.45Å; A367-T375 WeakPolarHBondContact CA-OG1 3.46Å; A367-T375 HydrophobicContact CB-CG2 3.7Å; A367-T375 WeakPolarHBondContact CB-OG1 3.43Å; A367-T375 PolarHBondContact O-OG1 3.24Å; G371-T375 VanDerWaalsContact O-CB 3.31Å; G371-T375 WeakPolarHBondContact O-CB 3.26Å; G371-T375 PolarHBondContact O-N 3.01Å; G371-T375 PolarHBondContact O-OG1 2.78Å; N372-T375 WeakPolarHBondContact O-CB 3.32Å; N372-T375 PolarHBondContact O-N 2.99Å; E373-T375 VanDerWaalsContact C-N 3.31Å; E373-T375 PolarHBondContact O-N 3.05Å; T375-L379 HydrophobicContact CG2-CB 4.29Å; T375-L379 HydrophobicContact CG2-CD1 4.31Å; T375-L379 WeakPolarHBondContact O-CA 3.3Å; T375-L379 WeakPolarHBondContact O-CB 3.38Å; T375-L379 PolarHBondContact O-N 3.08Å; T375-L380 PolarHBondContact O-N 3.17Å
376	I	80.3	Confident	86.7	Confident	80 Å²	80	35.9 Å²	35.9	41%	0.41	21%	0.207	S	C	.	.	I	π-helix	trans	-65.3	-45.9	177.7	-63.3	166.2	0	0	0	110.5	N372 E373 H378 P381 V426	N372-I376 WeakPolarHBondContact O-CG1 3.31Å; N372-I376 PolarHBondContact O-N 2.84Å; E373-I376 PolarHBondContact O-N 2.95Å; I376-H378 PolarHBondContact O-N 3.39Å; I376-P381 WeakPolarHBondContact O-CD 3.42Å; I376-V426 HydrophobicContact CD1-CG1 3.52Å; I376-V426 HydrophobicContact CG1-CG1 3.47Å; I376-V426 VanDerWaalsContact CG1-CG1 3.47Å
377	A	88.1	Confident	86.7	Confident	59 Å²	59	35.9 Å²	35.9	49%	0.488	21%	0.207	S	C	.	.	I	π-helix	trans	-70.8	-29.8	-173.8	0	0	0	0	0	113.6	E373 N374	E373-A377 VanDerWaalsContact O-CB 3.27Å; E373-A377 WeakPolarHBondContact O-CB 3.35Å; E373-A377 PolarHBondContact O-N 3.16Å; N374-A377 PolarHBondContact O-N 3.09Å
378	H	90.5	Very high	86.8	Confident	59 Å²	59	42.5 Å²	42.5	27%	0.273	24%	0.235	S	C	.	.	I	π-helix	trans	-126.6	-49.6	-170.1	-57.7	-40	0	0	0	114.3	L341 N374 I376 M382	L341-H378 HydrophobicContact CD1-CB 3.78Å; N374-H378 WeakPolarHBondContact O-CB 3.43Å; N374-H378 PolarHBondContact O-N 2.84Å; I376-H378 PolarHBondContact O-N 3.39Å; H378-M382 VanDerWaalsContact O-CE 3.31Å; H378-M382 WeakPolarHBondContact O-CE 3.44Å
379	L	88.9	Confident	87.4	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.226	C	C	.	.	I	π-helix	trans	-74.9	-40.2	-174.7	-63	-179.4	0	0	0	112	L341 I366 A367 V370 T375 M382 Y383	L341-L379 HydrophobicContact CD2-CD2 3.62Å; I366-L379 HydrophobicContact CB-CD1 4.25Å; I366-L379 HydrophobicContact CG2-CD1 4.48Å; A367-L379 HydrophobicContact CB-CD1 3.9Å; V370-L379 HydrophobicContact CG2-CD1 3.93Å; T375-L379 HydrophobicContact CG2-CB 4.29Å; T375-L379 HydrophobicContact CG2-CD1 4.31Å; T375-L379 WeakPolarHBondContact O-CA 3.3Å; T375-L379 WeakPolarHBondContact O-CB 3.38Å; T375-L379 PolarHBondContact O-N 3.08Å; L379-M382 HydrophobicContact CD2-CE 3.63Å; L379-M382 WeakPolarHBondContact O-CB 3.46Å; L379-M382 PolarHBondContact O-N 3.4Å; L379-Y383 WeakPolarHBondContact O-CB 3.39Å; L379-Y383 PolarHBondContact O-N 3.26Å
380	L	83	Confident	87.5	Confident	18 Å²	18	47 Å²	47	9%	0.094	26%	0.257	C	S	.	.	H	α-helix	trans	-60.3	-48.2	-177.4	176.2	62.3	0	0	0	113	T375 M382 Y383 L384 I427	T375-L380 PolarHBondContact O-N 3.17Å; L380-M382 VanDerWaalsContact C-N 3.26Å; L380-M382 PolarHBondContact O-N 3.41Å; L380-Y383 WeakPolarHBondContact O-CB 3.41Å; L380-Y383 PolarHBondContact O-N 3.38Å; L380-L384 HydrophobicContact CD1-CD1 4.15Å; L380-L384 HydrophobicContact CD1-CD2 4.29Å; L380-L384 HydrophobicContact CD1-CG 3.95Å; L380-L384 HydrophobicContact CG-CD1 4.22Å; L380-L384 HydrophobicContact CG-CG 4.42Å; L380-L384 WeakPolarHBondContact O-CG 3.38Å; L380-L384 PolarHBondContact O-N 2.9Å; L380-I427 HydrophobicContact CD1-CD1 3.35Å; L380-I427 HydrophobicContact CD1-CG1 3.85Å; L380-I427 HydrophobicContact CD2-CD1 4.36Å; L380-I427 HydrophobicContact CD2-CG1 3.9Å; L380-I427 HydrophobicContact CD2-CG2 4.42Å; L380-I427 HydrophobicContact CG-CD1 4.46Å
381	P	89	Confident	87.7	Confident	68 Å²	68	48 Å²	48	44%	0.442	26%	0.263	S	S	.	.	H	α-helix	trans	-54.1	-42.6	173.9	-28	34.7	0	0	0	113.1	I376 L384 T385	I376-P381 WeakPolarHBondContact O-CD 3.42Å; P381-L384 PolarHBondContact O-N 3.49Å; P381-T385 PolarHBondContact O-N 3.38Å; P381-T385 VanDerWaalsContact O-N 3.08Å; P381-T385 PolarHBondContact O-OG1 3.16Å; P381-T385 VanDerWaalsContact O-OG1 3.08Å
382	M	92.9	Very high	88.2	Confident	10 Å²	10	47.5 Å²	47.5	5%	0.049	26%	0.256	C	S	.	.	H	α-helix	trans	-67.5	-41.3	178.7	-66.1	-170.3	-65.6	0	0	112.3	L341 I344 K345 V348 I363 H378 L379 L380 L384 T385 L386	L341-M382 HydrophobicContact CD2-CE 3.9Å; I344-M382 HydrophobicContact CB-CE 4.4Å; I344-M382 HydrophobicContact CB-SD 4.26Å; I344-M382 HydrophobicContact CG2-CE 3.7Å; I344-M382 HydrophobicContact CG2-SD 3.57Å; I344-M382 VanDerWaalsContact CG2-SD 3.57Å; K345-M382 HydrophobicContact CB-SD 4.18Å; K345-M382 HydrophobicContact CG-CG 4.34Å; K345-M382 HydrophobicContact CG-SD 3.41Å; K345-M382 WeakPolarHBondContact CG-SD 3.41Å; V348-M382 HydrophobicContact CG2-CB 3.8Å; V348-M382 HydrophobicContact CG2-CG 4.05Å; V348-M382 HydrophobicContact CG2-SD 4.08Å; I363-M382 HydrophobicContact CD1-CB 3.99Å; I363-M382 HydrophobicContact CD1-CE 4.47Å; H378-M382 VanDerWaalsContact O-CE 3.31Å; H378-M382 WeakPolarHBondContact O-CE 3.44Å; L379-M382 HydrophobicContact CD2-CE 3.63Å; L379-M382 WeakPolarHBondContact O-CB 3.46Å; L379-M382 PolarHBondContact O-N 3.4Å; L380-M382 VanDerWaalsContact C-N 3.26Å; L380-M382 PolarHBondContact O-N 3.41Å; M382-L384 VanDerWaalsContact C-N 3.35Å; M382-L384 PolarHBondContact O-N 3.32Å; M382-T385 PolarHBondContact O-N 3.44Å; M382-L386 PolarHBondContact O-N 2.83Å
383	Y	88	Confident	89	Confident	1 Å²	1	49.8 Å²	49.8	0%	0.004	27%	0.266	C	S	.	.	H	α-helix	trans	-59.6	-45.3	175.5	-175.8	-96.6	0	0	0	111.6	M364 L379 L380 T385 L386 L387 I398 L402 L432	M364-Y383 HydrophobicContact CG-CD2 3.23Å; M364-Y383 HydrophobicContact CG-CE2 3.31Å; M364-Y383 HydrophobicContact CG-CG 4.27Å; M364-Y383 HydrophobicContact SD-CD2 3.43Å; M364-Y383 WeakPolarHBondContact SD-CD2 3.49Å; M364-Y383 HydrophobicContact SD-CE2 4.04Å; M364-Y383 HydrophobicContact SD-CG 3.92Å; L379-Y383 WeakPolarHBondContact O-CB 3.39Å; L379-Y383 PolarHBondContact O-N 3.26Å; L380-Y383 WeakPolarHBondContact O-CB 3.41Å; L380-Y383 PolarHBondContact O-N 3.38Å; Y383-T385 VanDerWaalsContact C-N 3.33Å; Y383-T385 PolarHBondContact O-N 2.82Å; Y383-L386 PolarHBondContact O-N 2.88Å; Y383-L387 WeakPolarHBondContact O-CB 3.48Å; Y383-L387 PolarHBondContact O-N 2.93Å; Y383-I398 HydrophobicContact CD1-CG2 4.32Å; Y383-I398 HydrophobicContact CD2-CD1 3.92Å; Y383-I398 HydrophobicContact CD2-CG2 3.93Å; Y383-I398 HydrophobicContact CE1-CG2 3.78Å; Y383-I398 HydrophobicContact CE2-CB 4.22Å; Y383-I398 HydrophobicContact CE2-CD1 4.01Å; Y383-I398 HydrophobicContact CE2-CG2 3.36Å; Y383-I398 HydrophobicContact CG-CG2 4.38Å; Y383-I398 WeakPolarHBondContact OH-CG2 3.27Å; Y383-I398 PolarHBondContact OH-O 3.15Å; Y383-L402 WeakPolarHBondContact OH-CD2 3.49Å; Y383-L402 VanDerWaalsContact OH-CG 3.3Å; Y383-L402 WeakPolarHBondContact OH-CG 3.32Å; Y383-L432 HydrophobicContact CE1-CD1 4.46Å
384	L	86	Confident	89.5	Confident	29 Å²	29	41.9 Å²	41.9	15%	0.152	23%	0.229	C	C	.	.	H	α-helix	trans	-67	-32.7	177.8	-65.2	-180	0	0	0	112.7	L380 P381 M382 L387 K388	L380-L384 HydrophobicContact CD1-CD1 4.15Å; L380-L384 HydrophobicContact CD1-CD2 4.29Å; L380-L384 HydrophobicContact CD1-CG 3.95Å; L380-L384 HydrophobicContact CG-CD1 4.22Å; L380-L384 HydrophobicContact CG-CG 4.42Å; L380-L384 WeakPolarHBondContact O-CG 3.38Å; L380-L384 PolarHBondContact O-N 2.9Å; P381-L384 PolarHBondContact O-N 3.49Å; M382-L384 VanDerWaalsContact C-N 3.35Å; M382-L384 PolarHBondContact O-N 3.32Å; L384-L387 HydrophobicContact CD2-CD2 4.45Å; L384-K388 WeakPolarHBondContact O-CG 3.31Å; L384-K388 PolarHBondContact O-N 3.37Å
385	T	92.2	Very high	89.7	Confident	64 Å²	64	41.5 Å²	41.5	39%	0.393	23%	0.225	S	C	.	.	H	α-helix	trans	-64.7	-50.4	172.2	-60.5	0	0	0	0	111	V348 P381 M382 Y383 L387 K388 D389	V348-T385 HydrophobicContact CG1-CG2 3.58Å; P381-T385 PolarHBondContact O-N 3.38Å; P381-T385 VanDerWaalsContact O-N 3.08Å; P381-T385 PolarHBondContact O-OG1 3.16Å; P381-T385 VanDerWaalsContact O-OG1 3.08Å; M382-T385 PolarHBondContact O-N 3.44Å; Y383-T385 VanDerWaalsContact C-N 3.33Å; Y383-T385 PolarHBondContact O-N 2.82Å; T385-L387 VanDerWaalsContact C-N 3.25Å; T385-L387 PolarHBondContact O-N 3.07Å; T385-K388 CarbonylContact O-C 3.59Å; T385-K388 PolarHBondContact O-N 3.22Å; T385-D389 PolarHBondContact O-N 2.75Å
386	L	92.9	Very high	90	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-64	-30.7	178.2	-68	172.9	0	0	0	112.5	V348 K356 A360 I363 M382 Y383 K388 D389 V394 I398	V348-L386 HydrophobicContact CB-CD2 4.44Å; V348-L386 HydrophobicContact CG1-CD2 4.1Å; V348-L386 HydrophobicContact CG1-CG 4.05Å; V348-L386 HydrophobicContact CG2-CD1 4.15Å; V348-L386 HydrophobicContact CG2-CG 4.26Å; K356-L386 HydrophobicContact CB-CD2 4.44Å; A360-L386 HydrophobicContact CB-CD1 4.36Å; I363-L386 HydrophobicContact CD1-CD1 3.98Å; I363-L386 HydrophobicContact CG2-CD1 4.25Å; M382-L386 PolarHBondContact O-N 2.83Å; Y383-L386 PolarHBondContact O-N 2.88Å; L386-K388 PolarHBondContact O-N 3.42Å; L386-D389 VanDerWaalsContact O-CB 3.22Å; L386-D389 WeakPolarHBondContact O-CB 3.42Å; L386-D389 PolarHBondContact O-N 2.94Å; L386-V394 HydrophobicContact CB-CG1 4.05Å; L386-V394 HydrophobicContact CD2-CG1 3.79Å; L386-V394 HydrophobicContact CG-CG1 4.5Å; L386-I398 HydrophobicContact CB-CD1 3.68Å; L386-I398 HydrophobicContact CB-CG1 3.59Å; L386-I398 HydrophobicContact CD1-CD1 3.82Å; L386-I398 HydrophobicContact CG-CD1 4.41Å
387	L	89.2	Confident	90.6	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-65.6	-25.3	175	-170.5	56.5	0	0	0	112.9	Y383 L384 T385 R395 I398 I399 L436 A439	Y383-L387 WeakPolarHBondContact O-CB 3.48Å; Y383-L387 PolarHBondContact O-N 2.93Å; L384-L387 HydrophobicContact CD2-CD2 4.45Å; T385-L387 VanDerWaalsContact C-N 3.25Å; T385-L387 PolarHBondContact O-N 3.07Å; L387-R395 WeakPolarHBondContact O-CD 3.39Å; L387-R395 WeakPolarHBondContact O-CG 3.19Å; L387-I398 HydrophobicContact CB-CG2 3.88Å; L387-I398 HydrophobicContact CD1-CB 4.44Å; L387-I398 HydrophobicContact CD1-CG2 3.62Å; L387-I398 HydrophobicContact CG-CG2 4.25Å; L387-I399 HydrophobicContact CD1-CG1 4.02Å; L387-L436 HydrophobicContact CD1-CD1 3.83Å; L387-L436 HydrophobicContact CD2-CB 4.26Å; L387-L436 HydrophobicContact CD2-CD1 3.89Å; L387-L436 HydrophobicContact CG-CD1 4.47Å; L387-A439 HydrophobicContact CD1-CB 3.7Å; L387-A439 HydrophobicContact CG-CB 3.82Å; L387-A439 WeakPolarHBondContact O-CB 3.46Å
388	K	89.3	Confident	90.6	Very high	140 Å²	140	36.9 Å²	36.9	61%	0.609	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.9	11.4	178	-64.2	175.7	-176.3	177.5	0	112.7	L384 T385 L386	L384-K388 WeakPolarHBondContact O-CG 3.31Å; L384-K388 PolarHBondContact O-N 3.37Å; T385-K388 CarbonylContact O-C 3.59Å; T385-K388 PolarHBondContact O-N 3.22Å; L386-K388 PolarHBondContact O-N 3.42Å
389	D	93.7	Very high	90.4	Very high	18 Å²	18	34.1 Å²	34.1	10%	0.096	18%	0.179	C	C	.	.			trans	-65.1	145.1	179.7	-161.9	-85.1	0	0	0	111.3	K356 T385 L386 T391 V394 R395	K356-D389 WeakPolarHBondContact CD-OD2 3.19Å; K356-D389 WeakPolarHBondContact CE-OD2 3.43Å; K356-D389 IonicContact NZ-OD1 2.71Å; K356-D389 PolarHBondContact NZ-OD1 3.36Å; K356-D389 IonicContact NZ-OD2 2.95Å; K356-D389 PolarHBondContact NZ-OD2 3.21Å; T385-D389 PolarHBondContact O-N 2.75Å; L386-D389 VanDerWaalsContact O-CB 3.22Å; L386-D389 WeakPolarHBondContact O-CB 3.42Å; L386-D389 PolarHBondContact O-N 2.94Å; D389-T391 PolarHBondContact O-N 3.35Å; D389-T391 WeakPolarHBondContact OD1-CB 3.44Å; D389-T391 PolarHBondContact OD1-N 2.99Å; D389-V394 HydrophobicContact CB-CB 3.94Å; D389-V394 HydrophobicContact CB-CG1 3.66Å; D389-R395 HydrophobicContact CB-CG 4.47Å; D389-R395 WeakPolarHBondContact O-CD 3.48Å; D389-R395 VanDerWaalsContact O-CG 3.28Å; D389-R395 WeakPolarHBondContact O-CG 3.42Å; D389-R395 PolarHBondContact O-NH1 2.83Å
390	D	92.2	Very high	90.2	Very high	152 Å²	152	35.2 Å²	35.2	81%	0.813	19%	0.187	S	C	*	.	S	Bend	trans	-64.5	-30.2	178	-66.7	-35.9	0	0	0	112.4	A392 R395	D390-A392 PolarHBondContact O-N 3.32Å; D390-R395 VanDerWaalsContact C-NH1 3.35Å; D390-R395 PolarHBondContact O-NH1 2.79Å
391	T	92.9	Very high	89.9	Confident	26 Å²	26	34.5 Å²	34.5	16%	0.16	18%	0.184	C	C	.	.	S	Bend	trans	-77.3	114.9	-179.4	-61.7	0	0	0	0	110.6	Q353 D389 E393 V394 R395	Q353-T391 HydrophobicContact CB-CG2 4.21Å; D389-T391 PolarHBondContact O-N 3.35Å; D389-T391 WeakPolarHBondContact OD1-CB 3.44Å; D389-T391 PolarHBondContact OD1-N 2.99Å; T391-E393 HydrophobicContact CG2-CB 4.1Å; T391-E393 PolarHBondContact O-N 3.34Å; T391-V394 HydrophobicContact CG2-CG2 3.95Å; T391-V394 WeakPolarHBondContact O-CB 3.35Å; T391-V394 PolarHBondContact O-N 3.4Å; T391-R395 PolarHBondContact O-N 3.46Å
392	A	92	Very high	89.1	Confident	15 Å²	15	31.7 Å²	31.7	12%	0.124	17%	0.165	C	C	.	.	H	α-helix	trans	-54.4	-37.7	179.8	0	0	0	0	0	113.8	D390 V394 R395 L396 L443 V451	D390-A392 PolarHBondContact O-N 3.32Å; A392-V394 VanDerWaalsContact C-N 3.35Å; A392-V394 PolarHBondContact O-N 2.85Å; A392-R395 PolarHBondContact O-N 2.85Å; A392-L396 WeakPolarHBondContact O-CB 3.49Å; A392-L396 VanDerWaalsContact O-CG 3.26Å; A392-L396 WeakPolarHBondContact O-CG 3.48Å; A392-L396 PolarHBondContact O-N 3.06Å; A392-L443 HydrophobicContact CB-CD2 3.79Å; A392-V451 HydrophobicContact CB-CB 4.38Å; A392-V451 HydrophobicContact CB-CG1 3.69Å; A392-V451 HydrophobicContact CB-CG2 3.72Å
393	E	92.2	Very high	87.7	Confident	98 Å²	98	33.1 Å²	33.1	46%	0.458	17%	0.173	S	C	.	.	H	α-helix	trans	-64.2	-37.5	179	-162.3	-178.2	-178.9	0	0	112.6	T357 T391 L396 N397	T357-E393 HydrophobicContact CG2-CB 4.46Å; T357-E393 VanDerWaalsContact CG2-CD 3.44Å; T357-E393 HydrophobicContact CG2-CG 3.73Å; T357-E393 WeakPolarHBondContact CG2-OE1 3.5Å; T391-E393 HydrophobicContact CG2-CB 4.1Å; T391-E393 PolarHBondContact O-N 3.34Å; E393-L396 PolarHBondContact O-N 3.14Å; E393-N397 WeakPolarHBondContact O-CB 3.49Å; E393-N397 PolarHBondContact O-N 3.3Å
394	V	94.5	Very high	86.3	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.2	-51.1	174	179	0	0	0	0	109.4	K356 A360 L386 D389 T391 A392 L396 N397 I398	K356-V394 HydrophobicContact CB-CG1 4.44Å; K356-V394 HydrophobicContact CB-CG2 3.77Å; A360-V394 HydrophobicContact CB-CG1 3.98Å; L386-V394 HydrophobicContact CB-CG1 4.05Å; L386-V394 HydrophobicContact CD2-CG1 3.79Å; L386-V394 HydrophobicContact CG-CG1 4.5Å; D389-V394 HydrophobicContact CB-CB 3.94Å; D389-V394 HydrophobicContact CB-CG1 3.66Å; T391-V394 HydrophobicContact CG2-CG2 3.95Å; T391-V394 WeakPolarHBondContact O-CB 3.35Å; T391-V394 PolarHBondContact O-N 3.4Å; A392-V394 VanDerWaalsContact C-N 3.35Å; A392-V394 PolarHBondContact O-N 2.85Å; V394-L396 VanDerWaalsContact C-N 3.33Å; V394-L396 PolarHBondContact O-N 3.36Å; V394-N397 PolarHBondContact O-N 3.12Å; V394-I398 WeakPolarHBondContact O-CG1 3.13Å; V394-I398 PolarHBondContact O-N 3.42Å
395	R	92.2	Very high	84.8	Confident	21 Å²	21	37 Å²	37	8%	0.079	19%	0.189	C	C	.	.	H	α-helix	trans	-60.3	-41.4	178.6	-56.7	-163.8	-63.2	-94.6	4.6	112.1	L387 D389 D390 T391 A392 I398 I399 L443	L387-R395 WeakPolarHBondContact O-CD 3.39Å; L387-R395 WeakPolarHBondContact O-CG 3.19Å; D389-R395 HydrophobicContact CB-CG 4.47Å; D389-R395 WeakPolarHBondContact O-CD 3.48Å; D389-R395 VanDerWaalsContact O-CG 3.28Å; D389-R395 WeakPolarHBondContact O-CG 3.42Å; D389-R395 PolarHBondContact O-NH1 2.83Å; D390-R395 VanDerWaalsContact C-NH1 3.35Å; D390-R395 PolarHBondContact O-NH1 2.79Å; T391-R395 PolarHBondContact O-N 3.46Å; A392-R395 PolarHBondContact O-N 2.85Å; R395-I398 PolarHBondContact O-N 2.9Å; R395-I399 WeakPolarHBondContact O-CG1 3.31Å; R395-I399 PolarHBondContact O-N 2.89Å; R395-L443 HydrophobicContact CB-CD1 3.94Å; R395-L443 HydrophobicContact CB-CD2 4.3Å; R395-L443 HydrophobicContact CB-CG 4.44Å
396	L	91	Very high	82.5	Confident	19 Å²	19	35.6 Å²	35.6	10%	0.099	19%	0.188	C	C	.	.	H	α-helix	trans	-63.5	-42.7	176.8	-74.6	166.8	0	0	0	112.1	A392 E393 V394 I398 I399 S400 L443 V451 A454 I455	A392-L396 WeakPolarHBondContact O-CB 3.49Å; A392-L396 VanDerWaalsContact O-CG 3.26Å; A392-L396 WeakPolarHBondContact O-CG 3.48Å; A392-L396 PolarHBondContact O-N 3.06Å; E393-L396 PolarHBondContact O-N 3.14Å; V394-L396 VanDerWaalsContact C-N 3.33Å; V394-L396 PolarHBondContact O-N 3.36Å; L396-I398 VanDerWaalsContact C-N 3.35Å; L396-I398 PolarHBondContact O-N 2.77Å; L396-I399 PolarHBondContact O-N 2.68Å; L396-S400 WeakPolarHBondContact O-CB 3.47Å; L396-S400 PolarHBondContact O-N 3.4Å; L396-S400 PolarHBondContact O-OG 3.2Å; L396-L443 HydrophobicContact CD2-CD1 4.04Å; L396-L443 HydrophobicContact CD2-CD2 4.41Å; L396-L443 HydrophobicContact CG-CD1 4.26Å; L396-L443 HydrophobicContact CG-CD2 4.08Å; L396-V451 HydrophobicContact CD1-CG1 4.48Å; L396-A454 HydrophobicContact CD1-CB 3.59Å; L396-A454 HydrophobicContact CD2-CB 3.7Å; L396-A454 HydrophobicContact CG-CB 4.29Å; L396-I455 HydrophobicContact CD2-CB 4.38Å
397	N	91.3	Very high	80.2	Confident	37 Å²	37	41.3 Å²	41.3	20%	0.198	21%	0.213	C	C	.	.	H	α-helix	trans	-63.1	-41.9	176.6	-80.5	-7.6	0	0	0	111.8	T357 A360 E393 V394 S400 S401	T357-N397 WeakPolarHBondContact CG2-ND2 3.39Å; T357-N397 PolarHBondContact O-ND2 3.02Å; A360-N397 HydrophobicContact CB-CB 3.75Å; E393-N397 WeakPolarHBondContact O-CB 3.49Å; E393-N397 PolarHBondContact O-N 3.3Å; V394-N397 PolarHBondContact O-N 3.12Å; N397-S400 PolarHBondContact O-N 3Å; N397-S400 PolarHBondContact O-OG 3.06Å; N397-S401 WeakPolarHBondContact O-CB 3.32Å; N397-S401 PolarHBondContact O-N 3.38Å
398	I	89.6	Confident	78	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.5	-46.7	173	-69.2	-54.1	0	0	0	111.3	A360 I363 Y383 L386 L387 V394 R395 L396 S401	A360-I398 HydrophobicContact CB-CD1 3.68Å; A360-I398 HydrophobicContact CB-CG1 3.87Å; I363-I398 HydrophobicContact CG2-CD1 3.95Å; Y383-I398 HydrophobicContact CD1-CG2 4.32Å; Y383-I398 HydrophobicContact CD2-CD1 3.92Å; Y383-I398 HydrophobicContact CD2-CG2 3.93Å; Y383-I398 HydrophobicContact CE1-CG2 3.78Å; Y383-I398 HydrophobicContact CE2-CB 4.22Å; Y383-I398 HydrophobicContact CE2-CD1 4.01Å; Y383-I398 HydrophobicContact CE2-CG2 3.36Å; Y383-I398 HydrophobicContact CG-CG2 4.38Å; Y383-I398 WeakPolarHBondContact OH-CG2 3.27Å; Y383-I398 PolarHBondContact OH-O 3.15Å; L386-I398 HydrophobicContact CB-CD1 3.68Å; L386-I398 HydrophobicContact CB-CG1 3.59Å; L386-I398 HydrophobicContact CD1-CD1 3.82Å; L386-I398 HydrophobicContact CG-CD1 4.41Å; L387-I398 HydrophobicContact CB-CG2 3.88Å; L387-I398 HydrophobicContact CD1-CB 4.44Å; L387-I398 HydrophobicContact CD1-CG2 3.62Å; L387-I398 HydrophobicContact CG-CG2 4.25Å; V394-I398 WeakPolarHBondContact O-CG1 3.13Å; V394-I398 PolarHBondContact O-N 3.42Å; R395-I398 PolarHBondContact O-N 2.9Å; L396-I398 VanDerWaalsContact C-N 3.35Å; L396-I398 PolarHBondContact O-N 2.77Å; I398-S401 PolarHBondContact O-N 3.26Å; I398-S401 PolarHBondContact O-OG 3.38Å
399	I	85.8	Confident	75.8	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-63.4	-45.4	178.2	-72.5	171	0	0	0	111.7	L387 R395 L396 S401 L402 L436 I440 L443 I455 H458 L462	L387-I399 HydrophobicContact CD1-CG1 4.02Å; R395-I399 WeakPolarHBondContact O-CG1 3.31Å; R395-I399 PolarHBondContact O-N 2.89Å; L396-I399 PolarHBondContact O-N 2.68Å; I399-S401 PolarHBondContact O-N 2.92Å; I399-L402 VanDerWaalsContact O-CB 3.3Å; I399-L402 WeakPolarHBondContact O-CB 3.23Å; I399-L402 WeakPolarHBondContact O-CG 3.34Å; I399-L402 PolarHBondContact O-N 3.16Å; I399-L436 HydrophobicContact CG1-CD1 3.98Å; I399-I440 HydrophobicContact CD1-CG1 4.24Å; I399-L443 HydrophobicContact CD1-CD1 3.38Å; I399-I455 HydrophobicContact CD1-CD1 3.92Å; I399-I455 HydrophobicContact CG2-CD1 4.4Å; I399-H458 HydrophobicContact CG2-CB 4.27Å; I399-L462 HydrophobicContact CG2-CD1 4.17Å; I399-L462 HydrophobicContact CG2-CD2 4Å; I399-L462 HydrophobicContact CG2-CG 4.31Å
400	S	83.6	Confident	73.1	Confident	23 Å²	23	41.9 Å²	41.9	16%	0.161	24%	0.237	C	C	.	.	H	α-helix	trans	-65.1	-29.4	179.6	71.7	0	0	0	0	112.6	L396 N397 L402 D403	L396-S400 WeakPolarHBondContact O-CB 3.47Å; L396-S400 PolarHBondContact O-N 3.4Å; L396-S400 PolarHBondContact O-OG 3.2Å; N397-S400 PolarHBondContact O-N 3Å; N397-S400 PolarHBondContact O-OG 3.06Å; S400-L402 PolarHBondContact O-N 3.38Å; S400-D403 WeakPolarHBondContact O-CB 3.5Å; S400-D403 PolarHBondContact O-N 3.49Å; S400-D403 VanDerWaalsContact O-N 3.13Å
401	S	78.1	Confident	70.6	Confident	4 Å²	4	45.3 Å²	45.3	3%	0.028	24%	0.24	C	C	.	.	H	α-helix	trans	-66.5	-19.5	177.5	77.8	0	0	0	0	113.7	N397 I398 I399 D403 K404 V405	N397-S401 WeakPolarHBondContact O-CB 3.32Å; N397-S401 PolarHBondContact O-N 3.38Å; I398-S401 PolarHBondContact O-N 3.26Å; I398-S401 PolarHBondContact O-OG 3.38Å; I399-S401 PolarHBondContact O-N 2.92Å; S401-D403 PolarHBondContact O-N 3.2Å; S401-K404 PolarHBondContact O-N 3.05Å; S401-K404 VanDerWaalsContact O-N 3.13Å; S401-V405 PolarHBondContact O-N 3.36Å
402	L	71.4	Confident	68	Low	8 Å²	8	47.6 Å²	47.6	4%	0.042	26%	0.262	C	S	.	.	H	α-helix	trans	-59.5	-28.7	172.2	-65.3	172.4	0	0	0	112	Y383 I399 S400 I423 L436 L462	Y383-L402 WeakPolarHBondContact OH-CD2 3.49Å; Y383-L402 VanDerWaalsContact OH-CG 3.3Å; Y383-L402 WeakPolarHBondContact OH-CG 3.32Å; I399-L402 VanDerWaalsContact O-CB 3.3Å; I399-L402 WeakPolarHBondContact O-CB 3.23Å; I399-L402 WeakPolarHBondContact O-CG 3.34Å; I399-L402 PolarHBondContact O-N 3.16Å; S400-L402 PolarHBondContact O-N 3.38Å; L402-I423 HydrophobicContact CD2-CB 4.35Å; L402-I423 HydrophobicContact CD2-CD1 3.81Å; L402-I423 HydrophobicContact CD2-CG2 3.96Å; L402-L436 HydrophobicContact CD1-CD1 4.29Å; L402-L436 HydrophobicContact CD1-CD2 4.17Å; L402-L462 HydrophobicContact CD1-CD2 4.2Å
403	D	63.9	Low	65.4	Low	41 Å²	41	50.5 Å²	50.5	22%	0.219	27%	0.27	C	S	.	.	H	α-helix	trans	-70	-44.7	175.4	-157.7	22.6	0	0	0	111.8	S400 S401 V405 G406 K407 L461	S400-D403 WeakPolarHBondContact O-CB 3.5Å; S400-D403 PolarHBondContact O-N 3.49Å; S400-D403 VanDerWaalsContact O-N 3.13Å; S401-D403 PolarHBondContact O-N 3.2Å; D403-V405 PolarHBondContact O-N 3.04Å; D403-G406 PolarHBondContact O-N 3.06Å; D403-G406 VanDerWaalsContact O-N 3.1Å; D403-K407 VanDerWaalsContact CG-NZ 3.26Å; D403-K407 PolarHBondContact O-N 2.94Å; D403-K407 WeakPolarHBondContact OD1-CD 3.31Å; D403-K407 WeakPolarHBondContact OD1-CE 3.47Å; D403-K407 IonicContact OD1-NZ 3.33Å; D403-K407 PolarHBondContact OD1-NZ 3.11Å; D403-K407 IonicContact OD2-NZ 3.36Å; D403-K407 PolarHBondContact OD2-NZ 3.4Å; D403-L461 HydrophobicContact CB-CD1 4.09Å; D403-L461 HydrophobicContact CB-CD2 3.47Å; D403-L461 VanDerWaalsContact CB-CD2 3.47Å; D403-L461 HydrophobicContact CB-CG 4.41Å; D403-L461 WeakPolarHBondContact OD1-CD1 3.27Å
