A0A093HGP1_STRCA Loading...

N-alpha-acetyltransferase 35, NatC auxiliary subunit

AlphaFold DB , UniProt , Accession A0A093HGP1, Species STRCA (Struthio camelus australis), Gene n/a, Length 725 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	31	Very low	27.1	Very low	249 Å²	249	162.5 Å²	162.5	100%	1.227	88%	0.883	S	S	*	*				0	92.8	0	-126.3	176.1	-179.7	0	0	106.3
2	V	24.2	Very low	27.2	Very low	144 Å²	144	154.9 Å²	154.9	87%	0.873	85%	0.85	S	S	*	*			trans	-111.5	118.2	-176.2	178.8	0	0	0	0	106.3	K4	V2-K4 PolarHBondContact O-N 2.82Å
3	M	22.6	Very low	27.2	Very low	188 Å²	188	148.3 Å²	148.3	93%	0.926	84%	0.84	S	S	*	*			trans	-63.7	124.6	176.4	-79.5	175.5	166.1	0	0	109.5	A5	M3-A5 PolarHBondContact O-N 3.43Å
4	K	24.2	Very low	27.2	Very low	208 Å²	208	154.8 Å²	154.8	90%	0.904	84%	0.844	S	S	*	*			trans	-68.7	116.2	164.2	-90.8	-179.2	168.5	-176.9	0	108.1	V2	V2-K4 PolarHBondContact O-N 2.82Å
5	A	26.2	Very low	27.3	Very low	95 Å²	95	157.1 Å²	157.1	79%	0.785	85%	0.847	S	S	*	*			trans	-83.8	112.7	157.2	0	0	0	0	0	107.2	M3 V7	M3-A5 PolarHBondContact O-N 3.43Å; A5-V7 PolarHBondContact O-N 2.64Å
6	S	25.2	Very low	27.7	Very low	111 Å²	111	157.6 Å²	157.6	78%	0.776	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-70.9	116.3	167.7	42.2	0	0	0	0	108.6
7	V	28.5	Very low	28.1	Very low	137 Å²	137	152.1 Å²	152.1	83%	0.83	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-84.1	116.9	165.7	-179.7	0	0	0	0	105.8	A5	A5-V7 PolarHBondContact O-N 2.64Å
8	E	26.1	Very low	28.7	Very low	178 Å²	178	150.4 Å²	150.4	83%	0.832	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-68.9	133.3	168.8	-71.6	177	155.5	0	0	108.5	D10	E8-D10 PolarHBondContact O-N 2.91Å; E8-D10 VanDerWaalsContact O-N 3.08Å
9	D	31.5	Very low	29.4	Very low	167 Å²	167	146.9 Å²	146.9	89%	0.893	81%	0.81	S	S	*	*			trans	-61	103.5	171.3	-78.8	-39.4	0	0	0	109.2
10	D	27.5	Very low	30.1	Very low	146 Å²	146	146.5 Å²	146.5	78%	0.781	81%	0.807	S	S	*	*			trans	-94.8	94.1	165.4	-151.4	8.3	0	0	0	107.7	E8 S12	E8-D10 PolarHBondContact O-N 2.91Å; E8-D10 VanDerWaalsContact O-N 3.08Å; D10-S12 PolarHBondContact O-N 3.12Å
11	D	30.8	Very low	30.6	Very low	165 Å²	165	148.7 Å²	148.7	88%	0.882	81%	0.808	S	S	*	*			trans	-71.3	56	-179.7	-159.6	16.9	0	0	0	111.1
12	S	28.6	Very low	31.3	Very low	71 Å²	71	141.7 Å²	141.7	50%	0.497	77%	0.774	S	S	.	*			trans	-100	96.1	167.9	59	0	0	0	0	108.3	D10 W14	D10-S12 PolarHBondContact O-N 3.12Å; S12-W14 PolarHBondContact O-N 2.85Å
13	G	27.9	Very low	32.4	Very low	69 Å²	69	142.3 Å²	142.3	71%	0.711	77%	0.767	S	S	*	*			trans	-48.8	111.9	179.7	0	0	0	0	0	111.8	E15	G13-E15 PolarHBondContact O-N 3.3Å
14	W	26.7	Very low	33.7	Very low	239 Å²	239	142.7 Å²	142.7	91%	0.905	76%	0.764	S	S	*	*			trans	-71.6	85.5	160.4	-71.7	78.3	0	0	0	107.1	S12 L16	S12-W14 PolarHBondContact O-N 2.85Å; W14-L16 VanDerWaalsContact C-N 3.35Å; W14-L16 PolarHBondContact O-N 3.12Å
15	E	29.1	Very low	35	Very low	190 Å²	190	135.2 Å²	135.2	89%	0.888	74%	0.738	S	S	*	*			trans	-60.1	103.5	163.7	-77.9	-173.3	167.5	0	0	107.6	G13 G17	G13-E15 PolarHBondContact O-N 3.3Å; E15-G17 PolarHBondContact O-N 3.48Å
16	L	33.4	Very low	36.5	Very low	165 Å²	165	139.4 Å²	139.4	86%	0.864	75%	0.747	S	S	*	*			trans	-63.7	82.3	166.7	-85.4	156.2	0	0	0	108	W14 I18	W14-L16 VanDerWaalsContact C-N 3.35Å; W14-L16 PolarHBondContact O-N 3.12Å; L16-I18 PolarHBondContact O-N 3.35Å; L16-I18 VanDerWaalsContact O-N 3.12Å
17	G	33.9	Very low	38.6	Very low	63 Å²	63	138 Å²	138	65%	0.649	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-56.8	117	168.8	0	0	0	0	0	109	E15 P19	E15-G17 PolarHBondContact O-N 3.48Å; G17-P19 WeakPolarHBondContact O-CD 3.3Å
18	I	38.6	Very low	41.1	Very low	122 Å²	122	136.8 Å²	136.8	63%	0.626	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-54.7	121.3	172.7	-60.9	171.8	0	0	0	106.9	L16 D20 M22	L16-I18 PolarHBondContact O-N 3.35Å; L16-I18 VanDerWaalsContact O-N 3.12Å; I18-D20 PolarHBondContact O-N 2.83Å; I18-M22 HydrophobicContact CG2-CB 3.77Å; I18-M22 HydrophobicContact CG2-SD 4.44Å
19	P	41.9	Very low	44	Very low	84 Å²	84	137.3 Å²	137.3	55%	0.545	73%	0.726	S	S	.	*	P	Polyproline II helix	trans	-62.6	130.3	-178.8	19.2	-26.9	0	0	0	110.1	G17 K21 M22	G17-P19 WeakPolarHBondContact O-CD 3.3Å; P19-K21 PolarHBondContact O-N 3.35Å; P19-M22 HydrophobicContact CG-SD 4.41Å; P19-M22 PolarHBondContact O-N 3.15Å
20	D	43.6	Very low	46.9	Very low	139 Å²	139	136 Å²	136	74%	0.743	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-43.8	-14.6	-177.3	-77.5	-27	0	0	0	116.6	I18	I18-D20 PolarHBondContact O-N 2.83Å
21	K	42	Very low	49.9	Very low	193 Å²	193	135.2 Å²	135.2	84%	0.839	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-20.3	174.3	-79.2	-175.5	175.3	180	0	114.4	P19	P19-K21 PolarHBondContact O-N 3.35Å
22	M	45.2	Very low	53	Low	102 Å²	102	132.2 Å²	132.2	50%	0.502	70%	0.696	S	S	.	*	G	3₁₀ helix	trans	-81.5	-21.4	-179.6	-86.9	-178.7	143.1	0	0	113.6	I18 P19 K24 S25	I18-M22 HydrophobicContact CG2-CB 3.77Å; I18-M22 HydrophobicContact CG2-SD 4.44Å; P19-M22 HydrophobicContact CG-SD 4.41Å; P19-M22 PolarHBondContact O-N 3.15Å; M22-K24 PolarHBondContact O-N 3.41Å; M22-K24 VanDerWaalsContact O-N 3.12Å; M22-S25 PolarHBondContact O-N 3.17Å; M22-S25 PolarHBondContact O-OG 3.44Å
23	E	47.2	Very low	56.1	Low	157 Å²	157	132.6 Å²	132.6	73%	0.734	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-65.9	-12.2	177.2	-70	-167.5	151.7	0	0	114.1
24	K	49.4	Very low	59.3	Low	195 Å²	195	136.4 Å²	136.4	85%	0.848	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-89.6	3.9	179.8	-72	-172.6	178.9	179.2	0	114.9	M22	M22-K24 PolarHBondContact O-N 3.41Å; M22-K24 VanDerWaalsContact O-N 3.12Å
25	S	51.5	Low	62.6	Low	51 Å²	51	130.3 Å²	130.3	36%	0.357	68%	0.68	S	S	.	*	S	Bend	trans	-102.6	128.1	172.4	81.2	0	0	0	0	110.1	M22 T27	M22-S25 PolarHBondContact O-N 3.17Å; M22-S25 PolarHBondContact O-OG 3.44Å; S25-T27 VanDerWaalsContact CB-OG1 3.24Å; S25-T27 WeakPolarHBondContact CB-OG1 3.24Å; S25-T27 PolarHBondContact O-N 3Å; S25-T27 PolarHBondContact OG-OG1 3.31Å
26	N	58.8	Low	65.8	Low	184 Å²	184	127.7 Å²	127.7	98%	0.984	67%	0.666	S	S	*	*			trans	-68.9	31	175.4	-94.2	-5.9	0	0	0	113.1
27	T	67.4	Low	68.7	Low	82 Å²	82	124.8 Å²	124.8	50%	0.503	65%	0.648	S	S	.	*			trans	-104.3	118.8	-170	-14	0	0	0	0	109.4	S25	S25-T27 VanDerWaalsContact CB-OG1 3.24Å; S25-T27 WeakPolarHBondContact CB-OG1 3.24Å; S25-T27 PolarHBondContact O-N 3Å; S25-T27 PolarHBondContact OG-OG1 3.31Å
28	S	82.6	Confident	71.7	Confident	110 Å²	110	127.4 Å²	127.4	77%	0.769	64%	0.643	S	S	*	*			trans	-78.1	117.3	170.4	167.2	0	0	0	0	108.6
29	W	85.8	Confident	74.3	Confident	189 Å²	189	124.2 Å²	124.2	72%	0.716	64%	0.635	S	S	*	*			trans	-90	139.9	173.3	-63	92.7	0	0	0	109.6
30	I	91.9	Very high	76.8	Confident	141 Å²	141	122.9 Å²	122.9	72%	0.723	63%	0.627	S	S	*	*			trans	-115.5	128.2	172.9	-56.8	175.1	0	0	0	106.5
31	D	90.7	Very high	79.2	Confident	128 Å²	128	124.9 Å²	124.9	68%	0.684	62%	0.624	S	S	*	*			trans	-74.9	127	174.4	-175.2	-1.5	0	0	0	110	T33	D31-T33 VanDerWaalsContact OD1-CB 3.3Å; D31-T33 WeakPolarHBondContact OD1-CB 3.49Å; D31-T33 PolarHBondContact OD1-N 3.42Å; D31-T33 PolarHBondContact OD1-OG1 3.26Å
32	I	95.8	Very high	81.7	Confident	103 Å²	103	123.4 Å²	123.4	53%	0.528	62%	0.62	S	S	.	*			trans	-119.2	15.1	-179.5	63.3	165.1	0	0	0	112.5	Q34 D35 F36	I32-Q34 PolarHBondContact O-N 3.35Å; I32-D35 PolarHBondContact O-N 3.3Å; I32-F36 WeakPolarHBondContact O-CB 3.48Å; I32-F36 PolarHBondContact O-N 3.42Å
33	T	95.1	Very high	84.1	Confident	79 Å²	79	122 Å²	122	49%	0.485	62%	0.615	S	S	.	*	H	α-helix	trans	-59.9	-46.9	-171.8	-54.5	0	0	0	0	112.1	D31 F36 E37	D31-T33 VanDerWaalsContact OD1-CB 3.3Å; D31-T33 WeakPolarHBondContact OD1-CB 3.49Å; D31-T33 PolarHBondContact OD1-N 3.42Å; D31-T33 PolarHBondContact OD1-OG1 3.26Å; T33-F36 PolarHBondContact O-N 3.04Å; T33-E37 WeakPolarHBondContact O-CG 3.34Å; T33-E37 PolarHBondContact O-N 2.98Å
34	Q	95.2	Very high	86.4	Confident	149 Å²	149	121.7 Å²	121.7	70%	0.696	61%	0.611	S	S	*	*	H	α-helix	trans	-65.7	-47.4	179.4	-70.8	-175.5	-3.4	0	0	112.3	I32 F36 E37 E38	I32-Q34 PolarHBondContact O-N 3.35Å; Q34-F36 PolarHBondContact O-N 2.97Å; Q34-E37 PolarHBondContact O-N 2.99Å; Q34-E38 WeakPolarHBondContact O-CG 3.43Å; Q34-E38 PolarHBondContact O-N 2.7Å
35	D	96.4	Very high	88.4	Confident	111 Å²	111	121.3 Å²	121.3	59%	0.594	62%	0.617	S	S	*	*	H	α-helix	trans	-58.2	-39.1	178.4	-64.5	-20.7	0	0	0	111.4	I32 A39	I32-D35 PolarHBondContact O-N 3.3Å; D35-A39 PolarHBondContact O-N 3.29Å; D35-A39 VanDerWaalsContact O-N 3.15Å
36	F	95.1	Very high	90.2	Very high	135 Å²	135	122.7 Å²	122.7	59%	0.592	64%	0.639	S	S	*	*	H	α-helix	trans	-69.5	-45.2	178.6	-166.7	-98.4	0	0	0	112.2	I32 T33 Q34 E38 A39 C40	I32-F36 WeakPolarHBondContact O-CB 3.48Å; I32-F36 PolarHBondContact O-N 3.42Å; T33-F36 PolarHBondContact O-N 3.04Å; Q34-F36 PolarHBondContact O-N 2.97Å; F36-E38 VanDerWaalsContact C-N 3.33Å; F36-E38 PolarHBondContact O-N 2.86Å; F36-A39 PolarHBondContact O-N 3.17Å; F36-C40 PolarHBondContact O-N 3.42Å; F36-C40 PolarHBondContact O-SG 3.03Å; F36-C40 VanDerWaalsContact O-SG 3.35Å