404	K	58.2	Low	62.9	Low	97 Å²	97	50.4 Å²	50.4	42%	0.422	29%	0.286	S	S	.	.	H	α-helix	trans	-68.2	-41	-167.2	-65.7	-175.4	-177.4	175.5	0	111.7	S401 G406 K407 D408	S401-K404 PolarHBondContact O-N 3.05Å; S401-K404 VanDerWaalsContact O-N 3.13Å; K404-G406 PolarHBondContact O-N 2.73Å; K404-K407 PolarHBondContact O-N 3.35Å; K404-D408 WeakPolarHBondContact O-CB 3.47Å; K404-D408 PolarHBondContact O-N 2.83Å
405	V	53.9	Low	60.2	Low	13 Å²	13	57.4 Å²	57.4	8%	0.079	32%	0.323	C	S	.	.	H	α-helix	trans	-64.3	-31	175.8	-177.1	0	0	0	0	111	M364 S401 D403 I409 I423	M364-V405 HydrophobicContact CB-CG2 3.96Å; S401-V405 PolarHBondContact O-N 3.36Å; D403-V405 PolarHBondContact O-N 3.04Å; V405-I409 HydrophobicContact CG1-CD1 4.08Å; V405-I409 WeakPolarHBondContact O-CD1 3.38Å; V405-I409 WeakPolarHBondContact O-CG1 3.43Å; V405-I423 HydrophobicContact CB-CD1 3.96Å; V405-I423 HydrophobicContact CB-CG1 4.33Å; V405-I423 HydrophobicContact CG1-CD1 4.23Å; V405-I423 HydrophobicContact CG1-CG1 4.09Å; V405-I423 HydrophobicContact CG2-CD1 3.9Å
406	G	45.4	Very low	57.5	Low	35 Å²	35	62.6 Å²	62.6	36%	0.361	35%	0.352	S	S	.	.	H	α-helix	trans	-75	-34.2	175.7	0	0	0	0	0	114.5	D403 K404	D403-G406 PolarHBondContact O-N 3.06Å; D403-G406 VanDerWaalsContact O-N 3.1Å; K404-G406 PolarHBondContact O-N 2.73Å
407	K	43.6	Very low	54.7	Low	120 Å²	120	70.3 Å²	70.3	52%	0.522	39%	0.394	S	S	.	.	H	α-helix	trans	-94.5	-39.9	-171.8	-73.7	177.9	179.5	162.7	0	114.8	D403 K404 I409 G410	D403-K407 VanDerWaalsContact CG-NZ 3.26Å; D403-K407 PolarHBondContact O-N 2.94Å; D403-K407 WeakPolarHBondContact OD1-CD 3.31Å; D403-K407 WeakPolarHBondContact OD1-CE 3.47Å; D403-K407 IonicContact OD1-NZ 3.33Å; D403-K407 PolarHBondContact OD1-NZ 3.11Å; D403-K407 IonicContact OD2-NZ 3.36Å; D403-K407 PolarHBondContact OD2-NZ 3.4Å; K404-K407 PolarHBondContact O-N 3.35Å; K407-I409 PolarHBondContact O-N 3.39Å; K407-G410 PolarHBondContact O-N 2.94Å; K407-G410 VanDerWaalsContact O-N 3.07Å
408	D	44.4	Very low	52.2	Low	83 Å²	83	71.9 Å²	71.9	44%	0.444	41%	0.407	S	S	.	.	H	α-helix	trans	-65.6	-24.5	-178.2	-75.5	-4.4	0	0	0	111.7	R321 K404	R321-D408 IonicContact CZ-OD2 3.93Å; R321-D408 IonicContact NH1-OD2 3.24Å; R321-D408 PolarHBondContact NH1-OD2 2.93Å; R321-D408 IonicContact NH2-OD2 2.91Å; R321-D408 PolarHBondContact NH2-OD2 3.08Å; K404-D408 WeakPolarHBondContact O-CB 3.47Å; K404-D408 PolarHBondContact O-N 2.83Å
409	I	42.6	Very low	49.6	Very low	24 Å²	24	79 Å²	79	12%	0.123	44%	0.438	C	S	.	.	H	α-helix	trans	-76.4	-30	177.4	-58.9	-175.3	0	0	0	111.1	V405 K407 Y411 W413 F420	V405-I409 HydrophobicContact CG1-CD1 4.08Å; V405-I409 WeakPolarHBondContact O-CD1 3.38Å; V405-I409 WeakPolarHBondContact O-CG1 3.43Å; K407-I409 PolarHBondContact O-N 3.39Å; I409-Y411 VanDerWaalsContact C-N 3.31Å; I409-Y411 PolarHBondContact O-N 3.46Å; I409-W413 HydrophobicContact CG2-CB 4.26Å; I409-W413 HydrophobicContact CG2-CD2 3.41Å; I409-W413 VanDerWaalsContact CG2-CD2 3.41Å; I409-W413 HydrophobicContact CG2-CE3 3.65Å; I409-W413 HydrophobicContact CG2-CG 3.65Å; I409-W413 HydrophobicContact CG2-CZ2 4.31Å; I409-W413 HydrophobicContact CG2-CZ3 4.17Å; I409-W413 VanDerWaalsContact O-CB 3.27Å; I409-W413 WeakPolarHBondContact O-CB 3.39Å; I409-W413 VanDerWaalsContact O-CD1 3.26Å; I409-W413 PolarHBondContact O-N 3.29Å; I409-F420 HydrophobicContact CD1-CB 3.83Å
410	G	36.5	Very low	47.6	Very low	63 Å²	63	80.1 Å²	80.1	65%	0.649	44%	0.443	S	S	*	.	H	α-helix	trans	-66.9	-22.1	-172.1	0	0	0	0	0	115.9	K407	K407-G410 PolarHBondContact O-N 2.94Å; K407-G410 VanDerWaalsContact O-N 3.07Å
411	Y	39.1	Very low	45.8	Very low	225 Å²	225	80.8 Å²	80.8	88%	0.882	44%	0.444	S	S	*	.	H	α-helix	trans	-104.7	-24	-178.3	-69.6	-76	0	0	0	114.3	I409	I409-Y411 VanDerWaalsContact C-N 3.31Å; I409-Y411 PolarHBondContact O-N 3.46Å
412	A	38.1	Very low	44.7	Very low	74 Å²	74	86 Å²	86	61%	0.612	47%	0.467	S	S	*	.	H	α-helix	trans	-96.4	-7.5	-176.4	0	0	0	0	0	114.3
413	W	37.7	Very low	43.9	Very low	75 Å²	75	86.4 Å²	86.4	28%	0.284	47%	0.469	S	S	.	.			trans	-108.6	11.6	-162.5	-73.4	48.2	0	0	0	115.9	P368 I409 N415 C418 F420	P368-W413 HydrophobicContact CB-CZ2 4.5Å; I409-W413 HydrophobicContact CG2-CB 4.26Å; I409-W413 HydrophobicContact CG2-CD2 3.41Å; I409-W413 VanDerWaalsContact CG2-CD2 3.41Å; I409-W413 HydrophobicContact CG2-CE3 3.65Å; I409-W413 HydrophobicContact CG2-CG 3.65Å; I409-W413 HydrophobicContact CG2-CZ2 4.31Å; I409-W413 HydrophobicContact CG2-CZ3 4.17Å; I409-W413 VanDerWaalsContact O-CB 3.27Å; I409-W413 WeakPolarHBondContact O-CB 3.39Å; I409-W413 VanDerWaalsContact O-CD1 3.26Å; I409-W413 PolarHBondContact O-N 3.29Å; W413-N415 PolarHBondContact O-N 3.03Å; W413-N415 VanDerWaalsContact O-N 3.12Å; W413-C418 HydrophobicContact CE3-CB 4.08Å; W413-C418 HydrophobicContact CH2-CB 3.66Å; W413-C418 VanDerWaalsContact CZ3-C 3.44Å; W413-C418 HydrophobicContact CZ3-CB 3.44Å; W413-C418 VanDerWaalsContact CZ3-CB 3.44Å; W413-C418 WeakPolarHBondContact CZ3-O 3.45Å; W413-F420 HydrophobicContact CH2-CB 3.54Å; W413-F420 AromaticContact CH2-CD2 3.61Å; W413-F420 HydrophobicContact CH2-CD2 3.61Å; W413-F420 AromaticContact CH2-CG 3.9Å; W413-F420 HydrophobicContact CH2-CG 3.9Å; W413-F420 HydrophobicContact CZ3-CB 3.64Å; W413-F420 HydrophobicContact CZ3-CD2 4.27Å; W413-F420 HydrophobicContact CZ3-CG 4.42Å
414	A	39.2	Very low	43.4	Very low	96 Å²	96	85 Å²	85	79%	0.793	46%	0.462	S	S	*	.	S	Bend	trans	-63.9	-16.3	175.6	0	0	0	0	0	113.9
415	N	38.2	Very low	43.2	Very low	148 Å²	148	85.6 Å²	85.6	79%	0.791	47%	0.466	S	S	*	.	S	Bend	trans	-125.5	-0.7	-166.9	-72.7	-21	0	0	0	116.5	W413	W413-N415 PolarHBondContact O-N 3.03Å; W413-N415 VanDerWaalsContact O-N 3.12Å
416	N	36.4	Very low	43	Very low	129 Å²	129	86.7 Å²	86.7	69%	0.69	47%	0.472	S	S	*	.	S	Bend	trans	-136.8	124.3	179.4	-75.4	-42.3	0	0	0	110.9	C418	N416-C418 PolarHBondContact O-N 3.07Å
417	N	31.4	Very low	43.4	Very low	181 Å²	181	86 Å²	86	97%	0.968	46%	0.46	S	S	*	.			trans	-68.1	37.5	-168.6	-136.7	15.5	0	0	0	114.9
418	C	38.2	Very low	44.1	Very low	70 Å²	70	81.8 Å²	81.8	47%	0.473	45%	0.451	S	S	.	.			trans	-88.5	130.5	176.1	-162.6	0	0	0	0	108.7	W413 N416	W413-C418 HydrophobicContact CE3-CB 4.08Å; W413-C418 HydrophobicContact CH2-CB 3.66Å; W413-C418 VanDerWaalsContact CZ3-C 3.44Å; W413-C418 HydrophobicContact CZ3-CB 3.44Å; W413-C418 VanDerWaalsContact CZ3-CB 3.44Å; W413-C418 WeakPolarHBondContact CZ3-O 3.45Å; N416-C418 PolarHBondContact O-N 3.07Å
419	F	36.6	Very low	44.8	Very low	149 Å²	149	80.6 Å²	80.6	65%	0.654	45%	0.446	S	S	*	.			trans	-103.2	79.8	-178.8	-169.5	-114.7	0	0	0	107.8	N372 L421	N372-F419 PolarHBondContact ND2-O 3.46Å; F419-L421 VanDerWaalsContact C-N 3.35Å; F419-L421 HydrophobicContact CD1-CD1 3.94Å; F419-L421 HydrophobicContact CD1-CD2 3.78Å; F419-L421 HydrophobicContact CD1-CG 3.53Å; F419-L421 HydrophobicContact CD2-CD2 4.48Å; F419-L421 HydrophobicContact CE1-CD1 3.58Å; F419-L421 HydrophobicContact CE1-CD2 3.09Å; F419-L421 HydrophobicContact CE1-CG 3.3Å; F419-L421 HydrophobicContact CE2-CD2 3.88Å; F419-L421 HydrophobicContact CG-CD2 4.44Å; F419-L421 HydrophobicContact CG-CG 4.33Å; F419-L421 HydrophobicContact CZ-CD1 4.47Å; F419-L421 HydrophobicContact CZ-CD2 3.14Å; F419-L421 HydrophobicContact CZ-CG 3.9Å; F419-L421 PolarHBondContact O-N 3.23Å
420	F	43	Very low	45.9	Very low	25 Å²	25	85.5 Å²	85.5	11%	0.11	47%	0.473	C	S	.	.			trans	-90.6	89.5	163.6	-100.5	-99	0	0	0	107.5	A367 G371 N372 I409 W413	A367-F420 HydrophobicContact CB-CE1 4.1Å; A367-F420 WeakPolarHBondContact O-CZ 3.31Å; G371-F420 VanDerWaalsContact C-CZ 3.49Å; N372-F420 WeakPolarHBondContact OD1-CD1 3.48Å; N372-F420 VanDerWaalsContact OD1-CE1 3.25Å; N372-F420 WeakPolarHBondContact OD1-CE1 3.32Å; N372-F420 WeakPolarHBondContact OD1-CE2 3.43Å; N372-F420 VanDerWaalsContact OD1-CZ 3.27Å; N372-F420 WeakPolarHBondContact OD1-CZ 3.36Å; I409-F420 HydrophobicContact CD1-CB 3.83Å; W413-F420 HydrophobicContact CH2-CB 3.54Å; W413-F420 AromaticContact CH2-CD2 3.61Å; W413-F420 HydrophobicContact CH2-CD2 3.61Å; W413-F420 AromaticContact CH2-CG 3.9Å; W413-F420 HydrophobicContact CH2-CG 3.9Å; W413-F420 HydrophobicContact CZ3-CB 3.64Å; W413-F420 HydrophobicContact CZ3-CD2 4.27Å; W413-F420 HydrophobicContact CZ3-CG 4.42Å
421	L	45.7	Very low	47.1	Very low	36 Å²	36	87.4 Å²	87.4	19%	0.188	47%	0.465	C	S	.	.			trans	-42.8	139.6	159.1	-74.8	177.9	0	0	0	110.4	F419 I423 E425 V426	F419-L421 VanDerWaalsContact C-N 3.35Å; F419-L421 HydrophobicContact CD1-CD1 3.94Å; F419-L421 HydrophobicContact CD1-CD2 3.78Å; F419-L421 HydrophobicContact CD1-CG 3.53Å; F419-L421 HydrophobicContact CD2-CD2 4.48Å; F419-L421 HydrophobicContact CE1-CD1 3.58Å; F419-L421 HydrophobicContact CE1-CD2 3.09Å; F419-L421 HydrophobicContact CE1-CG 3.3Å; F419-L421 HydrophobicContact CE2-CD2 3.88Å; F419-L421 HydrophobicContact CG-CD2 4.44Å; F419-L421 HydrophobicContact CG-CG 4.33Å; F419-L421 HydrophobicContact CZ-CD1 4.47Å; F419-L421 HydrophobicContact CZ-CD2 3.14Å; F419-L421 HydrophobicContact CZ-CG 3.9Å; F419-L421 PolarHBondContact O-N 3.23Å; L421-I423 PolarHBondContact O-N 3.28Å; L421-E425 WeakPolarHBondContact CA-OE2 3.36Å; L421-E425 HydrophobicContact CB-CB 3.56Å; L421-E425 HydrophobicContact CD1-CB 4.19Å; L421-E425 HydrophobicContact CD2-CB 3.68Å; L421-E425 HydrophobicContact CD2-CG 4.17Å; L421-E425 WeakPolarHBondContact CD2-OE2 3.46Å; L421-E425 HydrophobicContact CG-CB 3.99Å; L421-V426 HydrophobicContact CB-CG2 3.45Å; L421-V426 VanDerWaalsContact CB-CG2 3.45Å; L421-V426 HydrophobicContact CD1-CG2 4.26Å; L421-V426 HydrophobicContact CG-CG2 4.49Å
422	K	55.7	Low	48.3	Very low	113 Å²	113	76.8 Å²	76.8	49%	0.491	42%	0.423	S	S	.	.			trans	-47	147	167.3	-70.5	172.8	-179.1	168.5	0	107.8	N424 E425 V426	K422-N424 CarbonylContact O-C 3.58Å; K422-N424 PolarHBondContact O-N 3.27Å; K422-E425 HydrophobicContact CB-CG 4.33Å; K422-E425 PolarHBondContact N-OE2 3.1Å; K422-E425 WeakPolarHBondContact O-CA 3.46Å; K422-E425 WeakPolarHBondContact O-CB 3.35Å; K422-E425 PolarHBondContact O-N 2.97Å; K422-V426 PolarHBondContact O-N 3.44Å
423	I	55.1	Low	49.8	Very low	17 Å²	17	74.1 Å²	74.1	9%	0.087	40%	0.399	C	S	.	.	H	α-helix	trans	-46.1	-36	177.9	-74	173.5	0	0	0	111.6	M364 L402 V405 L421 E425 V426 I427 L432	M364-I423 HydrophobicContact CE-CD1 3.81Å; M364-I423 HydrophobicContact CE-CG1 4.24Å; L402-I423 HydrophobicContact CD2-CB 4.35Å; L402-I423 HydrophobicContact CD2-CD1 3.81Å; L402-I423 HydrophobicContact CD2-CG2 3.96Å; V405-I423 HydrophobicContact CB-CD1 3.96Å; V405-I423 HydrophobicContact CB-CG1 4.33Å; V405-I423 HydrophobicContact CG1-CD1 4.23Å; V405-I423 HydrophobicContact CG1-CG1 4.09Å; V405-I423 HydrophobicContact CG2-CD1 3.9Å; L421-I423 PolarHBondContact O-N 3.28Å; I423-E425 PolarHBondContact O-N 3.45Å; I423-V426 PolarHBondContact O-N 3.48Å; I423-I427 HydrophobicContact CG2-CD1 3.37Å; I423-I427 HydrophobicContact CG2-CG1 4.35Å; I423-I427 WeakPolarHBondContact O-CB 3.36Å; I423-I427 WeakPolarHBondContact O-CG1 3.38Å; I423-I427 PolarHBondContact O-N 3.47Å; I423-L432 HydrophobicContact CG2-CD1 4.33Å; I423-L432 HydrophobicContact CG2-CD2 4.3Å
424	N	53.2	Low	51.7	Low	13 Å²	13	77.7 Å²	77.7	7%	0.07	42%	0.419	C	S	.	.	H	α-helix	trans	-64	-34	175.9	-56.1	-8.3	0	0	0	114.5	K422 G428 V429 L432 Q465	K422-N424 CarbonylContact O-C 3.58Å; K422-N424 PolarHBondContact O-N 3.27Å; N424-G428 CarbonylContact O-C 3.57Å; N424-G428 VanDerWaalsContact O-CA 3.26Å; N424-G428 WeakPolarHBondContact O-CA 3.17Å; N424-G428 PolarHBondContact O-N 3.21Å; N424-G428 VanDerWaalsContact O-N 3.13Å; N424-V429 HydrophobicContact CB-CG2 4.2Å; N424-V429 PolarHBondContact O-N 3.48Å; N424-L432 WeakPolarHBondContact OD1-CD2 3.13Å; N424-Q465 VanDerWaalsContact ND2-C 3.3Å; N424-Q465 WeakPolarHBondContact ND2-CA 3.45Å; N424-Q465 WeakPolarHBondContact ND2-CB 3.47Å; N424-Q465 PolarHBondContact ND2-O 3.38Å; N424-Q465 PolarHBondContact ND2-OE1 3.27Å
425	E	53.9	Low	53.4	Low	108 Å²	108	73.8 Å²	73.8	51%	0.505	39%	0.386	S	S	.	.	H	α-helix	trans	-79.4	-26.1	179.1	-72.3	167.7	165.2	0	0	111.7	L421 K422 I423	L421-E425 WeakPolarHBondContact CA-OE2 3.36Å; L421-E425 HydrophobicContact CB-CB 3.56Å; L421-E425 HydrophobicContact CD1-CB 4.19Å; L421-E425 HydrophobicContact CD2-CB 3.68Å; L421-E425 HydrophobicContact CD2-CG 4.17Å; L421-E425 WeakPolarHBondContact CD2-OE2 3.46Å; L421-E425 HydrophobicContact CG-CB 3.99Å; K422-E425 HydrophobicContact CB-CG 4.33Å; K422-E425 PolarHBondContact N-OE2 3.1Å; K422-E425 WeakPolarHBondContact O-CA 3.46Å; K422-E425 WeakPolarHBondContact O-CB 3.35Å; K422-E425 PolarHBondContact O-N 2.97Å; I423-E425 PolarHBondContact O-N 3.45Å
426	V	48.5	Very low	55.4	Low	36 Å²	36	66.9 Å²	66.9	22%	0.218	35%	0.349	C	S	.	.	H	α-helix	trans	-82.9	-45.5	176.4	-175.4	0	0	0	0	112.2	I376 L421 K422 I423	I376-V426 HydrophobicContact CD1-CG1 3.52Å; I376-V426 HydrophobicContact CG1-CG1 3.47Å; I376-V426 VanDerWaalsContact CG1-CG1 3.47Å; L421-V426 HydrophobicContact CB-CG2 3.45Å; L421-V426 VanDerWaalsContact CB-CG2 3.45Å; L421-V426 HydrophobicContact CD1-CG2 4.26Å; L421-V426 HydrophobicContact CG-CG2 4.49Å; K422-V426 PolarHBondContact O-N 3.44Å; I423-V426 PolarHBondContact O-N 3.48Å
427	I	55.3	Low	57.7	Low	22 Å²	22	62.5 Å²	62.5	11%	0.113	33%	0.325	C	S	.	.	H	α-helix	trans	-82.8	-22.1	-175.7	-61.2	169.3	0	0	0	111.2	L380 I423 Q431 L432	L380-I427 HydrophobicContact CD1-CD1 3.35Å; L380-I427 HydrophobicContact CD1-CG1 3.85Å; L380-I427 HydrophobicContact CD2-CD1 4.36Å; L380-I427 HydrophobicContact CD2-CG1 3.9Å; L380-I427 HydrophobicContact CD2-CG2 4.42Å; L380-I427 HydrophobicContact CG-CD1 4.46Å; I423-I427 HydrophobicContact CG2-CD1 3.37Å; I423-I427 HydrophobicContact CG2-CG1 4.35Å; I423-I427 WeakPolarHBondContact O-CB 3.36Å; I423-I427 WeakPolarHBondContact O-CG1 3.38Å; I423-I427 PolarHBondContact O-N 3.47Å; I427-Q431 HydrophobicContact CG2-CB 3.82Å; I427-Q431 HydrophobicContact CG2-CG 4.13Å; I427-L432 HydrophobicContact CD1-CD1 3.92Å; I427-L432 HydrophobicContact CG2-CB 4.04Å
428	G	57.5	Low	60.3	Low	31 Å²	31	57.1 Å²	57.1	32%	0.32	30%	0.3	S	S	.	.			trans	76.4	133.9	-160.7	0	0	0	0	0	110.2	N424 D430 Q431 L432	N424-G428 CarbonylContact O-C 3.57Å; N424-G428 VanDerWaalsContact O-CA 3.26Å; N424-G428 WeakPolarHBondContact O-CA 3.17Å; N424-G428 PolarHBondContact O-N 3.21Å; N424-G428 VanDerWaalsContact O-N 3.13Å; G428-D430 PolarHBondContact O-N 3.29Å; G428-D430 VanDerWaalsContact O-N 3.11Å; G428-Q431 PolarHBondContact O-N 2.86Å; G428-L432 PolarHBondContact O-N 3.01Å
429	V	59.6	Low	62.6	Low	58 Å²	58	54 Å²	54	35%	0.352	28%	0.279	S	S	.	.	H	α-helix	trans	-54	-35.1	-179.8	-179.4	0	0	0	0	111	N424 T433	N424-V429 HydrophobicContact CB-CG2 4.2Å; N424-V429 PolarHBondContact O-N 3.48Å; V429-T433 WeakPolarHBondContact O-CB 3.47Å; V429-T433 PolarHBondContact O-N 3.3Å; V429-T433 PolarHBondContact O-OG1 3.39Å
430	D	65.4	Low	65	Low	126 Å²	126	47 Å²	47	67%	0.674	25%	0.249	S	C	*	.	H	α-helix	trans	-67.2	-44.7	-176.7	-63.7	-32.8	0	0	0	113.3	G428 T433 Q434	G428-D430 PolarHBondContact O-N 3.29Å; G428-D430 VanDerWaalsContact O-N 3.11Å; D430-T433 WeakPolarHBondContact O-CB 3.37Å; D430-T433 PolarHBondContact O-N 3.34Å; D430-Q434 WeakPolarHBondContact O-CG 3.29Å; D430-Q434 PolarHBondContact O-N 3.19Å
431	Q	62	Low	67.3	Low	104 Å²	104	46.9 Å²	46.9	49%	0.486	25%	0.251	S	S	.	.	H	α-helix	trans	-74.4	-36.1	-177.4	-172.4	172.9	29.9	0	0	111.4	I427 G428 S435	I427-Q431 HydrophobicContact CG2-CB 3.82Å; I427-Q431 HydrophobicContact CG2-CG 4.13Å; G428-Q431 PolarHBondContact O-N 2.86Å; Q431-S435 PolarHBondContact O-N 3.43Å
432	L	63.5	Low	69.4	Low	1 Å²	1	49.6 Å²	49.6	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-64.3	-47.6	171.4	-170.7	71	0	0	0	110.1	Y383 I423 N424 I427 G428 Q434 S435 L436	Y383-L432 HydrophobicContact CE1-CD1 4.46Å; I423-L432 HydrophobicContact CG2-CD1 4.33Å; I423-L432 HydrophobicContact CG2-CD2 4.3Å; N424-L432 WeakPolarHBondContact OD1-CD2 3.13Å; I427-L432 HydrophobicContact CD1-CD1 3.92Å; I427-L432 HydrophobicContact CG2-CB 4.04Å; G428-L432 PolarHBondContact O-N 3.01Å; L432-Q434 VanDerWaalsContact C-N 3.34Å; L432-Q434 PolarHBondContact O-N 3.1Å; L432-S435 PolarHBondContact O-N 2.95Å; L432-S435 VanDerWaalsContact O-N 3.14Å; L432-L436 HydrophobicContact CD2-CD2 4.47Å; L432-L436 HydrophobicContact CG-CB 4.46Å; L432-L436 HydrophobicContact CG-CD2 4.37Å; L432-L436 WeakPolarHBondContact O-CB 3.32Å; L432-L436 PolarHBondContact O-N 3.26Å
433	T	69.8	Low	71.1	Confident	19 Å²	19	44.2 Å²	44.2	12%	0.117	24%	0.242	C	C	.	.	H	α-helix	trans	-51.9	-48.1	175.8	-75.2	0	0	0	0	112.5	V429 D430 S435 L436 L437 F470	V429-T433 WeakPolarHBondContact O-CB 3.47Å; V429-T433 PolarHBondContact O-N 3.3Å; V429-T433 PolarHBondContact O-OG1 3.39Å; D430-T433 WeakPolarHBondContact O-CB 3.37Å; D430-T433 PolarHBondContact O-N 3.34Å; T433-S435 PolarHBondContact O-N 2.75Å; T433-L436 PolarHBondContact O-N 3.03Å; T433-L437 VanDerWaalsContact O-CB 3.24Å; T433-L437 WeakPolarHBondContact O-CB 3.36Å; T433-L437 PolarHBondContact O-N 3.18Å; T433-F470 HydrophobicContact CG2-CD2 4.07Å; T433-F470 HydrophobicContact CG2-CE2 3.14Å; T433-F470 HydrophobicContact CG2-CZ 3.48Å; T433-F470 VanDerWaalsContact CG2-CZ 3.48Å
434	Q	77.3	Confident	73	Confident	149 Å²	149	43.5 Å²	43.5	70%	0.696	24%	0.238	S	C	*	.	H	α-helix	trans	-61.9	-30.4	-177.8	-77.5	180	8.2	0	0	113.2	D430 L432 P438	D430-Q434 WeakPolarHBondContact O-CG 3.29Å; D430-Q434 PolarHBondContact O-N 3.19Å; L432-Q434 VanDerWaalsContact C-N 3.34Å; L432-Q434 PolarHBondContact O-N 3.1Å; Q434-P438 WeakPolarHBondContact O-CD 3.49Å
435	S	75.1	Confident	74.9	Confident	15 Å²	15	47.4 Å²	47.4	11%	0.105	26%	0.256	C	S	.	.	H	α-helix	trans	-95.4	-32.1	179.7	-58.4	0	0	0	0	113.2	Q431 L432 T433	Q431-S435 PolarHBondContact O-N 3.43Å; L432-S435 PolarHBondContact O-N 2.95Å; L432-S435 VanDerWaalsContact O-N 3.14Å; T433-S435 PolarHBondContact O-N 2.75Å
436	L	79.9	Confident	76.7	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-80.8	-37.3	-175.6	-172.4	69.3	0	0	0	112.3	L387 I399 L402 L432 T433 A439 I440 L462 L466	L387-L436 HydrophobicContact CD1-CD1 3.83Å; L387-L436 HydrophobicContact CD2-CB 4.26Å; L387-L436 HydrophobicContact CD2-CD1 3.89Å; L387-L436 HydrophobicContact CG-CD1 4.47Å; I399-L436 HydrophobicContact CG1-CD1 3.98Å; L402-L436 HydrophobicContact CD1-CD1 4.29Å; L402-L436 HydrophobicContact CD1-CD2 4.17Å; L432-L436 HydrophobicContact CD2-CD2 4.47Å; L432-L436 HydrophobicContact CG-CB 4.46Å; L432-L436 HydrophobicContact CG-CD2 4.37Å; L432-L436 WeakPolarHBondContact O-CB 3.32Å; L432-L436 PolarHBondContact O-N 3.26Å; T433-L436 PolarHBondContact O-N 3.03Å; L436-A439 PolarHBondContact O-N 3.44Å; L436-I440 HydrophobicContact CD1-CD1 4.32Å; L436-I440 HydrophobicContact CD1-CG1 4.36Å; L436-I440 HydrophobicContact CD2-CD1 3.9Å; L436-I440 HydrophobicContact CG-CD1 3.59Å; L436-I440 HydrophobicContact CG-CG1 4.06Å; L436-I440 WeakPolarHBondContact O-CG1 3.15Å; L436-I440 PolarHBondContact O-N 3.13Å; L436-L462 HydrophobicContact CD2-CD2 4.16Å; L436-L466 HydrophobicContact CD2-CD1 4.32Å; L436-L466 HydrophobicContact CD2-CD2 4.1Å
437	L	84.3	Confident	78.8	Confident	37 Å²	37	48.7 Å²	48.7	19%	0.194	27%	0.27	C	S	.	.	H	α-helix	trans	-59.8	-48.4	-178.1	-178.9	65.5	0	0	0	112.3	T433 A439 I440 V441 F470 K474 L475	T433-L437 VanDerWaalsContact O-CB 3.24Å; T433-L437 WeakPolarHBondContact O-CB 3.36Å; T433-L437 PolarHBondContact O-N 3.18Å; L437-A439 VanDerWaalsContact C-N 3.32Å; L437-A439 PolarHBondContact O-N 2.87Å; L437-I440 PolarHBondContact O-N 2.94Å; L437-V441 HydrophobicContact CD1-CG2 4.03Å; L437-V441 HydrophobicContact CG-CG2 4.34Å; L437-V441 VanDerWaalsContact O-CG2 3.27Å; L437-V441 WeakPolarHBondContact O-CG2 3.4Å; L437-V441 PolarHBondContact O-N 3.3Å; L437-F470 HydrophobicContact CB-CZ 4.46Å; L437-F470 HydrophobicContact CD1-CZ 4.25Å; L437-F470 HydrophobicContact CD2-CZ 4.33Å; L437-K474 HydrophobicContact CD1-CB 4.01Å; L437-K474 HydrophobicContact CD2-CB 4.32Å; L437-K474 HydrophobicContact CD2-CD 4.06Å; L437-K474 HydrophobicContact CD2-CG 4.21Å; L437-L475 HydrophobicContact CD1-CD2 3.78Å
438	P	86.8	Confident	80.6	Confident	68 Å²	68	54.7 Å²	54.7	44%	0.442	30%	0.295	S	S	.	.	H	α-helix	trans	-55.5	-46.3	175.4	-25.4	35	0	0	0	112.6	Q434 I440 V441 D442	Q434-P438 WeakPolarHBondContact O-CD 3.49Å; P438-I440 PolarHBondContact O-N 3.39Å; P438-V441 PolarHBondContact O-N 3.15Å; P438-D442 WeakPolarHBondContact O-CB 3.42Å; P438-D442 PolarHBondContact O-N 3.36Å
439	A	86.4	Confident	82.5	Confident	4 Å²	4	57.2 Å²	57.2	3%	0.033	30%	0.295	C	S	.	.	H	α-helix	trans	-64.1	-40.6	179.7	0	0	0	0	0	113	L387 L436 L437 L443	L387-A439 HydrophobicContact CD1-CB 3.7Å; L387-A439 HydrophobicContact CG-CB 3.82Å; L387-A439 WeakPolarHBondContact O-CB 3.46Å; L436-A439 PolarHBondContact O-N 3.44Å; L437-A439 VanDerWaalsContact C-N 3.32Å; L437-A439 PolarHBondContact O-N 2.87Å; A439-L443 WeakPolarHBondContact O-CB 3.48Å; A439-L443 WeakPolarHBondContact O-CD1 3.31Å; A439-L443 WeakPolarHBondContact O-CG 3.33Å; A439-L443 PolarHBondContact O-N 3.39Å; A439-L443 VanDerWaalsContact O-N 3.07Å
440	I	88.1	Confident	84.1	Confident	2 Å²	2	63 Å²	63	1%	0.01	31%	0.31	C	S	.	.	H	α-helix	trans	-62.7	-45.2	175	-69.1	168.4	0	0	0	110.2	I399 L436 L437 P438 L443 A444 I455 M459 L462 L466 L475	I399-I440 HydrophobicContact CD1-CG1 4.24Å; L436-I440 HydrophobicContact CD1-CD1 4.32Å; L436-I440 HydrophobicContact CD1-CG1 4.36Å; L436-I440 HydrophobicContact CD2-CD1 3.9Å; L436-I440 HydrophobicContact CG-CD1 3.59Å; L436-I440 HydrophobicContact CG-CG1 4.06Å; L436-I440 WeakPolarHBondContact O-CG1 3.15Å; L436-I440 PolarHBondContact O-N 3.13Å; L437-I440 PolarHBondContact O-N 2.94Å; P438-I440 PolarHBondContact O-N 3.39Å; I440-L443 PolarHBondContact O-N 3.39Å; I440-A444 WeakPolarHBondContact O-CB 3.49Å; I440-A444 PolarHBondContact O-N 3.23Å; I440-I455 HydrophobicContact CG1-CD1 4.5Å; I440-I455 HydrophobicContact CG2-CD1 4.44Å; I440-I455 HydrophobicContact CG2-CG1 4.38Å; I440-M459 HydrophobicContact CG2-CE 4.25Å; I440-L462 HydrophobicContact CD1-CD1 3.82Å; I440-L462 HydrophobicContact CD1-CD2 4.07Å; I440-L462 HydrophobicContact CD1-CG 4.47Å; I440-L462 HydrophobicContact CG1-CD1 4.04Å; I440-L466 HydrophobicContact CD1-CD1 4.3Å; I440-L475 HydrophobicContact CG2-CD2 3.83Å
441	V	90.7	Very high	85.4	Confident	24 Å²	24	57.7 Å²	57.7	15%	0.145	28%	0.283	C	S	.	.	H	α-helix	trans	-63.4	-46.7	-179.4	170.9	0	0	0	0	110.8	L437 P438 L443 A444 E445 Y478	L437-V441 HydrophobicContact CD1-CG2 4.03Å; L437-V441 HydrophobicContact CG-CG2 4.34Å; L437-V441 VanDerWaalsContact O-CG2 3.27Å; L437-V441 WeakPolarHBondContact O-CG2 3.4Å; L437-V441 PolarHBondContact O-N 3.3Å; P438-V441 PolarHBondContact O-N 3.15Å; V441-L443 VanDerWaalsContact C-N 3.29Å; V441-L443 PolarHBondContact O-N 2.74Å; V441-A444 WeakPolarHBondContact O-CB 3.46Å; V441-A444 PolarHBondContact O-N 3.08Å; V441-A444 VanDerWaalsContact O-N 3.1Å; V441-E445 PolarHBondContact O-N 3.11Å; V441-Y478 HydrophobicContact CB-CE1 4.48Å; V441-Y478 HydrophobicContact CG1-CE1 3.9Å; V441-Y478 VanDerWaalsContact CG1-OH 3.3Å; V441-Y478 WeakPolarHBondContact CG1-OH 3.48Å; V441-Y478 HydrophobicContact CG2-CE1 4.2Å; V441-Y478 HydrophobicContact CG2-CE2 3.83Å; V441-Y478 WeakPolarHBondContact CG2-OH 3.48Å
442	D	89.9	Confident	87	Confident	93 Å²	93	53.2 Å²	53.2	50%	0.497	26%	0.262	S	S	.	.	H	α-helix	trans	-60.8	-39.2	178.6	-68.5	-15.8	0	0	0	111.7	P438 D446	P438-D442 WeakPolarHBondContact O-CB 3.42Å; P438-D442 PolarHBondContact O-N 3.36Å; D442-D446 PolarHBondContact O-N 3.1Å
443	L	92	Very high	88.6	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-71.7	-35.9	174.7	-68.8	169	0	0	0	112.7	A392 R395 L396 I399 A439 I440 V441 E445 V451 I455	A392-L443 HydrophobicContact CB-CD2 3.79Å; R395-L443 HydrophobicContact CB-CD1 3.94Å; R395-L443 HydrophobicContact CB-CD2 4.3Å; R395-L443 HydrophobicContact CB-CG 4.44Å; L396-L443 HydrophobicContact CD2-CD1 4.04Å; L396-L443 HydrophobicContact CD2-CD2 4.41Å; L396-L443 HydrophobicContact CG-CD1 4.26Å; L396-L443 HydrophobicContact CG-CD2 4.08Å; I399-L443 HydrophobicContact CD1-CD1 3.38Å; A439-L443 WeakPolarHBondContact O-CB 3.48Å; A439-L443 WeakPolarHBondContact O-CD1 3.31Å; A439-L443 WeakPolarHBondContact O-CG 3.33Å; A439-L443 PolarHBondContact O-N 3.39Å; A439-L443 VanDerWaalsContact O-N 3.07Å; I440-L443 PolarHBondContact O-N 3.39Å; V441-L443 VanDerWaalsContact C-N 3.29Å; V441-L443 PolarHBondContact O-N 2.74Å; L443-E445 VanDerWaalsContact C-N 3.26Å; L443-E445 PolarHBondContact O-N 3.45Å; L443-V451 HydrophobicContact CB-CG1 4.39Å; L443-V451 HydrophobicContact CD2-CG1 3.47Å; L443-V451 VanDerWaalsContact CD2-CG1 3.47Å; L443-I455 HydrophobicContact CB-CB 4.12Å; L443-I455 HydrophobicContact CB-CG1 4.22Å; L443-I455 HydrophobicContact CB-CG2 4.29Å; L443-I455 HydrophobicContact CD1-CD1 4.33Å
444	A	93.5	Very high	89.7	Confident	2 Å²	2	55.1 Å²	55.1	2%	0.017	27%	0.274	C	S	.	.	H	α-helix	trans	-67.3	-28.2	179.9	0	0	0	0	0	112.9	I440 V441 R452 Y478 W482	I440-A444 WeakPolarHBondContact O-CB 3.49Å; I440-A444 PolarHBondContact O-N 3.23Å; V441-A444 WeakPolarHBondContact O-CB 3.46Å; V441-A444 PolarHBondContact O-N 3.08Å; V441-A444 VanDerWaalsContact O-N 3.1Å; A444-R452 VanDerWaalsContact O-CD 3.24Å; A444-R452 WeakPolarHBondContact O-CD 3.39Å; A444-Y478 HydrophobicContact CB-CD1 4.12Å; A444-W482 HydrophobicContact CB-CH2 4.44Å; A444-W482 HydrophobicContact CB-CZ2 3.45Å; A444-W482 VanDerWaalsContact CB-CZ2 3.45Å; A444-W482 PolarHBondContact O-NE1 2.85Å
445	E	93.2	Very high	90.4	Very high	95 Å²	95	48 Å²	48	44%	0.444	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	8	-178.1	-57.8	-165.2	152.2	0	0	113.6	V441 L443 Y478 K481	V441-E445 PolarHBondContact O-N 3.11Å; L443-E445 VanDerWaalsContact C-N 3.26Å; L443-E445 PolarHBondContact O-N 3.45Å; E445-Y478 HydrophobicContact CG-CD1 4.34Å; E445-Y478 HydrophobicContact CG-CE1 4.09Å; E445-Y478 WeakPolarHBondContact OE1-CE1 3.47Å; E445-K481 IonicContact OE1-NZ 2.65Å; E445-K481 PolarHBondContact OE1-NZ 2.62Å
446	D	93.3	Very high	91.4	Very high	33 Å²	33	47.4 Å²	47.4	18%	0.176	24%	0.236	C	C	.	.			trans	-55.3	140.8	-178.6	-165.6	-67.9	0	0	0	111.6	D442 K448 V451 R452	D442-D446 PolarHBondContact O-N 3.1Å; D446-K448 PolarHBondContact O-N 3.39Å; D446-K448 WeakPolarHBondContact OD1-CB 3.13Å; D446-K448 PolarHBondContact OD1-N 3.26Å; D446-V451 HydrophobicContact CB-CB 3.79Å; D446-V451 HydrophobicContact CB-CG1 3.58Å; D446-R452 HydrophobicContact CB-CG 4.34Å; D446-R452 VanDerWaalsContact O-CD 3.27Å; D446-R452 WeakPolarHBondContact O-CD 3.43Å; D446-R452 VanDerWaalsContact O-CG 3.28Å; D446-R452 WeakPolarHBondContact O-CG 3.16Å; D446-R452 PolarHBondContact O-NH1 3.09Å
447	V	92.6	Very high	92	Very high	137 Å²	137	53.2 Å²	53.2	83%	0.83	26%	0.263	S	S	*	.	S	Bend	trans	-58.8	-37.9	179.6	-178.7	0	0	0	0	111.1	W449 R452	V447-W449 PolarHBondContact O-N 3.48Å; V447-R452 PolarHBondContact O-NH1 3.35Å
448	K	93.1	Very high	92.2	Very high	149 Å²	149	53.9 Å²	53.9	65%	0.648	27%	0.265	S	S	*	.	S	Bend	trans	-79.7	113.4	179.8	-64.2	170.8	-175.6	155.4	0	109.5	D446 R450 V451 R452	D446-K448 PolarHBondContact O-N 3.39Å; D446-K448 WeakPolarHBondContact OD1-CB 3.13Å; D446-K448 PolarHBondContact OD1-N 3.26Å; K448-R450 PolarHBondContact O-N 3.3Å; K448-R450 VanDerWaalsContact O-N 3.11Å; K448-V451 HydrophobicContact CB-CG2 4Å; K448-V451 WeakPolarHBondContact O-CB 3.22Å; K448-V451 PolarHBondContact O-N 3.3Å; K448-R452 PolarHBondContact O-N 3.47Å
449	W	95.7	Very high	92.5	Very high	84 Å²	84	50.6 Å²	50.6	32%	0.318	24%	0.244	S	C	.	.	H	α-helix	trans	-57.8	-31.1	179.8	73.9	-93.4	0	0	0	113.1	V447 V451 R452 L453 V487 A489 I490	V447-W449 PolarHBondContact O-N 3.48Å; W449-V451 VanDerWaalsContact C-N 3.25Å; W449-V451 PolarHBondContact O-N 3.13Å; W449-R452 PolarHBondContact O-N 3.2Å; W449-R452 VanDerWaalsContact O-N 3.16Å; W449-L453 HydrophobicContact CE3-CB 4.37Å; W449-L453 HydrophobicContact CE3-CD2 4.49Å; W449-L453 HydrophobicContact CZ3-CB 4.48Å; W449-L453 HydrophobicContact CZ3-CD2 3.81Å; W449-L453 WeakPolarHBondContact O-CB 3.4Å; W449-L453 PolarHBondContact O-N 3.14Å; W449-V487 HydrophobicContact CB-CB 4.34Å; W449-V487 HydrophobicContact CB-CG1 4.31Å; W449-V487 HydrophobicContact CB-CG2 3.85Å; W449-V487 HydrophobicContact CD2-CG1 4.2Å; W449-V487 HydrophobicContact CE3-CG1 4.38Å; W449-V487 HydrophobicContact CG-CG1 4.17Å; W449-V487 HydrophobicContact CG-CG2 4.21Å; W449-A489 HydrophobicContact CE3-CB 4.36Å; W449-A489 HydrophobicContact CZ3-CB 3.95Å; W449-I490 HydrophobicContact CB-CD1 4.29Å; W449-I490 HydrophobicContact CB-CG1 4.08Å; W449-I490 HydrophobicContact CE3-CD1 4.23Å; W449-I490 WeakPolarHBondContact O-CD1 3.4Å
450	R	94.6	Very high	92.6	Very high	178 Å²	178	51.3 Å²	51.3	67%	0.672	25%	0.248	S	C	*	.	H	α-helix	trans	-61.1	-32.6	175.2	-71.8	-175.3	173.6	85.6	-1.9	113.2	K448 A454	K448-R450 PolarHBondContact O-N 3.3Å; K448-R450 VanDerWaalsContact O-N 3.11Å; R450-A454 PolarHBondContact O-N 3.31Å; R450-A454 VanDerWaalsContact O-N 3.15Å
451	V	92.8	Very high	92.4	Very high	16 Å²	16	52.4 Å²	52.4	10%	0.097	25%	0.254	C	S	.	.	H	α-helix	trans	-70.2	-45.9	174.4	176.7	0	0	0	0	110.1	A392 L396 L443 D446 K448 W449 L453 A454 I455	A392-V451 HydrophobicContact CB-CB 4.38Å; A392-V451 HydrophobicContact CB-CG1 3.69Å; A392-V451 HydrophobicContact CB-CG2 3.72Å; L396-V451 HydrophobicContact CD1-CG1 4.48Å; L443-V451 HydrophobicContact CB-CG1 4.39Å; L443-V451 HydrophobicContact CD2-CG1 3.47Å; L443-V451 VanDerWaalsContact CD2-CG1 3.47Å; D446-V451 HydrophobicContact CB-CB 3.79Å; D446-V451 HydrophobicContact CB-CG1 3.58Å; K448-V451 HydrophobicContact CB-CG2 4Å; K448-V451 WeakPolarHBondContact O-CB 3.22Å; K448-V451 PolarHBondContact O-N 3.3Å; W449-V451 VanDerWaalsContact C-N 3.25Å; W449-V451 PolarHBondContact O-N 3.13Å; V451-L453 VanDerWaalsContact C-N 3.28Å; V451-L453 PolarHBondContact O-N 3.37Å; V451-A454 PolarHBondContact O-N 3.34Å; V451-I455 PolarHBondContact O-N 3.48Å
452	R	95.5	Very high	92.1	Very high	10 Å²	10	51.3 Å²	51.3	4%	0.038	25%	0.247	C	C	.	.	H	α-helix	trans	-58.7	-40.3	174.3	-58	-160.7	-59.5	-78.6	4.6	112	A444 D446 V447 K448 W449 I455 I456 D485 H486 I490	A444-R452 VanDerWaalsContact O-CD 3.24Å; A444-R452 WeakPolarHBondContact O-CD 3.39Å; D446-R452 HydrophobicContact CB-CG 4.34Å; D446-R452 VanDerWaalsContact O-CD 3.27Å; D446-R452 WeakPolarHBondContact O-CD 3.43Å; D446-R452 VanDerWaalsContact O-CG 3.28Å; D446-R452 WeakPolarHBondContact O-CG 3.16Å; D446-R452 PolarHBondContact O-NH1 3.09Å; V447-R452 PolarHBondContact O-NH1 3.35Å; K448-R452 PolarHBondContact O-N 3.47Å; W449-R452 PolarHBondContact O-N 3.2Å; W449-R452 VanDerWaalsContact O-N 3.16Å; R452-I455 WeakPolarHBondContact O-CG2 3.26Å; R452-I455 PolarHBondContact O-N 3.32Å; R452-I456 WeakPolarHBondContact O-CD1 3.33Å; R452-I456 WeakPolarHBondContact O-CG1 3.45Å; R452-I456 PolarHBondContact O-N 3.43Å; R452-I456 VanDerWaalsContact O-N 3.1Å; R452-D485 IonicContact CZ-OD1 3.67Å; R452-D485 IonicContact CZ-OD2 3.52Å; R452-D485 VanDerWaalsContact CZ-OD2 3.24Å; R452-D485 IonicContact NE-OD2 2.77Å; R452-D485 PolarHBondContact NE-OD2 3.05Å; R452-D485 VanDerWaalsContact NH2-CG 3.31Å; R452-D485 IonicContact NH2-OD1 2.83Å; R452-D485 PolarHBondContact NH2-OD1 2.92Å; R452-D485 IonicContact NH2-OD2 2.79Å; R452-D485 PolarHBondContact NH2-OD2 3Å; R452-H486 PolarHBondContact NH2-CE1 2.58Å; R452-I490 HydrophobicContact CB-CD1 3.85Å
453	L	95.6	Very high	92	Very high	39 Å²	39	46.9 Å²	46.9	20%	0.204	22%	0.224	C	C	.	.	H	α-helix	trans	-60.9	-46.6	176.6	179.2	63.5	0	0	0	111.3	W449 V451 I455 I456 E457 I490 A493	W449-L453 HydrophobicContact CE3-CB 4.37Å; W449-L453 HydrophobicContact CE3-CD2 4.49Å; W449-L453 HydrophobicContact CZ3-CB 4.48Å; W449-L453 HydrophobicContact CZ3-CD2 3.81Å; W449-L453 WeakPolarHBondContact O-CB 3.4Å; W449-L453 PolarHBondContact O-N 3.14Å; V451-L453 VanDerWaalsContact C-N 3.28Å; V451-L453 PolarHBondContact O-N 3.37Å; L453-I455 PolarHBondContact O-N 2.78Å; L453-I456 WeakPolarHBondContact O-CB 3.44Å; L453-I456 PolarHBondContact O-N 3.07Å; L453-E457 PolarHBondContact O-N 2.9Å; L453-E457 VanDerWaalsContact O-N 3.08Å; L453-I490 HydrophobicContact CB-CD1 3.84Å; L453-A493 HydrophobicContact CD1-CB 3.33Å
454	A	92.7	Very high	91.5	Very high	21 Å²	21	49.4 Å²	49.4	17%	0.174	24%	0.241	C	C	.	.	H	α-helix	trans	-61.2	-42.1	-179	0	0	0	0	0	112.3	L396 R450 V451 I456 E457 H458	L396-A454 HydrophobicContact CD1-CB 3.59Å; L396-A454 HydrophobicContact CD2-CB 3.7Å; L396-A454 HydrophobicContact CG-CB 4.29Å; R450-A454 PolarHBondContact O-N 3.31Å; R450-A454 VanDerWaalsContact O-N 3.15Å; V451-A454 PolarHBondContact O-N 3.34Å; A454-I456 PolarHBondContact O-N 2.62Å; A454-E457 PolarHBondContact O-N 3.42Å; A454-H458 PolarHBondContact O-CD2 3.44Å; A454-H458 PolarHBondContact O-N 2.89Å
455	I	93.4	Very high	90.7	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-69.8	-32.1	177	-169.6	63.1	0	0	0	112.5	L396 I399 I440 L443 V451 R452 L453 E457 H458 M459 L462 W482	L396-I455 HydrophobicContact CD2-CB 4.38Å; I399-I455 HydrophobicContact CD1-CD1 3.92Å; I399-I455 HydrophobicContact CG2-CD1 4.4Å; I440-I455 HydrophobicContact CG1-CD1 4.5Å; I440-I455 HydrophobicContact CG2-CD1 4.44Å; I440-I455 HydrophobicContact CG2-CG1 4.38Å; L443-I455 HydrophobicContact CB-CB 4.12Å; L443-I455 HydrophobicContact CB-CG1 4.22Å; L443-I455 HydrophobicContact CB-CG2 4.29Å; L443-I455 HydrophobicContact CD1-CD1 4.33Å; V451-I455 PolarHBondContact O-N 3.48Å; R452-I455 WeakPolarHBondContact O-CG2 3.26Å; R452-I455 PolarHBondContact O-N 3.32Å; L453-I455 PolarHBondContact O-N 2.78Å; I455-E457 VanDerWaalsContact C-N 3.33Å; I455-E457 PolarHBondContact O-N 2.83Å; I455-H458 PolarHBondContact O-N 3.25Å; I455-M459 PolarHBondContact O-N 3.22Å; I455-L462 HydrophobicContact CD1-CD1 3.77Å; I455-W482 HydrophobicContact CG2-CH2 4.19Å; I455-W482 HydrophobicContact CG2-CZ2 3.79Å
456	I	95.2	Very high	90.1	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-60.2	-44.3	172.4	-71.3	163	0	0	0	110.5	R452 L453 A454 H458 M459 W482 I490 A493 N497	R452-I456 WeakPolarHBondContact O-CD1 3.33Å; R452-I456 WeakPolarHBondContact O-CG1 3.45Å; R452-I456 PolarHBondContact O-N 3.43Å; R452-I456 VanDerWaalsContact O-N 3.1Å; L453-I456 WeakPolarHBondContact O-CB 3.44Å; L453-I456 PolarHBondContact O-N 3.07Å; A454-I456 PolarHBondContact O-N 2.62Å; I456-H458 VanDerWaalsContact C-N 3.25Å; I456-H458 PolarHBondContact O-N 2.86Å; I456-M459 WeakPolarHBondContact O-CB 3.48Å; I456-M459 PolarHBondContact O-N 3.36Å; I456-M459 VanDerWaalsContact O-N 3.15Å; I456-W482 HydrophobicContact CB-CZ3 4.34Å; I456-W482 HydrophobicContact CD1-CB 4.21Å; I456-W482 HydrophobicContact CD1-CD2 3.79Å; I456-W482 HydrophobicContact CD1-CE3 4.04Å; I456-W482 HydrophobicContact CD1-CG 3.88Å; I456-W482 HydrophobicContact CG1-CD2 3.54Å; I456-W482 HydrophobicContact CG1-CE3 3.4Å; I456-W482 HydrophobicContact CG1-CG 4.2Å; I456-W482 HydrophobicContact CG1-CH2 3.68Å; I456-W482 HydrophobicContact CG1-CZ2 3.86Å; I456-W482 HydrophobicContact CG1-CZ3 3.49Å; I456-W482 VanDerWaalsContact CG1-CZ3 3.49Å; I456-I490 HydrophobicContact CD1-CD1 4.08Å; I456-I490 HydrophobicContact CD1-CG2 3.69Å; I456-A493 HydrophobicContact CG2-CB 3.9Å; I456-N497 HydrophobicContact CG2-CB 3.89Å; I456-N497 PolarHBondContact O-ND2 2.92Å
457	E	92.2	Very high	89.5	Confident	123 Å²	123	46.9 Å²	46.9	58%	0.575	24%	0.236	S	C	*	.	H	α-helix	trans	-63.2	-32.2	179.5	-69.6	178.7	167	0	0	112.6	L453 A454 I455 P460	L453-E457 PolarHBondContact O-N 2.9Å; L453-E457 VanDerWaalsContact O-N 3.08Å; A454-E457 PolarHBondContact O-N 3.42Å; I455-E457 VanDerWaalsContact C-N 3.33Å; I455-E457 PolarHBondContact O-N 2.83Å; E457-P460 WeakPolarHBondContact O-CD 3.16Å
458	H	89.4	Confident	89.4	Confident	51 Å²	51	44.4 Å²	44.4	24%	0.236	22%	0.215	C	C	.	.	H	α-helix	trans	-84.4	-11.9	176.3	-64.4	-48.2	0	0	0	114.5	I399 A454 I455 I456 P460 L461 L462	I399-H458 HydrophobicContact CG2-CB 4.27Å; A454-H458 PolarHBondContact O-CD2 3.44Å; A454-H458 PolarHBondContact O-N 2.89Å; I455-H458 PolarHBondContact O-N 3.25Å; I456-H458 VanDerWaalsContact C-N 3.25Å; I456-H458 PolarHBondContact O-N 2.86Å; H458-P460 VanDerWaalsContact C-CD 3.43Å; H458-L461 WeakPolarHBondContact O-CB 3.15Å; H458-L461 PolarHBondContact O-N 3.37Å; H458-L461 VanDerWaalsContact O-N 3.1Å; H458-L462 PolarHBondContact O-N 3.16Å
459	M	91.9	Very high	89.1	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-57.5	-39.8	-175.2	-167.8	54.7	69.3	0	0	114.8	I440 I455 I456 L461 L462 A463 F471 L475 W482	I440-M459 HydrophobicContact CG2-CE 4.25Å; I455-M459 PolarHBondContact O-N 3.22Å; I456-M459 WeakPolarHBondContact O-CB 3.48Å; I456-M459 PolarHBondContact O-N 3.36Å; I456-M459 VanDerWaalsContact O-N 3.15Å; M459-L461 VanDerWaalsContact C-N 3.26Å; M459-L461 PolarHBondContact O-N 2.86Å; M459-L462 PolarHBondContact O-N 2.9Å; M459-L462 HydrophobicContact SD-CB 4.39Å; M459-L462 HydrophobicContact SD-CD1 4.46Å; M459-A463 VanDerWaalsContact O-CB 3.29Å; M459-A463 WeakPolarHBondContact O-CB 3.47Å; M459-A463 PolarHBondContact O-N 2.93Å; M459-F471 HydrophobicContact CG-CE2 3.93Å; M459-F471 HydrophobicContact CG-CZ 4.49Å; M459-F471 HydrophobicContact SD-CD2 4.48Å; M459-F471 HydrophobicContact SD-CE2 3.75Å; M459-L475 HydrophobicContact SD-CB 4.45Å; M459-L475 HydrophobicContact SD-CD1 4.16Å; M459-W482 HydrophobicContact CB-CZ3 4.43Å; M459-W482 HydrophobicContact CE-CH2 3.32Å; M459-W482 HydrophobicContact CE-CZ2 4.41Å; M459-W482 HydrophobicContact CE-CZ3 3.78Å; M459-W482 HydrophobicContact CG-CZ3 4.27Å
460	P	89.6	Confident	88.7	Confident	19 Å²	19	44 Å²	44	12%	0.123	21%	0.211	C	C	.	.	H	α-helix	trans	-65.6	-32.7	178.9	-20	35.3	0	0	0	111.9	E457 H458 S464 N497 K500 K504	E457-P460 WeakPolarHBondContact O-CD 3.16Å; H458-P460 VanDerWaalsContact C-CD 3.43Å; P460-S464 PolarHBondContact O-N 3.35Å; P460-S464 PolarHBondContact O-OG 3.49Å; P460-N497 WeakPolarHBondContact CD-ND2 3.23Å; P460-N497 VanDerWaalsContact CG-ND2 3.27Å; P460-N497 WeakPolarHBondContact CG-ND2 3.5Å; P460-K500 HydrophobicContact CB-CB 4.26Å; P460-K500 HydrophobicContact CG-CB 3.97Å; P460-K500 HydrophobicContact CG-CD 4.03Å; P460-K504 PolarHBondContact O-NZ 3.16Å
461	L	83.6	Confident	88.4	Confident	25 Å²	25	35.6 Å²	35.6	13%	0.131	18%	0.179	C	C	.	.	H	α-helix	trans	-68.8	-49.2	174.7	171.9	70.2	0	0	0	110.8	D403 H458 M459 A463 S464 Q465	D403-L461 HydrophobicContact CB-CD1 4.09Å; D403-L461 HydrophobicContact CB-CD2 3.47Å; D403-L461 VanDerWaalsContact CB-CD2 3.47Å; D403-L461 HydrophobicContact CB-CG 4.41Å; D403-L461 WeakPolarHBondContact OD1-CD1 3.27Å; H458-L461 WeakPolarHBondContact O-CB 3.15Å; H458-L461 PolarHBondContact O-N 3.37Å; H458-L461 VanDerWaalsContact O-N 3.1Å; M459-L461 VanDerWaalsContact C-N 3.26Å; M459-L461 PolarHBondContact O-N 2.86Å; L461-A463 PolarHBondContact O-N 2.87Å; L461-S464 PolarHBondContact O-N 3.31Å; L461-S464 PolarHBondContact O-OG 2.91Å; L461-Q465 HydrophobicContact CD1-CG 4.28Å; L461-Q465 WeakPolarHBondContact O-CG 3.35Å; L461-Q465 PolarHBondContact O-N 3.23Å; L461-Q465 VanDerWaalsContact O-N 3.11Å
462	L	85	Confident	88.4	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-55.9	-42.1	176.6	-71	172.3	0	0	0	110.9	I399 L402 L436 I440 I455 H458 M459 S464 Q465 L466	I399-L462 HydrophobicContact CG2-CD1 4.17Å; I399-L462 HydrophobicContact CG2-CD2 4Å; I399-L462 HydrophobicContact CG2-CG 4.31Å; L402-L462 HydrophobicContact CD1-CD2 4.2Å; L436-L462 HydrophobicContact CD2-CD2 4.16Å; I440-L462 HydrophobicContact CD1-CD1 3.82Å; I440-L462 HydrophobicContact CD1-CD2 4.07Å; I440-L462 HydrophobicContact CD1-CG 4.47Å; I440-L462 HydrophobicContact CG1-CD1 4.04Å; I455-L462 HydrophobicContact CD1-CD1 3.77Å; H458-L462 PolarHBondContact O-N 3.16Å; M459-L462 PolarHBondContact O-N 2.9Å; M459-L462 HydrophobicContact SD-CB 4.39Å; M459-L462 HydrophobicContact SD-CD1 4.46Å; L462-S464 VanDerWaalsContact C-N 3.35Å; L462-S464 PolarHBondContact O-N 3.15Å; L462-Q465 PolarHBondContact O-N 3.2Å; L462-Q465 VanDerWaalsContact O-N 3.12Å; L462-L466 HydrophobicContact CB-CD1 4.39Å; L462-L466 WeakPolarHBondContact O-CB 3.36Å; L462-L466 WeakPolarHBondContact O-CG 3.29Å; L462-L466 PolarHBondContact O-N 3.19Å
463	A	86.5	Confident	88.1	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-59.1	-38	175.3	0	0	0	0	0	113.3	M459 L461 G467 F471 L501 F505	M459-A463 VanDerWaalsContact O-CB 3.29Å; M459-A463 WeakPolarHBondContact O-CB 3.47Å; M459-A463 PolarHBondContact O-N 2.93Å; L461-A463 PolarHBondContact O-N 2.87Å; A463-G467 PolarHBondContact O-N 3.26Å; A463-F471 HydrophobicContact CB-CD2 3.56Å; A463-F471 HydrophobicContact CB-CE2 3.79Å; A463-F471 HydrophobicContact CB-CG 4.26Å; A463-L501 HydrophobicContact CB-CD2 3.68Å; A463-F505 HydrophobicContact CB-CE2 3.85Å; A463-F505 HydrophobicContact CB-CZ 3.66Å
464	S	81.8	Confident	87.8	Confident	52 Å²	52	44.5 Å²	44.5	36%	0.364	22%	0.219	S	C	.	.	H	α-helix	trans	-65.5	-44.4	171.5	19.6	0	0	0	0	112.9	P460 L461 L462 K504	P460-S464 PolarHBondContact O-N 3.35Å; P460-S464 PolarHBondContact O-OG 3.49Å; L461-S464 PolarHBondContact O-N 3.31Å; L461-S464 PolarHBondContact O-OG 2.91Å; L462-S464 VanDerWaalsContact C-N 3.35Å; L462-S464 PolarHBondContact O-N 3.15Å; S464-K504 VanDerWaalsContact CA-CE 3.45Å; S464-K504 PolarHBondContact OG-NZ 3.3Å
465	Q	76.3	Confident	87.8	Confident	36 Å²	36	43.5 Å²	43.5	17%	0.168	21%	0.21	C	C	.	.	H	α-helix	trans	-73.4	-42.3	-167.3	-68.3	-62.7	-14.7	0	0	109.7	N424 L461 L462	N424-Q465 VanDerWaalsContact ND2-C 3.3Å; N424-Q465 WeakPolarHBondContact ND2-CA 3.45Å; N424-Q465 WeakPolarHBondContact ND2-CB 3.47Å; N424-Q465 PolarHBondContact ND2-O 3.38Å; N424-Q465 PolarHBondContact ND2-OE1 3.27Å; L461-Q465 HydrophobicContact CD1-CG 4.28Å; L461-Q465 WeakPolarHBondContact O-CG 3.35Å; L461-Q465 PolarHBondContact O-N 3.23Å; L461-Q465 VanDerWaalsContact O-N 3.11Å; L462-Q465 PolarHBondContact O-N 3.2Å; L462-Q465 VanDerWaalsContact O-N 3.12Å
466	L	80.6	Confident	87.8	Confident	13 Å²	13	43.7 Å²	43.7	7%	0.068	21%	0.212	C	C	.	.	H	α-helix	trans	-82.8	-18.9	-177.5	-59.7	167.7	0	0	0	113.1	L436 I440 L462 F470 L475	L436-L466 HydrophobicContact CD2-CD1 4.32Å; L436-L466 HydrophobicContact CD2-CD2 4.1Å; I440-L466 HydrophobicContact CD1-CD1 4.3Å; L462-L466 HydrophobicContact CB-CD1 4.39Å; L462-L466 WeakPolarHBondContact O-CB 3.36Å; L462-L466 WeakPolarHBondContact O-CG 3.29Å; L462-L466 PolarHBondContact O-N 3.19Å; L466-F470 HydrophobicContact CB-CB 4.29Å; L466-F470 HydrophobicContact CB-CD1 3.59Å; L466-F470 HydrophobicContact CB-CE1 4.33Å; L466-F470 HydrophobicContact CB-CG 4.18Å; L466-F470 HydrophobicContact CD1-CD1 3.84Å; L466-F470 HydrophobicContact CD1-CE1 3.77Å; L466-F470 HydrophobicContact CD2-CD1 4.38Å; L466-F470 HydrophobicContact CD2-CE1 4.43Å; L466-F470 HydrophobicContact CG-CD1 4.13Å; L466-F470 HydrophobicContact CG-CE1 4.39Å; L466-F470 WeakPolarHBondContact O-CB 3.17Å; L466-L475 HydrophobicContact CD1-CD1 3.76Å
467	G	82.4	Confident	87.7	Confident	29 Å²	29	48.2 Å²	48.2	30%	0.299	24%	0.236	S	C	.	.			trans	81.9	159.1	-178.6	0	0	0	0	0	113.6	A463 R469 F470 F471	A463-G467 PolarHBondContact O-N 3.26Å; G467-R469 PolarHBondContact O-N 3.14Å; G467-F470 PolarHBondContact O-N 3.11Å; G467-F471 WeakPolarHBondContact O-CB 3.32Å; G467-F471 PolarHBondContact O-N 3.11Å; G467-F471 VanDerWaalsContact O-N 3.08Å
468	Q	88.6	Confident	87.8	Confident	84 Å²	84	44.9 Å²	44.9	39%	0.393	22%	0.218	S	C	.	.	H	α-helix	trans	-60.8	-45.6	-171.5	-173.1	-175	-35.7	0	0	113.1	F470 F471 D472 F505	Q468-F470 VanDerWaalsContact C-N 3.34Å; Q468-F470 PolarHBondContact O-N 3.32Å; Q468-F471 WeakPolarHBondContact O-CB 3.24Å; Q468-F471 PolarHBondContact O-N 3.44Å; Q468-D472 PolarHBondContact O-N 3.45Å; Q468-F505 HydrophobicContact CB-CD1 3.78Å; Q468-F505 HydrophobicContact CB-CE1 3.6Å; Q468-F505 HydrophobicContact CB-CZ 4.19Å; Q468-F505 HydrophobicContact CG-CD1 3.82Å; Q468-F505 HydrophobicContact CG-CE1 4.02Å; Q468-F505 HydrophobicContact CG-CG 4.1Å; Q468-F505 HydrophobicContact CG-CZ 4.44Å
469	R	87.9	Confident	88	Confident	195 Å²	195	42.9 Å²	42.9	74%	0.736	21%	0.21	S	C	*	.	H	α-helix	trans	-58.7	-46.2	-178.4	-178.6	179	177	166.3	-0.4	112.1	G467 F471 D472 E473	G467-R469 PolarHBondContact O-N 3.14Å; R469-F471 VanDerWaalsContact C-N 3.35Å; R469-D472 PolarHBondContact O-N 3.22Å; R469-E473 WeakPolarHBondContact CG-OE1 3.22Å; R469-E473 IonicContact CZ-OE1 3.82Å; R469-E473 IonicContact NE-OE1 3.01Å; R469-E473 PolarHBondContact NE-OE1 3.21Å; R469-E473 IonicContact NH2-OE1 3.71Å; R469-E473 WeakPolarHBondContact O-CG 3.5Å; R469-E473 PolarHBondContact O-N 3.46Å; R469-E473 VanDerWaalsContact O-N 3.1Å