37	E	95.1	Very high	91.8	Very high	104 Å²	104	118.8 Å²	118.8	49%	0.486	62%	0.615	S	S	.	*	H	α-helix	trans	-61.3	-39.8	176.5	-76.1	-174.6	179.5	0	0	112.5	T33 Q34 C40 R41	T33-E37 WeakPolarHBondContact O-CG 3.34Å; T33-E37 PolarHBondContact O-N 2.98Å; Q34-E37 PolarHBondContact O-N 2.99Å; E37-C40 PolarHBondContact O-N 2.92Å; E37-R41 WeakPolarHBondContact O-CG 3.43Å; E37-R41 PolarHBondContact O-N 2.8Å
38	E	95.5	Very high	92.9	Very high	117 Å²	117	120 Å²	120	55%	0.547	62%	0.618	S	S	.	*	H	α-helix	trans	-63.9	-46.6	176.5	-73.8	-173.8	176.5	0	0	111.7	Q34 F36 C40 R41	Q34-E38 WeakPolarHBondContact O-CG 3.43Å; Q34-E38 PolarHBondContact O-N 2.7Å; F36-E38 VanDerWaalsContact C-N 3.33Å; F36-E38 PolarHBondContact O-N 2.86Å; E38-C40 VanDerWaalsContact C-N 3.32Å; E38-C40 PolarHBondContact O-N 3.08Å; E38-R41 WeakPolarHBondContact O-CB 3.45Å; E38-R41 PolarHBondContact O-N 3.23Å; E38-R41 VanDerWaalsContact O-N 3.17Å
39	A	94.7	Very high	93.3	Very high	56 Å²	56	121.8 Å²	121.8	46%	0.463	62%	0.618	S	S	.	*	H	α-helix	trans	-61.4	-39	176	0	0	0	0	0	112.3	D35 F36 R41 E42	D35-A39 PolarHBondContact O-N 3.29Å; D35-A39 VanDerWaalsContact O-N 3.15Å; F36-A39 PolarHBondContact O-N 3.17Å; A39-R41 PolarHBondContact O-N 3.28Å; A39-E42 WeakPolarHBondContact O-CB 3.46Å; A39-E42 PolarHBondContact O-N 3.47Å
40	C	93.8	Very high	93.5	Very high	56 Å²	56	116.9 Å²	116.9	38%	0.378	60%	0.603	S	S	.	*	H	α-helix	trans	-62.8	-27.6	177.1	-75.9	0	0	0	0	113.5	F36 E37 E38 E42 L43	F36-C40 PolarHBondContact O-N 3.42Å; F36-C40 PolarHBondContact O-SG 3.03Å; F36-C40 VanDerWaalsContact O-SG 3.35Å; E37-C40 PolarHBondContact O-N 2.92Å; E38-C40 VanDerWaalsContact C-N 3.32Å; E38-C40 PolarHBondContact O-N 3.08Å; C40-E42 PolarHBondContact O-N 2.82Å; C40-L43 WeakPolarHBondContact O-CB 3.46Å; C40-L43 PolarHBondContact O-N 2.96Å
41	R	94.4	Very high	93.5	Very high	180 Å²	180	115 Å²	115	68%	0.679	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-16.9	177.6	-69.5	172.8	-170.7	153.2	7.3	113.3	E37 E38 A39 L43	E37-R41 WeakPolarHBondContact O-CG 3.43Å; E37-R41 PolarHBondContact O-N 2.8Å; E38-R41 WeakPolarHBondContact O-CB 3.45Å; E38-R41 PolarHBondContact O-N 3.23Å; E38-R41 VanDerWaalsContact O-N 3.17Å; A39-R41 PolarHBondContact O-N 3.28Å; R41-L43 VanDerWaalsContact C-N 3.29Å
42	E	94.9	Very high	93.5	Very high	162 Å²	162	118.7 Å²	118.7	76%	0.757	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-20.7	175.6	-58.9	-170.9	171.2	0	0	112.8	A39 C40	A39-E42 WeakPolarHBondContact O-CB 3.46Å; A39-E42 PolarHBondContact O-N 3.47Å; C40-E42 PolarHBondContact O-N 2.82Å
43	L	94.8	Very high	93.3	Very high	74 Å²	74	121.3 Å²	121.3	39%	0.387	62%	0.619	S	S	.	*	P	Polyproline II helix	trans	-71.8	134.3	180	-66.5	170.9	0	0	0	111.6	C40 R41 E47 L49	C40-L43 WeakPolarHBondContact O-CB 3.46Å; C40-L43 PolarHBondContact O-N 2.96Å; R41-L43 VanDerWaalsContact C-N 3.29Å; L43-E47 HydrophobicContact CD2-CB 4.2Å; L43-L49 HydrophobicContact CD1-CB 4.5Å; L43-L49 HydrophobicContact CD2-CB 4.43Å
44	K	95.2	Very high	93	Very high	150 Å²	150	121.1 Å²	121.1	65%	0.652	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-87.3	162.1	175.3	-61	173.8	-173.6	164.1	0	111.6	G46 E47	K44-G46 PolarHBondContact O-N 3.17Å; K44-E47 HydrophobicContact CB-CG 4.13Å; K44-E47 PolarHBondContact N-OE2 3.14Å; K44-E47 WeakPolarHBondContact O-CB 3.39Å; K44-E47 PolarHBondContact O-N 2.81Å
45	L	92.4	Very high	92.6	Very high	187 Å²	187	115.5 Å²	115.5	98%	0.979	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57	122.5	174.5	-175.1	69	0	0	0	110.7
46	G	89.6	Confident	92.2	Very high	80 Å²	80	115.4 Å²	115.4	83%	0.825	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	92.5	-4.5	-177.9	0	0	0	0	0	114.7	K44	K44-G46 PolarHBondContact O-N 3.17Å
47	E	92.6	Very high	91.7	Very high	102 Å²	102	117.2 Å²	117.2	48%	0.477	60%	0.6	S	S	.	*			trans	-85.3	140	171.3	-65.4	-180	163.1	0	0	110.6	L43 K44	L43-E47 HydrophobicContact CD2-CB 4.2Å; K44-E47 HydrophobicContact CB-CG 4.13Å; K44-E47 PolarHBondContact N-OE2 3.14Å; K44-E47 WeakPolarHBondContact O-CB 3.39Å; K44-E47 PolarHBondContact O-N 2.81Å
48	L	89.3	Confident	91.2	Very high	106 Å²	106	117.9 Å²	117.9	56%	0.555	60%	0.603	S	S	*	*			trans	-131.5	124.1	174.2	-179.6	72	0	0	0	108.3	L56	L48-L56 HydrophobicContact CD2-CD2 3.33Å
49	L	90.9	Very high	90.6	Very high	148 Å²	148	114.2 Å²	114.2	78%	0.775	59%	0.593	S	S	*	*			trans	-86.8	115.1	172.7	-174.6	67.1	0	0	0	109.3	L43	L43-L49 HydrophobicContact CD1-CB 4.5Å; L43-L49 HydrophobicContact CD2-CB 4.43Å
50	H	90.5	Very high	90.1	Very high	86 Å²	86	118.8 Å²	118.8	40%	0.398	61%	0.606	S	S	.	*			trans	-150.5	167.9	175.3	65.6	90.8	0	0	0	110.3	F54	H50-F54 HydrophobicContact CB-CB 4.44Å; H50-F54 HydrophobicContact CB-CD1 3.89Å; H50-F54 PolarHBondContact CE1-O 3.41Å; H50-F54 VanDerWaalsContact CE1-O 3.28Å; H50-F54 PolarHBondContact ND1-O 3.01Å
51	D	92.1	Very high	89.4	Confident	103 Å²	103	121 Å²	121	55%	0.551	62%	0.622	S	S	*	*			trans	-65.7	148.5	174.9	-174.4	-94.3	0	0	0	111.4	L53 F54	D51-L53 PolarHBondContact O-N 3.21Å; D51-L53 VanDerWaalsContact O-N 3.14Å; D51-L53 VanDerWaalsContact OD1-CB 3.31Å; D51-L53 WeakPolarHBondContact OD1-CB 3.45Å; D51-L53 PolarHBondContact OD1-N 2.9Å; D51-F54 HydrophobicContact CB-CB 4.31Å; D51-F54 WeakPolarHBondContact O-CB 3.31Å; D51-F54 PolarHBondContact O-N 3.45Å
52	K	90.3	Very high	88.9	Confident	204 Å²	204	115.7 Å²	115.7	89%	0.887	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	-25.3	-179.1	-68.2	-179.6	-179.9	176.9	0	113.7
53	L	92.1	Very high	88.2	Confident	158 Å²	158	111.5 Å²	111.5	83%	0.827	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-14	178.8	-58.4	176.3	0	0	0	112.7	D51 G55	D51-L53 PolarHBondContact O-N 3.21Å; D51-L53 VanDerWaalsContact O-N 3.14Å; D51-L53 VanDerWaalsContact OD1-CB 3.31Å; D51-L53 WeakPolarHBondContact OD1-CB 3.45Å; D51-L53 PolarHBondContact OD1-N 2.9Å; L53-G55 PolarHBondContact O-N 3.39Å
54	F	88	Confident	87.7	Confident	76 Å²	76	113.4 Å²	113.4	33%	0.333	61%	0.606	S	S	.	*			trans	-76.4	119.1	178.9	-176.8	-103	0	0	0	110.6	H50 D51 E58 A59	H50-F54 HydrophobicContact CB-CB 4.44Å; H50-F54 HydrophobicContact CB-CD1 3.89Å; H50-F54 PolarHBondContact CE1-O 3.41Å; H50-F54 VanDerWaalsContact CE1-O 3.28Å; H50-F54 PolarHBondContact ND1-O 3.01Å; D51-F54 HydrophobicContact CB-CB 4.31Å; D51-F54 WeakPolarHBondContact O-CB 3.31Å; D51-F54 PolarHBondContact O-N 3.45Å; F54-E58 VanDerWaalsContact CD2-OE2 3.31Å; F54-E58 WeakPolarHBondContact CD2-OE2 3.19Å; F54-E58 HydrophobicContact CE2-CB 3.92Å; F54-E58 HydrophobicContact CZ-CB 4.34Å; F54-A59 HydrophobicContact CE1-CB 4.06Å; F54-A59 HydrophobicContact CZ-CB 3.88Å
55	G	86.8	Confident	87.2	Confident	31 Å²	31	113.3 Å²	113.3	32%	0.32	61%	0.61	S	S	.	*			trans	-93.9	137.4	177.2	0	0	0	0	0	111.9	L53 F57 E58	L53-G55 PolarHBondContact O-N 3.39Å; G55-F57 PolarHBondContact O-N 2.97Å; G55-E58 WeakPolarHBondContact O-CB 3.37Å; G55-E58 PolarHBondContact O-N 3.46Å
56	L	88.1	Confident	86.7	Confident	109 Å²	109	110.9 Å²	110.9	57%	0.571	60%	0.596	S	S	*	*	H	α-helix	trans	-59.6	-20.1	176.7	-70	179.9	0	0	0	114.4	L48 E58 A59	L48-L56 HydrophobicContact CD2-CD2 3.33Å; L56-E58 VanDerWaalsContact C-N 3.28Å; L56-E58 PolarHBondContact O-N 3.47Å; L56-A59 WeakPolarHBondContact O-CB 3.34Å; L56-A59 PolarHBondContact O-N 3.33Å
57	F	85.4	Confident	86.4	Confident	172 Å²	172	109 Å²	109	75%	0.754	57%	0.566	S	S	*	*	H	α-helix	trans	-64.2	-33.9	172.1	-174.9	-100.7	0	0	0	112	G55 A59 M60	G55-F57 PolarHBondContact O-N 2.97Å; F57-A59 VanDerWaalsContact C-N 3.32Å; F57-M60 HydrophobicContact CD2-SD 4.2Å; F57-M60 WeakPolarHBondContact O-CB 3.46Å; F57-M60 PolarHBondContact O-N 3.46Å
58	E	83.1	Confident	85.6	Confident	119 Å²	119	107.8 Å²	107.8	56%	0.556	57%	0.567	S	S	*	*	H	α-helix	trans	-68.1	-35.7	176.3	-59.3	179.9	159.6	0	0	110.9	F54 G55 L56 M60 S61	F54-E58 VanDerWaalsContact CD2-OE2 3.31Å; F54-E58 WeakPolarHBondContact CD2-OE2 3.19Å; F54-E58 HydrophobicContact CE2-CB 3.92Å; F54-E58 HydrophobicContact CZ-CB 4.34Å; G55-E58 WeakPolarHBondContact O-CB 3.37Å; G55-E58 PolarHBondContact O-N 3.46Å; L56-E58 VanDerWaalsContact C-N 3.28Å; L56-E58 PolarHBondContact O-N 3.47Å; E58-M60 PolarHBondContact O-N 3.28Å; E58-S61 PolarHBondContact O-N 3.19Å; E58-S61 VanDerWaalsContact O-N 3.11Å
59	A	84.1	Confident	85	Confident	40 Å²	40	110.3 Å²	110.3	33%	0.331	57%	0.574	S	S	.	*	H	α-helix	trans	-62.3	-22.7	175.5	0	0	0	0	0	113.1	F54 L56 F57 S61 A62	F54-A59 HydrophobicContact CE1-CB 4.06Å; F54-A59 HydrophobicContact CZ-CB 3.88Å; L56-A59 WeakPolarHBondContact O-CB 3.34Å; L56-A59 PolarHBondContact O-N 3.33Å; F57-A59 VanDerWaalsContact C-N 3.32Å; A59-S61 PolarHBondContact O-N 3.11Å; A59-A62 WeakPolarHBondContact O-CB 3.37Å; A59-A62 PolarHBondContact O-N 3.12Å
60	M	83.3	Confident	84.2	Confident	151 Å²	151	105.3 Å²	105.3	74%	0.744	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-16.9	175.5	-66.5	-170	55.2	0	0	113.7	F57 E58	F57-M60 HydrophobicContact CD2-SD 4.2Å; F57-M60 WeakPolarHBondContact O-CB 3.46Å; F57-M60 PolarHBondContact O-N 3.46Å; E58-M60 PolarHBondContact O-N 3.28Å
61	S	79.5	Confident	83.6	Confident	102 Å²	102	102.7 Å²	102.7	71%	0.713	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	2.5	175.5	-56	0	0	0	0	112.9	E58 A59	E58-S61 PolarHBondContact O-N 3.19Å; E58-S61 VanDerWaalsContact O-N 3.11Å; A59-S61 PolarHBondContact O-N 3.11Å