470	F	86.1	Confident	88.1	Confident	31 Å²	31	44.1 Å²	44.1	14%	0.136	22%	0.217	C	C	.	.	H	α-helix	trans	-65.1	-43	178	-176.8	-91.2	0	0	0	111.4	T433 L437 L466 G467 Q468 D472 E473 K474 L475	T433-F470 HydrophobicContact CG2-CD2 4.07Å; T433-F470 HydrophobicContact CG2-CE2 3.14Å; T433-F470 HydrophobicContact CG2-CZ 3.48Å; T433-F470 VanDerWaalsContact CG2-CZ 3.48Å; L437-F470 HydrophobicContact CB-CZ 4.46Å; L437-F470 HydrophobicContact CD1-CZ 4.25Å; L437-F470 HydrophobicContact CD2-CZ 4.33Å; L466-F470 HydrophobicContact CB-CB 4.29Å; L466-F470 HydrophobicContact CB-CD1 3.59Å; L466-F470 HydrophobicContact CB-CE1 4.33Å; L466-F470 HydrophobicContact CB-CG 4.18Å; L466-F470 HydrophobicContact CD1-CD1 3.84Å; L466-F470 HydrophobicContact CD1-CE1 3.77Å; L466-F470 HydrophobicContact CD2-CD1 4.38Å; L466-F470 HydrophobicContact CD2-CE1 4.43Å; L466-F470 HydrophobicContact CG-CD1 4.13Å; L466-F470 HydrophobicContact CG-CE1 4.39Å; L466-F470 WeakPolarHBondContact O-CB 3.17Å; G467-F470 PolarHBondContact O-N 3.11Å; Q468-F470 VanDerWaalsContact C-N 3.34Å; Q468-F470 PolarHBondContact O-N 3.32Å; F470-D472 VanDerWaalsContact C-N 3.33Å; F470-D472 PolarHBondContact O-N 3.16Å; F470-E473 PolarHBondContact O-N 2.96Å; F470-K474 HydrophobicContact CD1-CB 4.47Å; F470-K474 HydrophobicContact CD2-CG 4.15Å; F470-K474 HydrophobicContact CE1-CB 3.96Å; F470-K474 HydrophobicContact CE1-CG 4.28Å; F470-K474 HydrophobicContact CE2-CB 4.2Å; F470-K474 HydrophobicContact CE2-CG 3.6Å; F470-K474 HydrophobicContact CZ-CB 3.81Å; F470-K474 HydrophobicContact CZ-CG 3.71Å; F470-K474 WeakPolarHBondContact O-CB 3.4Å; F470-K474 PolarHBondContact O-N 3.21Å; F470-L475 HydrophobicContact CD1-CD1 4.44Å; F470-L475 HydrophobicContact CE1-CD1 4.23Å; F470-L475 HydrophobicContact CE1-CG 4.28Å
471	F	90.2	Very high	88.4	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-57.3	-47.3	177.3	-176.4	-89.6	0	0	0	111.6	M459 A463 G467 Q468 R469 E473 L475 L476 C479 L501 F505 W509	M459-F471 HydrophobicContact CG-CE2 3.93Å; M459-F471 HydrophobicContact CG-CZ 4.49Å; M459-F471 HydrophobicContact SD-CD2 4.48Å; M459-F471 HydrophobicContact SD-CE2 3.75Å; A463-F471 HydrophobicContact CB-CD2 3.56Å; A463-F471 HydrophobicContact CB-CE2 3.79Å; A463-F471 HydrophobicContact CB-CG 4.26Å; G467-F471 WeakPolarHBondContact O-CB 3.32Å; G467-F471 PolarHBondContact O-N 3.11Å; G467-F471 VanDerWaalsContact O-N 3.08Å; Q468-F471 WeakPolarHBondContact O-CB 3.24Å; Q468-F471 PolarHBondContact O-N 3.44Å; R469-F471 VanDerWaalsContact C-N 3.35Å; F471-E473 PolarHBondContact O-N 3.35Å; F471-L475 HydrophobicContact CD2-CB 3.81Å; F471-L475 HydrophobicContact CD2-CD1 4.05Å; F471-L475 HydrophobicContact CE2-CB 3.99Å; F471-L475 HydrophobicContact CG-CB 4.35Å; F471-L475 CarbonylContact O-C 3.59Å; F471-L475 WeakPolarHBondContact O-CA 3.29Å; F471-L475 PolarHBondContact O-N 3.46Å; F471-L476 HydrophobicContact CD1-CB 4.31Å; F471-L476 HydrophobicContact CE1-CB 4.05Å; F471-L476 HydrophobicContact CE1-CD1 4.07Å; F471-L476 PolarHBondContact O-N 3.05Å; F471-C479 VanDerWaalsContact CZ-SG 3.59Å; F471-L501 HydrophobicContact CE1-CD1 4.24Å; F471-L501 HydrophobicContact CE1-CD2 4.46Å; F471-L501 HydrophobicContact CE2-CD1 4.43Å; F471-L501 HydrophobicContact CE2-CD2 4.01Å; F471-L501 HydrophobicContact CZ-CD1 3.58Å; F471-L501 HydrophobicContact CZ-CD2 3.8Å; F471-L501 HydrophobicContact CZ-CG 4.33Å; F471-F505 HydrophobicContact CB-CE2 4.32Å; F471-F505 HydrophobicContact CB-CZ 4.17Å; F471-F505 AromaticContact CD1-CE2 3.74Å; F471-F505 HydrophobicContact CD1-CE2 3.74Å; F471-F505 HydrophobicContact CD1-CZ 4.43Å; F471-F505 HydrophobicContact CD2-CE2 4.44Å; F471-F505 HydrophobicContact CE1-CE2 4.17Å; F471-F505 AromaticContact CG-CE2 3.9Å; F471-F505 HydrophobicContact CG-CE2 3.9Å; F471-F505 HydrophobicContact CG-CZ 4.19Å; F471-W509 HydrophobicContact CD1-CZ2 4.02Å; F471-W509 HydrophobicContact CE1-CH2 4.12Å; F471-W509 AromaticContact CE1-CZ2 3.79Å; F471-W509 HydrophobicContact CE1-CZ2 3.79Å
472	D	91.5	Very high	89	Confident	44 Å²	44	47.4 Å²	47.4	24%	0.235	23%	0.228	C	C	.	.	H	α-helix	trans	-63.2	-42.4	179.2	-71.3	-16.9	0	0	0	112	Q468 R469 F470 W509	Q468-D472 PolarHBondContact O-N 3.45Å; R469-D472 PolarHBondContact O-N 3.22Å; F470-D472 VanDerWaalsContact C-N 3.33Å; F470-D472 PolarHBondContact O-N 3.16Å; D472-W509 PolarHBondContact OD1-NE1 2.99Å; D472-W509 PolarHBondContact OD2-NE1 3.09Å
473	E	89.8	Confident	89.6	Confident	110 Å²	110	47.4 Å²	47.4	51%	0.514	23%	0.229	S	C	.	.	H	α-helix	trans	-74.7	-29.4	-177.7	-72.6	178.5	-163.5	0	0	113.7	R469 F470 F471	R469-E473 WeakPolarHBondContact CG-OE1 3.22Å; R469-E473 IonicContact CZ-OE1 3.82Å; R469-E473 IonicContact NE-OE1 3.01Å; R469-E473 PolarHBondContact NE-OE1 3.21Å; R469-E473 IonicContact NH2-OE1 3.71Å; R469-E473 WeakPolarHBondContact O-CG 3.5Å; R469-E473 PolarHBondContact O-N 3.46Å; R469-E473 VanDerWaalsContact O-N 3.1Å; F470-E473 PolarHBondContact O-N 2.96Å; F471-E473 PolarHBondContact O-N 3.35Å
474	K	88.9	Confident	90.1	Very high	98 Å²	98	49.7 Å²	49.7	43%	0.426	24%	0.243	S	C	.	.	H	α-helix	trans	-126.7	-26.2	-167.3	-59.5	-61.1	179.3	-172.3	0	116.3	L437 F470 Y478	L437-K474 HydrophobicContact CD1-CB 4.01Å; L437-K474 HydrophobicContact CD2-CB 4.32Å; L437-K474 HydrophobicContact CD2-CD 4.06Å; L437-K474 HydrophobicContact CD2-CG 4.21Å; F470-K474 HydrophobicContact CD1-CB 4.47Å; F470-K474 HydrophobicContact CD2-CG 4.15Å; F470-K474 HydrophobicContact CE1-CB 3.96Å; F470-K474 HydrophobicContact CE1-CG 4.28Å; F470-K474 HydrophobicContact CE2-CB 4.2Å; F470-K474 HydrophobicContact CE2-CG 3.6Å; F470-K474 HydrophobicContact CZ-CB 3.81Å; F470-K474 HydrophobicContact CZ-CG 3.71Å; F470-K474 WeakPolarHBondContact O-CB 3.4Å; F470-K474 PolarHBondContact O-N 3.21Å; K474-Y478 WeakPolarHBondContact O-CD2 3.31Å; K474-Y478 WeakPolarHBondContact O-CE2 3.45Å
475	L	92.1	Very high	90.8	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.2	-27.1	-168.3	-61.7	-178.7	0	0	0	114.1	L437 I440 M459 L466 F470 F471 D477 Y478 C479	L437-L475 HydrophobicContact CD1-CD2 3.78Å; I440-L475 HydrophobicContact CG2-CD2 3.83Å; M459-L475 HydrophobicContact SD-CB 4.45Å; M459-L475 HydrophobicContact SD-CD1 4.16Å; L466-L475 HydrophobicContact CD1-CD1 3.76Å; F470-L475 HydrophobicContact CD1-CD1 4.44Å; F470-L475 HydrophobicContact CE1-CD1 4.23Å; F470-L475 HydrophobicContact CE1-CG 4.28Å; F471-L475 HydrophobicContact CD2-CB 3.81Å; F471-L475 HydrophobicContact CD2-CD1 4.05Å; F471-L475 HydrophobicContact CE2-CB 3.99Å; F471-L475 HydrophobicContact CG-CB 4.35Å; F471-L475 CarbonylContact O-C 3.59Å; F471-L475 WeakPolarHBondContact O-CA 3.29Å; F471-L475 PolarHBondContact O-N 3.46Å; L475-D477 VanDerWaalsContact C-N 3.27Å; L475-D477 PolarHBondContact O-N 3.47Å; L475-Y478 WeakPolarHBondContact O-CB 3.3Å; L475-Y478 PolarHBondContact O-N 2.92Å; L475-Y478 VanDerWaalsContact O-N 3.1Å; L475-C479 PolarHBondContact O-N 2.93Å; L475-C479 PolarHBondContact O-SG 3.25Å
476	L	93.7	Very high	91.7	Very high	5 Å²	5	53.6 Å²	53.6	3%	0.026	26%	0.255	C	S	.	.	H	α-helix	trans	-57.8	-39	-178	176.8	59.9	0	0	0	112.4	F471 Y478 C479 V480 W509 V514 K517	F471-L476 HydrophobicContact CD1-CB 4.31Å; F471-L476 HydrophobicContact CE1-CB 4.05Å; F471-L476 HydrophobicContact CE1-CD1 4.07Å; F471-L476 PolarHBondContact O-N 3.05Å; L476-Y478 VanDerWaalsContact C-N 3.3Å; L476-Y478 PolarHBondContact O-N 3.2Å; L476-C479 WeakPolarHBondContact O-CB 3.49Å; L476-C479 PolarHBondContact O-N 2.82Å; L476-C479 VanDerWaalsContact O-N 3.14Å; L476-V480 HydrophobicContact CD1-CG2 4.36Å; L476-V480 WeakPolarHBondContact O-CG2 3.41Å; L476-V480 PolarHBondContact O-N 2.91Å; L476-W509 HydrophobicContact CD1-CZ2 4.28Å; L476-V514 HydrophobicContact CD1-CG2 4.36Å; L476-K517 HydrophobicContact CD2-CD 4.26Å; L476-K517 HydrophobicContact CG-CD 4.34Å
477	D	93.3	Very high	92.5	Very high	96 Å²	96	54.6 Å²	54.6	51%	0.513	26%	0.262	S	S	.	.	H	α-helix	trans	-64.1	-34	179.1	-76	-17.8	0	0	0	112.7	L475 V480 K481 K517	L475-D477 VanDerWaalsContact C-N 3.27Å; L475-D477 PolarHBondContact O-N 3.47Å; D477-V480 PolarHBondContact O-N 2.95Å; D477-K481 VanDerWaalsContact O-CB 3.31Å; D477-K481 WeakPolarHBondContact O-CB 3.4Å; D477-K481 PolarHBondContact O-N 3.25Å; D477-K517 IonicContact OD1-NZ 4Å; D477-K517 PolarHBondContact OD1-NZ 3.45Å
478	Y	93.9	Very high	93.1	Very high	54 Å²	54	58.5 Å²	58.5	21%	0.212	27%	0.268	C	S	.	.	H	α-helix	trans	-68.8	-39.6	173.3	-65.9	-84.2	0	0	0	111.5	V441 A444 E445 K474 L475 L476 V480 K481 W482	V441-Y478 HydrophobicContact CB-CE1 4.48Å; V441-Y478 HydrophobicContact CG1-CE1 3.9Å; V441-Y478 VanDerWaalsContact CG1-OH 3.3Å; V441-Y478 WeakPolarHBondContact CG1-OH 3.48Å; V441-Y478 HydrophobicContact CG2-CE1 4.2Å; V441-Y478 HydrophobicContact CG2-CE2 3.83Å; V441-Y478 WeakPolarHBondContact CG2-OH 3.48Å; A444-Y478 HydrophobicContact CB-CD1 4.12Å; E445-Y478 HydrophobicContact CG-CD1 4.34Å; E445-Y478 HydrophobicContact CG-CE1 4.09Å; E445-Y478 WeakPolarHBondContact OE1-CE1 3.47Å; K474-Y478 WeakPolarHBondContact O-CD2 3.31Å; K474-Y478 WeakPolarHBondContact O-CE2 3.45Å; L475-Y478 WeakPolarHBondContact O-CB 3.3Å; L475-Y478 PolarHBondContact O-N 2.92Å; L475-Y478 VanDerWaalsContact O-N 3.1Å; L476-Y478 VanDerWaalsContact C-N 3.3Å; L476-Y478 PolarHBondContact O-N 3.2Å; Y478-V480 VanDerWaalsContact C-N 3.31Å; Y478-V480 PolarHBondContact O-N 2.71Å; Y478-K481 WeakPolarHBondContact O-CB 3.39Å; Y478-K481 PolarHBondContact O-N 3.37Å; Y478-W482 VanDerWaalsContact O-CD2 3.31Å; Y478-W482 PolarHBondContact O-N 3.32Å
479	C	95.1	Very high	93.6	Very high	9 Å²	9	56 Å²	56	6%	0.061	26%	0.262	C	S	.	.	H	α-helix	trans	-59.7	-43.3	175.6	-61.9	0	0	0	0	111.7	F471 L475 L476 W482	F471-C479 VanDerWaalsContact CZ-SG 3.59Å; L475-C479 PolarHBondContact O-N 2.93Å; L475-C479 PolarHBondContact O-SG 3.25Å; L476-C479 WeakPolarHBondContact O-CB 3.49Å; L476-C479 PolarHBondContact O-N 2.82Å; L476-C479 VanDerWaalsContact O-N 3.14Å; C479-W482 HydrophobicContact CB-CE3 4.4Å
480	V	94.3	Very high	94	Very high	25 Å²	25	46.7 Å²	46.7	15%	0.152	23%	0.227	C	C	.	.	H	α-helix	trans	-69.5	-38.5	175.7	176.3	0	0	0	0	111.3	L476 D477 Y478 W482 L483 K517	L476-V480 HydrophobicContact CD1-CG2 4.36Å; L476-V480 WeakPolarHBondContact O-CG2 3.41Å; L476-V480 PolarHBondContact O-N 2.91Å; D477-V480 PolarHBondContact O-N 2.95Å; Y478-V480 VanDerWaalsContact C-N 3.31Å; Y478-V480 PolarHBondContact O-N 2.71Å; V480-W482 VanDerWaalsContact C-N 3.31Å; V480-W482 PolarHBondContact O-N 2.93Å; V480-L483 VanDerWaalsContact O-CB 3.32Å; V480-L483 WeakPolarHBondContact O-CB 2.96Å; V480-L483 PolarHBondContact O-N 3.44Å; V480-L483 VanDerWaalsContact O-N 3.13Å; V480-K517 HydrophobicContact CG1-CB 4.18Å; V480-K517 HydrophobicContact CG2-CB 3.93Å; V480-K517 HydrophobicContact CG2-CD 3.91Å
481	K	95.2	Very high	94.6	Very high	108 Å²	108	45.9 Å²	45.9	47%	0.47	22%	0.223	S	C	.	.	H	α-helix	trans	-58.3	-42	176.4	-176.5	175.6	176.1	175.2	0	111.8	E445 D477 Y478 L483 T484 D485	E445-K481 IonicContact OE1-NZ 2.65Å; E445-K481 PolarHBondContact OE1-NZ 2.62Å; D477-K481 VanDerWaalsContact O-CB 3.31Å; D477-K481 WeakPolarHBondContact O-CB 3.4Å; D477-K481 PolarHBondContact O-N 3.25Å; Y478-K481 WeakPolarHBondContact O-CB 3.39Å; Y478-K481 PolarHBondContact O-N 3.37Å; K481-L483 PolarHBondContact O-N 3.32Å; K481-T484 PolarHBondContact O-N 2.81Å; K481-T484 PolarHBondContact O-OG1 2.71Å; K481-D485 PolarHBondContact O-N 2.89Å
482	W	96.8	Very high	94.9	Very high	5 Å²	5	50 Å²	50	2%	0.019	24%	0.242	C	C	.	.	H	α-helix	trans	-62.2	-26.3	177.7	-64.4	-40.4	0	0	0	114.1	A444 I455 I456 M459 Y478 C479 V480 T484 D485 I490 A494	A444-W482 HydrophobicContact CB-CH2 4.44Å; A444-W482 HydrophobicContact CB-CZ2 3.45Å; A444-W482 VanDerWaalsContact CB-CZ2 3.45Å; A444-W482 PolarHBondContact O-NE1 2.85Å; I455-W482 HydrophobicContact CG2-CH2 4.19Å; I455-W482 HydrophobicContact CG2-CZ2 3.79Å; I456-W482 HydrophobicContact CB-CZ3 4.34Å; I456-W482 HydrophobicContact CD1-CB 4.21Å; I456-W482 HydrophobicContact CD1-CD2 3.79Å; I456-W482 HydrophobicContact CD1-CE3 4.04Å; I456-W482 HydrophobicContact CD1-CG 3.88Å; I456-W482 HydrophobicContact CG1-CD2 3.54Å; I456-W482 HydrophobicContact CG1-CE3 3.4Å; I456-W482 HydrophobicContact CG1-CG 4.2Å; I456-W482 HydrophobicContact CG1-CH2 3.68Å; I456-W482 HydrophobicContact CG1-CZ2 3.86Å; I456-W482 HydrophobicContact CG1-CZ3 3.49Å; I456-W482 VanDerWaalsContact CG1-CZ3 3.49Å; M459-W482 HydrophobicContact CB-CZ3 4.43Å; M459-W482 HydrophobicContact CE-CH2 3.32Å; M459-W482 HydrophobicContact CE-CZ2 4.41Å; M459-W482 HydrophobicContact CE-CZ3 3.78Å; M459-W482 HydrophobicContact CG-CZ3 4.27Å; Y478-W482 VanDerWaalsContact O-CD2 3.31Å; Y478-W482 PolarHBondContact O-N 3.32Å; C479-W482 HydrophobicContact CB-CE3 4.4Å; V480-W482 VanDerWaalsContact C-N 3.31Å; V480-W482 PolarHBondContact O-N 2.93Å; W482-T484 PolarHBondContact O-N 3.26Å; W482-D485 VanDerWaalsContact O-CB 3.27Å; W482-D485 WeakPolarHBondContact O-CB 3.49Å; W482-D485 PolarHBondContact O-N 2.92Å; W482-D485 VanDerWaalsContact O-N 3.14Å; W482-I490 HydrophobicContact CB-CG2 3.99Å; W482-I490 HydrophobicContact CG-CG2 4.28Å; W482-A494 HydrophobicContact CB-CB 3.55Å
483	L	97	Very high	95.2	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.01	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-16.8	172.9	-58	175.5	0	0	0	112.7	V480 K481 R491 A494 V518 L521 T532	V480-L483 VanDerWaalsContact O-CB 3.32Å; V480-L483 WeakPolarHBondContact O-CB 2.96Å; V480-L483 PolarHBondContact O-N 3.44Å; V480-L483 VanDerWaalsContact O-N 3.13Å; K481-L483 PolarHBondContact O-N 3.32Å; L483-R491 WeakPolarHBondContact O-CD 3.39Å; L483-A494 HydrophobicContact CD2-CB 3.74Å; L483-A494 HydrophobicContact CG-CB 4.44Å; L483-V518 HydrophobicContact CD1-CG2 3.94Å; L483-L521 HydrophobicContact CB-CD1 3.87Å; L483-L521 HydrophobicContact CD1-CD1 4Å; L483-T532 HydrophobicContact CB-CG2 3.92Å; L483-T532 HydrophobicContact CD2-CG2 4.04Å; L483-T532 WeakPolarHBondContact O-CG2 3.05Å; L483-T532 PolarHBondContact O-OG1 3.03Å
484	T	96.3	Very high	95.6	Very high	48 Å²	48	43.7 Å²	43.7	29%	0.294	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.6	7.7	176.8	63.6	0	0	0	0	113.8	K481 W482 L521 Q529	K481-T484 PolarHBondContact O-N 2.81Å; K481-T484 PolarHBondContact O-OG1 2.71Å; W482-T484 PolarHBondContact O-N 3.26Å; T484-L521 HydrophobicContact CG2-CD2 3.37Å; T484-Q529 HydrophobicContact CG2-CG 4.19Å
485	D	96.9	Very high	96	Very high	20 Å²	20	39.2 Å²	39.2	11%	0.107	20%	0.196	C	C	.	.			trans	-57.7	148.5	-179.3	-164.6	-72.6	0	0	0	111.7	R452 K481 W482 V487 I490 R491	R452-D485 IonicContact CZ-OD1 3.67Å; R452-D485 IonicContact CZ-OD2 3.52Å; R452-D485 VanDerWaalsContact CZ-OD2 3.24Å; R452-D485 IonicContact NE-OD2 2.77Å; R452-D485 PolarHBondContact NE-OD2 3.05Å; R452-D485 VanDerWaalsContact NH2-CG 3.31Å; R452-D485 IonicContact NH2-OD1 2.83Å; R452-D485 PolarHBondContact NH2-OD1 2.92Å; R452-D485 IonicContact NH2-OD2 2.79Å; R452-D485 PolarHBondContact NH2-OD2 3Å; K481-D485 PolarHBondContact O-N 2.89Å; W482-D485 VanDerWaalsContact O-CB 3.27Å; W482-D485 WeakPolarHBondContact O-CB 3.49Å; W482-D485 PolarHBondContact O-N 2.92Å; W482-D485 VanDerWaalsContact O-N 3.14Å; D485-V487 VanDerWaalsContact C-N 3.27Å; D485-V487 PolarHBondContact O-N 3.41Å; D485-V487 WeakPolarHBondContact OD1-CB 3.23Å; D485-V487 PolarHBondContact OD1-N 3.25Å; D485-I490 HydrophobicContact CB-CB 3.8Å; D485-I490 HydrophobicContact CB-CG2 3.43Å; D485-I490 VanDerWaalsContact CB-CG2 3.43Å; D485-I490 VanDerWaalsContact CG-CG2 3.45Å; D485-I490 WeakPolarHBondContact OD2-CG2 3.5Å; D485-R491 HydrophobicContact CB-CG 4.17Å; D485-R491 WeakPolarHBondContact O-CD 3.47Å; D485-R491 WeakPolarHBondContact O-CG 3.32Å; D485-R491 PolarHBondContact O-NH1 3.2Å
486	H	95.5	Very high	96.2	Very high	150 Å²	150	42.8 Å²	42.8	69%	0.694	22%	0.215	S	C	*	.	S	Bend	trans	-67.5	-29.1	179	57.2	-81.4	0	0	0	112.1	R452 R491	R452-H486 PolarHBondContact NH2-CE1 2.58Å; H486-R491 PolarHBondContact O-NH1 3.16Å
487	V	96.7	Very high	96.2	Very high	33 Å²	33	42.9 Å²	42.9	20%	0.2	22%	0.215	C	C	.	.	S	Bend	trans	-86.4	123.7	178.4	-175.4	0	0	0	0	110.8	W449 D485 A489 I490 R491	W449-V487 HydrophobicContact CB-CB 4.34Å; W449-V487 HydrophobicContact CB-CG1 4.31Å; W449-V487 HydrophobicContact CB-CG2 3.85Å; W449-V487 HydrophobicContact CD2-CG1 4.2Å; W449-V487 HydrophobicContact CE3-CG1 4.38Å; W449-V487 HydrophobicContact CG-CG1 4.17Å; W449-V487 HydrophobicContact CG-CG2 4.21Å; D485-V487 VanDerWaalsContact C-N 3.27Å; D485-V487 PolarHBondContact O-N 3.41Å; D485-V487 WeakPolarHBondContact OD1-CB 3.23Å; D485-V487 PolarHBondContact OD1-N 3.25Å; V487-A489 VanDerWaalsContact C-N 3.35Å; V487-A489 HydrophobicContact CG1-CB 4.12Å; V487-A489 PolarHBondContact O-N 3.45Å; V487-I490 HydrophobicContact CB-CB 4.39Å; V487-I490 HydrophobicContact CB-CG1 3.98Å; V487-I490 HydrophobicContact CG1-CG1 4.27Å; V487-I490 PolarHBondContact O-N 3.39Å; V487-R491 PolarHBondContact O-N 3.38Å
488	Y	96.3	Very high	96.3	Very high	111 Å²	111	38.7 Å²	38.7	44%	0.435	19%	0.193	S	C	.	.	H	α-helix	trans	-57.2	-43.9	178.6	172.7	-92	0	0	0	112.9	I490 R491 E492 F535	Y488-I490 PolarHBondContact O-N 3.06Å; Y488-R491 WeakPolarHBondContact O-CB 3.34Å; Y488-R491 PolarHBondContact O-N 3.16Å; Y488-E492 HydrophobicContact CE1-CB 4.04Å; Y488-E492 HydrophobicContact CE1-CG 4.41Å; Y488-E492 PolarHBondContact O-N 3.38Å; Y488-E492 PolarHBondContact OH-OE1 3.38Å; Y488-F535 HydrophobicContact CE2-CE2 4.09Å
489	A	97.6	Very high	96.4	Very high	31 Å²	31	38.4 Å²	38.4	26%	0.256	19%	0.193	S	C	.	.	H	α-helix	trans	-57.4	-33.8	179.7	0	0	0	0	0	112.8	W449 V487 A493	W449-A489 HydrophobicContact CE3-CB 4.36Å; W449-A489 HydrophobicContact CZ3-CB 3.95Å; V487-A489 VanDerWaalsContact C-N 3.35Å; V487-A489 HydrophobicContact CG1-CB 4.12Å; V487-A489 PolarHBondContact O-N 3.45Å; A489-A493 VanDerWaalsContact O-CB 3.27Å; A489-A493 WeakPolarHBondContact O-CB 3.49Å; A489-A493 PolarHBondContact O-N 2.87Å
490	I	97.8	Very high	96.3	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-69.9	-44.4	174.6	-63.1	-60.2	0	0	0	111.1	W449 R452 L453 I456 W482 D485 V487 Y488 E492 A493 A494	W449-I490 HydrophobicContact CB-CD1 4.29Å; W449-I490 HydrophobicContact CB-CG1 4.08Å; W449-I490 HydrophobicContact CE3-CD1 4.23Å; W449-I490 WeakPolarHBondContact O-CD1 3.4Å; R452-I490 HydrophobicContact CB-CD1 3.85Å; L453-I490 HydrophobicContact CB-CD1 3.84Å; I456-I490 HydrophobicContact CD1-CD1 4.08Å; I456-I490 HydrophobicContact CD1-CG2 3.69Å; W482-I490 HydrophobicContact CB-CG2 3.99Å; W482-I490 HydrophobicContact CG-CG2 4.28Å; D485-I490 HydrophobicContact CB-CB 3.8Å; D485-I490 HydrophobicContact CB-CG2 3.43Å; D485-I490 VanDerWaalsContact CB-CG2 3.43Å; D485-I490 VanDerWaalsContact CG-CG2 3.45Å; D485-I490 WeakPolarHBondContact OD2-CG2 3.5Å; V487-I490 HydrophobicContact CB-CB 4.39Å; V487-I490 HydrophobicContact CB-CG1 3.98Å; V487-I490 HydrophobicContact CG1-CG1 4.27Å; V487-I490 PolarHBondContact O-N 3.39Å; Y488-I490 PolarHBondContact O-N 3.06Å; I490-E492 VanDerWaalsContact C-N 3.31Å; I490-E492 PolarHBondContact O-N 2.69Å; I490-A493 PolarHBondContact O-N 2.78Å; I490-A494 VanDerWaalsContact O-CB 3.22Å; I490-A494 WeakPolarHBondContact O-CB 3.46Å; I490-A494 PolarHBondContact O-N 3.45Å
491	R	97.4	Very high	96.3	Very high	15 Å²	15	42.1 Å²	42.1	6%	0.057	21%	0.207	C	C	.	.	H	α-helix	trans	-62.2	-40.7	177	-59.3	-163.5	-60.1	-84.3	1	111.7	L483 D485 H486 V487 Y488 T495 T532	L483-R491 WeakPolarHBondContact O-CD 3.39Å; D485-R491 HydrophobicContact CB-CG 4.17Å; D485-R491 WeakPolarHBondContact O-CD 3.47Å; D485-R491 WeakPolarHBondContact O-CG 3.32Å; D485-R491 PolarHBondContact O-NH1 3.2Å; H486-R491 PolarHBondContact O-NH1 3.16Å; V487-R491 PolarHBondContact O-N 3.38Å; Y488-R491 WeakPolarHBondContact O-CB 3.34Å; Y488-R491 PolarHBondContact O-N 3.16Å; R491-T495 VanDerWaalsContact O-CB 3.32Å; R491-T495 WeakPolarHBondContact O-CB 3.29Å; R491-T495 PolarHBondContact O-N 3.29Å; R491-T495 PolarHBondContact O-OG1 3.33Å; R491-T532 HydrophobicContact CB-CG2 4.34Å; R491-T532 WeakPolarHBondContact CD-OG1 3.4Å; R491-T532 PolarHBondContact NE-OG1 2.73Å
492	E	97.4	Very high	96.3	Very high	86 Å²	86	37 Å²	37	40%	0.402	19%	0.185	S	C	.	.	H	α-helix	trans	-66.5	-47.3	176.8	-177.2	172.1	-114.4	0	0	111.7	Y488 I490 A494 T495 N496	Y488-E492 HydrophobicContact CE1-CB 4.04Å; Y488-E492 HydrophobicContact CE1-CG 4.41Å; Y488-E492 PolarHBondContact O-N 3.38Å; Y488-E492 PolarHBondContact OH-OE1 3.38Å; I490-E492 VanDerWaalsContact C-N 3.31Å; I490-E492 PolarHBondContact O-N 2.69Å; E492-A494 PolarHBondContact O-N 3.02Å; E492-T495 WeakPolarHBondContact O-CB 3.3Å; E492-T495 PolarHBondContact O-N 3.22Å; E492-N496 PolarHBondContact O-N 3.36Å; E492-N496 PolarHBondContact O-ND2 3.45Å
493	A	97.5	Very high	96.1	Very high	18 Å²	18	42.2 Å²	42.2	15%	0.149	21%	0.209	C	C	.	.	H	α-helix	trans	-61	-43.7	175.8	0	0	0	0	0	111.8	L453 I456 A489 I490 T495 N496 N497	L453-A493 HydrophobicContact CD1-CB 3.33Å; I456-A493 HydrophobicContact CG2-CB 3.9Å; A489-A493 VanDerWaalsContact O-CB 3.27Å; A489-A493 WeakPolarHBondContact O-CB 3.49Å; A489-A493 PolarHBondContact O-N 2.87Å; I490-A493 PolarHBondContact O-N 2.78Å; A493-T495 VanDerWaalsContact C-N 3.33Å; A493-T495 PolarHBondContact O-N 3.44Å; A493-N496 PolarHBondContact O-N 2.92Å; A493-N497 VanDerWaalsContact O-CB 3.23Å; A493-N497 WeakPolarHBondContact O-CB 3.4Å; A493-N497 PolarHBondContact O-N 3.05Å
494	A	97.7	Very high	95.8	Very high	4 Å²	4	46.3 Å²	46.3	3%	0.033	23%	0.227	C	C	.	.	H	α-helix	trans	-64.8	-36	176	0	0	0	0	0	112.3	W482 L483 I490 E492 N497 L498	W482-A494 HydrophobicContact CB-CB 3.55Å; L483-A494 HydrophobicContact CD2-CB 3.74Å; L483-A494 HydrophobicContact CG-CB 4.44Å; I490-A494 VanDerWaalsContact O-CB 3.22Å; I490-A494 WeakPolarHBondContact O-CB 3.46Å; I490-A494 PolarHBondContact O-N 3.45Å; E492-A494 PolarHBondContact O-N 3.02Å; A494-N497 WeakPolarHBondContact O-CB 3.36Å; A494-N497 PolarHBondContact O-N 2.8Å; A494-L498 PolarHBondContact O-N 3.25Å
495	T	97	Very high	95.6	Very high	4 Å²	4	45.6 Å²	45.6	3%	0.025	22%	0.22	C	C	.	.	H	α-helix	trans	-61.8	-51.4	173.2	-63.6	0	0	0	0	110.8	R491 E492 A493 N497 L498 F535 V539	R491-T495 VanDerWaalsContact O-CB 3.32Å; R491-T495 WeakPolarHBondContact O-CB 3.29Å; R491-T495 PolarHBondContact O-N 3.29Å; R491-T495 PolarHBondContact O-OG1 3.33Å; E492-T495 WeakPolarHBondContact O-CB 3.3Å; E492-T495 PolarHBondContact O-N 3.22Å; A493-T495 VanDerWaalsContact C-N 3.33Å; A493-T495 PolarHBondContact O-N 3.44Å; T495-N497 VanDerWaalsContact C-N 3.28Å; T495-N497 PolarHBondContact O-N 3.03Å; T495-L498 VanDerWaalsContact O-CB 3.28Å; T495-L498 WeakPolarHBondContact O-CB 3.34Å; T495-L498 PolarHBondContact O-N 3.25Å; T495-F535 HydrophobicContact CG2-CB 4.03Å; T495-F535 WeakPolarHBondContact CG2-O 3.47Å; T495-V539 HydrophobicContact CG2-CG1 4.06Å; T495-V539 HydrophobicContact CG2-CG2 3.59Å; T495-V539 WeakPolarHBondContact O-CG2 3.36Å
496	N	96.2	Very high	95.4	Very high	74 Å²	74	46 Å²	46	40%	0.396	23%	0.228	S	C	.	.	H	α-helix	trans	-65.4	-32.6	177.3	-67.9	-32.9	0	0	0	112.2	E492 A493 L498 Q499 K500	E492-N496 PolarHBondContact O-N 3.36Å; E492-N496 PolarHBondContact O-ND2 3.45Å; A493-N496 PolarHBondContact O-N 2.92Å; N496-L498 VanDerWaalsContact C-N 3.31Å; N496-L498 PolarHBondContact O-N 2.92Å; N496-Q499 WeakPolarHBondContact O-CB 3.1Å; N496-Q499 PolarHBondContact O-N 2.83Å; N496-K500 PolarHBondContact O-N 3.21Å
497	N	95.3	Very high	95.4	Very high	7 Å²	7	42 Å²	42	4%	0.037	21%	0.211	C	C	.	.	H	α-helix	trans	-62.3	-40.4	174.5	-169.8	-98.6	0	0	0	111.7	I456 P460 A493 A494 T495 Q499 K500 L501	I456-N497 HydrophobicContact CG2-CB 3.89Å; I456-N497 PolarHBondContact O-ND2 2.92Å; P460-N497 WeakPolarHBondContact CD-ND2 3.23Å; P460-N497 VanDerWaalsContact CG-ND2 3.27Å; P460-N497 WeakPolarHBondContact CG-ND2 3.5Å; A493-N497 VanDerWaalsContact O-CB 3.23Å; A493-N497 WeakPolarHBondContact O-CB 3.4Å; A493-N497 PolarHBondContact O-N 3.05Å; A494-N497 WeakPolarHBondContact O-CB 3.36Å; A494-N497 PolarHBondContact O-N 2.8Å; T495-N497 VanDerWaalsContact C-N 3.28Å; T495-N497 PolarHBondContact O-N 3.03Å; N497-Q499 VanDerWaalsContact C-N 3.28Å; N497-Q499 PolarHBondContact O-N 3.46Å; N497-K500 WeakPolarHBondContact O-CB 3.47Å; N497-K500 PolarHBondContact O-N 2.87Å; N497-K500 VanDerWaalsContact O-N 3.1Å; N497-L501 WeakPolarHBondContact O-CG 3.41Å; N497-L501 PolarHBondContact O-N 3.16Å; N497-L501 VanDerWaalsContact OD1-CD1 3.29Å; N497-L501 WeakPolarHBondContact OD1-CD1 3.46Å
498	L	94.9	Very high	95.3	Very high	8 Å²	8	47.8 Å²	47.8	4%	0.042	24%	0.236	C	C	.	.	H	α-helix	trans	-58	-41.9	178.1	-166.2	63.1	0	0	0	112	A494 T495 N496 K500 L501 V502 V514 V518 C536 T540	A494-L498 PolarHBondContact O-N 3.25Å; T495-L498 VanDerWaalsContact O-CB 3.28Å; T495-L498 WeakPolarHBondContact O-CB 3.34Å; T495-L498 PolarHBondContact O-N 3.25Å; N496-L498 VanDerWaalsContact C-N 3.31Å; N496-L498 PolarHBondContact O-N 2.92Å; L498-K500 VanDerWaalsContact C-N 3.34Å; L498-K500 PolarHBondContact O-N 3.3Å; L498-L501 PolarHBondContact O-N 3.37Å; L498-V502 WeakPolarHBondContact O-CG2 3.39Å; L498-V502 PolarHBondContact O-N 3.05Å; L498-V514 HydrophobicContact CD1-CG1 3.58Å; L498-V514 HydrophobicContact CD1-CG2 4.2Å; L498-V514 HydrophobicContact CD2-CG1 3.79Å; L498-V514 HydrophobicContact CG-CG1 4.02Å; L498-V518 HydrophobicContact CD2-CG2 3.8Å; L498-C536 HydrophobicContact CD2-CB 4.35Å; L498-T540 HydrophobicContact CD2-CG2 3.77Å; L498-T540 HydrophobicContact CG-CG2 4.05Å
499	Q	94.5	Very high	95.2	Very high	48 Å²	48	42.9 Å²	42.9	22%	0.224	22%	0.217	C	C	.	.	H	α-helix	trans	-56.2	-49.1	175.1	-173.5	-172.4	-16.3	0	0	111.2	N496 N497 L501 V502 E503 V539 V543	N496-Q499 WeakPolarHBondContact O-CB 3.1Å; N496-Q499 PolarHBondContact O-N 2.83Å; N497-Q499 VanDerWaalsContact C-N 3.28Å; N497-Q499 PolarHBondContact O-N 3.46Å; Q499-L501 VanDerWaalsContact C-N 3.29Å; Q499-L501 PolarHBondContact O-N 3.3Å; Q499-V502 PolarHBondContact O-N 3.2Å; Q499-E503 PolarHBondContact NE2-OE1 3.48Å; Q499-E503 WeakPolarHBondContact O-CG 3.18Å; Q499-E503 PolarHBondContact O-N 3.4Å; Q499-V539 HydrophobicContact CB-CB 4.16Å; Q499-V539 HydrophobicContact CB-CG2 4.31Å; Q499-V543 HydrophobicContact CG-CG1 3.65Å; Q499-V543 HydrophobicContact CG-CG2 4.36Å
500	K	94.1	Very high	95.1	Very high	112 Å²	112	41.4 Å²	41.4	49%	0.487	21%	0.205	S	C	.	.	H	α-helix	trans	-63	-34.9	179.6	-62.7	177.9	-178.9	177.7	0	112.6	P460 N496 N497 L498 K504	P460-K500 HydrophobicContact CB-CB 4.26Å; P460-K500 HydrophobicContact CG-CB 3.97Å; P460-K500 HydrophobicContact CG-CD 4.03Å; N496-K500 PolarHBondContact O-N 3.21Å; N497-K500 WeakPolarHBondContact O-CB 3.47Å; N497-K500 PolarHBondContact O-N 2.87Å; N497-K500 VanDerWaalsContact O-N 3.1Å; L498-K500 VanDerWaalsContact C-N 3.34Å; L498-K500 PolarHBondContact O-N 3.3Å; K500-K504 WeakPolarHBondContact O-CB 3.49Å; K500-K504 PolarHBondContact O-N 3.02Å
501	L	94.6	Very high	95	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-69.1	-41.1	175.6	-68.4	171	0	0	0	111.5	A463 F471 N497 L498 Q499 K504 F505 W509	A463-L501 HydrophobicContact CB-CD2 3.68Å; F471-L501 HydrophobicContact CE1-CD1 4.24Å; F471-L501 HydrophobicContact CE1-CD2 4.46Å; F471-L501 HydrophobicContact CE2-CD1 4.43Å; F471-L501 HydrophobicContact CE2-CD2 4.01Å; F471-L501 HydrophobicContact CZ-CD1 3.58Å; F471-L501 HydrophobicContact CZ-CD2 3.8Å; F471-L501 HydrophobicContact CZ-CG 4.33Å; N497-L501 WeakPolarHBondContact O-CG 3.41Å; N497-L501 PolarHBondContact O-N 3.16Å; N497-L501 VanDerWaalsContact OD1-CD1 3.29Å; N497-L501 WeakPolarHBondContact OD1-CD1 3.46Å; L498-L501 PolarHBondContact O-N 3.37Å; Q499-L501 VanDerWaalsContact C-N 3.29Å; Q499-L501 PolarHBondContact O-N 3.3Å; L501-K504 WeakPolarHBondContact O-CB 3.27Å; L501-K504 PolarHBondContact O-N 2.88Å; L501-K504 VanDerWaalsContact O-N 3.14Å; L501-F505 HydrophobicContact CD2-CE2 4.26Å; L501-F505 PolarHBondContact O-N 3.41Å; L501-W509 HydrophobicContact CB-CH2 3.93Å; L501-W509 HydrophobicContact CB-CZ3 3.98Å
502	V	94.5	Very high	94.8	Very high	2 Å²	2	49 Å²	49	1%	0.012	24%	0.243	C	C	.	.	H	α-helix	trans	-66.5	-41.1	176.7	173.4	0	0	0	0	111.6	L498 Q499 K504 G506 W509 A510 T540 V543	L498-V502 WeakPolarHBondContact O-CG2 3.39Å; L498-V502 PolarHBondContact O-N 3.05Å; Q499-V502 PolarHBondContact O-N 3.2Å; V502-K504 PolarHBondContact O-N 2.9Å; V502-K504 VanDerWaalsContact O-N 3.17Å; V502-G506 CarbonylContact O-C 3.6Å; V502-G506 VanDerWaalsContact O-CA 3.28Å; V502-G506 WeakPolarHBondContact O-CA 3.48Å; V502-G506 PolarHBondContact O-N 2.89Å; V502-W509 HydrophobicContact CG2-CZ3 4.11Å; V502-A510 HydrophobicContact CB-CB 4.34Å; V502-A510 HydrophobicContact CG1-CB 3.79Å; V502-A510 HydrophobicContact CG2-CB 3.67Å; V502-T540 HydrophobicContact CG2-CG2 4.42Å; V502-V543 HydrophobicContact CB-CG2 4.04Å; V502-V543 HydrophobicContact CG1-CB 4.46Å; V502-V543 HydrophobicContact CG1-CG2 3.56Å
503	E	93.4	Very high	94.6	Very high	113 Å²	113	46.3 Å²	46.3	53%	0.528	23%	0.233	S	C	.	.	H	α-helix	trans	-58.4	-27.2	172.9	-73	168.2	177.9	0	0	112.2	Q499 V543	Q499-E503 PolarHBondContact NE2-OE1 3.48Å; Q499-E503 WeakPolarHBondContact O-CG 3.18Å; Q499-E503 PolarHBondContact O-N 3.4Å; E503-V543 HydrophobicContact CG-CB 4.25Å; E503-V543 HydrophobicContact CG-CG1 3.65Å; E503-V543 VanDerWaalsContact OE1-CG1 3.3Å; E503-V543 WeakPolarHBondContact OE1-CG1 3.46Å
504	K	89.7	Confident	94.5	Very high	88 Å²	88	45.4 Å²	45.4	38%	0.383	23%	0.226	S	C	.	.	H	α-helix	trans	-91.6	-47.4	-175.3	-170.6	172.2	-162.6	143.2	0	114.5	P460 S464 K500 L501 V502	P460-K504 PolarHBondContact O-NZ 3.16Å; S464-K504 VanDerWaalsContact CA-CE 3.45Å; S464-K504 PolarHBondContact OG-NZ 3.3Å; K500-K504 WeakPolarHBondContact O-CB 3.49Å; K500-K504 PolarHBondContact O-N 3.02Å; L501-K504 WeakPolarHBondContact O-CB 3.27Å; L501-K504 PolarHBondContact O-N 2.88Å; L501-K504 VanDerWaalsContact O-N 3.14Å; V502-K504 PolarHBondContact O-N 2.9Å; V502-K504 VanDerWaalsContact O-N 3.17Å
505	F	93	Very high	94.4	Very high	34 Å²	34	45.4 Å²	45.4	15%	0.149	23%	0.225	C	C	.	.	H	α-helix	trans	-93.4	-9.5	-178.2	-64.7	-47.3	0	0	0	113.1	A463 Q468 F471 L501 W509	A463-F505 HydrophobicContact CB-CE2 3.85Å; A463-F505 HydrophobicContact CB-CZ 3.66Å; Q468-F505 HydrophobicContact CB-CD1 3.78Å; Q468-F505 HydrophobicContact CB-CE1 3.6Å; Q468-F505 HydrophobicContact CB-CZ 4.19Å; Q468-F505 HydrophobicContact CG-CD1 3.82Å; Q468-F505 HydrophobicContact CG-CE1 4.02Å; Q468-F505 HydrophobicContact CG-CG 4.1Å; Q468-F505 HydrophobicContact CG-CZ 4.44Å; F471-F505 HydrophobicContact CB-CE2 4.32Å; F471-F505 HydrophobicContact CB-CZ 4.17Å; F471-F505 AromaticContact CD1-CE2 3.74Å; F471-F505 HydrophobicContact CD1-CE2 3.74Å; F471-F505 HydrophobicContact CD1-CZ 4.43Å; F471-F505 HydrophobicContact CD2-CE2 4.44Å; F471-F505 HydrophobicContact CE1-CE2 4.17Å; F471-F505 AromaticContact CG-CE2 3.9Å; F471-F505 HydrophobicContact CG-CE2 3.9Å; F471-F505 HydrophobicContact CG-CZ 4.19Å; L501-F505 HydrophobicContact CD2-CE2 4.26Å; L501-F505 PolarHBondContact O-N 3.41Å; F505-W509 HydrophobicContact CB-CB 3.98Å; F505-W509 HydrophobicContact CB-CD2 3.47Å; F505-W509 VanDerWaalsContact CB-CD2 3.47Å; F505-W509 HydrophobicContact CB-CE3 3.54Å; F505-W509 HydrophobicContact CB-CG 3.68Å; F505-W509 HydrophobicContact CB-CZ3 4.21Å; F505-W509 AromaticContact CD2-CD2 3.96Å; F505-W509 HydrophobicContact CD2-CD2 3.96Å; F505-W509 AromaticContact CD2-CE2 3.77Å; F505-W509 HydrophobicContact CD2-CE3 4.04Å; F505-W509 AromaticContact CD2-CH2 3.77Å; F505-W509 HydrophobicContact CD2-CH2 3.77Å; F505-W509 AromaticContact CD2-CZ2 3.69Å; F505-W509 HydrophobicContact CD2-CZ2 3.69Å; F505-W509 AromaticContact CD2-CZ3 3.94Å; F505-W509 HydrophobicContact CD2-CZ3 3.94Å; F505-W509 HydrophobicContact CE2-CH2 4.46Å; F505-W509 HydrophobicContact CE2-CZ2 4.24Å; F505-W509 HydrophobicContact CG-CD2 4.12Å; F505-W509 HydrophobicContact CG-CE3 4.29Å
506	G	93.3	Very high	94.3	Very high	27 Å²	27	49 Å²	49	28%	0.278	25%	0.249	S	C	.	.			trans	89.3	170.5	174.5	0	0	0	0	0	114.4	V502 W509 A510	V502-G506 CarbonylContact O-C 3.6Å; V502-G506 VanDerWaalsContact O-CA 3.28Å; V502-G506 WeakPolarHBondContact O-CA 3.48Å; V502-G506 PolarHBondContact O-N 2.89Å; G506-W509 PolarHBondContact O-N 2.98Å; G506-A510 PolarHBondContact O-N 3.23Å
507	I	94.6	Very high	94.2	Very high	67 Å²	67	49.1 Å²	49.1	34%	0.344	25%	0.246	S	C	.	.	H	α-helix	trans	-72.5	-34.3	-170.6	-54.2	170.4	0	0	0	111.7	A510 T511 C544 I548	I507-A510 WeakPolarHBondContact O-CB 3.23Å; I507-A510 PolarHBondContact O-N 3.16Å; I507-T511 PolarHBondContact O-N 3.41Å; I507-T511 PolarHBondContact O-OG1 3.11Å; I507-C544 HydrophobicContact CG2-CB 3.99Å; I507-I548 HydrophobicContact CG2-CB 4.38Å; I507-I548 HydrophobicContact CG2-CG1 3.81Å; I507-I548 HydrophobicContact CG2-CG2 4.17Å
508	E	94.2	Very high	94.2	Very high	155 Å²	155	48.9 Å²	48.9	72%	0.724	25%	0.245	S	C	*	.	H	α-helix	trans	-62.9	-45.2	176.7	-66.9	-176.3	179.6	0	0	111.2	A510 T511 Q512	E508-A510 VanDerWaalsContact C-N 3.35Å; E508-A510 PolarHBondContact O-N 3.25Å; E508-T511 PolarHBondContact O-N 2.7Å; E508-Q512 WeakPolarHBondContact O-CG 3.3Å; E508-Q512 PolarHBondContact O-N 2.92Å
509	W	94.8	Very high	94.2	Very high	7 Å²	7	50.1 Å²	50.1	3%	0.027	25%	0.251	C	S	.	.	H	α-helix	trans	-60.6	-43.8	174.3	172.5	77.9	0	0	0	111.8	F471 D472 L476 L501 V502 F505 G506 T511 Q512 S513 V514	F471-W509 HydrophobicContact CD1-CZ2 4.02Å; F471-W509 HydrophobicContact CE1-CH2 4.12Å; F471-W509 AromaticContact CE1-CZ2 3.79Å; F471-W509 HydrophobicContact CE1-CZ2 3.79Å; D472-W509 PolarHBondContact OD1-NE1 2.99Å; D472-W509 PolarHBondContact OD2-NE1 3.09Å; L476-W509 HydrophobicContact CD1-CZ2 4.28Å; L501-W509 HydrophobicContact CB-CH2 3.93Å; L501-W509 HydrophobicContact CB-CZ3 3.98Å; V502-W509 HydrophobicContact CG2-CZ3 4.11Å; F505-W509 HydrophobicContact CB-CB 3.98Å; F505-W509 HydrophobicContact CB-CD2 3.47Å; F505-W509 VanDerWaalsContact CB-CD2 3.47Å; F505-W509 HydrophobicContact CB-CE3 3.54Å; F505-W509 HydrophobicContact CB-CG 3.68Å; F505-W509 HydrophobicContact CB-CZ3 4.21Å; F505-W509 AromaticContact CD2-CD2 3.96Å; F505-W509 HydrophobicContact CD2-CD2 3.96Å; F505-W509 AromaticContact CD2-CE2 3.77Å; F505-W509 HydrophobicContact CD2-CE3 4.04Å; F505-W509 AromaticContact CD2-CH2 3.77Å; F505-W509 HydrophobicContact CD2-CH2 3.77Å; F505-W509 AromaticContact CD2-CZ2 3.69Å; F505-W509 HydrophobicContact CD2-CZ2 3.69Å; F505-W509 AromaticContact CD2-CZ3 3.94Å; F505-W509 HydrophobicContact CD2-CZ3 3.94Å; F505-W509 HydrophobicContact CE2-CH2 4.46Å; F505-W509 HydrophobicContact CE2-CZ2 4.24Å; F505-W509 HydrophobicContact CG-CD2 4.12Å; F505-W509 HydrophobicContact CG-CE3 4.29Å; G506-W509 PolarHBondContact O-N 2.98Å; W509-T511 VanDerWaalsContact C-N 3.26Å; W509-T511 PolarHBondContact O-N 3.22Å; W509-Q512 PolarHBondContact O-N 2.88Å; W509-S513 WeakPolarHBondContact O-CB 3.22Å; W509-S513 PolarHBondContact O-N 3.24Å; W509-V514 HydrophobicContact CD2-CG2 4.37Å; W509-V514 HydrophobicContact CE3-CG2 3.94Å; W509-V514 HydrophobicContact CH2-CG2 3.36Å; W509-V514 HydrophobicContact CZ2-CG2 3.82Å; W509-V514 HydrophobicContact CZ3-CG2 3.43Å; W509-V514 VanDerWaalsContact CZ3-CG2 3.43Å
510	A	95.3	Very high	94.3	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.262	C	S	.	.	I	π-helix	trans	-57.9	-41.9	176.5	0	0	0	0	0	111.8	V502 G506 I507 E508 V514 F515	V502-A510 HydrophobicContact CB-CB 4.34Å; V502-A510 HydrophobicContact CG1-CB 3.79Å; V502-A510 HydrophobicContact CG2-CB 3.67Å; G506-A510 PolarHBondContact O-N 3.23Å; I507-A510 WeakPolarHBondContact O-CB 3.23Å; I507-A510 PolarHBondContact O-N 3.16Å; E508-A510 VanDerWaalsContact C-N 3.35Å; E508-A510 PolarHBondContact O-N 3.25Å; A510-V514 WeakPolarHBondContact O-CA 3.35Å; A510-V514 WeakPolarHBondContact O-CB 3.13Å; A510-V514 PolarHBondContact O-N 3.12Å; A510-V514 VanDerWaalsContact O-N 3.13Å; A510-F515 HydrophobicContact CB-CE1 4.34Å; A510-F515 HydrophobicContact CB-CE2 4.45Å; A510-F515 HydrophobicContact CB-CZ 4.12Å; A510-F515 WeakPolarHBondContact O-CG 3.37Å; A510-F515 PolarHBondContact O-N 2.64Å
511	T	94.7	Very high	94.4	Very high	30 Å²	30	46.1 Å²	46.1	18%	0.184	24%	0.24	C	C	.	.	I	π-helix	trans	-69	-37.9	-178.7	-53.2	0	0	0	0	112.4	I507 E508 W509 P516	I507-T511 PolarHBondContact O-N 3.41Å; I507-T511 PolarHBondContact O-OG1 3.11Å; E508-T511 PolarHBondContact O-N 2.7Å; W509-T511 VanDerWaalsContact C-N 3.26Å; W509-T511 PolarHBondContact O-N 3.22Å; T511-P516 WeakPolarHBondContact O-CD 3.48Å
512	Q	94.6	Very high	94.4	Very high	146 Å²	146	46.4 Å²	46.4	68%	0.682	24%	0.242	S	C	*	.	I	π-helix	trans	-85.6	-40.8	-176.1	-67	176.7	12.4	0	0	113.4	E508 W509	E508-Q512 WeakPolarHBondContact O-CG 3.3Å; E508-Q512 PolarHBondContact O-N 2.92Å; W509-Q512 PolarHBondContact O-N 2.88Å
513	S	93.5	Very high	94.4	Very high	28 Å²	28	50.3 Å²	50.3	20%	0.196	27%	0.269	C	S	.	.	I	π-helix	trans	-107.3	-34.7	-168.9	-60	0	0	0	0	113.4	W509	W509-S513 WeakPolarHBondContact O-CB 3.22Å; W509-S513 PolarHBondContact O-N 3.24Å
514	V	94.3	Very high	94.5	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.26	C	S	.	.	I	π-helix	trans	-93.8	-57.4	-171	171.8	0	0	0	0	112.4	L476 L498 W509 A510 K517 V518	L476-V514 HydrophobicContact CD1-CG2 4.36Å; L498-V514 HydrophobicContact CD1-CG1 3.58Å; L498-V514 HydrophobicContact CD1-CG2 4.2Å; L498-V514 HydrophobicContact CD2-CG1 3.79Å; L498-V514 HydrophobicContact CG-CG1 4.02Å; W509-V514 HydrophobicContact CD2-CG2 4.37Å; W509-V514 HydrophobicContact CE3-CG2 3.94Å; W509-V514 HydrophobicContact CH2-CG2 3.36Å; W509-V514 HydrophobicContact CZ2-CG2 3.82Å; W509-V514 HydrophobicContact CZ3-CG2 3.43Å; W509-V514 VanDerWaalsContact CZ3-CG2 3.43Å; A510-V514 WeakPolarHBondContact O-CA 3.35Å; A510-V514 WeakPolarHBondContact O-CB 3.13Å; A510-V514 PolarHBondContact O-N 3.12Å; A510-V514 VanDerWaalsContact O-N 3.13Å; V514-K517 PolarHBondContact O-N 3.36Å; V514-V518 HydrophobicContact CG1-CG2 3.67Å; V514-V518 WeakPolarHBondContact O-CG2 3.43Å; V514-V518 PolarHBondContact O-N 3.12Å
515	F	95.4	Very high	94.8	Very high	4 Å²	4	49.8 Å²	49.8	2%	0.018	28%	0.281	C	S	.	.	H	α-helix	trans	-58.6	-40.9	-173.6	-63.1	-21.8	0	0	0	113.8	A510 K517 V518 L519 T540 I548 H552 L553	A510-F515 HydrophobicContact CB-CE1 4.34Å; A510-F515 HydrophobicContact CB-CE2 4.45Å; A510-F515 HydrophobicContact CB-CZ 4.12Å; A510-F515 WeakPolarHBondContact O-CG 3.37Å; A510-F515 PolarHBondContact O-N 2.64Å; F515-K517 PolarHBondContact O-N 3.37Å; F515-K517 VanDerWaalsContact O-N 3.14Å; F515-V518 PolarHBondContact O-N 3.01Å; F515-L519 HydrophobicContact CB-CD1 4.23Å; F515-L519 WeakPolarHBondContact O-CB 3.37Å; F515-L519 VanDerWaalsContact O-CG 3.24Å; F515-L519 WeakPolarHBondContact O-CG 3.49Å; F515-L519 PolarHBondContact O-N 3.29Å; F515-T540 HydrophobicContact CE1-CG2 4.28Å; F515-I548 HydrophobicContact CE2-CG2 3.76Å; F515-H552 HydrophobicContact CD2-CB 4.08Å; F515-H552 HydrophobicContact CE2-CB 4.49Å; F515-L553 HydrophobicContact CD1-CD2 3.83Å; F515-L553 HydrophobicContact CD2-CD2 4.06Å; F515-L553 HydrophobicContact CE1-CD1 4.42Å; F515-L553 HydrophobicContact CE1-CD2 3.83Å; F515-L553 HydrophobicContact CE2-CD2 4.07Å; F515-L553 HydrophobicContact CE2-CG 4.47Å; F515-L553 HydrophobicContact CG-CD2 3.96Å; F515-L553 HydrophobicContact CZ-CD1 4.13Å; F515-L553 HydrophobicContact CZ-CD2 3.94Å; F515-L553 HydrophobicContact CZ-CG 4.36Å
516	P	95	Very high	94.9	Very high	80 Å²	80	51.1 Å²	51.1	52%	0.519	29%	0.289	S	S	.	.	H	α-helix	trans	-58.2	-28.9	175.6	-27.1	37.5	0	0	0	113.6	T511 T520	T511-P516 WeakPolarHBondContact O-CD 3.48Å; P516-T520 VanDerWaalsContact O-CG2 3.24Å; P516-T520 WeakPolarHBondContact O-CG2 3.43Å
517	K	94.5	Very high	95	Very high	75 Å²	75	54 Å²	54	33%	0.326	29%	0.292	S	S	.	.	H	α-helix	trans	-85.5	-49	176.7	-65.6	177.8	-175.8	-97	0	111.4	L476 D477 V480 V514 F515 L519 T520	L476-K517 HydrophobicContact CD2-CD 4.26Å; L476-K517 HydrophobicContact CG-CD 4.34Å; D477-K517 IonicContact OD1-NZ 4Å; D477-K517 PolarHBondContact OD1-NZ 3.45Å; V480-K517 HydrophobicContact CG1-CB 4.18Å; V480-K517 HydrophobicContact CG2-CB 3.93Å; V480-K517 HydrophobicContact CG2-CD 3.91Å; V514-K517 PolarHBondContact O-N 3.36Å; F515-K517 PolarHBondContact O-N 3.37Å; F515-K517 VanDerWaalsContact O-N 3.14Å; K517-L519 PolarHBondContact O-N 3.49Å; K517-T520 WeakPolarHBondContact O-CB 3.24Å; K517-T520 PolarHBondContact O-N 2.89Å; K517-T520 PolarHBondContact O-OG1 3.17Å
518	V	94.5	Very high	95.1	Very high	3 Å²	3	53.4 Å²	53.4	2%	0.018	29%	0.29	C	S	.	.	H	α-helix	trans	-62.9	-41.6	-176.5	172.4	0	0	0	0	112.2	L483 L498 V514 F515 T520 L521 C536	L483-V518 HydrophobicContact CD1-CG2 3.94Å; L498-V518 HydrophobicContact CD2-CG2 3.8Å; V514-V518 HydrophobicContact CG1-CG2 3.67Å; V514-V518 WeakPolarHBondContact O-CG2 3.43Å; V514-V518 PolarHBondContact O-N 3.12Å; F515-V518 PolarHBondContact O-N 3.01Å; V518-T520 PolarHBondContact O-N 3.22Å; V518-L521 HydrophobicContact CG1-CD1 4.5Å; V518-L521 WeakPolarHBondContact O-CB 3.44Å; V518-L521 WeakPolarHBondContact O-CG 3.27Å; V518-L521 PolarHBondContact O-N 3.14Å; V518-L521 VanDerWaalsContact O-N 3.09Å; V518-C536 HydrophobicContact CG1-CB 3.5Å
519	L	96.3	Very high	95.1	Very high	34 Å²	34	47.7 Å²	47.7	18%	0.178	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-69.9	-17.1	-176.9	-61.4	176.9	0	0	0	113	F515 K517 L521 A522 I537 H552 L553 T556	F515-L519 HydrophobicContact CB-CD1 4.23Å; F515-L519 WeakPolarHBondContact O-CB 3.37Å; F515-L519 VanDerWaalsContact O-CG 3.24Å; F515-L519 WeakPolarHBondContact O-CG 3.49Å; F515-L519 PolarHBondContact O-N 3.29Å; K517-L519 PolarHBondContact O-N 3.49Å; L519-L521 PolarHBondContact O-N 2.61Å; L519-A522 WeakPolarHBondContact O-CB 3.32Å; L519-A522 PolarHBondContact O-N 3.29Å; L519-I537 HydrophobicContact CD2-CD1 4.14Å; L519-I537 HydrophobicContact CD2-CG1 4.36Å; L519-H552 VanDerWaalsContact CD1-O 3.28Å; L519-H552 WeakPolarHBondContact CD1-O 3.37Å; L519-L553 HydrophobicContact CD2-CD2 4.08Å; L519-T556 HydrophobicContact CD2-CG2 4.12Å
520	T	95.8	Very high	95.3	Very high	73 Å²	73	48.2 Å²	48.2	45%	0.448	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-64.6	-25	172.4	68.9	0	0	0	0	112.4	P516 K517 V518 A522 S523	P516-T520 VanDerWaalsContact O-CG2 3.24Å; P516-T520 WeakPolarHBondContact O-CG2 3.43Å; K517-T520 WeakPolarHBondContact O-CB 3.24Å; K517-T520 PolarHBondContact O-N 2.89Å; K517-T520 PolarHBondContact O-OG1 3.17Å; V518-T520 PolarHBondContact O-N 3.22Å; T520-A522 PolarHBondContact O-N 3.21Å; T520-A522 VanDerWaalsContact O-N 3.16Å; T520-S523 PolarHBondContact O-N 2.87Å
521	L	95.6	Very high	95.4	Very high	3 Å²	3	49 Å²	49	2%	0.016	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-58.5	-28.3	176.9	-63.5	176.7	0	0	0	112.2	L483 T484 V518 L519 S523 Q524 R530 T532 C533	L483-L521 HydrophobicContact CB-CD1 3.87Å; L483-L521 HydrophobicContact CD1-CD1 4Å; T484-L521 HydrophobicContact CG2-CD2 3.37Å; V518-L521 HydrophobicContact CG1-CD1 4.5Å; V518-L521 WeakPolarHBondContact O-CB 3.44Å; V518-L521 WeakPolarHBondContact O-CG 3.27Å; V518-L521 PolarHBondContact O-N 3.14Å; V518-L521 VanDerWaalsContact O-N 3.09Å; L519-L521 PolarHBondContact O-N 2.61Å; L521-S523 PolarHBondContact O-N 3.09Å; L521-Q524 HydrophobicContact CD2-CG 4.48Å; L521-Q524 WeakPolarHBondContact O-CB 3.38Å; L521-Q524 PolarHBondContact O-N 2.9Å; L521-R530 WeakPolarHBondContact O-CG 3.49Å; L521-T532 HydrophobicContact CD1-CG2 4.45Å; L521-C533 HydrophobicContact CB-CB 3.8Å
522	A	96	Very high	95.5	Very high	6 Å²	6	47.7 Å²	47.7	5%	0.05	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-64.7	-17.1	177	0	0	0	0	0	114	L519 T520 R530 T556 L560	L519-A522 WeakPolarHBondContact O-CB 3.32Å; L519-A522 PolarHBondContact O-N 3.29Å; T520-A522 PolarHBondContact O-N 3.21Å; T520-A522 VanDerWaalsContact O-N 3.16Å; A522-R530 VanDerWaalsContact O-CD 3.23Å; A522-R530 WeakPolarHBondContact O-CD 3.36Å; A522-T556 HydrophobicContact CB-CG2 3.44Å; A522-T556 VanDerWaalsContact CB-CG2 3.44Å; A522-L560 HydrophobicContact CB-CD1 3.98Å; A522-L560 HydrophobicContact CB-CD2 4.02Å; A522-L560 HydrophobicContact CB-CG 4.15Å
523	S	94.8	Very high	95.6	Very high	83 Å²	83	40.7 Å²	40.7	58%	0.58	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-106.5	5.6	-179.2	-51.3	0	0	0	0	113.1	T520 L521 K559	T520-S523 PolarHBondContact O-N 2.87Å; L521-S523 PolarHBondContact O-N 3.09Å; S523-K559 PolarHBondContact OG-NZ 3.39Å
524	Q	94.9	Very high	95.8	Very high	75 Å²	75	39.4 Å²	39.4	35%	0.35	22%	0.219	S	C	.	.			trans	-70.7	148	179.4	-67.9	-66.9	-18.1	0	0	111.9	L521 N526 Q529 R530	L521-Q524 HydrophobicContact CD2-CG 4.48Å; L521-Q524 WeakPolarHBondContact O-CB 3.38Å; L521-Q524 PolarHBondContact O-N 2.9Å; Q524-N526 VanDerWaalsContact C-N 3.3Å; Q524-N526 PolarHBondContact O-N 2.79Å; Q524-Q529 HydrophobicContact CB-CB 3.97Å; Q524-Q529 VanDerWaalsContact CB-OE1 3.23Å; Q524-Q529 HydrophobicContact CG-CB 4.23Å; Q524-Q529 VanDerWaalsContact CG-OE1 3.24Å; Q524-R530 WeakPolarHBondContact O-CD 3.49Å; Q524-R530 WeakPolarHBondContact O-CG 3.46Å; Q524-R530 PolarHBondContact O-NH1 2.7Å
525	S	94.7	Very high	96	Very high	115 Å²	115	41.7 Å²	41.7	80%	0.804	23%	0.229	S	C	*	.	S	Bend	trans	-64.8	-35.5	179.3	57.8	0	0	0	0	112.3	Y527 R530	S525-Y527 PolarHBondContact O-N 3.44Å; S525-R530 PolarHBondContact O-NH1 2.77Å