62	A	83.3	Confident	82.5	Confident	70 Å²	70	98.9 Å²	98.9	58%	0.579	52%	0.519	S	S	*	.			trans	-67.5	143.7	178.5	0	0	0	0	0	110.9	A59	A59-A62 WeakPolarHBondContact O-CB 3.37Å; A59-A62 PolarHBondContact O-N 3.12Å
63	I	80.5	Confident	81.6	Confident	74 Å²	74	90.9 Å²	90.9	38%	0.379	49%	0.494	S	S	.	.			trans	-91.2	146.9	170.2	51	155	0	0	0	110.7	P311	I63-P311 HydrophobicContact CB-CB 4.41Å; I63-P311 HydrophobicContact CD1-CB 3.49Å; I63-P311 VanDerWaalsContact CD1-CB 3.49Å; I63-P311 HydrophobicContact CG1-CB 3.88Å; I63-P311 VanDerWaalsContact CG2-C 3.48Å; I63-P311 HydrophobicContact CG2-CB 3.72Å; I63-P311 VanDerWaalsContact CG2-O 3.25Å; I63-P311 WeakPolarHBondContact CG2-O 3.47Å
64	E	84.8	Confident	80.7	Confident	113 Å²	113	85.4 Å²	85.4	53%	0.528	47%	0.465	S	S	.	.			trans	-99	114.8	170.6	-170.7	170.7	-178.7	0	0	108.9	D67 M70	E64-D67 HydrophobicContact CB-CB 3.93Å; E64-D67 HydrophobicContact CG-CB 4Å; E64-D67 PolarHBondContact O-N 2.74Å; E64-M70 HydrophobicContact CB-CB 4.31Å; E64-M70 HydrophobicContact CB-CE 3.84Å; E64-M70 HydrophobicContact CB-SD 4.05Å; E64-M70 WeakPolarHBondContact OE2-CE 3.38Å
65	M	85	Confident	79.5	Confident	149 Å²	149	82.7 Å²	82.7	73%	0.734	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	147.8	173	-65.5	-170.9	-61	0	0	109.7	D67	M65-D67 PolarHBondContact O-N 2.9Å; M65-D67 VanDerWaalsContact O-N 3.12Å
66	M	81.7	Confident	78.2	Confident	136 Å²	136	82.4 Å²	82.4	67%	0.67	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.5	-2.4	-177.1	-51.7	-67.3	-76.4	0	0	115.6	P68 D71 M74	M66-P68 WeakPolarHBondContact O-CD 3.33Å; M66-D71 PolarHBondContact N-OD2 3.21Å; M66-M74 HydrophobicContact CE-SD 4.2Å; M66-M74 HydrophobicContact SD-SD 3.79Å
67	D	82.3	Confident	76.8	Confident	39 Å²	39	83.7 Å²	83.7	21%	0.209	46%	0.458	C	S	.	.			trans	-78.3	124	169.3	179.3	-82	0	0	0	110	E64 M65 K69 M70 D71	E64-D67 HydrophobicContact CB-CB 3.93Å; E64-D67 HydrophobicContact CG-CB 4Å; E64-D67 PolarHBondContact O-N 2.74Å; M65-D67 PolarHBondContact O-N 2.9Å; M65-D67 VanDerWaalsContact O-N 3.12Å; D67-K69 PolarHBondContact O-N 3.41Å; D67-K69 VanDerWaalsContact OD1-CA 3.27Å; D67-K69 WeakPolarHBondContact OD1-CA 3.3Å; D67-K69 VanDerWaalsContact OD1-CB 3.3Å; D67-K69 WeakPolarHBondContact OD1-CB 3.31Å; D67-K69 PolarHBondContact OD1-N 3.27Å; D67-M70 HydrophobicContact CB-CB 4.1Å; D67-M70 HydrophobicContact CB-CE 4.21Å; D67-M70 HydrophobicContact CB-CG 4.49Å; D67-M70 PolarHBondContact O-N 3.34Å; D67-M70 PolarHBondContact OD1-N 3.26Å; D67-D71 VanDerWaalsContact O-CB 3.3Å; D67-D71 WeakPolarHBondContact O-CB 3.33Å; D67-D71 PolarHBondContact O-N 3.3Å
68	P	76.2	Confident	75.6	Confident	77 Å²	77	81.3 Å²	81.3	50%	0.5	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-17.1	-176.9	-25.5	34.8	0	0	0	115.6	M66	M66-P68 WeakPolarHBondContact O-CD 3.33Å
69	K	75.9	Confident	74.6	Confident	159 Å²	159	76.7 Å²	76.7	69%	0.691	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-21	179.9	-62.3	177.5	-179.8	173.5	0	112.9	D67 F313 P314	D67-K69 PolarHBondContact O-N 3.41Å; D67-K69 VanDerWaalsContact OD1-CA 3.27Å; D67-K69 WeakPolarHBondContact OD1-CA 3.3Å; D67-K69 VanDerWaalsContact OD1-CB 3.3Å; D67-K69 WeakPolarHBondContact OD1-CB 3.31Å; D67-K69 PolarHBondContact OD1-N 3.27Å; K69-F313 VanDerWaalsContact O-CD1 3.26Å; K69-F313 WeakPolarHBondContact O-CD1 3.48Å; K69-P314 WeakPolarHBondContact O-CD 3.25Å
70	M	75.4	Confident	73.6	Confident	44 Å²	44	83.2 Å²	83.2	22%	0.217	46%	0.458	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.2	-23.7	-177.5	-60.9	-169.5	-104.2	0	0	113.2	E64 D67 F313	E64-M70 HydrophobicContact CB-CB 4.31Å; E64-M70 HydrophobicContact CB-CE 3.84Å; E64-M70 HydrophobicContact CB-SD 4.05Å; E64-M70 WeakPolarHBondContact OE2-CE 3.38Å; D67-M70 HydrophobicContact CB-CB 4.1Å; D67-M70 HydrophobicContact CB-CE 4.21Å; D67-M70 HydrophobicContact CB-CG 4.49Å; D67-M70 PolarHBondContact O-N 3.34Å; D67-M70 PolarHBondContact OD1-N 3.26Å; M70-F313 HydrophobicContact CG-CD1 3.96Å; M70-F313 HydrophobicContact CG-CE1 3.48Å; M70-F313 VanDerWaalsContact CG-CE1 3.48Å; M70-F313 HydrophobicContact CG-CZ 4.29Å; M70-F313 HydrophobicContact SD-CE1 4.05Å; M70-F313 HydrophobicContact SD-CZ 4.39Å
71	D	76.6	Confident	73.2	Confident	30 Å²	30	78.9 Å²	78.9	16%	0.16	43%	0.434	C	S	.	.			trans	-98.9	107.5	-179.9	-168.4	-14.3	0	0	0	111.7	M66 D67 G73 M74	M66-D71 PolarHBondContact N-OD2 3.21Å; D67-D71 VanDerWaalsContact O-CB 3.3Å; D67-D71 WeakPolarHBondContact O-CB 3.33Å; D67-D71 PolarHBondContact O-N 3.3Å; D71-G73 PolarHBondContact O-N 2.99Å; D71-G73 WeakPolarHBondContact OD1-CA 3.4Å; D71-G73 PolarHBondContact OD1-N 3.49Å; D71-M74 HydrophobicContact CB-CB 4.27Å; D71-M74 HydrophobicContact CB-CG 3.74Å; D71-M74 PolarHBondContact O-N 3.13Å
72	A	70.4	Confident	73	Confident	23 Å²	23	81.8 Å²	81.8	19%	0.19	43%	0.434	C	S	.	.	H	α-helix	trans	-62.6	-27.5	173.9	0	0	0	0	0	112.8	M74 I75 Q306 P314	A72-M74 VanDerWaalsContact C-N 3.33Å; A72-I75 PolarHBondContact O-N 3.37Å; A72-Q306 PolarHBondContact O-NE2 2.71Å; A72-P314 HydrophobicContact CB-CG 4.23Å
73	G	71.4	Confident	73	Confident	36 Å²	36	80.9 Å²	80.9	37%	0.371	42%	0.421	S	S	.	.	H	α-helix	trans	-66.8	-31.5	177.2	0	0	0	0	0	113.4	D71 I75 G76 N77	D71-G73 PolarHBondContact O-N 2.99Å; D71-G73 WeakPolarHBondContact OD1-CA 3.4Å; D71-G73 PolarHBondContact OD1-N 3.49Å; G73-I75 PolarHBondContact O-N 2.87Å; G73-G76 PolarHBondContact O-N 3.42Å; G73-N77 PolarHBondContact O-N 3.31Å; G73-N77 PolarHBondContact O-ND2 3.36Å
74	M	72.6	Confident	73.2	Confident	43 Å²	43	78.3 Å²	78.3	21%	0.212	41%	0.408	C	S	.	.	H	α-helix	trans	-61.4	-32	177.9	-75	-64.4	-75.9	0	0	112.6	M66 D71 A72 Q78	M66-M74 HydrophobicContact CE-SD 4.2Å; M66-M74 HydrophobicContact SD-SD 3.79Å; D71-M74 HydrophobicContact CB-CB 4.27Å; D71-M74 HydrophobicContact CB-CG 3.74Å; D71-M74 PolarHBondContact O-N 3.13Å; A72-M74 VanDerWaalsContact C-N 3.33Å; M74-Q78 VanDerWaalsContact O-CG 3.29Å; M74-Q78 WeakPolarHBondContact O-CG 3.34Å; M74-Q78 PolarHBondContact O-N 3.19Å
75	I	63.5	Low	73.4	Confident	20 Å²	20	76 Å²	76	10%	0.103	40%	0.399	C	S	.	.	H	α-helix	trans	-82.8	-37.8	-178.6	-61.6	174.9	0	0	0	111.7	A72 G73 N77 Q78 P314 Y316	A72-I75 PolarHBondContact O-N 3.37Å; G73-I75 PolarHBondContact O-N 2.87Å; I75-N77 PolarHBondContact O-N 2.88Å; I75-Q78 WeakPolarHBondContact O-CB 3.45Å; I75-Q78 PolarHBondContact O-N 2.84Å; I75-P314 HydrophobicContact CD1-CB 3.35Å; I75-P314 HydrophobicContact CD1-CG 3.57Å; I75-Y316 WeakPolarHBondContact CG2-OH 3.24Å
76	G	59.5	Low	73.6	Confident	24 Å²	24	69.3 Å²	69.3	25%	0.247	37%	0.366	C	S	.	.	H	α-helix	trans	-58.8	-30.1	174.3	0	0	0	0	0	112.4	G73	G73-G76 PolarHBondContact O-N 3.42Å
77	N	58.9	Low	74	Confident	137 Å²	137	67.5 Å²	67.5	73%	0.733	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-13.4	176.2	-65.2	-19.3	0	0	0	114	G73 I75	G73-N77 PolarHBondContact O-N 3.31Å; G73-N77 PolarHBondContact O-ND2 3.36Å; I75-N77 PolarHBondContact O-N 2.88Å
78	Q	59.3	Low	74.4	Confident	121 Å²	121	69.6 Å²	69.6	57%	0.565	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-19.6	177.7	-76.4	170.5	18.9	0	0	113.2	M74 I75 N80	M74-Q78 VanDerWaalsContact O-CG 3.29Å; M74-Q78 WeakPolarHBondContact O-CG 3.34Å; M74-Q78 PolarHBondContact O-N 3.19Å; I75-Q78 WeakPolarHBondContact O-CB 3.45Å; I75-Q78 PolarHBondContact O-N 2.84Å; Q78-N80 PolarHBondContact O-N 3.32Å
79	V	62.7	Low	75	Confident	23 Å²	23	66 Å²	66	14%	0.139	34%	0.341	C	S	.	.			trans	-85.5	110.8	178.4	-169.3	0	0	0	0	108.9	R81 L303	V79-R81 HydrophobicContact CG1-CB 4.14Å; V79-R81 HydrophobicContact CG1-CG 3.62Å; V79-R81 PolarHBondContact O-N 2.99Å; V79-L303 HydrophobicContact CB-CD1 4.15Å; V79-L303 HydrophobicContact CG1-CD1 4.39Å; V79-L303 HydrophobicContact CG2-CD1 3.59Å
80	N	63.4	Low	75.6	Confident	176 Å²	176	60.6 Å²	60.6	94%	0.941	32%	0.319	S	S	*	.			trans	-68.8	17.4	178	-76.3	-15.5	0	0	0	114	Q78	Q78-N80 PolarHBondContact O-N 3.32Å
81	R	73.5	Confident	76.3	Confident	61 Å²	61	66.8 Å²	66.8	23%	0.23	35%	0.345	C	S	.	.	S	Bend	trans	-116.8	142.7	-180	95.3	-175.2	176.5	-119.3	-2.8	110.3	V79 V83 D293 I296 E301	V79-R81 HydrophobicContact CG1-CB 4.14Å; V79-R81 HydrophobicContact CG1-CG 3.62Å; V79-R81 PolarHBondContact O-N 2.99Å; R81-V83 PolarHBondContact O-N 3.29Å; R81-D293 IonicContact NH1-OD1 3.2Å; R81-D293 PolarHBondContact NH1-OD1 3.07Å; R81-D293 IonicContact NH1-OD2 3Å; R81-D293 PolarHBondContact NH1-OD2 3.18Å; R81-I296 VanDerWaalsContact NH1-CD1 3.25Å; R81-I296 VanDerWaalsContact NH2-CD1 3.27Å; R81-E301 IonicContact CZ-OE1 3.75Å; R81-E301 IonicContact NE-OE1 3.93Å; R81-E301 IonicContact NE-OE2 3.54Å; R81-E301 IonicContact NH2-OE1 3.67Å; R81-E301 PolarHBondContact NH2-OE1 3.35Å; R81-E301 IonicContact NH2-OE2 2.67Å
82	K	77	Confident	76.8	Confident	163 Å²	163	70.4 Å²	70.4	71%	0.709	36%	0.364	S	S	*	.	P	Polyproline II helix	trans	-73.1	117	175.4	-171.6	177.6	176.1	-176	0	109.6	L84	K82-L84 HydrophobicContact CB-CD2 4.44Å; K82-L84 HydrophobicContact CD-CD2 3.76Å; K82-L84 HydrophobicContact CG-CD2 3.79Å; K82-L84 PolarHBondContact O-N 3.07Å
83	V	83	Confident	77.4	Confident	50 Å²	50	72.1 Å²	72.1	30%	0.303	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-72.1	116.4	172.1	179.1	0	0	0	0	108.6	R81 E301 L303 V304	R81-V83 PolarHBondContact O-N 3.29Å; V83-E301 HydrophobicContact CG1-CG 3.64Å; V83-L303 HydrophobicContact CG1-CB 4.27Å; V83-L303 HydrophobicContact CG2-CB 3.82Å; V83-L303 HydrophobicContact CG2-CD1 4.3Å; V83-V304 HydrophobicContact CG1-CB 4.42Å