526	N	95.1	Very high	96.1	Very high	63 Å²	63	41.5 Å²	41.5	34%	0.337	23%	0.228	S	C	.	.	S	Bend	trans	-79.3	119	178.6	-172	-16.7	0	0	0	111.5	Q524 L528 Q529 R530	Q524-N526 VanDerWaalsContact C-N 3.3Å; Q524-N526 PolarHBondContact O-N 2.79Å; N526-L528 PolarHBondContact O-N 3.4Å; N526-L528 WeakPolarHBondContact OD1-CB 3.4Å; N526-L528 PolarHBondContact OD1-N 3.15Å; N526-Q529 HydrophobicContact CB-CG 4.26Å; N526-Q529 PolarHBondContact O-N 3.28Å; N526-Q529 VanDerWaalsContact O-N 3.09Å; N526-R530 PolarHBondContact O-N 3.45Å
527	Y	95.9	Very high	96.2	Very high	86 Å²	86	37.8 Å²	37.8	34%	0.337	20%	0.204	S	C	.	.	H	α-helix	trans	-60.7	-29	179.6	84.9	-83.8	0	0	0	113	S525 Q529 R530 L531 V565 N567	S525-Y527 PolarHBondContact O-N 3.44Å; Y527-Q529 VanDerWaalsContact C-N 3.27Å; Y527-Q529 PolarHBondContact O-N 3.28Å; Y527-R530 PolarHBondContact O-N 3.35Å; Y527-L531 HydrophobicContact CD2-CD1 3.8Å; Y527-L531 HydrophobicContact CD2-CG 4.26Å; Y527-L531 HydrophobicContact CE2-CD1 3.8Å; Y527-L531 WeakPolarHBondContact O-CG 3.43Å; Y527-L531 PolarHBondContact O-N 2.82Å; Y527-V565 HydrophobicContact CD2-CG1 4.18Å; Y527-V565 HydrophobicContact CG-CG1 4.16Å; Y527-N567 HydrophobicContact CD2-CB 4.21Å; Y527-N567 HydrophobicContact CE2-CB 4.12Å
528	L	96.2	Very high	96.2	Very high	55 Å²	55	35.2 Å²	35.2	29%	0.288	19%	0.194	S	C	.	.	H	α-helix	trans	-62.4	-34.8	176.8	-65.3	176.4	0	0	0	112.2	N526 T532	N526-L528 PolarHBondContact O-N 3.4Å; N526-L528 WeakPolarHBondContact OD1-CB 3.4Å; N526-L528 PolarHBondContact OD1-N 3.15Å; L528-T532 PolarHBondContact O-N 2.96Å; L528-T532 VanDerWaalsContact O-N 3.08Å; L528-T532 PolarHBondContact O-OG1 3.17Å; L528-T532 VanDerWaalsContact O-OG1 3.07Å
529	Q	95.7	Very high	96.3	Very high	35 Å²	35	35.8 Å²	35.8	16%	0.164	20%	0.198	C	C	.	.	H	α-helix	trans	-75.3	-36.4	176.8	-64.7	175.4	-4.2	0	0	110.9	T484 Q524 N526 Y527 L531 T532 C533	T484-Q529 HydrophobicContact CG2-CG 4.19Å; Q524-Q529 HydrophobicContact CB-CB 3.97Å; Q524-Q529 VanDerWaalsContact CB-OE1 3.23Å; Q524-Q529 HydrophobicContact CG-CB 4.23Å; Q524-Q529 VanDerWaalsContact CG-OE1 3.24Å; N526-Q529 HydrophobicContact CB-CG 4.26Å; N526-Q529 PolarHBondContact O-N 3.28Å; N526-Q529 VanDerWaalsContact O-N 3.09Å; Y527-Q529 VanDerWaalsContact C-N 3.27Å; Y527-Q529 PolarHBondContact O-N 3.28Å; Q529-L531 VanDerWaalsContact C-N 3.31Å; Q529-L531 PolarHBondContact O-N 3.4Å; Q529-T532 WeakPolarHBondContact O-CB 3.16Å; Q529-T532 PolarHBondContact O-N 3.38Å; Q529-T532 VanDerWaalsContact O-N 3.16Å; Q529-C533 PolarHBondContact O-N 3.13Å; Q529-C533 VanDerWaalsContact O-N 3.11Å
530	R	97.6	Very high	96.2	Very high	19 Å²	19	34.3 Å²	34.3	7%	0.072	19%	0.19	C	C	.	.	H	α-helix	trans	-63.4	-37.1	171.9	-57.6	-162.6	-61.3	-86.6	8.3	111.8	L521 A522 Q524 S525 N526 Y527 C533 L534 L560 D563 V568	L521-R530 WeakPolarHBondContact O-CG 3.49Å; A522-R530 VanDerWaalsContact O-CD 3.23Å; A522-R530 WeakPolarHBondContact O-CD 3.36Å; Q524-R530 WeakPolarHBondContact O-CD 3.49Å; Q524-R530 WeakPolarHBondContact O-CG 3.46Å; Q524-R530 PolarHBondContact O-NH1 2.7Å; S525-R530 PolarHBondContact O-NH1 2.77Å; N526-R530 PolarHBondContact O-N 3.45Å; Y527-R530 PolarHBondContact O-N 3.35Å; R530-C533 WeakPolarHBondContact O-CB 3.36Å; R530-C533 PolarHBondContact O-N 3.3Å; R530-L534 PolarHBondContact O-N 3.47Å; R530-L560 HydrophobicContact CB-CD2 4.44Å; R530-D563 WeakPolarHBondContact CD-OD2 3.24Å; R530-D563 IonicContact CZ-OD1 3.51Å; R530-D563 IonicContact CZ-OD2 2.69Å; R530-D563 IonicContact NE-OD1 3.09Å; R530-D563 IonicContact NE-OD2 3.02Å; R530-D563 PolarHBondContact NE-OD2 2.9Å; R530-D563 IonicContact NH2-OD1 2.79Å; R530-D563 PolarHBondContact NH2-OD1 3.11Å; R530-D563 IonicContact NH2-OD2 3.02Å; R530-D563 PolarHBondContact NH2-OD2 3.34Å; R530-V568 HydrophobicContact CB-CG2 4.32Å
531	L	97.2	Very high	96.2	Very high	16 Å²	16	30.9 Å²	30.9	8%	0.084	17%	0.169	C	C	.	.	H	α-helix	trans	-63.4	-42.3	170.5	-69.9	-179.7	0	0	0	112.2	Y527 Q529 C533 L534 F535 N567 V568 N571	Y527-L531 HydrophobicContact CD2-CD1 3.8Å; Y527-L531 HydrophobicContact CD2-CG 4.26Å; Y527-L531 HydrophobicContact CE2-CD1 3.8Å; Y527-L531 WeakPolarHBondContact O-CG 3.43Å; Y527-L531 PolarHBondContact O-N 2.82Å; Q529-L531 VanDerWaalsContact C-N 3.31Å; Q529-L531 PolarHBondContact O-N 3.4Å; L531-C533 PolarHBondContact O-N 3.47Å; L531-L534 HydrophobicContact CD2-CD1 4.35Å; L531-L534 WeakPolarHBondContact O-CB 3.47Å; L531-L534 PolarHBondContact O-N 2.99Å; L531-F535 HydrophobicContact CB-CE2 4.15Å; L531-F535 HydrophobicContact CB-CZ 4.33Å; L531-F535 WeakPolarHBondContact O-CD2 3.19Å; L531-F535 WeakPolarHBondContact O-CG 3.42Å; L531-F535 PolarHBondContact O-N 3.38Å; L531-N567 WeakPolarHBondContact CD2-O 3.21Å; L531-V568 HydrophobicContact CD2-CB 4.43Å; L531-V568 HydrophobicContact CD2-CG2 4.11Å; L531-V568 HydrophobicContact CG-CG2 4.33Å; L531-N571 HydrophobicContact CD2-CB 3.62Å; L531-N571 WeakPolarHBondContact CD2-ND2 3.43Å
532	T	97.3	Very high	96	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.012	20%	0.196	C	C	.	.	H	α-helix	trans	-57.8	-35.4	174.5	-50.4	0	0	0	0	112	L483 R491 L521 L528 Q529 L534 F535 C536	L483-T532 HydrophobicContact CB-CG2 3.92Å; L483-T532 HydrophobicContact CD2-CG2 4.04Å; L483-T532 WeakPolarHBondContact O-CG2 3.05Å; L483-T532 PolarHBondContact O-OG1 3.03Å; R491-T532 HydrophobicContact CB-CG2 4.34Å; R491-T532 WeakPolarHBondContact CD-OG1 3.4Å; R491-T532 PolarHBondContact NE-OG1 2.73Å; L521-T532 HydrophobicContact CD1-CG2 4.45Å; L528-T532 PolarHBondContact O-N 2.96Å; L528-T532 VanDerWaalsContact O-N 3.08Å; L528-T532 PolarHBondContact O-OG1 3.17Å; L528-T532 VanDerWaalsContact O-OG1 3.07Å; Q529-T532 WeakPolarHBondContact O-CB 3.16Å; Q529-T532 PolarHBondContact O-N 3.38Å; Q529-T532 VanDerWaalsContact O-N 3.16Å; T532-L534 PolarHBondContact O-N 3.44Å; T532-F535 PolarHBondContact O-N 3.41Å; T532-C536 PolarHBondContact O-N 2.97Å; T532-C536 PolarHBondContact O-SG 2.96Å
533	C	97.7	Very high	95.9	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-56.7	-48.9	173.7	-167.6	0	0	0	0	111.6	L521 Q529 R530 L531 F535 C536 I537	L521-C533 HydrophobicContact CB-CB 3.8Å; Q529-C533 PolarHBondContact O-N 3.13Å; Q529-C533 VanDerWaalsContact O-N 3.11Å; R530-C533 WeakPolarHBondContact O-CB 3.36Å; R530-C533 PolarHBondContact O-N 3.3Å; L531-C533 PolarHBondContact O-N 3.47Å; C533-F535 VanDerWaalsContact C-N 3.33Å; C533-F535 PolarHBondContact O-N 3.4Å; C533-C536 WeakPolarHBondContact O-CB 3.42Å; C533-C536 PolarHBondContact O-N 3.13Å; C533-I537 WeakPolarHBondContact O-CG1 3.33Å; C533-I537 PolarHBondContact O-N 3.22Å
534	L	97.8	Very high	95.8	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.8	-40.2	177	-66.8	173.2	0	0	0	111.9	R530 L531 T532 I537 N538 V557 L560 V568 N571 V572 T575	R530-L534 PolarHBondContact O-N 3.47Å; L531-L534 HydrophobicContact CD2-CD1 4.35Å; L531-L534 WeakPolarHBondContact O-CB 3.47Å; L531-L534 PolarHBondContact O-N 2.99Å; T532-L534 PolarHBondContact O-N 3.44Å; L534-I537 PolarHBondContact O-N 3.29Å; L534-N538 PolarHBondContact O-N 3.45Å; L534-N538 PolarHBondContact O-ND2 3.49Å; L534-V557 HydrophobicContact CD2-CG1 4.46Å; L534-V557 HydrophobicContact CD2-CG2 4.36Å; L534-L560 HydrophobicContact CD1-CD1 4.42Å; L534-L560 HydrophobicContact CD2-CD1 3.7Å; L534-L560 HydrophobicContact CG-CD1 3.86Å; L534-V568 HydrophobicContact CD1-CG1 4.28Å; L534-N571 HydrophobicContact CD1-CB 3.71Å; L534-V572 HydrophobicContact CD1-CG2 3.97Å; L534-V572 HydrophobicContact CD2-CG2 4.06Å; L534-T575 HydrophobicContact CD2-CG2 4.23Å
535	F	97.3	Very high	95.6	Very high	49 Å²	49	32.6 Å²	32.6	22%	0.215	17%	0.174	C	C	.	.	H	α-helix	trans	-66.3	-39.2	176.4	-56.7	-29.8	0	0	0	112.5	Y488 T495 L531 T532 C533 I537 N538 V539	Y488-F535 HydrophobicContact CE2-CE2 4.09Å; T495-F535 HydrophobicContact CG2-CB 4.03Å; T495-F535 WeakPolarHBondContact CG2-O 3.47Å; L531-F535 HydrophobicContact CB-CE2 4.15Å; L531-F535 HydrophobicContact CB-CZ 4.33Å; L531-F535 WeakPolarHBondContact O-CD2 3.19Å; L531-F535 WeakPolarHBondContact O-CG 3.42Å; L531-F535 PolarHBondContact O-N 3.38Å; T532-F535 PolarHBondContact O-N 3.41Å; C533-F535 VanDerWaalsContact C-N 3.33Å; C533-F535 PolarHBondContact O-N 3.4Å; F535-I537 VanDerWaalsContact C-N 3.33Å; F535-I537 PolarHBondContact O-N 3.48Å; F535-N538 WeakPolarHBondContact O-CB 3.33Å; F535-N538 PolarHBondContact O-N 3.02Å; F535-V539 PolarHBondContact O-N 3.33Å
536	C	97.3	Very high	95.5	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-61.1	-41.9	172.1	-67.6	0	0	0	0	111.9	L498 V518 T532 C533 V539 T540	L498-C536 HydrophobicContact CD2-CB 4.35Å; V518-C536 HydrophobicContact CG1-CB 3.5Å; T532-C536 PolarHBondContact O-N 2.97Å; T532-C536 PolarHBondContact O-SG 2.96Å; C533-C536 WeakPolarHBondContact O-CB 3.42Å; C533-C536 PolarHBondContact O-N 3.13Å; C536-V539 WeakPolarHBondContact O-CG2 3.35Å; C536-V539 PolarHBondContact O-N 3.44Å; C536-T540 WeakPolarHBondContact O-CB 3.47Å; C536-T540 WeakPolarHBondContact O-CG2 3.41Å; C536-T540 PolarHBondContact O-N 3.44Å; C536-T540 PolarHBondContact O-OG1 2.89Å
537	I	97	Very high	95.4	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-62.2	-44.3	175.5	-68.2	168	0	0	0	110.4	L519 C533 L534 F535 V539 T540 A541 L553 V557 T575 I579	L519-I537 HydrophobicContact CD2-CD1 4.14Å; L519-I537 HydrophobicContact CD2-CG1 4.36Å; C533-I537 WeakPolarHBondContact O-CG1 3.33Å; C533-I537 PolarHBondContact O-N 3.22Å; L534-I537 PolarHBondContact O-N 3.29Å; F535-I537 VanDerWaalsContact C-N 3.33Å; F535-I537 PolarHBondContact O-N 3.48Å; I537-V539 VanDerWaalsContact C-N 3.3Å; I537-V539 PolarHBondContact O-N 3.02Å; I537-T540 PolarHBondContact O-N 2.85Å; I537-A541 WeakPolarHBondContact O-CB 3.46Å; I537-A541 PolarHBondContact O-N 3.29Å; I537-L553 HydrophobicContact CG1-CB 4.29Å; I537-L553 HydrophobicContact CG1-CD2 4.36Å; I537-L553 HydrophobicContact CG2-CB 4.02Å; I537-L553 HydrophobicContact CG2-CD1 4.31Å; I537-V557 HydrophobicContact CD1-CG2 3.73Å; I537-V557 HydrophobicContact CG2-CG2 3.95Å; I537-T575 HydrophobicContact CG2-CG2 4.25Å; I537-I579 HydrophobicContact CG2-CD1 4.4Å
538	N	96	Very high	95.3	Very high	21 Å²	21	28.4 Å²	28.4	11%	0.112	16%	0.162	C	C	.	.	H	α-helix	trans	-57.5	-39	179.5	-75.3	-27.7	0	0	0	113.7	L534 F535 K542 T575 T578	L534-N538 PolarHBondContact O-N 3.45Å; L534-N538 PolarHBondContact O-ND2 3.49Å; F535-N538 WeakPolarHBondContact O-CB 3.33Å; F535-N538 PolarHBondContact O-N 3.02Å; N538-K542 WeakPolarHBondContact O-CG 3.4Å; N538-T575 WeakPolarHBondContact OD1-CA 3.27Å; N538-T575 VanDerWaalsContact OD1-CG2 3.32Å; N538-T575 WeakPolarHBondContact OD1-CG2 3.35Å; N538-T578 HydrophobicContact CB-CG2 4.39Å
539	V	95.4	Very high	95.2	Very high	16 Å²	16	25.8 Å²	25.8	10%	0.097	15%	0.148	C	C	.	.	H	α-helix	trans	-86.2	-38.7	-178.6	-58.9	0	0	0	0	112.4	T495 Q499 F535 C536 I537	T495-V539 HydrophobicContact CG2-CG1 4.06Å; T495-V539 HydrophobicContact CG2-CG2 3.59Å; T495-V539 WeakPolarHBondContact O-CG2 3.36Å; Q499-V539 HydrophobicContact CB-CB 4.16Å; Q499-V539 HydrophobicContact CB-CG2 4.31Å; F535-V539 PolarHBondContact O-N 3.33Å; C536-V539 WeakPolarHBondContact O-CG2 3.35Å; C536-V539 PolarHBondContact O-N 3.44Å; I537-V539 VanDerWaalsContact C-N 3.3Å; I537-V539 PolarHBondContact O-N 3.02Å
540	T	95.1	Very high	95.1	Very high	2 Å²	2	26 Å²	26	1%	0.012	15%	0.154	C	C	.	.	H	α-helix	trans	-74.9	-32.7	-179.1	55.2	0	0	0	0	112.8	L498 V502 F515 C536 I537 K542 V543 C544	L498-T540 HydrophobicContact CD2-CG2 3.77Å; L498-T540 HydrophobicContact CG-CG2 4.05Å; V502-T540 HydrophobicContact CG2-CG2 4.42Å; F515-T540 HydrophobicContact CE1-CG2 4.28Å; C536-T540 WeakPolarHBondContact O-CB 3.47Å; C536-T540 WeakPolarHBondContact O-CG2 3.41Å; C536-T540 PolarHBondContact O-N 3.44Å; C536-T540 PolarHBondContact O-OG1 2.89Å; I537-T540 PolarHBondContact O-N 2.85Å; T540-K542 VanDerWaalsContact C-N 3.25Å; T540-K542 PolarHBondContact O-N 2.93Å; T540-V543 WeakPolarHBondContact O-CG2 3.25Å; T540-V543 PolarHBondContact O-N 2.89Å; T540-V543 VanDerWaalsContact O-N 3.12Å; T540-C544 PolarHBondContact O-N 2.98Å; T540-C544 PolarHBondContact O-SG 3.3Å
541	A	94.7	Very high	94.9	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.008	18%	0.179	C	C	.	.	H	α-helix	trans	-60.9	-34.5	176.5	0	0	0	0	0	112.5	I537 V543 G545 T549 L553 I579 M582	I537-A541 WeakPolarHBondContact O-CB 3.46Å; I537-A541 PolarHBondContact O-N 3.29Å; A541-V543 PolarHBondContact O-N 3.06Å; A541-G545 PolarHBondContact O-N 3.46Å; A541-T549 WeakPolarHBondContact CA-OG1 3.14Å; A541-T549 HydrophobicContact CB-CG2 3.64Å; A541-T549 WeakPolarHBondContact CB-OG1 3.35Å; A541-L553 HydrophobicContact CB-CD1 4.22Å; A541-I579 HydrophobicContact CB-CB 4.42Å; A541-I579 HydrophobicContact CB-CG2 3.77Å; A541-M582 HydrophobicContact CB-CE 3.75Å; A541-M582 HydrophobicContact CB-SD 4.06Å
542	K	92.2	Very high	94.8	Very high	136 Å²	136	33.3 Å²	33.3	59%	0.591	19%	0.188	S	C	*	.	H	α-helix	trans	-61.8	-29.3	176.8	-67.7	176.7	-176.8	179.3	0	113.2	N538 T540	N538-K542 WeakPolarHBondContact O-CG 3.4Å; T540-K542 VanDerWaalsContact C-N 3.25Å; T540-K542 PolarHBondContact O-N 2.93Å
543	V	93.2	Very high	94.8	Very high	34 Å²	34	33.2 Å²	33.2	21%	0.206	19%	0.188	C	C	.	.	H	α-helix	trans	-102.1	-23.2	-176.2	-62.3	0	0	0	0	113.3	Q499 V502 E503 T540 A541	Q499-V543 HydrophobicContact CG-CG1 3.65Å; Q499-V543 HydrophobicContact CG-CG2 4.36Å; V502-V543 HydrophobicContact CB-CG2 4.04Å; V502-V543 HydrophobicContact CG1-CB 4.46Å; V502-V543 HydrophobicContact CG1-CG2 3.56Å; E503-V543 HydrophobicContact CG-CB 4.25Å; E503-V543 HydrophobicContact CG-CG1 3.65Å; E503-V543 VanDerWaalsContact OE1-CG1 3.3Å; E503-V543 WeakPolarHBondContact OE1-CG1 3.46Å; T540-V543 WeakPolarHBondContact O-CG2 3.25Å; T540-V543 PolarHBondContact O-N 2.89Å; T540-V543 VanDerWaalsContact O-N 3.12Å; A541-V543 PolarHBondContact O-N 3.06Å
544	C	93	Very high	94.6	Very high	8 Å²	8	33.3 Å²	33.3	5%	0.054	19%	0.188	C	C	.	.	H	α-helix	trans	-90	-16.4	-178.4	-60.6	0	0	0	0	113.8	I507 T540 I548	I507-C544 HydrophobicContact CG2-CB 3.99Å; T540-C544 PolarHBondContact O-N 2.98Å; T540-C544 PolarHBondContact O-SG 3.3Å; C544-I548 HydrophobicContact CB-CB 4.07Å; C544-I548 HydrophobicContact CB-CG2 3.89Å
545	G	91.7	Very high	94.5	Very high	25 Å²	25	36.6 Å²	36.6	26%	0.258	21%	0.21	S	C	.	.	H	α-helix	trans	77.5	174.3	-179.4	0	0	0	0	0	114.2	A541 T549	A541-G545 PolarHBondContact O-N 3.46Å; G545-T549 WeakPolarHBondContact O-CB 3.27Å; G545-T549 PolarHBondContact O-N 3.49Å; G545-T549 VanDerWaalsContact O-N 3.14Å; G545-T549 PolarHBondContact O-OG1 3.29Å
546	P	92.5	Very high	94.5	Very high	64 Å²	64	35.3 Å²	35.3	42%	0.416	21%	0.206	S	C	.	.	H	α-helix	trans	-67.4	-39.6	-168.4	22.5	-32.4	0	0	0	114.1	T549 S550 M582 F583	P546-T549 PolarHBondContact O-N 3.37Å; P546-S550 WeakPolarHBondContact O-CB 3.47Å; P546-S550 PolarHBondContact O-N 2.77Å; P546-M582 HydrophobicContact CB-CG 4.23Å; P546-M582 WeakPolarHBondContact CB-O 3.17Å; P546-F583 HydrophobicContact CB-CD1 4.06Å; P546-F583 HydrophobicContact CB-CE1 4.05Å; P546-F583 WeakPolarHBondContact O-CE1 3.36Å
547	A	92.3	Very high	94.5	Very high	74 Å²	74	35.3 Å²	35.3	61%	0.612	21%	0.206	S	C	*	.	H	α-helix	trans	-62	-50.6	-176.3	0	0	0	0	0	112	T549 S550 Q551	A547-T549 VanDerWaalsContact C-N 3.35Å; A547-S550 PolarHBondContact O-N 2.77Å; A547-Q551 WeakPolarHBondContact O-CB 3.35Å; A547-Q551 PolarHBondContact O-N 2.98Å
548	I	93.4	Very high	94.5	Very high	38 Å²	38	37.5 Å²	37.5	20%	0.195	22%	0.215	C	C	.	.	H	α-helix	trans	-67.5	-38.3	178.8	-60.6	-61	0	0	0	110.9	I507 F515 C544 Q551 H552	I507-I548 HydrophobicContact CG2-CB 4.38Å; I507-I548 HydrophobicContact CG2-CG1 3.81Å; I507-I548 HydrophobicContact CG2-CG2 4.17Å; F515-I548 HydrophobicContact CE2-CG2 3.76Å; C544-I548 HydrophobicContact CB-CB 4.07Å; C544-I548 HydrophobicContact CB-CG2 3.89Å; I548-Q551 PolarHBondContact O-N 3.33Å; I548-H552 WeakPolarHBondContact O-CB 3.5Å; I548-H552 PolarHBondContact O-N 3.42Å
549	T	94.4	Very high	94.5	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.235	C	C	.	.	I	π-helix	trans	-63.1	-46.3	177.4	-57.6	0	0	0	0	111.6	A541 G545 P546 A547 L553 L554 I579 M582 F583	A541-T549 WeakPolarHBondContact CA-OG1 3.14Å; A541-T549 HydrophobicContact CB-CG2 3.64Å; A541-T549 WeakPolarHBondContact CB-OG1 3.35Å; G545-T549 WeakPolarHBondContact O-CB 3.27Å; G545-T549 PolarHBondContact O-N 3.49Å; G545-T549 VanDerWaalsContact O-N 3.14Å; G545-T549 PolarHBondContact O-OG1 3.29Å; P546-T549 PolarHBondContact O-N 3.37Å; A547-T549 VanDerWaalsContact C-N 3.35Å; T549-L553 HydrophobicContact CG2-CB 4.24Å; T549-L553 HydrophobicContact CG2-CD1 4.26Å; T549-L553 WeakPolarHBondContact O-CB 3.21Å; T549-L553 PolarHBondContact O-N 2.71Å; T549-L554 WeakPolarHBondContact O-CB 3.24Å; T549-L554 PolarHBondContact O-N 3.39Å; T549-I579 HydrophobicContact CG2-CD1 4.24Å; T549-M582 HydrophobicContact CG2-SD 3.85Å; T549-F583 HydrophobicContact CG2-CE2 4.29Å; T549-F583 HydrophobicContact CG2-CZ 3.77Å
550	S	93.7	Very high	94.6	Very high	40 Å²	40	41.8 Å²	41.8	28%	0.28	23%	0.232	S	C	.	.	I	π-helix	trans	-62.3	-45.1	175.9	172.1	0	0	0	0	111.5	P546 A547 P555 E591	P546-S550 WeakPolarHBondContact O-CB 3.47Å; P546-S550 PolarHBondContact O-N 2.77Å; A547-S550 PolarHBondContact O-N 2.77Å; S550-P555 WeakPolarHBondContact O-CD 3.42Å; S550-E591 PolarHBondContact OG-OE2 2.93Å
551	Q	94.5	Very high	94.7	Very high	129 Å²	129	41.8 Å²	41.8	60%	0.603	23%	0.232	S	C	*	.	I	π-helix	trans	-70.5	-43.9	-175.5	-175.6	177.9	1.2	0	0	113.6	A547 I548	A547-Q551 WeakPolarHBondContact O-CB 3.35Å; A547-Q551 PolarHBondContact O-N 2.98Å; I548-Q551 PolarHBondContact O-N 3.33Å
552	H	94.6	Very high	94.8	Very high	59 Å²	59	46.9 Å²	46.9	27%	0.273	26%	0.259	S	S	.	.	I	π-helix	trans	-110.1	-31.5	-167.4	-68.3	-78.3	0	0	0	114.6	F515 L519 I548	F515-H552 HydrophobicContact CD2-CB 4.08Å; F515-H552 HydrophobicContact CE2-CB 4.49Å; L519-H552 VanDerWaalsContact CD1-O 3.28Å; L519-H552 WeakPolarHBondContact CD1-O 3.37Å; I548-H552 WeakPolarHBondContact O-CB 3.5Å; I548-H552 PolarHBondContact O-N 3.42Å
553	L	96.1	Very high	95.1	Very high	1 Å²	1	41 Å²	41	1%	0.005	23%	0.234	C	C	.	.	I	π-helix	trans	-102.5	-43.2	-170.3	-55	-177.9	0	0	0	112.4	F515 L519 I537 A541 T549 P555 T556 V557	F515-L553 HydrophobicContact CD1-CD2 3.83Å; F515-L553 HydrophobicContact CD2-CD2 4.06Å; F515-L553 HydrophobicContact CE1-CD1 4.42Å; F515-L553 HydrophobicContact CE1-CD2 3.83Å; F515-L553 HydrophobicContact CE2-CD2 4.07Å; F515-L553 HydrophobicContact CE2-CG 4.47Å; F515-L553 HydrophobicContact CG-CD2 3.96Å; F515-L553 HydrophobicContact CZ-CD1 4.13Å; F515-L553 HydrophobicContact CZ-CD2 3.94Å; F515-L553 HydrophobicContact CZ-CG 4.36Å; L519-L553 HydrophobicContact CD2-CD2 4.08Å; I537-L553 HydrophobicContact CG1-CB 4.29Å; I537-L553 HydrophobicContact CG1-CD2 4.36Å; I537-L553 HydrophobicContact CG2-CB 4.02Å; I537-L553 HydrophobicContact CG2-CD1 4.31Å; A541-L553 HydrophobicContact CB-CD1 4.22Å; T549-L553 HydrophobicContact CG2-CB 4.24Å; T549-L553 HydrophobicContact CG2-CD1 4.26Å; T549-L553 WeakPolarHBondContact O-CB 3.21Å; T549-L553 PolarHBondContact O-N 2.71Å; L553-P555 VanDerWaalsContact C-CD 3.46Å; L553-T556 WeakPolarHBondContact O-CB 3.4Å; L553-T556 PolarHBondContact O-N 3.34Å; L553-T556 VanDerWaalsContact O-N 3.11Å; L553-V557 PolarHBondContact O-N 2.78Å
554	L	94.9	Very high	95.2	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-59.8	-38.3	-175.1	-161.6	64.9	0	0	0	114.2	T549 T556 V557 F558 L576 I579 F583 E591	T549-L554 WeakPolarHBondContact O-CB 3.24Å; T549-L554 PolarHBondContact O-N 3.39Å; L554-T556 PolarHBondContact O-N 3.16Å; L554-V557 WeakPolarHBondContact O-CB 3.49Å; L554-V557 PolarHBondContact O-N 3.07Å; L554-V557 VanDerWaalsContact O-N 3.08Å; L554-F558 HydrophobicContact CD1-CD1 4.33Å; L554-F558 HydrophobicContact CD1-CE1 3.64Å; L554-F558 HydrophobicContact CD1-CZ 3.8Å; L554-F558 HydrophobicContact CD2-CE1 4.2Å; L554-F558 HydrophobicContact CD2-CE2 3.84Å; L554-F558 HydrophobicContact CD2-CZ 3.46Å; L554-F558 VanDerWaalsContact CD2-CZ 3.46Å; L554-F558 HydrophobicContact CG-CD1 4.28Å; L554-F558 HydrophobicContact CG-CD2 4.32Å; L554-F558 HydrophobicContact CG-CE1 3.66Å; L554-F558 HydrophobicContact CG-CE2 3.68Å; L554-F558 HydrophobicContact CG-CZ 3.33Å; L554-F558 WeakPolarHBondContact O-CG 3.4Å; L554-F558 PolarHBondContact O-N 3.25Å; L554-L576 HydrophobicContact CD1-CD2 3.94Å; L554-I579 HydrophobicContact CD1-CD1 4Å; L554-F583 HydrophobicContact CD2-CZ 4.48Å; L554-E591 HydrophobicContact CD2-CB 4.44Å; L554-E591 WeakPolarHBondContact CD2-OE2 3.44Å
555	P	96.2	Very high	95.4	Very high	70 Å²	70	46.8 Å²	46.8	46%	0.455	27%	0.271	S	S	.	.	H	α-helix	trans	-57.5	-34.8	175.2	-26.6	36.3	0	0	0	113.3	S550 L553 K559	S550-P555 WeakPolarHBondContact O-CD 3.42Å; L553-P555 VanDerWaalsContact C-CD 3.46Å; P555-K559 PolarHBondContact O-N 3.06Å
556	T	97	Very high	95.7	Very high	22 Å²	22	46.3 Å²	46.3	14%	0.135	27%	0.265	C	S	.	.	H	α-helix	trans	-72.8	-38.9	176.5	-56.9	0	0	0	0	112	L519 A522 L553 L554 F558 K559 L560	L519-T556 HydrophobicContact CD2-CG2 4.12Å; A522-T556 HydrophobicContact CB-CG2 3.44Å; A522-T556 VanDerWaalsContact CB-CG2 3.44Å; L553-T556 WeakPolarHBondContact O-CB 3.4Å; L553-T556 PolarHBondContact O-N 3.34Å; L553-T556 VanDerWaalsContact O-N 3.11Å; L554-T556 PolarHBondContact O-N 3.16Å; T556-F558 VanDerWaalsContact C-N 3.3Å; T556-F558 PolarHBondContact O-N 3.2Å; T556-K559 PolarHBondContact O-N 3Å; T556-L560 HydrophobicContact CG2-CD1 4.36Å; T556-L560 WeakPolarHBondContact O-CG 3.3Å; T556-L560 PolarHBondContact O-N 2.71Å
557	V	97.3	Very high	95.9	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-59.5	-44	174	-179.1	0	0	0	0	110.4	L534 I537 L553 L554 L560 A561 V572 T575 L576	L534-V557 HydrophobicContact CD2-CG1 4.46Å; L534-V557 HydrophobicContact CD2-CG2 4.36Å; I537-V557 HydrophobicContact CD1-CG2 3.73Å; I537-V557 HydrophobicContact CG2-CG2 3.95Å; L553-V557 PolarHBondContact O-N 2.78Å; L554-V557 WeakPolarHBondContact O-CB 3.49Å; L554-V557 PolarHBondContact O-N 3.07Å; L554-V557 VanDerWaalsContact O-N 3.08Å; V557-L560 PolarHBondContact O-N 3.22Å; V557-A561 PolarHBondContact O-N 3.16Å; V557-V572 HydrophobicContact CG1-CG1 3.82Å; V557-T575 HydrophobicContact CG1-CG2 4.06Å; V557-T575 HydrophobicContact CG2-CG2 3.95Å; V557-L576 HydrophobicContact CG1-CD2 3.71Å; V557-L576 HydrophobicContact CG1-CG 3.96Å