84	L	84.9	Confident	78.1	Confident	21 Å²	21	73.9 Å²	73.9	11%	0.11	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-102.8	137.5	-177.4	-58.4	177.9	0	0	0	111.1	K82 Q88 A89 D92 T94	K82-L84 HydrophobicContact CB-CD2 4.44Å; K82-L84 HydrophobicContact CD-CD2 3.76Å; K82-L84 HydrophobicContact CG-CD2 3.79Å; K82-L84 PolarHBondContact O-N 3.07Å; L84-Q88 HydrophobicContact CB-CB 4.22Å; L84-Q88 HydrophobicContact CD2-CB 4.12Å; L84-A89 HydrophobicContact CB-CB 4.13Å; L84-A89 HydrophobicContact CD1-CB 4.46Å; L84-D92 HydrophobicContact CD1-CB 3.98Å; L84-T94 HydrophobicContact CD1-CG2 4.39Å
85	N	88.1	Confident	78.9	Confident	64 Å²	64	72.3 Å²	72.3	34%	0.342	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-80.9	172.4	164.7	70	36.2	0	0	0	111.1	E87 Q88 A89	N85-E87 PolarHBondContact O-N 3.37Å; N85-E87 PolarHBondContact OD1-N 3.08Å; N85-Q88 VanDerWaalsContact CG-CD 3.49Å; N85-Q88 VanDerWaalsContact N-OE1 3.11Å; N85-Q88 VanDerWaalsContact ND2-CD 3.34Å; N85-Q88 PolarHBondContact ND2-OE1 3.41Å; N85-Q88 PolarHBondContact O-N 3.42Å; N85-Q88 WeakPolarHBondContact OD1-CB 3.41Å; N85-Q88 WeakPolarHBondContact OD1-CG 3.48Å; N85-Q88 PolarHBondContact OD1-N 3.41Å; N85-A89 WeakPolarHBondContact O-CB 3.28Å; N85-A89 PolarHBondContact O-N 3.04Å
86	F	89	Confident	80.2	Confident	8 Å²	8	75.7 Å²	75.7	4%	0.035	39%	0.394	C	S	.	.	H	α-helix	trans	-54.8	-49.5	-174.5	-177.2	-120.2	0	0	0	114	Q88 A89 I90 I95 I97 L133 Y134 N137 F140 I141	F86-Q88 PolarHBondContact O-N 3.17Å; F86-A89 PolarHBondContact O-N 3.43Å; F86-I90 HydrophobicContact CD1-CD1 3.99Å; F86-I90 HydrophobicContact CD2-CD1 4.34Å; F86-I90 HydrophobicContact CE1-CD1 3.7Å; F86-I90 HydrophobicContact CE2-CD1 4.07Å; F86-I90 HydrophobicContact CE2-CG1 4.46Å; F86-I90 HydrophobicContact CG-CD1 4.32Å; F86-I90 HydrophobicContact CZ-CD1 3.75Å; F86-I90 VanDerWaalsContact O-CG1 3.28Å; F86-I90 WeakPolarHBondContact O-CG1 3.19Å; F86-I90 PolarHBondContact O-N 2.87Å; F86-I95 HydrophobicContact CD2-CD1 4.45Å; F86-I95 HydrophobicContact CE2-CG2 4.23Å; F86-I97 HydrophobicContact CZ-CG2 4.38Å; F86-L133 HydrophobicContact CB-CB 4.13Å; F86-L133 HydrophobicContact CD2-CB 3.81Å; F86-L133 VanDerWaalsContact CD2-O 3.24Å; F86-L133 WeakPolarHBondContact CD2-O 3.25Å; F86-L133 HydrophobicContact CG-CB 4.42Å; F86-L133 WeakPolarHBondContact CG-O 3.42Å; F86-Y134 HydrophobicContact CE2-CD1 4.01Å; F86-Y134 HydrophobicContact CE2-CE1 4.49Å; F86-N137 HydrophobicContact CD1-CB 3.87Å; F86-N137 HydrophobicContact CE1-CB 4.04Å; F86-N137 WeakPolarHBondContact CE1-O 3.48Å; F86-F140 HydrophobicContact CE1-CB 3.92Å; F86-I141 HydrophobicContact CZ-CG1 4.3Å
87	E	90.6	Very high	81.7	Confident	99 Å²	99	76.1 Å²	76.1	46%	0.463	39%	0.39	S	S	.	.	H	α-helix	trans	-66.4	-37.4	179.7	-67.6	179.7	-164.3	0	0	112.7	N85 K91	N85-E87 PolarHBondContact O-N 3.37Å; N85-E87 PolarHBondContact OD1-N 3.08Å; E87-K91 WeakPolarHBondContact O-CG 3.3Å; E87-K91 PolarHBondContact O-N 3.48Å; E87-K91 VanDerWaalsContact O-N 3.11Å
88	Q	90.3	Very high	83.3	Confident	83 Å²	83	74.9 Å²	74.9	39%	0.388	38%	0.378	S	S	.	.	H	α-helix	trans	-66.5	-42	176	-70.7	168.2	-14	0	0	111.1	L84 N85 F86 I90 K91 D92	L84-Q88 HydrophobicContact CB-CB 4.22Å; L84-Q88 HydrophobicContact CD2-CB 4.12Å; N85-Q88 VanDerWaalsContact CG-CD 3.49Å; N85-Q88 VanDerWaalsContact N-OE1 3.11Å; N85-Q88 VanDerWaalsContact ND2-CD 3.34Å; N85-Q88 PolarHBondContact ND2-OE1 3.41Å; N85-Q88 PolarHBondContact O-N 3.42Å; N85-Q88 WeakPolarHBondContact OD1-CB 3.41Å; N85-Q88 WeakPolarHBondContact OD1-CG 3.48Å; N85-Q88 PolarHBondContact OD1-N 3.41Å; F86-Q88 PolarHBondContact O-N 3.17Å; Q88-I90 VanDerWaalsContact C-N 3.32Å; Q88-I90 PolarHBondContact O-N 3.43Å; Q88-K91 PolarHBondContact O-N 3.38Å; Q88-D92 WeakPolarHBondContact O-CB 3.37Å; Q88-D92 PolarHBondContact O-N 2.94Å
89	A	88.2	Confident	84.8	Confident	1 Å²	1	75.1 Å²	75.1	1%	0.008	38%	0.384	C	S	.	.	H	α-helix	trans	-64.7	-35.2	178	0	0	0	0	0	112.4	L84 N85 F86 G93 T94 I95 L133	L84-A89 HydrophobicContact CB-CB 4.13Å; L84-A89 HydrophobicContact CD1-CB 4.46Å; N85-A89 WeakPolarHBondContact O-CB 3.28Å; N85-A89 PolarHBondContact O-N 3.04Å; F86-A89 PolarHBondContact O-N 3.43Å; A89-G93 PolarHBondContact O-N 3.2Å; A89-T94 WeakPolarHBondContact CA-OG1 3.41Å; A89-T94 WeakPolarHBondContact CB-OG1 3.21Å; A89-T94 PolarHBondContact O-N 3.2Å; A89-T94 PolarHBondContact O-OG1 3.3Å; A89-I95 HydrophobicContact CB-CB 4.25Å; A89-I95 HydrophobicContact CB-CD1 3.61Å; A89-I95 HydrophobicContact CB-CG1 3.88Å; A89-I95 PolarHBondContact O-N 2.75Å; A89-L133 HydrophobicContact CB-CD1 4.15Å
90	I	89.3	Confident	86.3	Confident	45 Å²	45	74.7 Å²	74.7	23%	0.231	38%	0.38	C	S	.	.	H	α-helix	trans	-64.1	-48.4	171.6	-66	165.7	0	0	0	110.5	F86 Q88 D92 G93 I95 I97	F86-I90 HydrophobicContact CD1-CD1 3.99Å; F86-I90 HydrophobicContact CD2-CD1 4.34Å; F86-I90 HydrophobicContact CE1-CD1 3.7Å; F86-I90 HydrophobicContact CE2-CD1 4.07Å; F86-I90 HydrophobicContact CE2-CG1 4.46Å; F86-I90 HydrophobicContact CG-CD1 4.32Å; F86-I90 HydrophobicContact CZ-CD1 3.75Å; F86-I90 VanDerWaalsContact O-CG1 3.28Å; F86-I90 WeakPolarHBondContact O-CG1 3.19Å; F86-I90 PolarHBondContact O-N 2.87Å; Q88-I90 VanDerWaalsContact C-N 3.32Å; Q88-I90 PolarHBondContact O-N 3.43Å; I90-D92 VanDerWaalsContact C-N 3.28Å; I90-D92 PolarHBondContact O-N 3.3Å; I90-G93 PolarHBondContact O-N 3.25Å; I90-I95 HydrophobicContact CG1-CG2 4.47Å; I90-I97 HydrophobicContact CD1-CG2 3.61Å; I90-I97 HydrophobicContact CG1-CG2 3.69Å; I90-I97 HydrophobicContact CG2-CD1 4.5Å; I90-I97 HydrophobicContact CG2-CG2 4.5Å
91	K	90.1	Very high	87.8	Confident	174 Å²	174	69.5 Å²	69.5	76%	0.757	36%	0.355	S	S	*	.	H	α-helix	trans	-62.4	-36	179.8	-73.8	173.7	-178.1	173.4	0	112.5	E87 Q88 G93	E87-K91 WeakPolarHBondContact O-CG 3.3Å; E87-K91 PolarHBondContact O-N 3.48Å; E87-K91 VanDerWaalsContact O-N 3.11Å; Q88-K91 PolarHBondContact O-N 3.38Å; K91-G93 PolarHBondContact O-N 3.49Å
92	D	86.9	Confident	88.8	Confident	107 Å²	107	68 Å²	68	57%	0.572	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-7.8	177.5	-154.9	58.4	0	0	0	112.7	L84 Q88 I90 T94	L84-D92 HydrophobicContact CD1-CB 3.98Å; Q88-D92 WeakPolarHBondContact O-CB 3.37Å; Q88-D92 PolarHBondContact O-N 2.94Å; I90-D92 VanDerWaalsContact C-N 3.28Å; I90-D92 PolarHBondContact O-N 3.3Å; D92-T94 HydrophobicContact CB-CG2 4.18Å; D92-T94 PolarHBondContact O-N 3.07Å; D92-T94 VanDerWaalsContact OD2-CG2 3.25Å; D92-T94 WeakPolarHBondContact OD2-CG2 3.27Å
93	G	84.1	Confident	89.7	Confident	59 Å²	59	61.6 Å²	61.6	61%	0.608	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.6	8.3	-179.5	0	0	0	0	0	114.6	A89 I90 K91 I95	A89-G93 PolarHBondContact O-N 3.2Å; I90-G93 PolarHBondContact O-N 3.25Å; K91-G93 PolarHBondContact O-N 3.49Å; G93-I95 VanDerWaalsContact C-N 3.29Å
94	T	84.4	Confident	90.3	Very high	72 Å²	72	60.2 Å²	60.2	44%	0.442	32%	0.319	S	S	.	.	S	Bend	trans	-75	-20.6	178.7	57.1	0	0	0	0	112.7	L84 A89 D92	L84-T94 HydrophobicContact CD1-CG2 4.39Å; A89-T94 WeakPolarHBondContact CA-OG1 3.41Å; A89-T94 WeakPolarHBondContact CB-OG1 3.21Å; A89-T94 PolarHBondContact O-N 3.2Å; A89-T94 PolarHBondContact O-OG1 3.3Å; D92-T94 HydrophobicContact CB-CG2 4.18Å; D92-T94 PolarHBondContact O-N 3.07Å; D92-T94 VanDerWaalsContact OD2-CG2 3.25Å; D92-T94 WeakPolarHBondContact OD2-CG2 3.27Å
95	I	89.4	Confident	90.9	Very high	10 Å²	10	59.6 Å²	59.6	5%	0.051	32%	0.316	C	S	.	.	S	Bend	trans	-123.6	130.7	177.1	-71.5	-176.4	0	0	0	110.1	F86 A89 I90 G93 L133 Y134	F86-I95 HydrophobicContact CD2-CD1 4.45Å; F86-I95 HydrophobicContact CE2-CG2 4.23Å; A89-I95 HydrophobicContact CB-CB 4.25Å; A89-I95 HydrophobicContact CB-CD1 3.61Å; A89-I95 HydrophobicContact CB-CG1 3.88Å; A89-I95 PolarHBondContact O-N 2.75Å; I90-I95 HydrophobicContact CG1-CG2 4.47Å; G93-I95 VanDerWaalsContact C-N 3.29Å; I95-L133 HydrophobicContact CD1-CB 3.82Å; I95-L133 HydrophobicContact CD1-CD1 3.54Å; I95-L133 HydrophobicContact CD1-CG 4.25Å; I95-Y134 HydrophobicContact CG2-CE1 3.7Å; I95-Y134 HydrophobicContact CG2-CE2 4.46Å
96	K	91.1	Very high	91.3	Very high	92 Å²	92	56.6 Å²	56.6	40%	0.4	30%	0.3	S	S	.	.			trans	-90.1	135.7	170.1	-61.7	176.9	-177.9	170	0	110.4	L100 E104 Y134 M298	K96-L100 HydrophobicContact CB-CD2 3.92Å; K96-L100 HydrophobicContact CB-CG 4.46Å; K96-E104 WeakPolarHBondContact CE-OE1 3.29Å; K96-E104 IonicContact NZ-OE1 3.37Å; K96-E104 PolarHBondContact NZ-OE1 3.11Å; K96-E104 IonicContact NZ-OE2 3.91Å; K96-Y134 VanDerWaalsContact O-CE1 3.27Å; K96-Y134 WeakPolarHBondContact O-CE1 3.33Å; K96-Y134 PolarHBondContact O-OH 3.04Å; K96-M298 HydrophobicContact CB-CE 4.02Å; K96-M298 HydrophobicContact CD-CE 4.44Å; K96-M298 HydrophobicContact CG-CE 4.27Å
97	I	92.2	Very high	91.6	Very high	32 Å²	32	56.2 Å²	56.2	16%	0.164	30%	0.298	C	S	.	.	S	Bend	trans	-105.5	-13.2	176.3	58.9	173	0	0	0	113.6	F86 I90 E142 D143	F86-I97 HydrophobicContact CZ-CG2 4.38Å; I90-I97 HydrophobicContact CD1-CG2 3.61Å; I90-I97 HydrophobicContact CG1-CG2 3.69Å; I90-I97 HydrophobicContact CG2-CD1 4.5Å; I90-I97 HydrophobicContact CG2-CG2 4.5Å; I97-E142 HydrophobicContact CD1-CG 4.46Å; I97-E142 WeakPolarHBondContact O-CA 3.39Å; I97-E142 WeakPolarHBondContact O-CB 3.46Å; I97-E142 PolarHBondContact O-N 3.47Å; I97-D143 PolarHBondContact O-N 3.45Å
98	K	92.3	Very high	91.8	Very high	112 Å²	112	51.5 Å²	51.5	49%	0.487	28%	0.276	S	S	.	.	S	Bend	trans	-140.1	164.5	179.7	67.3	-178.8	-172	-178.9	0	109.8	L100 E142	K98-L100 PolarHBondContact O-N 2.88Å; K98-E142 HydrophobicContact CB-CB 3.93Å; K98-E142 WeakPolarHBondContact CD-OE2 3.27Å
99	D	90.8	Very high	92.2	Very high	126 Å²	126	47.5 Å²	47.5	67%	0.674	26%	0.258	S	S	*	.	S	Bend	trans	52.9	39.4	174.8	-52.1	-46.4	0	0	0	113	T101	D99-T101 PolarHBondContact O-N 3.21Å
100	L	94.4	Very high	92.6	Very high	14 Å²	14	47.5 Å²	47.5	7%	0.073	26%	0.257	C	S	.	.			trans	-69	128.9	175.5	-76.1	162.2	0	0	0	109.3	K96 K98 E104 L105 I108 D143 M146 M298	K96-L100 HydrophobicContact CB-CD2 3.92Å; K96-L100 HydrophobicContact CB-CG 4.46Å; K98-L100 PolarHBondContact O-N 2.88Å; L100-E104 HydrophobicContact CD2-CB 4.17Å; L100-L105 HydrophobicContact CB-CD2 3.87Å; L100-L105 HydrophobicContact CB-CG 3.93Å; L100-L105 HydrophobicContact CD1-CD2 3.87Å; L100-L105 HydrophobicContact CG-CD2 4.47Å; L100-I108 HydrophobicContact CD2-CD1 4.35Å; L100-D143 HydrophobicContact CD1-CB 3.94Å; L100-M146 HydrophobicContact CD1-CB 3.67Å; L100-M146 HydrophobicContact CD1-CG 3.8Å; L100-M298 HydrophobicContact CD2-CE 3.44Å; L100-M298 VanDerWaalsContact CD2-CE 3.44Å
101	T	94.9	Very high	92.9	Very high	66 Å²	66	46.3 Å²	46.3	41%	0.405	25%	0.252	S	S	.	.			trans	-73.2	155.6	177.1	63.7	0	0	0	0	110.8	D99 E104 L105	D99-T101 PolarHBondContact O-N 3.21Å; T101-E104 WeakPolarHBondContact CB-OE2 3.49Å; T101-E104 PolarHBondContact N-OE2 2.73Å; T101-E104 WeakPolarHBondContact O-CB 3.28Å; T101-E104 PolarHBondContact O-N 3.44Å; T101-E104 VanDerWaalsContact O-N 3.08Å; T101-E104 VanDerWaalsContact OG1-CG 3.23Å; T101-E104 WeakPolarHBondContact OG1-CG 3.3Å; T101-E104 PolarHBondContact OG1-N 3.42Å; T101-E104 PolarHBondContact OG1-OE2 2.72Å; T101-L105 PolarHBondContact O-N 3Å
102	S	94.9	Very high	93.2	Very high	30 Å²	30	38.2 Å²	38.2	21%	0.21	22%	0.217	C	C	.	.	H	α-helix	trans	-54.8	-43.6	177.5	-56.3	0	0	0	0	113.1	E104 L105 I106	S102-E104 PolarHBondContact O-N 2.91Å; S102-L105 PolarHBondContact O-N 3.2Å; S102-I106 WeakPolarHBondContact O-CB 3.49Å; S102-I106 VanDerWaalsContact O-CD1 3.29Å; S102-I106 WeakPolarHBondContact O-CD1 3.25Å; S102-I106 WeakPolarHBondContact O-CG1 3.34Å; S102-I106 PolarHBondContact O-N 2.9Å
103	P	95.8	Very high	93.7	Very high	28 Å²	28	33.1 Å²	33.1	18%	0.182	19%	0.19	C	C	.	.	H	α-helix	trans	-60.5	-38.2	174.1	-27.4	38.3	0	0	0	114.6	G107 H281 G282 I283	P103-G107 PolarHBondContact O-N 3.4Å; P103-H281 WeakPolarHBondContact CA-O 3.01Å; P103-H281 WeakPolarHBondContact CB-O 3.39Å; P103-G282 WeakPolarHBondContact O-CA 3.46Å; P103-I283 HydrophobicContact CB-CG2 3.79Å; P103-I283 PolarHBondContact O-N 3.04Å
104	E	95.4	Very high	94.3	Very high	22 Å²	22	30.4 Å²	30.4	10%	0.103	16%	0.162	C	C	.	.	H	α-helix	trans	-64.9	-49.5	176.7	-73.8	164.7	150.9	0	0	110.4	K96 L100 T101 S102 I106 G107 I108 I283 M298	K96-E104 WeakPolarHBondContact CE-OE1 3.29Å; K96-E104 IonicContact NZ-OE1 3.37Å; K96-E104 PolarHBondContact NZ-OE1 3.11Å; K96-E104 IonicContact NZ-OE2 3.91Å; L100-E104 HydrophobicContact CD2-CB 4.17Å; T101-E104 WeakPolarHBondContact CB-OE2 3.49Å; T101-E104 PolarHBondContact N-OE2 2.73Å; T101-E104 WeakPolarHBondContact O-CB 3.28Å; T101-E104 PolarHBondContact O-N 3.44Å; T101-E104 VanDerWaalsContact O-N 3.08Å; T101-E104 VanDerWaalsContact OG1-CG 3.23Å; T101-E104 WeakPolarHBondContact OG1-CG 3.3Å; T101-E104 PolarHBondContact OG1-N 3.42Å; T101-E104 PolarHBondContact OG1-OE2 2.72Å; S102-E104 PolarHBondContact O-N 2.91Å; E104-I106 VanDerWaalsContact C-N 3.34Å; E104-I106 PolarHBondContact O-N 3.05Å; E104-G107 PolarHBondContact O-N 3.1Å; E104-I108 WeakPolarHBondContact O-CD1 3.31Å; E104-I108 VanDerWaalsContact O-CG1 3.24Å; E104-I108 WeakPolarHBondContact O-CG1 3.15Å; E104-I108 PolarHBondContact O-N 3.21Å; E104-I283 HydrophobicContact CB-CD1 4.32Å; E104-I283 HydrophobicContact CG-CD1 3.92Å; E104-I283 HydrophobicContact CG-CG2 4.36Å; E104-M298 HydrophobicContact CG-SD 4.13Å
105	L	96.4	Very high	94.8	Very high	8 Å²	8	27 Å²	27	4%	0.042	14%	0.141	C	C	.	.	H	α-helix	trans	-56	-48.2	176.2	-71.3	173.4	0	0	0	111.6	L100 T101 S102 G107 I108 M109 A145 M146 V233	L100-L105 HydrophobicContact CB-CD2 3.87Å; L100-L105 HydrophobicContact CB-CG 3.93Å; L100-L105 HydrophobicContact CD1-CD2 3.87Å; L100-L105 HydrophobicContact CG-CD2 4.47Å; T101-L105 PolarHBondContact O-N 3Å; S102-L105 PolarHBondContact O-N 3.2Å; L105-G107 PolarHBondContact O-N 3.04Å; L105-I108 PolarHBondContact O-N 2.82Å; L105-M109 HydrophobicContact CB-CE 4.35Å; L105-M109 HydrophobicContact CD2-CE 4.33Å; L105-M109 WeakPolarHBondContact O-CB 3.37Å; L105-M109 WeakPolarHBondContact O-CG 3.18Å; L105-M109 PolarHBondContact O-N 3.04Å; L105-A145 HydrophobicContact CD1-CB 4.29Å; L105-M146 HydrophobicContact CD2-CB 3.87Å; L105-M146 HydrophobicContact CD2-CG 4.49Å; L105-M146 HydrophobicContact CD2-SD 4.2Å; L105-V233 HydrophobicContact CB-CG2 4.19Å; L105-V233 HydrophobicContact CD1-CG1 4.22Å; L105-V233 HydrophobicContact CD1-CG2 4.41Å
106	I	96.9	Very high	95.2	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-58.4	-50	179.9	-69.7	162.2	0	0	0	110.7	S102 E104 I108 M109 D110 A232 V233 H281	S102-I106 WeakPolarHBondContact O-CB 3.49Å; S102-I106 VanDerWaalsContact O-CD1 3.29Å; S102-I106 WeakPolarHBondContact O-CD1 3.25Å; S102-I106 WeakPolarHBondContact O-CG1 3.34Å; S102-I106 PolarHBondContact O-N 2.9Å; E104-I106 VanDerWaalsContact C-N 3.34Å; E104-I106 PolarHBondContact O-N 3.05Å; I106-I108 PolarHBondContact O-N 2.85Å; I106-M109 PolarHBondContact O-N 3.39Å; I106-D110 WeakPolarHBondContact O-CB 3.42Å; I106-D110 VanDerWaalsContact O-CG 3.3Å; I106-D110 PolarHBondContact O-N 2.92Å; I106-A232 HydrophobicContact CD1-CB 3.58Å; I106-A232 HydrophobicContact CG1-CB 4.09Å; I106-V233 HydrophobicContact CD1-CG2 4.17Å; I106-V233 HydrophobicContact CG1-CG2 3.76Å; I106-H281 HydrophobicContact CD1-CB 3.84Å
107	G	95.3	Very high	95.5	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-65.1	-38.4	-178.4	0	0	0	0	0	113	P103 E104 L105 T111	P103-G107 PolarHBondContact O-N 3.4Å; E104-G107 PolarHBondContact O-N 3.1Å; L105-G107 PolarHBondContact O-N 3.04Å; G107-T111 WeakPolarHBondContact O-CB 3.17Å; G107-T111 PolarHBondContact O-N 3.17Å; G107-T111 VanDerWaalsContact O-N 3.14Å; G107-T111 PolarHBondContact O-OG1 2.84Å
108	I	95.7	Very high	95.6	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-67.8	-47.5	177.8	-66.7	161.7	0	0	0	110.1	L100 E104 L105 I106 D110 T111 C112 Y134 M146 M297 M298 F300	L100-I108 HydrophobicContact CD2-CD1 4.35Å; E104-I108 WeakPolarHBondContact O-CD1 3.31Å; E104-I108 VanDerWaalsContact O-CG1 3.24Å; E104-I108 WeakPolarHBondContact O-CG1 3.15Å; E104-I108 PolarHBondContact O-N 3.21Å; L105-I108 PolarHBondContact O-N 2.82Å; I106-I108 PolarHBondContact O-N 2.85Å; I108-D110 PolarHBondContact O-N 2.89Å; I108-T111 PolarHBondContact O-N 3.27Å; I108-C112 PolarHBondContact O-N 3.21Å; I108-Y134 HydrophobicContact CD1-CE2 3.65Å; I108-Y134 HydrophobicContact CG1-CE2 4.3Å; I108-Y134 HydrophobicContact CG2-CD2 4.07Å; I108-Y134 HydrophobicContact CG2-CE2 4.22Å; I108-M146 HydrophobicContact CB-SD 4.48Å; I108-M146 HydrophobicContact CG2-CE 3.77Å; I108-M146 HydrophobicContact CG2-SD 3.77Å; I108-M297 HydrophobicContact CB-CE 4.47Å; I108-M297 HydrophobicContact CG1-CE 3.73Å; I108-M297 VanDerWaalsContact N-CE 3.33Å; I108-M298 HydrophobicContact CD1-CE 4.15Å; I108-F300 HydrophobicContact CG2-CE2 4.18Å
109	M	97.4	Very high	95.7	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-60.8	-45.5	179.7	-70.8	178.2	-176	0	0	112	L105 I106 T111 C112 F113 F149 R236 V237	L105-M109 HydrophobicContact CB-CE 4.35Å; L105-M109 HydrophobicContact CD2-CE 4.33Å; L105-M109 WeakPolarHBondContact O-CB 3.37Å; L105-M109 WeakPolarHBondContact O-CG 3.18Å; L105-M109 PolarHBondContact O-N 3.04Å; I106-M109 PolarHBondContact O-N 3.39Å; M109-T111 VanDerWaalsContact C-N 3.32Å; M109-T111 PolarHBondContact O-N 3.26Å; M109-C112 WeakPolarHBondContact O-CB 3.11Å; M109-C112 PolarHBondContact O-N 3.29Å; M109-F113 WeakPolarHBondContact O-CD2 3.46Å; M109-F113 PolarHBondContact O-N 2.95Å; M109-F149 HydrophobicContact CB-CD2 4.49Å; M109-F149 HydrophobicContact CB-CE1 4.04Å; M109-F149 HydrophobicContact CB-CE2 3.89Å; M109-F149 HydrophobicContact CB-CZ 3.64Å; M109-F149 HydrophobicContact CE-CB 3.94Å; M109-F149 HydrophobicContact CE-CD2 4.18Å; M109-F149 HydrophobicContact CE-CG 3.99Å; M109-F149 HydrophobicContact CG-CD1 3.81Å; M109-F149 HydrophobicContact CG-CD2 3.78Å; M109-F149 HydrophobicContact CG-CE1 3.71Å; M109-F149 HydrophobicContact CG-CE2 3.68Å; M109-F149 HydrophobicContact CG-CG 3.84Å; M109-F149 HydrophobicContact CG-CZ 3.65Å; M109-F149 HydrophobicContact SD-CD2 4.05Å; M109-F149 HydrophobicContact SD-CE2 4.29Å; M109-F149 HydrophobicContact SD-CG 4.35Å; M109-R236 HydrophobicContact CB-CB 4.47Å; M109-R236 HydrophobicContact SD-CB 3.69Å; M109-V237 HydrophobicContact CE-CG2 3.81Å; M109-V237 HydrophobicContact SD-CG2 4.31Å