558	F	96.8	Very high	96.2	Very high	46 Å²	46	43 Å²	43	20%	0.202	23%	0.233	C	C	.	.	H	α-helix	trans	-65.5	-41	178.3	-63.5	-15.1	0	0	0	112.5	L554 T556 L560 A561 L576 E591 I595	L554-F558 HydrophobicContact CD1-CD1 4.33Å; L554-F558 HydrophobicContact CD1-CE1 3.64Å; L554-F558 HydrophobicContact CD1-CZ 3.8Å; L554-F558 HydrophobicContact CD2-CE1 4.2Å; L554-F558 HydrophobicContact CD2-CE2 3.84Å; L554-F558 HydrophobicContact CD2-CZ 3.46Å; L554-F558 VanDerWaalsContact CD2-CZ 3.46Å; L554-F558 HydrophobicContact CG-CD1 4.28Å; L554-F558 HydrophobicContact CG-CD2 4.32Å; L554-F558 HydrophobicContact CG-CE1 3.66Å; L554-F558 HydrophobicContact CG-CE2 3.68Å; L554-F558 HydrophobicContact CG-CZ 3.33Å; L554-F558 WeakPolarHBondContact O-CG 3.4Å; L554-F558 PolarHBondContact O-N 3.25Å; T556-F558 VanDerWaalsContact C-N 3.3Å; T556-F558 PolarHBondContact O-N 3.2Å; F558-L560 VanDerWaalsContact C-N 3.29Å; F558-L560 PolarHBondContact O-N 3.2Å; F558-A561 VanDerWaalsContact O-CB 3.26Å; F558-A561 WeakPolarHBondContact O-CB 3.36Å; F558-A561 PolarHBondContact O-N 3.01Å; F558-L576 HydrophobicContact CD1-CD2 4.49Å; F558-L576 HydrophobicContact CE1-CD2 3.95Å; F558-E591 HydrophobicContact CE2-CB 4.33Å; F558-E591 HydrophobicContact CZ-CB 4.01Å; F558-E591 VanDerWaalsContact CZ-O 3.28Å; F558-E591 WeakPolarHBondContact CZ-O 3.5Å; F558-I595 HydrophobicContact CB-CD1 4.38Å; F558-I595 HydrophobicContact CD1-CB 4.42Å; F558-I595 HydrophobicContact CD1-CD1 4.31Å; F558-I595 HydrophobicContact CD1-CG1 3.63Å; F558-I595 HydrophobicContact CD1-CG2 4.44Å; F558-I595 HydrophobicContact CE1-CB 4.49Å; F558-I595 HydrophobicContact CE1-CG1 3.78Å; F558-I595 HydrophobicContact CG-CD1 4.32Å; F558-I595 HydrophobicContact CG-CG1 4.08Å; F558-I595 HydrophobicContact CZ-CG1 4.37Å
559	K	96.5	Very high	96.4	Very high	124 Å²	124	42.8 Å²	42.8	54%	0.539	23%	0.23	S	C	.	.	H	α-helix	trans	-58.5	-41.4	173.5	-178.3	-172.6	175	-170.9	0	112	S523 P555 T556 A561 D562	S523-K559 PolarHBondContact OG-NZ 3.39Å; P555-K559 PolarHBondContact O-N 3.06Å; T556-K559 PolarHBondContact O-N 3Å; K559-A561 PolarHBondContact O-N 2.99Å; K559-D562 PolarHBondContact O-N 3.33Å
560	L	97.4	Very high	96.6	Very high	4 Å²	4	44 Å²	44	2%	0.021	24%	0.235	C	C	.	.	H	α-helix	trans	-72.7	-11.4	-179.3	-71.4	173.2	0	0	0	113.6	A522 R530 L534 T556 V557 F558 D562 D563 V568 V572	A522-L560 HydrophobicContact CB-CD1 3.98Å; A522-L560 HydrophobicContact CB-CD2 4.02Å; A522-L560 HydrophobicContact CB-CG 4.15Å; R530-L560 HydrophobicContact CB-CD2 4.44Å; L534-L560 HydrophobicContact CD1-CD1 4.42Å; L534-L560 HydrophobicContact CD2-CD1 3.7Å; L534-L560 HydrophobicContact CG-CD1 3.86Å; T556-L560 HydrophobicContact CG2-CD1 4.36Å; T556-L560 WeakPolarHBondContact O-CG 3.3Å; T556-L560 PolarHBondContact O-N 2.71Å; V557-L560 PolarHBondContact O-N 3.22Å; F558-L560 VanDerWaalsContact C-N 3.29Å; F558-L560 PolarHBondContact O-N 3.2Å; L560-D562 PolarHBondContact O-N 3.05Å; L560-D563 VanDerWaalsContact O-CB 3.31Å; L560-D563 WeakPolarHBondContact O-CB 3.49Å; L560-D563 PolarHBondContact O-N 3.26Å; L560-D563 VanDerWaalsContact O-N 3.17Å; L560-V568 HydrophobicContact CB-CG1 4.11Å; L560-V568 HydrophobicContact CD2-CG1 4.03Å; L560-V568 HydrophobicContact CG-CG1 4.5Å; L560-V572 HydrophobicContact CB-CG2 3.68Å
561	A	97.4	Very high	96.8	Very high	2 Å²	2	42.9 Å²	42.9	2%	0.017	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-23	171.9	0	0	0	0	0	112.3	V557 F558 K559 R569 V572 I595 L599	V557-A561 PolarHBondContact O-N 3.16Å; F558-A561 VanDerWaalsContact O-CB 3.26Å; F558-A561 WeakPolarHBondContact O-CB 3.36Å; F558-A561 PolarHBondContact O-N 3.01Å; K559-A561 PolarHBondContact O-N 2.99Å; A561-R569 WeakPolarHBondContact O-CD 3.48Å; A561-V572 HydrophobicContact CB-CG1 4.15Å; A561-I595 HydrophobicContact CB-CG2 3.72Å; A561-L599 HydrophobicContact CB-CD2 4.4Å
562	D	96.5	Very high	97	Very high	107 Å²	107	36.7 Å²	36.7	57%	0.572	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.2	11.2	177.3	-75.6	-60.3	0	0	0	113.7	K559 L560 K598	K559-D562 PolarHBondContact O-N 3.33Å; L560-D562 PolarHBondContact O-N 3.05Å; D562-K598 VanDerWaalsContact OD1-CE 3.23Å; D562-K598 WeakPolarHBondContact OD1-CE 3.4Å; D562-K598 IonicContact OD1-NZ 2.59Å; D562-K598 PolarHBondContact OD1-NZ 2.73Å; D562-K598 IonicContact OD2-NZ 2.78Å; D562-K598 PolarHBondContact OD2-NZ 2.97Å
563	D	97.6	Very high	97.1	Very high	14 Å²	14	33.9 Å²	33.9	8%	0.075	19%	0.185	C	C	.	.			trans	-62	137.3	-178.6	-162.1	-80.2	0	0	0	111.5	R530 L560 V565 V568 R569	R530-D563 WeakPolarHBondContact CD-OD2 3.24Å; R530-D563 IonicContact CZ-OD1 3.51Å; R530-D563 IonicContact CZ-OD2 2.69Å; R530-D563 IonicContact NE-OD1 3.09Å; R530-D563 IonicContact NE-OD2 3.02Å; R530-D563 PolarHBondContact NE-OD2 2.9Å; R530-D563 IonicContact NH2-OD1 2.79Å; R530-D563 PolarHBondContact NH2-OD1 3.11Å; R530-D563 IonicContact NH2-OD2 3.02Å; R530-D563 PolarHBondContact NH2-OD2 3.34Å; L560-D563 VanDerWaalsContact O-CB 3.31Å; L560-D563 WeakPolarHBondContact O-CB 3.49Å; L560-D563 PolarHBondContact O-N 3.26Å; L560-D563 VanDerWaalsContact O-N 3.17Å; D563-V565 PolarHBondContact O-N 3.15Å; D563-V565 VanDerWaalsContact O-N 3.14Å; D563-V565 WeakPolarHBondContact OD1-CB 3.35Å; D563-V565 PolarHBondContact OD1-N 3.49Å; D563-V568 HydrophobicContact CB-CB 3.71Å; D563-V568 HydrophobicContact CB-CG1 3.59Å; D563-V568 HydrophobicContact CB-CG2 4.48Å; D563-R569 HydrophobicContact CB-CG 4.2Å; D563-R569 WeakPolarHBondContact O-CD 3.27Å; D563-R569 VanDerWaalsContact O-CG 3.26Å; D563-R569 WeakPolarHBondContact O-CG 3.45Å; D563-R569 PolarHBondContact O-NH1 3.48Å
564	P	96.5	Very high	97.2	Very high	114 Å²	114	37.5 Å²	37.5	74%	0.74	20%	0.2	S	C	*	.	S	Bend	trans	-61.4	-24.3	178.3	23.8	-34.7	0	0	0	113.3	R569	P564-R569 VanDerWaalsContact C-NH1 3.3Å; P564-R569 PolarHBondContact O-NH1 3.4Å
565	V	97.1	Very high	97.3	Very high	48 Å²	48	37.4 Å²	37.4	29%	0.291	20%	0.2	S	C	.	.	S	Bend	trans	-92.7	120.2	-177	-175.9	0	0	0	0	110.8	Y527 D563 N567 V568 R569	Y527-V565 HydrophobicContact CD2-CG1 4.18Å; Y527-V565 HydrophobicContact CG-CG1 4.16Å; D563-V565 PolarHBondContact O-N 3.15Å; D563-V565 VanDerWaalsContact O-N 3.14Å; D563-V565 WeakPolarHBondContact OD1-CB 3.35Å; D563-V565 PolarHBondContact OD1-N 3.49Å; V565-N567 HydrophobicContact CG1-CB 4.03Å; V565-N567 PolarHBondContact O-N 3.23Å; V565-V568 HydrophobicContact CB-CG2 4.23Å; V565-V568 PolarHBondContact O-N 3.45Å; V565-R569 PolarHBondContact O-N 3.13Å
566	A	97.5	Very high	97.3	Very high	16 Å²	16	34.1 Å²	34.1	13%	0.132	18%	0.178	C	C	.	.	H	α-helix	trans	-53.9	-37.7	179	0	0	0	0	0	113.1	V568 R569 F570 D604 V607	A566-V568 PolarHBondContact O-N 2.98Å; A566-R569 PolarHBondContact O-N 2.85Å; A566-R569 VanDerWaalsContact O-N 3.08Å; A566-F570 VanDerWaalsContact O-CD1 3.3Å; A566-F570 WeakPolarHBondContact O-CD1 3.15Å; A566-F570 PolarHBondContact O-N 3.47Å; A566-D604 HydrophobicContact CB-CB 3.85Å; A566-D604 VanDerWaalsContact CB-CG 3.46Å; A566-D604 VanDerWaalsContact CB-OD2 3.27Å; A566-D604 WeakPolarHBondContact CB-OD2 3.43Å; A566-V607 HydrophobicContact CB-CG2 4.08Å
567	N	97.1	Very high	97.3	Very high	68 Å²	68	34.5 Å²	34.5	36%	0.364	18%	0.182	S	C	.	.	H	α-helix	trans	-55.4	-37.6	175.9	-66.2	45.2	0	0	0	113.6	Y527 L531 V565 F570 N571	Y527-N567 HydrophobicContact CD2-CB 4.21Å; Y527-N567 HydrophobicContact CE2-CB 4.12Å; L531-N567 WeakPolarHBondContact CD2-O 3.21Å; V565-N567 HydrophobicContact CG1-CB 4.03Å; V565-N567 PolarHBondContact O-N 3.23Å; N567-F570 HydrophobicContact CB-CE1 3.96Å; N567-F570 HydrophobicContact CB-CZ 4.25Å; N567-N571 WeakPolarHBondContact O-CB 3.45Å; N567-N571 PolarHBondContact O-N 2.94Å; N567-N571 PolarHBondContact O-ND2 2.99Å
568	V	97.7	Very high	97.1	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-72.5	-47	176.5	179.8	0	0	0	0	109.7	R530 L531 L534 L560 D563 V565 A566 F570 N571 V572	R530-V568 HydrophobicContact CB-CG2 4.32Å; L531-V568 HydrophobicContact CD2-CB 4.43Å; L531-V568 HydrophobicContact CD2-CG2 4.11Å; L531-V568 HydrophobicContact CG-CG2 4.33Å; L534-V568 HydrophobicContact CD1-CG1 4.28Å; L560-V568 HydrophobicContact CB-CG1 4.11Å; L560-V568 HydrophobicContact CD2-CG1 4.03Å; L560-V568 HydrophobicContact CG-CG1 4.5Å; D563-V568 HydrophobicContact CB-CB 3.71Å; D563-V568 HydrophobicContact CB-CG1 3.59Å; D563-V568 HydrophobicContact CB-CG2 4.48Å; V565-V568 HydrophobicContact CB-CG2 4.23Å; V565-V568 PolarHBondContact O-N 3.45Å; A566-V568 PolarHBondContact O-N 2.98Å; V568-F570 PolarHBondContact O-N 3.27Å; V568-N571 CarbonylContact O-C 3.28Å; V568-N571 PolarHBondContact O-N 3.47Å; V568-N571 VanDerWaalsContact O-N 3.12Å; V568-V572 WeakPolarHBondContact O-CG2 3.41Å; V568-V572 PolarHBondContact O-N 3.11Å
569	R	98.2	Very high	97	Very high	34 Å²	34	35.2 Å²	35.2	13%	0.128	19%	0.19	C	C	.	.	H	α-helix	trans	-60.7	-42.6	-179.1	-60.4	-161.4	-58.1	-82.8	3.3	113.4	A561 D563 P564 V565 A566 N571 V572 A573 L599 D602 V607	A561-R569 WeakPolarHBondContact O-CD 3.48Å; D563-R569 HydrophobicContact CB-CG 4.2Å; D563-R569 WeakPolarHBondContact O-CD 3.27Å; D563-R569 VanDerWaalsContact O-CG 3.26Å; D563-R569 WeakPolarHBondContact O-CG 3.45Å; D563-R569 PolarHBondContact O-NH1 3.48Å; P564-R569 VanDerWaalsContact C-NH1 3.3Å; P564-R569 PolarHBondContact O-NH1 3.4Å; V565-R569 PolarHBondContact O-N 3.13Å; A566-R569 PolarHBondContact O-N 2.85Å; A566-R569 VanDerWaalsContact O-N 3.08Å; R569-N571 VanDerWaalsContact C-N 3.33Å; R569-N571 PolarHBondContact O-N 3.49Å; R569-V572 WeakPolarHBondContact O-CB 3.34Å; R569-V572 PolarHBondContact O-N 3.3Å; R569-A573 PolarHBondContact O-N 3.5Å; R569-L599 HydrophobicContact CB-CD2 4.12Å; R569-D602 IonicContact CZ-OD1 2.73Å; R569-D602 IonicContact CZ-OD2 3.18Å; R569-D602 IonicContact NE-OD1 2.91Å; R569-D602 IonicContact NE-OD2 3.06Å; R569-D602 PolarHBondContact NE-OD2 3.18Å; R569-D602 IonicContact NH2-OD1 3.9Å; R569-D602 PolarHBondContact NH2-OD1 3.18Å; R569-D602 IonicContact NH2-OD2 3.32Å; R569-D602 PolarHBondContact NH2-OD2 2.94Å; R569-V607 HydrophobicContact CB-CG1 4.1Å; R569-V607 HydrophobicContact CB-CG2 3.92Å
570	F	97.7	Very high	96.8	Very high	24 Å²	24	29.3 Å²	29.3	11%	0.105	17%	0.165	C	C	.	.	H	α-helix	trans	-72.2	-28.6	176.6	78.9	-120.4	0	0	0	112.5	A566 N567 V568 V572 A573 K574 D606 V607 F610	A566-F570 VanDerWaalsContact O-CD1 3.3Å; A566-F570 WeakPolarHBondContact O-CD1 3.15Å; A566-F570 PolarHBondContact O-N 3.47Å; N567-F570 HydrophobicContact CB-CE1 3.96Å; N567-F570 HydrophobicContact CB-CZ 4.25Å; V568-F570 PolarHBondContact O-N 3.27Å; F570-V572 VanDerWaalsContact C-N 3.31Å; F570-A573 WeakPolarHBondContact O-CB 3.38Å; F570-A573 PolarHBondContact O-N 3.32Å; F570-K574 HydrophobicContact CD2-CD 4.36Å; F570-K574 PolarHBondContact O-N 2.86Å; F570-K574 VanDerWaalsContact O-N 3.09Å; F570-D606 HydrophobicContact CD1-CB 3.92Å; F570-D606 HydrophobicContact CE1-CB 4.4Å; F570-D606 HydrophobicContact CG-CB 4.44Å; F570-V607 HydrophobicContact CB-CB 4.37Å; F570-V607 HydrophobicContact CB-CG2 3.98Å; F570-F610 HydrophobicContact CB-CB 4.3Å; F570-F610 HydrophobicContact CB-CD2 3.84Å; F570-F610 HydrophobicContact CB-CG 4.48Å; F570-F610 AromaticContact CD2-CD2 3.72Å; F570-F610 HydrophobicContact CD2-CD2 3.72Å; F570-F610 AromaticContact CD2-CE2 4Å; F570-F610 HydrophobicContact CD2-CE2 4Å; F570-F610 HydrophobicContact CE2-CE2 4.36Å; F570-F610 AromaticContact CG-CD2 3.9Å; F570-F610 HydrophobicContact CG-CD2 3.9Å; F570-F610 HydrophobicContact CG-CE2 4.39Å
571	N	98	Very high	96.4	Very high	17 Å²	17	34.8 Å²	34.8	9%	0.091	19%	0.194	C	C	.	.	H	α-helix	trans	-72.3	-24.9	172.3	-85.8	-73.8	0	0	0	112.2	L531 L534 N567 V568 R569 K574 T575	L531-N571 HydrophobicContact CD2-CB 3.62Å; L531-N571 WeakPolarHBondContact CD2-ND2 3.43Å; L534-N571 HydrophobicContact CD1-CB 3.71Å; N567-N571 WeakPolarHBondContact O-CB 3.45Å; N567-N571 PolarHBondContact O-N 2.94Å; N567-N571 PolarHBondContact O-ND2 2.99Å; V568-N571 CarbonylContact O-C 3.28Å; V568-N571 PolarHBondContact O-N 3.47Å; V568-N571 VanDerWaalsContact O-N 3.12Å; R569-N571 VanDerWaalsContact C-N 3.33Å; R569-N571 PolarHBondContact O-N 3.49Å; N571-K574 PolarHBondContact O-N 3.32Å; N571-T575 VanDerWaalsContact O-CB 3.28Å; N571-T575 WeakPolarHBondContact O-CB 3.37Å; N571-T575 PolarHBondContact O-N 3.39Å; N571-T575 PolarHBondContact O-OG1 3.18Å
572	V	98.2	Very high	96	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.4	-46.9	166.7	169.4	0	0	0	0	110	L534 V557 L560 A561 V568 R569 F570 K574 T575 L576 L599	L534-V572 HydrophobicContact CD1-CG2 3.97Å; L534-V572 HydrophobicContact CD2-CG2 4.06Å; V557-V572 HydrophobicContact CG1-CG1 3.82Å; L560-V572 HydrophobicContact CB-CG2 3.68Å; A561-V572 HydrophobicContact CB-CG1 4.15Å; V568-V572 WeakPolarHBondContact O-CG2 3.41Å; V568-V572 PolarHBondContact O-N 3.11Å; R569-V572 WeakPolarHBondContact O-CB 3.34Å; R569-V572 PolarHBondContact O-N 3.3Å; F570-V572 VanDerWaalsContact C-N 3.31Å; V572-K574 PolarHBondContact O-N 2.87Å; V572-T575 WeakPolarHBondContact O-CB 3.46Å; V572-T575 PolarHBondContact O-N 2.86Å; V572-T575 VanDerWaalsContact O-N 3.16Å; V572-L576 HydrophobicContact CG1-CD1 3.97Å; V572-L576 HydrophobicContact CG1-CG 4.31Å; V572-L576 WeakPolarHBondContact O-CG 3.36Å; V572-L576 PolarHBondContact O-N 3.34Å; V572-L599 HydrophobicContact CB-CD1 4.47Å; V572-L599 HydrophobicContact CG1-CD1 4.11Å
573	A	97.7	Very high	95.8	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-59.1	-44.3	175.5	0	0	0	0	0	112.5	R569 F570 T575 L576 S577 L596 L599 F610 A611 A614	R569-A573 PolarHBondContact O-N 3.5Å; F570-A573 WeakPolarHBondContact O-CB 3.38Å; F570-A573 PolarHBondContact O-N 3.32Å; A573-T575 VanDerWaalsContact C-N 3.35Å; A573-T575 PolarHBondContact O-N 3.12Å; A573-L576 PolarHBondContact O-N 3.26Å; A573-S577 PolarHBondContact O-N 3.03Å; A573-L596 HydrophobicContact CB-CD2 4.21Å; A573-L599 HydrophobicContact CB-CD1 4.1Å; A573-F610 HydrophobicContact CB-CB 4.05Å; A573-A611 HydrophobicContact CB-CB 4.31Å; A573-A614 WeakPolarHBondContact O-CB 3.36Å
574	K	97.4	Very high	95.5	Very high	76 Å²	76	37.2 Å²	37.2	33%	0.33	21%	0.205	S	C	.	.	H	α-helix	trans	-61.3	-40.7	174.1	-68.9	-179.3	177.3	-178.4	0	112.8	F570 N571 V572 S577 T578 F610	F570-K574 HydrophobicContact CD2-CD 4.36Å; F570-K574 PolarHBondContact O-N 2.86Å; F570-K574 VanDerWaalsContact O-N 3.09Å; N571-K574 PolarHBondContact O-N 3.32Å; V572-K574 PolarHBondContact O-N 2.87Å; K574-S577 WeakPolarHBondContact O-CB 3.47Å; K574-S577 PolarHBondContact O-N 3.37Å; K574-T578 WeakPolarHBondContact O-CB 3.31Å; K574-T578 PolarHBondContact O-N 3.34Å; K574-T578 PolarHBondContact O-OG1 3.21Å; K574-F610 HydrophobicContact CD-CD1 4.28Å; K574-F610 HydrophobicContact CD-CE1 4.41Å; K574-F610 HydrophobicContact CG-CB 4.4Å; K574-F610 HydrophobicContact CG-CD1 3.96Å; K574-F610 HydrophobicContact CG-CG 4.16Å
575	T	97.4	Very high	95.3	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-63.5	-49.3	177.8	-63.2	0	0	0	0	110.5	L534 I537 N538 V557 N571 V572 A573 S577 T578 I579	L534-T575 HydrophobicContact CD2-CG2 4.23Å; I537-T575 HydrophobicContact CG2-CG2 4.25Å; N538-T575 WeakPolarHBondContact OD1-CA 3.27Å; N538-T575 VanDerWaalsContact OD1-CG2 3.32Å; N538-T575 WeakPolarHBondContact OD1-CG2 3.35Å; V557-T575 HydrophobicContact CG1-CG2 4.06Å; V557-T575 HydrophobicContact CG2-CG2 3.95Å; N571-T575 VanDerWaalsContact O-CB 3.28Å; N571-T575 WeakPolarHBondContact O-CB 3.37Å; N571-T575 PolarHBondContact O-N 3.39Å; N571-T575 PolarHBondContact O-OG1 3.18Å; V572-T575 WeakPolarHBondContact O-CB 3.46Å; V572-T575 PolarHBondContact O-N 2.86Å; V572-T575 VanDerWaalsContact O-N 3.16Å; A573-T575 VanDerWaalsContact C-N 3.35Å; A573-T575 PolarHBondContact O-N 3.12Å; T575-S577 VanDerWaalsContact C-N 3.31Å; T575-S577 PolarHBondContact O-N 2.95Å; T575-T578 WeakPolarHBondContact O-CB 3.45Å; T575-T578 PolarHBondContact O-N 3.44Å; T575-I579 HydrophobicContact CG2-CD1 4.25Å; T575-I579 WeakPolarHBondContact O-CG1 3.47Å; T575-I579 PolarHBondContact O-N 3.36Å
576	L	96.9	Very high	95	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.5	-38.4	176.3	-68.1	175	0	0	0	112.3	L554 V557 F558 V572 A573 G580 I592 I595 L596	L554-L576 HydrophobicContact CD1-CD2 3.94Å; V557-L576 HydrophobicContact CG1-CD2 3.71Å; V557-L576 HydrophobicContact CG1-CG 3.96Å; F558-L576 HydrophobicContact CD1-CD2 4.49Å; F558-L576 HydrophobicContact CE1-CD2 3.95Å; V572-L576 HydrophobicContact CG1-CD1 3.97Å; V572-L576 HydrophobicContact CG1-CG 4.31Å; V572-L576 WeakPolarHBondContact O-CG 3.36Å; V572-L576 PolarHBondContact O-N 3.34Å; A573-L576 PolarHBondContact O-N 3.26Å; L576-G580 WeakPolarHBondContact O-CA 3.44Å; L576-G580 PolarHBondContact O-N 3.42Å; L576-I592 HydrophobicContact CB-CG2 4.09Å; L576-I592 HydrophobicContact CD1-CG2 4.29Å; L576-I592 HydrophobicContact CD2-CG1 4.32Å; L576-I592 HydrophobicContact CD2-CG2 4.19Å; L576-I592 HydrophobicContact CG-CG2 4.41Å; L576-I595 HydrophobicContact CD1-CB 4.21Å; L576-I595 HydrophobicContact CD1-CG2 3.81Å; L576-L596 HydrophobicContact CB-CD2 4.24Å; L576-L596 HydrophobicContact CD1-CD2 3.86Å; L576-L596 HydrophobicContact CD1-CG 4.13Å
577	S	95.6	Very high	94.7	Very high	30 Å²	30	41.6 Å²	41.6	21%	0.21	21%	0.21	C	C	.	.	H	α-helix	trans	-61.6	-43.7	171.9	-171	0	0	0	0	112.1	A573 K574 T575	A573-S577 PolarHBondContact O-N 3.03Å; K574-S577 WeakPolarHBondContact O-CB 3.47Å; K574-S577 PolarHBondContact O-N 3.37Å; T575-S577 VanDerWaalsContact C-N 3.31Å; T575-S577 PolarHBondContact O-N 2.95Å
578	T	94.3	Very high	94.4	Very high	62 Å²	62	38.6 Å²	38.6	38%	0.38	19%	0.194	S	C	.	.	H	α-helix	trans	-68.8	-48	-176.7	-58.6	0	0	0	0	112.1	N538 K574 T575	N538-T578 HydrophobicContact CB-CG2 4.39Å; K574-T578 WeakPolarHBondContact O-CB 3.31Å; K574-T578 PolarHBondContact O-N 3.34Å; K574-T578 PolarHBondContact O-OG1 3.21Å; T575-T578 WeakPolarHBondContact O-CB 3.45Å; T575-T578 PolarHBondContact O-N 3.44Å
579	I	94.6	Very high	94.2	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-86.5	-23	-177.4	72.7	-176.8	0	0	0	112.3	I537 A541 T549 L554 T575 N581 M582 F583	I537-I579 HydrophobicContact CG2-CD1 4.4Å; A541-I579 HydrophobicContact CB-CB 4.42Å; A541-I579 HydrophobicContact CB-CG2 3.77Å; T549-I579 HydrophobicContact CG2-CD1 4.24Å; L554-I579 HydrophobicContact CD1-CD1 4Å; T575-I579 HydrophobicContact CG2-CD1 4.25Å; T575-I579 WeakPolarHBondContact O-CG1 3.47Å; T575-I579 PolarHBondContact O-N 3.36Å; I579-N581 PolarHBondContact O-N 2.92Å; I579-N581 VanDerWaalsContact O-N 3.1Å; I579-M582 HydrophobicContact CB-CE 3.71Å; I579-M582 HydrophobicContact CB-SD 4.19Å; I579-M582 HydrophobicContact CG2-CE 4.12Å; I579-M582 WeakPolarHBondContact O-CE 3.29Å; I579-M582 WeakPolarHBondContact O-CG 3.39Å; I579-M582 PolarHBondContact O-N 3.35Å; I579-F583 HydrophobicContact CG1-CE2 4.27Å
580	G	91.2	Very high	93.9	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-56.4	-33.7	-172.3	0	0	0	0	0	114.2	L576 M582 F583 I588	L576-G580 WeakPolarHBondContact O-CA 3.44Å; L576-G580 PolarHBondContact O-N 3.42Å; G580-M582 PolarHBondContact O-N 3.41Å; G580-M582 VanDerWaalsContact O-N 3.12Å; G580-F583 PolarHBondContact O-N 3.41Å; G580-F583 VanDerWaalsContact O-N 3.08Å; G580-I588 WeakPolarHBondContact O-CD1 3.33Å
581	N	89.1	Confident	93.6	Very high	119 Å²	119	47.7 Å²	47.7	64%	0.636	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-12.1	178.5	-70.8	-37.3	0	0	0	114.6	I579	I579-N581 PolarHBondContact O-N 2.92Å; I579-N581 VanDerWaalsContact O-N 3.1Å
582	M	90.9	Very high	93.4	Very high	52 Å²	52	46.9 Å²	46.9	26%	0.256	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-14.5	174.8	81.3	-165.7	40.1	0	0	113.3	A541 P546 T549 I579 G580	A541-M582 HydrophobicContact CB-CE 3.75Å; A541-M582 HydrophobicContact CB-SD 4.06Å; P546-M582 HydrophobicContact CB-CG 4.23Å; P546-M582 WeakPolarHBondContact CB-O 3.17Å; T549-M582 HydrophobicContact CG2-SD 3.85Å; I579-M582 HydrophobicContact CB-CE 3.71Å; I579-M582 HydrophobicContact CB-SD 4.19Å; I579-M582 HydrophobicContact CG2-CE 4.12Å; I579-M582 WeakPolarHBondContact O-CE 3.29Å; I579-M582 WeakPolarHBondContact O-CG 3.39Å; I579-M582 PolarHBondContact O-N 3.35Å; G580-M582 PolarHBondContact O-N 3.41Å; G580-M582 VanDerWaalsContact O-N 3.12Å
583	F	92	Very high	93.2	Very high	21 Å²	21	49.9 Å²	49.9	9%	0.092	25%	0.25	C	S	.	.	S	Bend	trans	-94.3	153	-179.2	-64	-73.5	0	0	0	111.1	P546 T549 L554 I579 G580 A587 I588 I592	P546-F583 HydrophobicContact CB-CD1 4.06Å; P546-F583 HydrophobicContact CB-CE1 4.05Å; P546-F583 WeakPolarHBondContact O-CE1 3.36Å; T549-F583 HydrophobicContact CG2-CE2 4.29Å; T549-F583 HydrophobicContact CG2-CZ 3.77Å; L554-F583 HydrophobicContact CD2-CZ 4.48Å; I579-F583 HydrophobicContact CG1-CE2 4.27Å; G580-F583 PolarHBondContact O-N 3.41Å; G580-F583 VanDerWaalsContact O-N 3.08Å; F583-A587 HydrophobicContact CB-CB 4.1Å; F583-A587 HydrophobicContact CD1-CB 4.48Å; F583-I588 HydrophobicContact CB-CG1 3.92Å; F583-I592 HydrophobicContact CD2-CD1 3.92Å; F583-I592 HydrophobicContact CE2-CD1 4.43Å
584	D	91.4	Very high	93.1	Very high	101 Å²	101	53.2 Å²	53.2	54%	0.54	27%	0.272	S	S	.	.			trans	-70.3	160.8	170.9	71.4	30.5	0	0	0	111.1	K586 A587 I588	D584-K586 PolarHBondContact O-N 3.45Å; D584-K586 VanDerWaalsContact O-N 3.12Å; D584-K586 WeakPolarHBondContact OD1-CA 3.47Å; D584-K586 WeakPolarHBondContact OD1-CB 3.34Å; D584-K586 PolarHBondContact OD1-N 2.97Å; D584-A587 PolarHBondContact O-N 3.27Å; D584-A587 WeakPolarHBondContact OD1-CB 3.28Å; D584-A587 PolarHBondContact OD1-N 3.5Å; D584-I588 VanDerWaalsContact O-CG1 3.3Å; D584-I588 WeakPolarHBondContact O-CG1 3.42Å; D584-I588 PolarHBondContact O-N 3.46Å
585	Q	90.8	Very high	93.1	Very high	94 Å²	94	51 Å²	51	44%	0.439	26%	0.264	S	S	.	.	H	α-helix	trans	-59.8	-26	-178.9	-80.4	-66.8	-12.9	0	0	113.4	Q589	Q585-Q589 WeakPolarHBondContact O-CB 3.38Å; Q585-Q589 WeakPolarHBondContact O-CG 3.45Å; Q585-Q589 PolarHBondContact O-N 3.25Å
586	K	91.4	Very high	93	Very high	156 Å²	156	51 Å²	51	68%	0.678	26%	0.264	S	S	*	.	H	α-helix	trans	-71.5	-45.5	178.9	-173.7	-178	178.2	-174.8	0	110.7	D584 Q589 N590	D584-K586 PolarHBondContact O-N 3.45Å; D584-K586 VanDerWaalsContact O-N 3.12Å; D584-K586 WeakPolarHBondContact OD1-CA 3.47Å; D584-K586 WeakPolarHBondContact OD1-CB 3.34Å; D584-K586 PolarHBondContact OD1-N 2.97Å; K586-Q589 PolarHBondContact O-N 3.42Å; K586-N590 WeakPolarHBondContact O-CB 3.24Å; K586-N590 PolarHBondContact O-N 2.87Å; K586-N590 PolarHBondContact O-ND2 2.75Å
587	A	90.7	Very high	92.9	Very high	19 Å²	19	53.6 Å²	53.6	16%	0.157	28%	0.28	C	S	.	.	H	α-helix	trans	-65.2	-41.4	174.9	0	0	0	0	0	111.4	F583 D584 Q589 N590 E591	F583-A587 HydrophobicContact CB-CB 4.1Å; F583-A587 HydrophobicContact CD1-CB 4.48Å; D584-A587 PolarHBondContact O-N 3.27Å; D584-A587 WeakPolarHBondContact OD1-CB 3.28Å; D584-A587 PolarHBondContact OD1-N 3.5Å; A587-Q589 PolarHBondContact O-N 3.39Å; A587-N590 PolarHBondContact O-N 2.73Å; A587-E591 WeakPolarHBondContact O-CB 3.5Å; A587-E591 PolarHBondContact O-N 3.23Å
588	I	92.2	Very high	93	Very high	5 Å²	5	56.6 Å²	56.6	3%	0.026	29%	0.289	C	S	.	.	I	π-helix	trans	-60	-45.9	175.7	-60.8	169.8	0	0	0	110.7	G580 F583 D584 I592 K593 L618 L620	G580-I588 WeakPolarHBondContact O-CD1 3.33Å; F583-I588 HydrophobicContact CB-CG1 3.92Å; D584-I588 VanDerWaalsContact O-CG1 3.3Å; D584-I588 WeakPolarHBondContact O-CG1 3.42Å; D584-I588 PolarHBondContact O-N 3.46Å; I588-I592 HydrophobicContact CG1-CD1 4.36Å; I588-I592 HydrophobicContact CG2-CB 4.38Å; I588-I592 PolarHBondContact O-N 2.94Å; I588-K593 PolarHBondContact O-N 3.19Å; I588-L618 HydrophobicContact CG2-CB 4.23Å; I588-L618 HydrophobicContact CG2-CD1 4.34Å; I588-L620 HydrophobicContact CG2-CD1 3.88Å; I588-L620 HydrophobicContact CG2-CD2 3.85Å; I588-L620 HydrophobicContact CG2-CG 4.01Å
589	Q	92.4	Very high	93.1	Very high	68 Å²	68	53.7 Å²	53.7	32%	0.318	27%	0.271	S	S	.	.	I	π-helix	trans	-67.2	-36.9	179.6	-68.3	-78	-17.4	0	0	112.8	Q585 K586 A587 K593 L620	Q585-Q589 WeakPolarHBondContact O-CB 3.38Å; Q585-Q589 WeakPolarHBondContact O-CG 3.45Å; Q585-Q589 PolarHBondContact O-N 3.25Å; K586-Q589 PolarHBondContact O-N 3.42Å; A587-Q589 PolarHBondContact O-N 3.39Å; Q589-K593 WeakPolarHBondContact O-CB 3.41Å; Q589-K593 VanDerWaalsContact OE1-CD 3.23Å; Q589-L620 HydrophobicContact CG-CD2 4.35Å; Q589-L620 VanDerWaalsContact NE2-CD2 3.29Å
590	N	92.4	Very high	93.1	Very high	108 Å²	108	55.5 Å²	55.5	58%	0.578	28%	0.28	S	S	*	.	I	π-helix	trans	-86.2	-37.7	-174	-69.7	-16.6	0	0	0	113.6	K586 A587 P594	K586-N590 WeakPolarHBondContact O-CB 3.24Å; K586-N590 PolarHBondContact O-N 2.87Å; K586-N590 PolarHBondContact O-ND2 2.75Å; A587-N590 PolarHBondContact O-N 2.73Å; N590-P594 WeakPolarHBondContact O-CG 3.37Å
591	E	90.7	Very high	93.3	Very high	73 Å²	73	61.6 Å²	61.6	34%	0.341	31%	0.313	S	S	.	.	I	π-helix	trans	-106.5	-45.6	-171	-61.9	177.5	-146.2	0	0	112.1	S550 L554 F558 A587	S550-E591 PolarHBondContact OG-OE2 2.93Å; L554-E591 HydrophobicContact CD2-CB 4.44Å; L554-E591 WeakPolarHBondContact CD2-OE2 3.44Å; F558-E591 HydrophobicContact CE2-CB 4.33Å; F558-E591 HydrophobicContact CZ-CB 4.01Å; F558-E591 VanDerWaalsContact CZ-O 3.28Å; F558-E591 WeakPolarHBondContact CZ-O 3.5Å; A587-E591 WeakPolarHBondContact O-CB 3.5Å; A587-E591 PolarHBondContact O-N 3.23Å
592	I	94.3	Very high	93.7	Very high	1 Å²	1	57 Å²	57	1%	0.005	29%	0.289	C	S	.	.	I	π-helix	trans	-85.5	-44.2	-172.4	-61.8	-179.8	0	0	0	112.2	L576 F583 I588 I595 L596 L618	L576-I592 HydrophobicContact CB-CG2 4.09Å; L576-I592 HydrophobicContact CD1-CG2 4.29Å; L576-I592 HydrophobicContact CD2-CG1 4.32Å; L576-I592 HydrophobicContact CD2-CG2 4.19Å; L576-I592 HydrophobicContact CG-CG2 4.41Å; F583-I592 HydrophobicContact CD2-CD1 3.92Å; F583-I592 HydrophobicContact CE2-CD1 4.43Å; I588-I592 HydrophobicContact CG1-CD1 4.36Å; I588-I592 HydrophobicContact CG2-CB 4.38Å; I588-I592 PolarHBondContact O-N 2.94Å; I592-I595 PolarHBondContact O-N 3.48Å; I592-I595 VanDerWaalsContact O-N 3.17Å; I592-L596 HydrophobicContact CG2-CD1 3.79Å; I592-L596 HydrophobicContact CG2-CG 4.11Å; I592-L596 PolarHBondContact O-N 3.24Å; I592-L596 VanDerWaalsContact O-N 3.09Å; I592-L618 HydrophobicContact CG2-CD1 3.91Å
593	K	94.2	Very high	93.9	Very high	62 Å²	62	62.2 Å²	62.2	27%	0.27	32%	0.317	S	S	.	.	H	α-helix	trans	-55.9	-44.3	-177.5	-176.6	-174.9	-169	173	0	113.6	I588 Q589 I595 L596 T597 L620	I588-K593 PolarHBondContact O-N 3.19Å; Q589-K593 WeakPolarHBondContact O-CB 3.41Å; Q589-K593 VanDerWaalsContact OE1-CD 3.23Å; K593-I595 PolarHBondContact O-N 2.92Å; K593-L596 PolarHBondContact O-N 3.38Å; K593-T597 WeakPolarHBondContact O-CB 3.49Å; K593-T597 PolarHBondContact O-N 2.88Å; K593-T597 PolarHBondContact O-OG1 3.13Å; K593-L620 HydrophobicContact CB-CD1 3.91Å; K593-L620 HydrophobicContact CB-CD2 4.14Å; K593-L620 HydrophobicContact CD-CD2 4.17Å; K593-L620 HydrophobicContact CG-CD1 4.26Å; K593-L620 HydrophobicContact CG-CD2 4.28Å
594	P	95.5	Very high	94.2	Very high	71 Å²	71	63.7 Å²	63.7	46%	0.461	33%	0.326	S	S	.	.	H	α-helix	trans	-57.9	-38.5	178.8	-25.6	36	0	0	0	113	N590 K598	N590-P594 WeakPolarHBondContact O-CG 3.37Å; P594-K598 PolarHBondContact O-N 2.78Å; P594-K598 VanDerWaalsContact O-N 3.07Å
595	I	96.3	Very high	94.4	Very high	29 Å²	29	65.6 Å²	65.6	15%	0.149	34%	0.336	C	S	.	.	H	α-helix	trans	-71.6	-43.6	179.5	-56.4	-60.3	0	0	0	111.1	F558 A561 L576 I592 K593 T597 K598 L599	F558-I595 HydrophobicContact CB-CD1 4.38Å; F558-I595 HydrophobicContact CD1-CB 4.42Å; F558-I595 HydrophobicContact CD1-CD1 4.31Å; F558-I595 HydrophobicContact CD1-CG1 3.63Å; F558-I595 HydrophobicContact CD1-CG2 4.44Å; F558-I595 HydrophobicContact CE1-CB 4.49Å; F558-I595 HydrophobicContact CE1-CG1 3.78Å; F558-I595 HydrophobicContact CG-CD1 4.32Å; F558-I595 HydrophobicContact CG-CG1 4.08Å; F558-I595 HydrophobicContact CZ-CG1 4.37Å; A561-I595 HydrophobicContact CB-CG2 3.72Å; L576-I595 HydrophobicContact CD1-CB 4.21Å; L576-I595 HydrophobicContact CD1-CG2 3.81Å; I592-I595 PolarHBondContact O-N 3.48Å; I592-I595 VanDerWaalsContact O-N 3.17Å; K593-I595 PolarHBondContact O-N 2.92Å; I595-T597 VanDerWaalsContact C-N 3.34Å; I595-T597 PolarHBondContact O-N 2.97Å; I595-K598 WeakPolarHBondContact O-CB 3.03Å; I595-K598 PolarHBondContact O-N 3.13Å; I595-L599 HydrophobicContact CG2-CD1 4.4Å; I595-L599 WeakPolarHBondContact O-CG 3.47Å; I595-L599 PolarHBondContact O-N 3.03Å
596	L	96.1	Very high	94.7	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-64.7	-37.7	176.2	-70	178.7	0	0	0	112.4	A573 L576 I592 K593 L599 L600 A614 R615 L618 L620	A573-L596 HydrophobicContact CB-CD2 4.21Å; L576-L596 HydrophobicContact CB-CD2 4.24Å; L576-L596 HydrophobicContact CD1-CD2 3.86Å; L576-L596 HydrophobicContact CD1-CG 4.13Å; I592-L596 HydrophobicContact CG2-CD1 3.79Å; I592-L596 HydrophobicContact CG2-CG 4.11Å; I592-L596 PolarHBondContact O-N 3.24Å; I592-L596 VanDerWaalsContact O-N 3.09Å; K593-L596 PolarHBondContact O-N 3.38Å; L596-L599 PolarHBondContact O-N 2.95Å; L596-L600 WeakPolarHBondContact O-CG 3.47Å; L596-L600 PolarHBondContact O-N 2.71Å; L596-L600 VanDerWaalsContact O-N 3.12Å; L596-A614 HydrophobicContact CD1-CB 3.98Å; L596-A614 HydrophobicContact CD2-CB 3.72Å; L596-R615 HydrophobicContact CB-CG 3.99Å; L596-R615 HydrophobicContact CD1-CG 4.06Å; L596-L618 HydrophobicContact CD1-CD1 4.04Å; L596-L620 HydrophobicContact CD1-CD1 3.91Å
597	T	95.6	Very high	95	Very high	55 Å²	55	57.8 Å²	57.8	34%	0.337	31%	0.305	S	S	.	.	H	α-helix	trans	-62.1	-44.8	173.8	-59	0	0	0	0	110.9	K593 I595 L599 L600	K593-T597 WeakPolarHBondContact O-CB 3.49Å; K593-T597 PolarHBondContact O-N 2.88Å; K593-T597 PolarHBondContact O-OG1 3.13Å; I595-T597 VanDerWaalsContact C-N 3.34Å; I595-T597 PolarHBondContact O-N 2.97Å; T597-L599 VanDerWaalsContact C-N 3.3Å; T597-L599 PolarHBondContact O-N 2.88Å; T597-L600 WeakPolarHBondContact O-CB 3.35Å; T597-L600 PolarHBondContact O-N 2.74Å; T597-L600 VanDerWaalsContact O-N 3.12Å
598	K	95.8	Very high	95.4	Very high	92 Å²	92	60.7 Å²	60.7	40%	0.4	31%	0.313	S	S	.	.	H	α-helix	trans	-57.5	-41.3	174.7	176.4	-178.7	177	174.5	0	112.6	D562 P594 I595 L600 D601	D562-K598 VanDerWaalsContact OD1-CE 3.23Å; D562-K598 WeakPolarHBondContact OD1-CE 3.4Å; D562-K598 IonicContact OD1-NZ 2.59Å; D562-K598 PolarHBondContact OD1-NZ 2.73Å; D562-K598 IonicContact OD2-NZ 2.78Å; D562-K598 PolarHBondContact OD2-NZ 2.97Å; P594-K598 PolarHBondContact O-N 2.78Å; P594-K598 VanDerWaalsContact O-N 3.07Å; I595-K598 WeakPolarHBondContact O-CB 3.03Å; I595-K598 PolarHBondContact O-N 3.13Å; K598-L600 VanDerWaalsContact C-N 3.31Å; K598-L600 PolarHBondContact O-N 3.24Å; K598-D601 PolarHBondContact O-N 2.87Å
599	L	96.7	Very high	95.6	Very high	2 Å²	2	66.6 Å²	66.6	1%	0.01	34%	0.336	C	S	.	.	H	α-helix	trans	-72.2	-20.1	179	-66.8	175	0	0	0	113.5	A561 R569 V572 A573 I595 L596 T597 D601 D602 V607 A611	A561-L599 HydrophobicContact CB-CD2 4.4Å; R569-L599 HydrophobicContact CB-CD2 4.12Å; V572-L599 HydrophobicContact CB-CD1 4.47Å; V572-L599 HydrophobicContact CG1-CD1 4.11Å; A573-L599 HydrophobicContact CB-CD1 4.1Å; I595-L599 HydrophobicContact CG2-CD1 4.4Å; I595-L599 WeakPolarHBondContact O-CG 3.47Å; I595-L599 PolarHBondContact O-N 3.03Å; L596-L599 PolarHBondContact O-N 2.95Å; T597-L599 VanDerWaalsContact C-N 3.3Å; T597-L599 PolarHBondContact O-N 2.88Å; L599-D601 VanDerWaalsContact C-N 3.28Å; L599-D602 WeakPolarHBondContact O-CB 3.43Å; L599-D602 PolarHBondContact O-N 3Å; L599-V607 HydrophobicContact CB-CG1 3.98Å; L599-V607 HydrophobicContact CD2-CG1 3.76Å; L599-V607 HydrophobicContact CG-CG1 4.39Å; L599-A611 HydrophobicContact CB-CB 3.69Å
600	L	96.1	Very high	95.9	Very high	37 Å²	37	65.3 Å²	65.3	19%	0.194	33%	0.33	C	S	.	.	H	α-helix	trans	-70.7	-26.5	171.2	-74.2	172.4	0	0	0	112.8	L596 T597 K598 D602 K608 A611 N612 R615	L596-L600 WeakPolarHBondContact O-CG 3.47Å; L596-L600 PolarHBondContact O-N 2.71Å; L596-L600 VanDerWaalsContact O-N 3.12Å; T597-L600 WeakPolarHBondContact O-CB 3.35Å; T597-L600 PolarHBondContact O-N 2.74Å; T597-L600 VanDerWaalsContact O-N 3.12Å; K598-L600 VanDerWaalsContact C-N 3.31Å; K598-L600 PolarHBondContact O-N 3.24Å; L600-D602 VanDerWaalsContact C-N 3.28Å; L600-K608 WeakPolarHBondContact O-CD 3.33Å; L600-K608 WeakPolarHBondContact O-CE 3.47Å; L600-K608 WeakPolarHBondContact O-CG 3.45Å; L600-A611 HydrophobicContact CD2-CB 3.98Å; L600-A611 HydrophobicContact CG-CB 4.09Å; L600-N612 HydrophobicContact CD2-CB 3.78Å; L600-R615 VanDerWaalsContact CD1-CD 3.46Å
601	D	95.6	Very high	96.1	Very high	128 Å²	128	60.1 Å²	60.1	68%	0.684	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	10.2	178.3	-64.2	-32.3	0	0	0	112.5	K598 L599	K598-D601 PolarHBondContact O-N 2.87Å; L599-D601 VanDerWaalsContact C-N 3.28Å
602	D	96.8	Very high	96.4	Very high	24 Å²	24	60.1 Å²	60.1	13%	0.128	31%	0.305	C	S	.	.			trans	-62.3	170.3	179	-155.4	-78	0	0	0	112.2	R569 L599 L600 D604 V607 K608	R569-D602 IonicContact CZ-OD1 2.73Å; R569-D602 IonicContact CZ-OD2 3.18Å; R569-D602 IonicContact NE-OD1 2.91Å; R569-D602 IonicContact NE-OD2 3.06Å; R569-D602 PolarHBondContact NE-OD2 3.18Å; R569-D602 IonicContact NH2-OD1 3.9Å; R569-D602 PolarHBondContact NH2-OD1 3.18Å; R569-D602 IonicContact NH2-OD2 3.32Å; R569-D602 PolarHBondContact NH2-OD2 2.94Å; L599-D602 WeakPolarHBondContact O-CB 3.43Å; L599-D602 PolarHBondContact O-N 3Å; L600-D602 VanDerWaalsContact C-N 3.28Å; D602-D604 PolarHBondContact OD1-N 2.87Å; D602-V607 HydrophobicContact CB-CB 3.91Å; D602-V607 HydrophobicContact CB-CG1 3.66Å; D602-K608 WeakPolarHBondContact O-CE 3.49Å; D602-K608 PolarHBondContact O-NZ 3.39Å
603	N	95.4	Very high	96.4	Very high	160 Å²	160	63.8 Å²	63.8	86%	0.856	32%	0.322	S	S	*	.	S	Bend	trans	-89.2	-23.2	172.4	-69.2	-43.2	0	0	0	112.2
604	D	97.5	Very high	96.5	Very high	53 Å²	53	60.9 Å²	60.9	28%	0.283	31%	0.309	S	S	.	.	S	Bend	trans	-87.5	134.4	-176	-172.8	-78.1	0	0	0	112.3	A566 D602 D606 V607 K608	A566-D604 HydrophobicContact CB-CB 3.85Å; A566-D604 VanDerWaalsContact CB-CG 3.46Å; A566-D604 VanDerWaalsContact CB-OD2 3.27Å; A566-D604 WeakPolarHBondContact CB-OD2 3.43Å; D602-D604 PolarHBondContact OD1-N 2.87Å; D604-D606 WeakPolarHBondContact OD1-CB 3.13Å; D604-D606 PolarHBondContact OD1-N 3.1Å; D604-V607 HydrophobicContact CB-CB 4.23Å; D604-V607 HydrophobicContact CB-CG2 3.75Å; D604-V607 PolarHBondContact O-N 3.2Å; D604-V607 PolarHBondContact OD1-N 3Å; D604-K608 WeakPolarHBondContact O-CG 3.23Å; D604-K608 PolarHBondContact O-N 3.13Å
605	L	96.8	Very high	96.5	Very high	140 Å²	140	59.9 Å²	59.9	73%	0.733	30%	0.296	S	S	*	.	H	α-helix	trans	-67.5	-36.8	-176	-68.3	173.8	0	0	0	112.9	K608 Y609	L605-K608 PolarHBondContact O-N 3.35Å; L605-Y609 WeakPolarHBondContact O-CB 3.23Å; L605-Y609 PolarHBondContact O-N 3.35Å
606	D	97.1	Very high	96.4	Very high	87 Å²	87	64.9 Å²	64.9	47%	0.465	32%	0.319	S	S	.	.	H	α-helix	trans	-70.1	-38.2	-179.7	-70.8	-30.5	0	0	0	110.3	F570 D604 K608 Y609 F610	F570-D606 HydrophobicContact CD1-CB 3.92Å; F570-D606 HydrophobicContact CE1-CB 4.4Å; F570-D606 HydrophobicContact CG-CB 4.44Å; D604-D606 WeakPolarHBondContact OD1-CB 3.13Å; D604-D606 PolarHBondContact OD1-N 3.1Å; D606-K608 PolarHBondContact O-N 3.45Å; D606-Y609 PolarHBondContact O-N 2.89Å; D606-F610 HydrophobicContact CB-CD2 4.38Å; D606-F610 HydrophobicContact CB-CE2 4.41Å; D606-F610 WeakPolarHBondContact O-CD2 3.42Å; D606-F610 PolarHBondContact O-N 3.06Å
607	V	97.7	Very high	96.2	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-59.5	-47.8	175.2	-176.3	0	0	0	0	110.6	A566 R569 F570 L599 D602 D604 Y609 A611	A566-V607 HydrophobicContact CB-CG2 4.08Å; R569-V607 HydrophobicContact CB-CG1 4.1Å; R569-V607 HydrophobicContact CB-CG2 3.92Å; F570-V607 HydrophobicContact CB-CB 4.37Å; F570-V607 HydrophobicContact CB-CG2 3.98Å; L599-V607 HydrophobicContact CB-CG1 3.98Å; L599-V607 HydrophobicContact CD2-CG1 3.76Å; L599-V607 HydrophobicContact CG-CG1 4.39Å; D602-V607 HydrophobicContact CB-CB 3.91Å; D602-V607 HydrophobicContact CB-CG1 3.66Å; D604-V607 HydrophobicContact CB-CB 4.23Å; D604-V607 HydrophobicContact CB-CG2 3.75Å; D604-V607 PolarHBondContact O-N 3.2Å; D604-V607 PolarHBondContact OD1-N 3Å; V607-Y609 PolarHBondContact O-N 3.07Å; V607-A611 WeakPolarHBondContact O-CB 3.21Å; V607-A611 PolarHBondContact O-N 3.28Å
608	K	97.6	Very high	96.1	Very high	79 Å²	79	64.8 Å²	64.8	34%	0.343	32%	0.323	S	S	.	.	H	α-helix	trans	-60.5	-46.5	175.6	-64.9	-171.7	-175.9	-177.9	0	112.4	L600 D602 D604 L605 D606 A611 N612	L600-K608 WeakPolarHBondContact O-CD 3.33Å; L600-K608 WeakPolarHBondContact O-CE 3.47Å; L600-K608 WeakPolarHBondContact O-CG 3.45Å; D602-K608 WeakPolarHBondContact O-CE 3.49Å; D602-K608 PolarHBondContact O-NZ 3.39Å; D604-K608 WeakPolarHBondContact O-CG 3.23Å; D604-K608 PolarHBondContact O-N 3.13Å; L605-K608 PolarHBondContact O-N 3.35Å; D606-K608 PolarHBondContact O-N 3.45Å; K608-A611 PolarHBondContact O-N 2.97Å; K608-N612 WeakPolarHBondContact O-CB 3.5Å; K608-N612 PolarHBondContact O-N 3.41Å
609	Y	97.6	Very high	95.8	Very high	130 Å²	130	70.4 Å²	70.4	51%	0.51	34%	0.342	S	S	.	.	H	α-helix	trans	-59.3	-51.8	-178.2	177.3	-94.8	0	0	0	111.4	L605 D606 V607 N612 Q613	L605-Y609 WeakPolarHBondContact O-CB 3.23Å; L605-Y609 PolarHBondContact O-N 3.35Å; D606-Y609 PolarHBondContact O-N 2.89Å; V607-Y609 PolarHBondContact O-N 3.07Å; Y609-N612 PolarHBondContact O-N 3.37Å; Y609-Q613 HydrophobicContact CD1-CG 4.48Å; Y609-Q613 VanDerWaalsContact CE1-CD 3.43Å; Y609-Q613 HydrophobicContact CE1-CG 4.11Å; Y609-Q613 VanDerWaalsContact CE1-NE2 3.33Å; Y609-Q613 PolarHBondContact O-N 3.18Å; Y609-Q613 PolarHBondContact OH-NE2 2.68Å
610	F	97.6	Very high	95.2	Very high	40 Å²	40	70.4 Å²	70.4	18%	0.175	34%	0.342	C	S	.	.	H	α-helix	trans	-71.3	-30.9	-179.5	-72.2	-62	0	0	0	112.7	F570 A573 K574 D606 A614	F570-F610 HydrophobicContact CB-CB 4.3Å; F570-F610 HydrophobicContact CB-CD2 3.84Å; F570-F610 HydrophobicContact CB-CG 4.48Å; F570-F610 AromaticContact CD2-CD2 3.72Å; F570-F610 HydrophobicContact CD2-CD2 3.72Å; F570-F610 AromaticContact CD2-CE2 4Å; F570-F610 HydrophobicContact CD2-CE2 4Å; F570-F610 HydrophobicContact CE2-CE2 4.36Å; F570-F610 AromaticContact CG-CD2 3.9Å; F570-F610 HydrophobicContact CG-CD2 3.9Å; F570-F610 HydrophobicContact CG-CE2 4.39Å; A573-F610 HydrophobicContact CB-CB 4.05Å; K574-F610 HydrophobicContact CD-CD1 4.28Å; K574-F610 HydrophobicContact CD-CE1 4.41Å; K574-F610 HydrophobicContact CG-CB 4.4Å; K574-F610 HydrophobicContact CG-CD1 3.96Å; K574-F610 HydrophobicContact CG-CG 4.16Å; D606-F610 HydrophobicContact CB-CD2 4.38Å; D606-F610 HydrophobicContact CB-CE2 4.41Å; D606-F610 WeakPolarHBondContact O-CD2 3.42Å; D606-F610 PolarHBondContact O-N 3.06Å; F610-A614 VanDerWaalsContact O-CB 3.3Å; F610-A614 WeakPolarHBondContact O-CB 3.34Å; F610-A614 PolarHBondContact O-N 3.23Å
611	A	97.2	Very high	93.8	Very high	0 Å²	0	74.1 Å²	74.1	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-64	-41.7	171.1	0	0	0	0	0	111.9	A573 L599 L600 V607 K608 A614 R615	A573-A611 HydrophobicContact CB-CB 4.31Å; L599-A611 HydrophobicContact CB-CB 3.69Å; L600-A611 HydrophobicContact CD2-CB 3.98Å; L600-A611 HydrophobicContact CG-CB 4.09Å; V607-A611 WeakPolarHBondContact O-CB 3.21Å; V607-A611 PolarHBondContact O-N 3.28Å; K608-A611 PolarHBondContact O-N 2.97Å; A611-A614 PolarHBondContact O-N 3.37Å; A611-R615 PolarHBondContact O-N 3.28Å
612	N	96.6	Very high	93.7	Very high	73 Å²	73	71.5 Å²	71.5	39%	0.39	38%	0.375	S	S	.	.	H	α-helix	trans	-66.6	-44.3	176.1	-171.3	46.8	0	0	0	111.9	L600 K608 Y609 A614 R615 Q616	L600-N612 HydrophobicContact CD2-CB 3.78Å; K608-N612 WeakPolarHBondContact O-CB 3.5Å; K608-N612 PolarHBondContact O-N 3.41Å; Y609-N612 PolarHBondContact O-N 3.37Å; N612-A614 VanDerWaalsContact C-N 3.33Å; N612-A614 PolarHBondContact O-N 2.77Å; N612-R615 PolarHBondContact O-N 2.95Å; N612-Q616 PolarHBondContact ND2-NE2 3.41Å; N612-Q616 WeakPolarHBondContact O-CG 3.42Å; N612-Q616 PolarHBondContact O-N 3.08Å
613	Q	95.9	Very high	93.6	Very high	78 Å²	78	73.9 Å²	73.9	36%	0.364	39%	0.388	S	S	.	.	H	α-helix	trans	-59.4	-43.2	173.7	-76.3	-164.1	-23.3	0	0	112.2	Y609 R615 Q616 A617	Y609-Q613 HydrophobicContact CD1-CG 4.48Å; Y609-Q613 VanDerWaalsContact CE1-CD 3.43Å; Y609-Q613 HydrophobicContact CE1-CG 4.11Å; Y609-Q613 VanDerWaalsContact CE1-NE2 3.33Å; Y609-Q613 PolarHBondContact O-N 3.18Å; Y609-Q613 PolarHBondContact OH-NE2 2.68Å; Q613-R615 PolarHBondContact O-N 2.6Å; Q613-Q616 PolarHBondContact O-N 2.7Å; Q613-A617 WeakPolarHBondContact O-CB 3.34Å; Q613-A617 PolarHBondContact O-N 3.13Å
614	A	95.8	Very high	93.5	Very high	1 Å²	1	69.2 Å²	69.2	1%	0.008	36%	0.362	C	S	.	.	H	α-helix	trans	-61.8	-41.7	176.8	0	0	0	0	0	111.9	A573 L596 F610 A611 N612 A617 L618	A573-A614 WeakPolarHBondContact O-CB 3.36Å; L596-A614 HydrophobicContact CD1-CB 3.98Å; L596-A614 HydrophobicContact CD2-CB 3.72Å; F610-A614 VanDerWaalsContact O-CB 3.3Å; F610-A614 WeakPolarHBondContact O-CB 3.34Å; F610-A614 PolarHBondContact O-N 3.23Å; A611-A614 PolarHBondContact O-N 3.37Å; N612-A614 VanDerWaalsContact C-N 3.33Å; N612-A614 PolarHBondContact O-N 2.77Å; A614-A617 PolarHBondContact O-N 3.13Å; A614-L618 WeakPolarHBondContact O-CB 3.39Å; A614-L618 VanDerWaalsContact O-CG 3.3Å; A614-L618 WeakPolarHBondContact O-CG 3.49Å; A614-L618 PolarHBondContact O-N 2.85Å
615	R	94.6	Very high	93.2	Very high	49 Å²	49	70.1 Å²	70.1	19%	0.185	37%	0.366	C	S	.	.	H	α-helix	trans	-61.2	-44.3	174.2	-78.6	-175.6	65.5	175.6	-5	112.5	L596 L600 A611 N612 Q613 L618 R619 L620 G621	L596-R615 HydrophobicContact CB-CG 3.99Å; L596-R615 HydrophobicContact CD1-CG 4.06Å; L600-R615 VanDerWaalsContact CD1-CD 3.46Å; A611-R615 PolarHBondContact O-N 3.28Å; N612-R615 PolarHBondContact O-N 2.95Å; Q613-R615 PolarHBondContact O-N 2.6Å; R615-L618 PolarHBondContact O-N 3.26Å; R615-R619 PolarHBondContact O-N 3.02Å; R615-R619 VanDerWaalsContact O-N 3.08Å; R615-L620 HydrophobicContact CB-CB 4.11Å; R615-L620 HydrophobicContact CG-CB 4.13Å; R615-L620 HydrophobicContact CG-CD1 4.46Å; R615-L620 PolarHBondContact NE-O 3.35Å; R615-L620 PolarHBondContact NH2-O 3.19Å; R615-L620 PolarHBondContact O-N 2.89Å; R615-G621 PolarHBondContact NH2-OXT 2.7Å
616	Q	93.7	Very high	93	Very high	134 Å²	134	65.8 Å²	65.8	63%	0.626	34%	0.343	S	S	*	.	H	α-helix	trans	-63.1	-46	177.9	-70.8	177.7	3.7	0	0	111.2	N612 Q613 L618 R619	N612-Q616 PolarHBondContact ND2-NE2 3.41Å; N612-Q616 WeakPolarHBondContact O-CG 3.42Å; N612-Q616 PolarHBondContact O-N 3.08Å; Q613-Q616 PolarHBondContact O-N 2.7Å; Q616-L618 VanDerWaalsContact C-N 3.31Å; Q616-L618 PolarHBondContact O-N 2.95Å; Q616-R619 PolarHBondContact O-N 3Å
617	A	93.2	Very high	92.7	Very high	51 Å²	51	64.3 Å²	64.3	42%	0.421	34%	0.335	S	S	.	.	H	α-helix	trans	-59.8	-40.3	177.7	0	0	0	0	0	112.3	Q613 A614 R619	Q613-A617 WeakPolarHBondContact O-CB 3.34Å; Q613-A617 PolarHBondContact O-N 3.13Å; A614-A617 PolarHBondContact O-N 3.13Å; A617-R619 VanDerWaalsContact C-N 3.32Å; A617-R619 PolarHBondContact O-N 3.4Å
618	L	92.7	Very high	92.4	Very high	2 Å²	2	68.9 Å²	68.9	1%	0.01	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	5.6	-179.8	-61.3	176.7	0	0	0	114.2	I588 I592 L596 A614 R615 Q616 L620	I588-L618 HydrophobicContact CG2-CB 4.23Å; I588-L618 HydrophobicContact CG2-CD1 4.34Å; I592-L618 HydrophobicContact CG2-CD1 3.91Å; L596-L618 HydrophobicContact CD1-CD1 4.04Å; A614-L618 WeakPolarHBondContact O-CB 3.39Å; A614-L618 VanDerWaalsContact O-CG 3.3Å; A614-L618 WeakPolarHBondContact O-CG 3.49Å; A614-L618 PolarHBondContact O-N 2.85Å; R615-L618 PolarHBondContact O-N 3.26Å; Q616-L618 VanDerWaalsContact C-N 3.31Å; Q616-L618 PolarHBondContact O-N 2.95Å; L618-L620 VanDerWaalsContact C-N 3.26Å; L618-L620 HydrophobicContact CB-CD1 4.2Å; L618-L620 HydrophobicContact CB-CG 4.13Å; L618-L620 HydrophobicContact CD1-CD1 4.48Å; L618-L620 PolarHBondContact O-N 3.18Å
619	R	90.4	Very high	92	Very high	211 Å²	211	68.2 Å²	68.2	80%	0.796	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	36.3	-178.7	-53.5	179.8	-179.7	-179.4	-0.7	113.5	R615 Q616 A617 G621	R615-R619 PolarHBondContact O-N 3.02Å; R615-R619 VanDerWaalsContact O-N 3.08Å; Q616-R619 PolarHBondContact O-N 3Å; A617-R619 VanDerWaalsContact C-N 3.32Å; A617-R619 PolarHBondContact O-N 3.4Å; R619-G621 PolarHBondContact O-N 2.85Å
620	L	83.3	Confident	91.5	Very high	2 Å²	2	63 Å²	63	1%	0.01	35%	0.348	C	S	.	.			trans	-89.5	58.2	174.5	-67	176.2	0	0	0	110.9	I588 Q589 K593 L596 R615 L618	I588-L620 HydrophobicContact CG2-CD1 3.88Å; I588-L620 HydrophobicContact CG2-CD2 3.85Å; I588-L620 HydrophobicContact CG2-CG 4.01Å; Q589-L620 HydrophobicContact CG-CD2 4.35Å; Q589-L620 VanDerWaalsContact NE2-CD2 3.29Å; K593-L620 HydrophobicContact CB-CD1 3.91Å; K593-L620 HydrophobicContact CB-CD2 4.14Å; K593-L620 HydrophobicContact CD-CD2 4.17Å; K593-L620 HydrophobicContact CG-CD1 4.26Å; K593-L620 HydrophobicContact CG-CD2 4.28Å; L596-L620 HydrophobicContact CD1-CD1 3.91Å; R615-L620 HydrophobicContact CB-CB 4.11Å; R615-L620 HydrophobicContact CG-CB 4.13Å; R615-L620 HydrophobicContact CG-CD1 4.46Å; R615-L620 PolarHBondContact NE-O 3.35Å; R615-L620 PolarHBondContact NH2-O 3.19Å; R615-L620 PolarHBondContact O-N 2.89Å; L618-L620 VanDerWaalsContact C-N 3.26Å; L618-L620 HydrophobicContact CB-CD1 4.2Å; L618-L620 HydrophobicContact CB-CG 4.13Å; L618-L620 HydrophobicContact CD1-CD1 4.48Å; L618-L620 PolarHBondContact O-N 3.18Å
621	G	66.9	Low	91	Very high	115 Å²	115	65.1 Å²	65.1	100%	1.186	36%	0.363	S	S	*	.			trans	-59.8	0	171.1	0	0	0	0	0	112.1	R615 R619	R615-G621 PolarHBondContact NH2-OXT 2.7Å; R619-G621 PolarHBondContact O-N 2.85Å

Retrieved 621 of 621 residues in 241.4 ms (Link to these results)

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