110	D	96.6	Very high	95.9	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-63	-40	178.2	-73.8	-13.2	0	0	0	111.8	I106 I108 F113 C114 R236 R322	I106-D110 WeakPolarHBondContact O-CB 3.42Å; I106-D110 VanDerWaalsContact O-CG 3.3Å; I106-D110 PolarHBondContact O-N 2.92Å; I108-D110 PolarHBondContact O-N 2.89Å; D110-F113 PolarHBondContact O-N 2.94Å; D110-C114 PolarHBondContact O-N 3.09Å; D110-C114 PolarHBondContact O-SG 3.42Å; D110-R236 IonicContact OD1-CZ 2.74Å; D110-R236 IonicContact OD1-NE 3.06Å; D110-R236 PolarHBondContact OD1-NE 3.49Å; D110-R236 IonicContact OD1-NH2 3.52Å; D110-R236 PolarHBondContact OD1-NH2 2.74Å; D110-R236 IonicContact OD2-CZ 2.81Å; D110-R236 IonicContact OD2-NE 3.42Å; D110-R236 PolarHBondContact OD2-NE 3.48Å; D110-R236 IonicContact OD2-NH2 3.49Å; D110-R236 PolarHBondContact OD2-NH2 3.48Å; D110-R322 HydrophobicContact CB-CG 4.21Å
111	T	95.6	Very high	95.8	Very high	21 Å²	21	14.1 Å²	14.1	13%	0.129	8%	0.079	C	C	.	.	H	α-helix	trans	-68.6	-39.5	178.2	-51.6	0	0	0	0	111	G107 I108 M109 F113 C114 C115 M297 F300	G107-T111 WeakPolarHBondContact O-CB 3.17Å; G107-T111 PolarHBondContact O-N 3.17Å; G107-T111 VanDerWaalsContact O-N 3.14Å; G107-T111 PolarHBondContact O-OG1 2.84Å; I108-T111 PolarHBondContact O-N 3.27Å; M109-T111 VanDerWaalsContact C-N 3.32Å; M109-T111 PolarHBondContact O-N 3.26Å; T111-F113 VanDerWaalsContact C-N 3.32Å; T111-F113 PolarHBondContact O-N 3.25Å; T111-C114 PolarHBondContact O-N 3.14Å; T111-C115 PolarHBondContact O-N 2.81Å; T111-C115 PolarHBondContact O-SG 2.91Å; T111-M297 HydrophobicContact CG2-CB 4.13Å; T111-M297 HydrophobicContact CG2-CG 4.22Å; T111-M297 WeakPolarHBondContact OG1-CG 3.29Å; T111-F300 HydrophobicContact CG2-CD1 3.86Å; T111-F300 HydrophobicContact CG2-CD2 4.07Å; T111-F300 HydrophobicContact CG2-CE1 3.53Å; T111-F300 HydrophobicContact CG2-CE2 3.77Å; T111-F300 HydrophobicContact CG2-CG 4.13Å; T111-F300 HydrophobicContact CG2-CZ 3.5Å; T111-F300 VanDerWaalsContact CG2-CZ 3.5Å
112	C	96.6	Very high	95.6	Very high	3 Å²	3	11.8 Å²	11.8	2%	0.02	7%	0.068	C	C	.	.	H	α-helix	trans	-59.2	-42	171.8	-82.6	0	0	0	0	112.1	I108 M109 C115 L116 C132 F149 F300	I108-C112 PolarHBondContact O-N 3.21Å; M109-C112 WeakPolarHBondContact O-CB 3.11Å; M109-C112 PolarHBondContact O-N 3.29Å; C112-C115 PolarHBondContact O-N 3.07Å; C112-L116 WeakPolarHBondContact O-CB 3.49Å; C112-L116 PolarHBondContact O-N 3.16Å; C112-C132 VanDerWaalsContact SG-SG 3.61Å; C112-F149 HydrophobicContact CB-CE1 3.71Å; C112-F149 HydrophobicContact CB-CZ 3.9Å; C112-F300 HydrophobicContact CB-CZ 4.46Å; C112-F300 VanDerWaalsContact SG-CZ 3.59Å
113	F	97.7	Very high	95.4	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-64.1	-41.3	175	-72.6	-37.3	0	0	0	112.8	M109 D110 T111 L116 I117 F149 I153 R236 F239 T240 M325 F329	M109-F113 WeakPolarHBondContact O-CD2 3.46Å; M109-F113 PolarHBondContact O-N 2.95Å; D110-F113 PolarHBondContact O-N 2.94Å; T111-F113 VanDerWaalsContact C-N 3.32Å; T111-F113 PolarHBondContact O-N 3.25Å; F113-L116 PolarHBondContact O-N 3Å; F113-I117 WeakPolarHBondContact O-CG1 3.32Å; F113-I117 PolarHBondContact O-N 2.84Å; F113-F149 AromaticContact CE1-CE2 3.98Å; F113-F149 HydrophobicContact CE1-CE2 3.98Å; F113-F149 HydrophobicContact CE1-CZ 4.23Å; F113-F149 HydrophobicContact CE2-CE2 4.33Å; F113-F149 AromaticContact CZ-CE2 3.74Å; F113-F149 HydrophobicContact CZ-CE2 3.74Å; F113-F149 HydrophobicContact CZ-CZ 4.26Å; F113-I153 HydrophobicContact CD1-CD1 4.09Å; F113-I153 HydrophobicContact CE1-CD1 3.95Å; F113-R236 HydrophobicContact CE2-CB 4.4Å; F113-R236 HydrophobicContact CE2-CG 4.36Å; F113-F239 HydrophobicContact CE1-CD1 4.34Å; F113-F239 HydrophobicContact CE2-CD1 4.43Å; F113-F239 AromaticContact CZ-CD1 3.9Å; F113-F239 HydrophobicContact CZ-CD1 3.9Å; F113-F239 HydrophobicContact CZ-CE1 4.49Å; F113-T240 WeakPolarHBondContact CZ-OG1 3.27Å; F113-M325 HydrophobicContact CB-CG 3.88Å; F113-M325 HydrophobicContact CB-SD 4.38Å; F113-F329 HydrophobicContact CB-CE2 3.84Å; F113-F329 HydrophobicContact CB-CZ 4.23Å; F113-F329 HydrophobicContact CD1-CE2 4.05Å; F113-F329 AromaticContact CD1-CZ 3.93Å; F113-F329 HydrophobicContact CD1-CZ 3.93Å; F113-F329 HydrophobicContact CD2-CE2 4.43Å; F113-F329 AromaticContact CG-CE2 3.87Å; F113-F329 HydrophobicContact CG-CE2 3.87Å; F113-F329 HydrophobicContact CG-CZ 4.2Å
114	C	96.5	Very high	95.2	Very high	3 Å²	3	12.2 Å²	12.2	2%	0.02	6%	0.064	C	C	.	.	H	α-helix	trans	-61.8	-44	175	-62.5	0	0	0	0	111.2	D110 T111 I117 T118 I319 I320	D110-C114 PolarHBondContact O-N 3.09Å; D110-C114 PolarHBondContact O-SG 3.42Å; T111-C114 PolarHBondContact O-N 3.14Å; C114-I117 PolarHBondContact O-N 2.74Å; C114-T118 WeakPolarHBondContact O-CB 3.45Å; C114-T118 PolarHBondContact O-N 3.1Å; C114-T118 PolarHBondContact O-OG1 3.26Å; C114-I319 HydrophobicContact CB-CG2 3.63Å; C114-I320 HydrophobicContact CB-CG1 3.89Å
115	C	95.9	Very high	95	Very high	1 Å²	1	11.2 Å²	11.2	1%	0.007	6%	0.059	C	C	.	.	H	α-helix	trans	-61.6	-43.3	174.7	-72.6	0	0	0	0	112.5	T111 C112 I117 T118 W119 T128 V129	T111-C115 PolarHBondContact O-N 2.81Å; T111-C115 PolarHBondContact O-SG 2.91Å; C112-C115 PolarHBondContact O-N 3.07Å; C115-I117 VanDerWaalsContact C-N 3.34Å; C115-I117 PolarHBondContact O-N 3.08Å; C115-T118 PolarHBondContact O-N 2.84Å; C115-W119 PolarHBondContact O-N 3.14Å; C115-T128 WeakPolarHBondContact CB-O 3.48Å; C115-T128 PolarHBondContact SG-O 2.71Å; C115-V129 HydrophobicContact CB-CG2 4.28Å
116	L	97.1	Very high	94.7	Very high	2 Å²	2	10.8 Å²	10.8	1%	0.01	6%	0.057	C	C	.	.	H	α-helix	trans	-57.8	-46.7	176.8	174.9	68.8	0	0	0	111.3	C112 F113 W119 L120 V129 I156 F329	C112-L116 WeakPolarHBondContact O-CB 3.49Å; C112-L116 PolarHBondContact O-N 3.16Å; F113-L116 PolarHBondContact O-N 3Å; L116-W119 HydrophobicContact CD1-CE3 3.87Å; L116-W119 HydrophobicContact CD1-CZ3 4.03Å; L116-W119 PolarHBondContact O-N 3.3Å; L116-L120 HydrophobicContact CG-CD1 4.44Å; L116-L120 WeakPolarHBondContact O-CG 3.28Å; L116-L120 PolarHBondContact O-N 3.27Å; L116-L120 VanDerWaalsContact O-N 3.09Å; L116-V129 HydrophobicContact CB-CG2 4.44Å; L116-I156 HydrophobicContact CD1-CG2 4.15Å; L116-I156 HydrophobicContact CD2-CG2 3.91Å; L116-F329 HydrophobicContact CD2-CZ 4.43Å
117	I	96.9	Very high	94.3	Very high	2 Å²	2	13 Å²	13	1%	0.01	7%	0.067	C	C	.	.	H	α-helix	trans	-67.2	-42.6	179.2	-65.7	165.6	0	0	0	110.7	F113 C114 C115 W119 L120 E121 I320 M325 Y328 F329	F113-I117 WeakPolarHBondContact O-CG1 3.32Å; F113-I117 PolarHBondContact O-N 2.84Å; C114-I117 PolarHBondContact O-N 2.74Å; C115-I117 VanDerWaalsContact C-N 3.34Å; C115-I117 PolarHBondContact O-N 3.08Å; I117-W119 PolarHBondContact O-N 3.34Å; I117-L120 PolarHBondContact O-N 3.39Å; I117-E121 HydrophobicContact CG2-CG 4.42Å; I117-E121 WeakPolarHBondContact O-CG 3.46Å; I117-E121 PolarHBondContact O-N 2.69Å; I117-I320 HydrophobicContact CB-CD1 3.69Å; I117-I320 HydrophobicContact CD1-CD1 3.88Å; I117-I320 HydrophobicContact CG1-CD1 4.42Å; I117-I320 HydrophobicContact CG2-CD1 3.49Å; I117-I320 VanDerWaalsContact CG2-CD1 3.49Å; I117-I320 HydrophobicContact CG2-CG1 4.5Å; I117-M325 HydrophobicContact CD1-CB 3.89Å; I117-M325 HydrophobicContact CD1-CG 3.59Å; I117-Y328 HydrophobicContact CB-CD1 4.13Å; I117-Y328 HydrophobicContact CB-CE1 4.28Å; I117-Y328 HydrophobicContact CB-CG 4.48Å; I117-Y328 HydrophobicContact CD1-CD1 3.59Å; I117-Y328 HydrophobicContact CD1-CE1 4.4Å; I117-Y328 HydrophobicContact CD1-CG 4.04Å; I117-Y328 HydrophobicContact CG1-CD1 3.48Å; I117-Y328 VanDerWaalsContact CG1-CD1 3.48Å; I117-Y328 HydrophobicContact CG1-CE1 3.79Å; I117-Y328 HydrophobicContact CG1-CG 4.19Å; I117-Y328 HydrophobicContact CG2-CD1 3.54Å; I117-Y328 HydrophobicContact CG2-CD2 3.7Å; I117-Y328 HydrophobicContact CG2-CE1 3.76Å; I117-Y328 HydrophobicContact CG2-CE2 3.95Å; I117-Y328 HydrophobicContact CG2-CG 3.49Å; I117-Y328 VanDerWaalsContact CG2-CG 3.49Å; I117-F329 HydrophobicContact CD1-CD2 4.06Å; I117-F329 HydrophobicContact CD1-CE1 4.31Å; I117-F329 HydrophobicContact CD1-CE2 3.81Å; I117-F329 HydrophobicContact CD1-CG 4.43Å; I117-F329 HydrophobicContact CD1-CZ 3.92Å; I117-F329 HydrophobicContact CG1-CE1 4.34Å; I117-F329 HydrophobicContact CG1-CZ 4.13Å
118	T	94.9	Very high	94.2	Very high	2 Å²	2	13 Å²	13	1%	0.012	7%	0.067	C	C	.	.	H	α-helix	trans	-59.1	-38.3	178.3	-52	0	0	0	0	111.1	C114 C115 E121 H123 T128 I319 I320	C114-T118 WeakPolarHBondContact O-CB 3.45Å; C114-T118 PolarHBondContact O-N 3.1Å; C114-T118 PolarHBondContact O-OG1 3.26Å; C115-T118 PolarHBondContact O-N 2.84Å; T118-E121 PolarHBondContact O-N 2.82Å; T118-H123 HydrophobicContact CG2-CB 4.11Å; T118-H123 WeakPolarHBondContact CG2-CD2 2.92Å; T118-H123 WeakPolarHBondContact O-CB 3.26Å; T118-H123 PolarHBondContact O-CD2 3.01Å; T118-H123 PolarHBondContact O-N 3.37Å; T118-T128 HydrophobicContact CG2-CG2 3.68Å; T118-I319 HydrophobicContact CG2-CD1 4.09Å; T118-I320 PolarHBondContact OG1-N 3.28Å
119	W	94.8	Very high	94.2	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-64.6	-45.1	171.6	169.1	52.2	0	0	0	113	C115 L116 I117 E121 G122 H123 L125 T128 V129 C157 A160 R161 F175 Q176	C115-W119 PolarHBondContact O-N 3.14Å; L116-W119 HydrophobicContact CD1-CE3 3.87Å; L116-W119 HydrophobicContact CD1-CZ3 4.03Å; L116-W119 PolarHBondContact O-N 3.3Å; I117-W119 PolarHBondContact O-N 3.34Å; W119-E121 PolarHBondContact O-N 3.35Å; W119-E121 VanDerWaalsContact O-N 3.15Å; W119-G122 PolarHBondContact O-N 2.78Å; W119-H123 VanDerWaalsContact CD1-O 3.23Å; W119-L125 HydrophobicContact CD2-CD2 3.55Å; W119-L125 HydrophobicContact CD2-CG 3.99Å; W119-L125 HydrophobicContact CE3-CD2 4.08Å; W119-L125 HydrophobicContact CG-CD2 3.77Å; W119-L125 HydrophobicContact CG-CG 4.04Å; W119-L125 HydrophobicContact CH2-CD2 4.45Å; W119-L125 HydrophobicContact CZ2-CD1 3.82Å; W119-L125 HydrophobicContact CZ2-CD2 3.96Å; W119-L125 HydrophobicContact CZ2-CG 3.97Å; W119-T128 WeakPolarHBondContact CB-OG1 3.18Å; W119-V129 HydrophobicContact CB-CG2 4.18Å; W119-C157 HydrophobicContact CH2-CB 4.14Å; W119-C157 VanDerWaalsContact CH2-O 3.3Å; W119-C157 WeakPolarHBondContact CH2-O 3.29Å; W119-C157 HydrophobicContact CZ3-CB 3.96Å; W119-A160 HydrophobicContact CH2-CB 4.17Å; W119-A160 HydrophobicContact CZ3-CB 4.13Å; W119-R161 HydrophobicContact CH2-CB 4.01Å; W119-R161 HydrophobicContact CZ2-CB 4.1Å; W119-F175 HydrophobicContact CD2-CE2 4.05Å; W119-F175 AromaticContact CE2-CE2 3.38Å; W119-F175 AromaticContact CE2-CZ 3.6Å; W119-F175 HydrophobicContact CH2-CE2 4.11Å; W119-F175 AromaticContact CH2-CZ 3.89Å; W119-F175 HydrophobicContact CH2-CZ 3.89Å; W119-F175 HydrophobicContact CZ2-CE1 4.36Å; W119-F175 AromaticContact CZ2-CE2 3.49Å; W119-F175 HydrophobicContact CZ2-CE2 3.49Å; W119-F175 VanDerWaalsContact CZ2-CE2 3.49Å; W119-F175 AromaticContact CZ2-CZ 3.22Å; W119-F175 HydrophobicContact CZ2-CZ 3.22Å; W119-F175 AromaticContact NE1-CE2 3.47Å; W119-F175 AromaticContact NE1-CZ 3.81Å; W119-Q176 PolarHBondContact NE1-O 2.85Å
120	L	94.6	Very high	94.1	Very high	5 Å²	5	13.2 Å²	13.2	3%	0.026	7%	0.069	C	C	.	.	H	α-helix	trans	-63.7	-17.4	178.5	-69.5	175.9	0	0	0	113.5	L116 I117 A160 F175 V365 L366	L116-L120 HydrophobicContact CG-CD1 4.44Å; L116-L120 WeakPolarHBondContact O-CG 3.28Å; L116-L120 PolarHBondContact O-N 3.27Å; L116-L120 VanDerWaalsContact O-N 3.09Å; I117-L120 PolarHBondContact O-N 3.39Å; L120-A160 HydrophobicContact CD2-CB 4.4Å; L120-F175 HydrophobicContact CD2-CE2 4.21Å; L120-V365 VanDerWaalsContact O-CG1 3.25Å; L120-V365 WeakPolarHBondContact O-CG1 3.5Å; L120-L366 HydrophobicContact CD1-CD2 4.1Å; L120-L366 HydrophobicContact CD2-CB 4.24Å; L120-L366 HydrophobicContact CD2-CD2 4.45Å
121	E	92.1	Very high	93.9	Very high	104 Å²	104	13.5 Å²	13.5	49%	0.486	7%	0.071	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	15.8	175.7	-67.2	-67.9	124.4	0	0	113.2	I117 T118 W119 Y328	I117-E121 HydrophobicContact CG2-CG 4.42Å; I117-E121 WeakPolarHBondContact O-CG 3.46Å; I117-E121 PolarHBondContact O-N 2.69Å; T118-E121 PolarHBondContact O-N 2.82Å; W119-E121 PolarHBondContact O-N 3.35Å; W119-E121 VanDerWaalsContact O-N 3.15Å; E121-Y328 HydrophobicContact CG-CE2 4.25Å; E121-Y328 WeakPolarHBondContact OE1-CE2 3.41Å
122	G	90.6	Very high	93.8	Very high	16 Å²	16	12.5 Å²	12.5	17%	0.165	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	109.1	-7.4	167.1	0	0	0	0	0	116.1	W119 D174	W119-G122 PolarHBondContact O-N 2.78Å; G122-D174 VanDerWaalsContact CA-O 3.3Å; G122-D174 WeakPolarHBondContact CA-O 3.37Å; G122-D174 PolarHBondContact N-O 2.84Å
123	H	90.9	Very high	93.7	Very high	67 Å²	67	12.7 Å²	12.7	31%	0.31	7%	0.065	S	C	.	.			trans	-74.9	162	176.6	-69.1	-79.5	0	0	0	112.4	T118 W119 T128 A317	T118-H123 HydrophobicContact CG2-CB 4.11Å; T118-H123 WeakPolarHBondContact CG2-CD2 2.92Å; T118-H123 WeakPolarHBondContact O-CB 3.26Å; T118-H123 PolarHBondContact O-CD2 3.01Å; T118-H123 PolarHBondContact O-N 3.37Å; W119-H123 VanDerWaalsContact CD1-O 3.23Å; H123-T128 HydrophobicContact CB-CG2 3.69Å; H123-A317 HydrophobicContact CB-CB 4.14Å
124	S	90.6	Very high	93.5	Very high	1 Å²	1	12.7 Å²	12.7	1%	0.007	7%	0.065	C	C	.	.			trans	-72.6	146.4	179.1	74.8	0	0	0	0	112.7	A126 Q127 T128 Y180	S124-A126 PolarHBondContact O-N 3.26Å; S124-Q127 PolarHBondContact O-N 3.43Å; S124-Q127 WeakPolarHBondContact OG-CB 3.13Å; S124-Q127 WeakPolarHBondContact OG-CG 3.46Å; S124-Q127 PolarHBondContact OG-N 3.3Å; S124-Q127 PolarHBondContact OG-OE1 3.27Å; S124-T128 WeakPolarHBondContact O-CG2 3.22Å; S124-T128 PolarHBondContact O-N 2.8Å; S124-T128 PolarHBondContact O-OG1 3Å; S124-Y180 WeakPolarHBondContact CB-OH 3.29Å
125	L	91.6	Very high	93.4	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.065	C	C	.	.	G	3₁₀ helix	trans	-57.1	-39.5	172.6	-89.9	168.8	0	0	0	112.4	W119 Q127 T128 V129 F130 T179 M184	W119-L125 HydrophobicContact CD2-CD2 3.55Å; W119-L125 HydrophobicContact CD2-CG 3.99Å; W119-L125 HydrophobicContact CE3-CD2 4.08Å; W119-L125 HydrophobicContact CG-CD2 3.77Å; W119-L125 HydrophobicContact CG-CG 4.04Å; W119-L125 HydrophobicContact CH2-CD2 4.45Å; W119-L125 HydrophobicContact CZ2-CD1 3.82Å; W119-L125 HydrophobicContact CZ2-CD2 3.96Å; W119-L125 HydrophobicContact CZ2-CG 3.97Å; L125-Q127 VanDerWaalsContact C-N 3.3Å; L125-Q127 PolarHBondContact O-N 3.11Å; L125-T128 PolarHBondContact O-N 2.83Å; L125-V129 HydrophobicContact CD2-CB 3.97Å; L125-V129 HydrophobicContact CD2-CG2 4.11Å; L125-V129 PolarHBondContact O-N 3.21Å; L125-F130 HydrophobicContact CB-CD2 3.81Å; L125-F130 HydrophobicContact CB-CE2 3.96Å; L125-F130 HydrophobicContact CD1-CE2 4.24Å; L125-F130 HydrophobicContact CD2-CD2 4.38Å; L125-F130 HydrophobicContact CD2-CE2 4.09Å; L125-F130 HydrophobicContact CG-CE2 4.3Å; L125-F130 PolarHBondContact O-N 3.21Å; L125-T179 HydrophobicContact CD1-CG2 4.43Å; L125-M184 HydrophobicContact CD1-CE 3.78Å
126	A	90.6	Very high	93.2	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.076	C	C	.	.	G	3₁₀ helix	trans	-62.1	-34.6	-179	0	0	0	0	0	112.9	S124 Y180 N305 L309	S124-A126 PolarHBondContact O-N 3.26Å; A126-Y180 HydrophobicContact CB-CD1 4.4Å; A126-Y180 HydrophobicContact CB-CD2 3.67Å; A126-Y180 HydrophobicContact CB-CE1 4.5Å; A126-Y180 HydrophobicContact CB-CE2 3.81Å; A126-Y180 HydrophobicContact CB-CG 3.97Å; A126-N305 HydrophobicContact CB-CB 3.99Å; A126-N305 PolarHBondContact O-ND2 2.8Å; A126-L309 HydrophobicContact CB-CD2 3.8Å
127	Q	89.1	Confident	92.8	Very high	45 Å²	45	17.4 Å²	17.4	21%	0.21	9%	0.088	C	C	.	.	G	3₁₀ helix	trans	-95.5	-1.4	-177.6	-63.2	173.5	-56.6	0	0	113.8	S124 L125 T131 L309 R315 A317	S124-Q127 PolarHBondContact O-N 3.43Å; S124-Q127 WeakPolarHBondContact OG-CB 3.13Å; S124-Q127 WeakPolarHBondContact OG-CG 3.46Å; S124-Q127 PolarHBondContact OG-N 3.3Å; S124-Q127 PolarHBondContact OG-OE1 3.27Å; L125-Q127 VanDerWaalsContact C-N 3.3Å; L125-Q127 PolarHBondContact O-N 3.11Å; Q127-T131 VanDerWaalsContact C-CG2 3.47Å; Q127-T131 WeakPolarHBondContact O-CG2 3.4Å; Q127-L309 HydrophobicContact CG-CD1 3.79Å; Q127-L309 HydrophobicContact CG-CD2 3.75Å; Q127-L309 HydrophobicContact CG-CG 4.4Å; Q127-L309 VanDerWaalsContact NE2-CD1 3.33Å; Q127-R315 PolarHBondContact NE2-O 3.33Å; Q127-A317 HydrophobicContact CB-CB 3.95Å
128	T	93.4	Very high	92.6	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126	-89.3	-175.6	54.6	0	0	0	0	111	C115 T118 W119 H123 S124 L125 F130 T131 A317 I319	C115-T128 WeakPolarHBondContact CB-O 3.48Å; C115-T128 PolarHBondContact SG-O 2.71Å; T118-T128 HydrophobicContact CG2-CG2 3.68Å; W119-T128 WeakPolarHBondContact CB-OG1 3.18Å; H123-T128 HydrophobicContact CB-CG2 3.69Å; S124-T128 WeakPolarHBondContact O-CG2 3.22Å; S124-T128 PolarHBondContact O-N 2.8Å; S124-T128 PolarHBondContact O-OG1 3Å; L125-T128 PolarHBondContact O-N 2.83Å; T128-F130 PolarHBondContact O-N 3.45Å; T128-T131 PolarHBondContact O-N 3.35Å; T128-T131 PolarHBondContact O-OG1 3.41Å; T128-A317 HydrophobicContact CG2-CB 3.8Å; T128-I319 HydrophobicContact CG2-CD1 3.98Å
129	V	94.9	Very high	92.3	Very high	4 Å²	4	22.8 Å²	22.8	2%	0.024	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-62.9	-44.8	-174	176.5	0	0	0	0	110.7	C115 L116 W119 L125 T131 C132 I135 I153	C115-V129 HydrophobicContact CB-CG2 4.28Å; L116-V129 HydrophobicContact CB-CG2 4.44Å; W119-V129 HydrophobicContact CB-CG2 4.18Å; L125-V129 HydrophobicContact CD2-CB 3.97Å; L125-V129 HydrophobicContact CD2-CG2 4.11Å; L125-V129 PolarHBondContact O-N 3.21Å; V129-T131 PolarHBondContact O-N 3.47Å; V129-C132 WeakPolarHBondContact O-CB 3.33Å; V129-C132 PolarHBondContact O-N 3.44Å; V129-C132 VanDerWaalsContact O-N 3.11Å; V129-I135 HydrophobicContact CB-CD1 4.49Å; V129-I135 HydrophobicContact CG1-CD1 3.38Å; V129-I135 WeakPolarHBondContact O-CD1 3.5Å; V129-I153 HydrophobicContact CG1-CG2 4.16Å
130	F	94.1	Very high	92.1	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.009	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-79.6	9.5	-180	-66.9	-65.8	0	0	0	114.7	L125 T128 I135 H136 L154 F182 M184 N305	L125-F130 HydrophobicContact CB-CD2 3.81Å; L125-F130 HydrophobicContact CB-CE2 3.96Å; L125-F130 HydrophobicContact CD1-CE2 4.24Å; L125-F130 HydrophobicContact CD2-CD2 4.38Å; L125-F130 HydrophobicContact CD2-CE2 4.09Å; L125-F130 HydrophobicContact CG-CE2 4.3Å; L125-F130 PolarHBondContact O-N 3.21Å; T128-F130 PolarHBondContact O-N 3.45Å; F130-I135 HydrophobicContact CD1-CD1 3.64Å; F130-I135 HydrophobicContact CD1-CG1 4.12Å; F130-I135 HydrophobicContact CE1-CD1 3.89Å; F130-I135 HydrophobicContact CE1-CG1 4.45Å; F130-I135 HydrophobicContact CG-CD1 4.4Å; F130-H136 PolarHBondContact O-CE1 3.33Å; F130-H136 PolarHBondContact O-NE2 3.42Å; F130-L154 HydrophobicContact CE1-CD2 3.88Å; F130-L154 HydrophobicContact CZ-CD2 4.27Å; F130-F182 HydrophobicContact CB-CD2 4.12Å; F130-F182 HydrophobicContact CB-CE1 4.38Å; F130-F182 HydrophobicContact CB-CE2 3.86Å; F130-F182 HydrophobicContact CB-CZ 4.02Å; F130-F182 HydrophobicContact CD1-CB 4.09Å; F130-F182 AromaticContact CD1-CD1 3.7Å; F130-F182 HydrophobicContact CD1-CD1 3.7Å; F130-F182 HydrophobicContact CD1-CD2 4.03Å; F130-F182 HydrophobicContact CD1-CE1 4.16Å; F130-F182 HydrophobicContact CD1-CE2 4.47Å; F130-F182 AromaticContact CD1-CG 3.66Å; F130-F182 HydrophobicContact CD1-CG 3.66Å; F130-F182 HydrophobicContact CD2-CB 4.13Å; F130-F182 AromaticContact CD2-CD2 3.38Å; F130-F182 HydrophobicContact CD2-CD2 3.38Å; F130-F182 AromaticContact CD2-CE2 3.95Å; F130-F182 HydrophobicContact CD2-CE2 3.95Å; F130-F182 AromaticContact CD2-CG 3.77Å; F130-F182 HydrophobicContact CD2-CG 3.77Å; F130-F182 HydrophobicContact CE1-CB 3.55Å; F130-F182 AromaticContact CE1-CD1 3.92Å; F130-F182 HydrophobicContact CE1-CD1 3.92Å; F130-F182 HydrophobicContact CE1-CD2 4.31Å; F130-F182 AromaticContact CE1-CG 3.67Å; F130-F182 HydrophobicContact CE1-CG 3.67Å; F130-F182 HydrophobicContact CE2-CB 3.59Å; F130-F182 AromaticContact CE2-CD2 3.71Å; F130-F182 HydrophobicContact CE2-CD2 3.71Å; F130-F182 AromaticContact CE2-CG 3.77Å; F130-F182 HydrophobicContact CE2-CG 3.77Å; F130-F182 HydrophobicContact CG-CB 4.38Å; F130-F182 HydrophobicContact CG-CD1 4.06Å; F130-F182 AromaticContact CG-CD2 3.58Å; F130-F182 HydrophobicContact CG-CD2 3.58Å; F130-F182 HydrophobicContact CG-CE1 4.29Å; F130-F182 AromaticContact CG-CE2 3.85Å; F130-F182 HydrophobicContact CG-CE2 3.85Å; F130-F182 AromaticContact CG-CG 3.74Å; F130-F182 HydrophobicContact CG-CG 3.74Å; F130-F182 HydrophobicContact CG-CZ 4.22Å; F130-F182 HydrophobicContact CZ-CB 3.28Å; F130-F182 HydrophobicContact CZ-CD1 4.44Å; F130-F182 HydrophobicContact CZ-CD2 4.17Å; F130-F182 AromaticContact CZ-CG 3.74Å; F130-F182 HydrophobicContact CZ-CG 3.74Å; F130-M184 HydrophobicContact CE2-CE 3.78Å; F130-M184 HydrophobicContact CE2-SD 4.48Å; F130-M184 HydrophobicContact CZ-CE 3.65Å; F130-M184 HydrophobicContact CZ-SD 3.79Å; F130-N305 WeakPolarHBondContact CB-ND2 3.4Å; F130-N305 PolarHBondContact O-ND2 3.49Å
131	T	92.6	Very high	92.1	Very high	6 Å²	6	27.6 Å²	27.6	4%	0.037	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-74.3	-21.6	160.7	66.3	0	0	0	0	110.8	Q127 T128 V129 L133 F300 E301	Q127-T131 VanDerWaalsContact C-CG2 3.47Å; Q127-T131 WeakPolarHBondContact O-CG2 3.4Å; T128-T131 PolarHBondContact O-N 3.35Å; T128-T131 PolarHBondContact O-OG1 3.41Å; V129-T131 PolarHBondContact O-N 3.47Å; T131-L133 PolarHBondContact O-N 2.82Å; T131-F300 CarbonylContact O-C 3.6Å; T131-F300 VanDerWaalsContact O-CA 3.29Å; T131-F300 WeakPolarHBondContact O-CA 3.47Å; T131-E301 PolarHBondContact O-N 3.01Å
132	C	94.4	Very high	92.3	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.142	C	C	.	.	B	Isolated β-bridge	trans	-71.9	116.9	172.8	-177.4	0	0	0	0	110.3	C112 V129 I135 H136 F300	C112-C132 VanDerWaalsContact SG-SG 3.61Å; V129-C132 WeakPolarHBondContact O-CB 3.33Å; V129-C132 PolarHBondContact O-N 3.44Å; V129-C132 VanDerWaalsContact O-N 3.11Å; C132-I135 HydrophobicContact CB-CD1 4.39Å; C132-I135 HydrophobicContact CB-CG1 4.09Å; C132-I135 WeakPolarHBondContact O-CG1 3.29Å; C132-H136 PolarHBondContact O-CD2 3.4Å; C132-H136 VanDerWaalsContact O-CD2 3.26Å; C132-H136 PolarHBondContact O-NE2 3.11Å; C132-F300 HydrophobicContact CB-CD1 3.97Å; C132-F300 HydrophobicContact CB-CE1 3.57Å; C132-F300 HydrophobicContact CB-CE2 4.5Å; C132-F300 HydrophobicContact CB-CZ 3.86Å
133	L	93.8	Very high	92.5	Very high	6 Å²	6	28.6 Å²	28.6	3%	0.031	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-73.5	-29	-177.4	-62.5	179.2	0	0	0	112.1	F86 A89 I95 T131 I135 H136 G299 E301 V304	F86-L133 HydrophobicContact CB-CB 4.13Å; F86-L133 HydrophobicContact CD2-CB 3.81Å; F86-L133 VanDerWaalsContact CD2-O 3.24Å; F86-L133 WeakPolarHBondContact CD2-O 3.25Å; F86-L133 HydrophobicContact CG-CB 4.42Å; F86-L133 WeakPolarHBondContact CG-O 3.42Å; A89-L133 HydrophobicContact CB-CD1 4.15Å; I95-L133 HydrophobicContact CD1-CB 3.82Å; I95-L133 HydrophobicContact CD1-CD1 3.54Å; I95-L133 HydrophobicContact CD1-CG 4.25Å; T131-L133 PolarHBondContact O-N 2.82Å; L133-I135 VanDerWaalsContact C-N 3.26Å; L133-I135 PolarHBondContact O-N 2.94Å; L133-H136 WeakPolarHBondContact O-CB 3.42Å; L133-H136 PolarHBondContact O-N 3.32Å; L133-H136 VanDerWaalsContact O-N 3.14Å; L133-G299 PolarHBondContact N-O 3.32Å; L133-E301 HydrophobicContact CD1-CB 4.11Å; L133-E301 HydrophobicContact CD2-CB 4.35Å; L133-E301 HydrophobicContact CG-CB 4.34Å; L133-V304 HydrophobicContact CD2-CB 4.26Å; L133-V304 HydrophobicContact CD2-CG1 4.22Å; L133-V304 HydrophobicContact CD2-CG2 3.86Å
134	Y	94.1	Very high	92.7	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-58.4	-35	178.2	-70.9	-72.5	0	0	0	113.4	F86 I95 K96 I108 H136 I141 M146 M298	F86-Y134 HydrophobicContact CE2-CD1 4.01Å; F86-Y134 HydrophobicContact CE2-CE1 4.49Å; I95-Y134 HydrophobicContact CG2-CE1 3.7Å; I95-Y134 HydrophobicContact CG2-CE2 4.46Å; K96-Y134 VanDerWaalsContact O-CE1 3.27Å; K96-Y134 WeakPolarHBondContact O-CE1 3.33Å; K96-Y134 PolarHBondContact O-OH 3.04Å; I108-Y134 HydrophobicContact CD1-CE2 3.65Å; I108-Y134 HydrophobicContact CG1-CE2 4.3Å; I108-Y134 HydrophobicContact CG2-CD2 4.07Å; I108-Y134 HydrophobicContact CG2-CE2 4.22Å; Y134-H136 VanDerWaalsContact C-N 3.32Å; Y134-I141 HydrophobicContact CD1-CD1 4.05Å; Y134-I141 HydrophobicContact CD1-CG1 4.28Å; Y134-I141 WeakPolarHBondContact O-CD1 3.19Å; Y134-M146 HydrophobicContact CD1-CG 4.12Å; Y134-M146 HydrophobicContact CD2-CE 4.3Å; Y134-M146 HydrophobicContact CE1-CG 4.36Å; Y134-M146 HydrophobicContact CG-CE 4.08Å; Y134-M146 HydrophobicContact CG-CG 4.4Å; Y134-M298 WeakPolarHBondContact OH-CE 3.49Å
135	I	93.3	Very high	93	Very high	3 Å²	3	29.8 Å²	29.8	2%	0.015	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-83.1	-9.1	-177.4	65	165.4	0	0	0	113	V129 F130 C132 L133 A150 L154	V129-I135 HydrophobicContact CB-CD1 4.49Å; V129-I135 HydrophobicContact CG1-CD1 3.38Å; V129-I135 WeakPolarHBondContact O-CD1 3.5Å; F130-I135 HydrophobicContact CD1-CD1 3.64Å; F130-I135 HydrophobicContact CD1-CG1 4.12Å; F130-I135 HydrophobicContact CE1-CD1 3.89Å; F130-I135 HydrophobicContact CE1-CG1 4.45Å; F130-I135 HydrophobicContact CG-CD1 4.4Å; C132-I135 HydrophobicContact CB-CD1 4.39Å; C132-I135 HydrophobicContact CB-CG1 4.09Å; C132-I135 WeakPolarHBondContact O-CG1 3.29Å; L133-I135 VanDerWaalsContact C-N 3.26Å; L133-I135 PolarHBondContact O-N 2.94Å; I135-A150 HydrophobicContact CG2-CB 3.99Å; I135-L154 HydrophobicContact CB-CD1 4.36Å; I135-L154 HydrophobicContact CB-CD2 4.07Å; I135-L154 HydrophobicContact CB-CG 4.12Å; I135-L154 HydrophobicContact CD1-CD2 4.24Å
136	H	91.8	Very high	93.2	Very high	54 Å²	54	29.8 Å²	29.8	25%	0.25	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-39.4	177.5	-70.3	-167.1	0	0	0	111.3	F130 C132 L133 Y134	F130-H136 PolarHBondContact O-CE1 3.33Å; F130-H136 PolarHBondContact O-NE2 3.42Å; C132-H136 PolarHBondContact O-CD2 3.4Å; C132-H136 VanDerWaalsContact O-CD2 3.26Å; C132-H136 PolarHBondContact O-NE2 3.11Å; L133-H136 WeakPolarHBondContact O-CB 3.42Å; L133-H136 PolarHBondContact O-N 3.32Å; L133-H136 VanDerWaalsContact O-N 3.14Å; Y134-H136 VanDerWaalsContact C-N 3.32Å
137	N	89.6	Confident	93.5	Very high	48 Å²	48	32.3 Å²	32.3	26%	0.257	17%	0.165	S	C	.	.			trans	-144.7	75.4	-179.5	-153.3	-18.3	0	0	0	112.5	F86 D139 F140	F86-N137 HydrophobicContact CD1-CB 3.87Å; F86-N137 HydrophobicContact CE1-CB 4.04Å; F86-N137 WeakPolarHBondContact CE1-O 3.48Å; N137-D139 PolarHBondContact O-N 3.48Å; N137-D139 VanDerWaalsContact O-N 3.08Å; N137-F140 HydrophobicContact CB-CD2 4.19Å; N137-F140 VanDerWaalsContact CG-CD2 3.46Å; N137-F140 WeakPolarHBondContact ND2-CD2 3.42Å; N137-F140 WeakPolarHBondContact ND2-CE2 3.24Å; N137-F140 PolarHBondContact O-N 3.06Å
138	P	91.8	Very high	93.9	Very high	13 Å²	13	30.2 Å²	30.2	8%	0.084	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-61.8	-18.4	-176.2	-23.4	34.1	0	0	0	114.7	F140 I141 K147 A150 L151 L154	P138-F140 VanDerWaalsContact C-N 3.29Å; P138-F140 PolarHBondContact O-N 3.11Å; P138-I141 HydrophobicContact CB-CD1 4.35Å; P138-I141 WeakPolarHBondContact O-CB 3.48Å; P138-I141 PolarHBondContact O-N 3.39Å; P138-I141 VanDerWaalsContact O-N 3.17Å; P138-K147 VanDerWaalsContact O-CE 3.28Å; P138-K147 WeakPolarHBondContact O-CE 3.47Å; P138-A150 HydrophobicContact CB-CB 4.48Å; P138-L151 HydrophobicContact CB-CD2 3.85Å; P138-L151 HydrophobicContact CB-CG 4.09Å; P138-L151 HydrophobicContact CG-CD2 4.04Å; P138-L154 HydrophobicContact CG-CD1 3.72Å
139	D	89.8	Confident	94.1	Very high	105 Å²	105	30.2 Å²	30.2	56%	0.561	16%	0.155	S	C	*	.	G	3₁₀ helix	trans	-65.1	-32.9	-176.4	-71.9	-32.6	0	0	0	112.6	N137 I141 K147	N137-D139 PolarHBondContact O-N 3.48Å; N137-D139 VanDerWaalsContact O-N 3.08Å; D139-I141 VanDerWaalsContact C-N 3.3Å; D139-I141 PolarHBondContact O-N 3.43Å; D139-K147 PolarHBondContact O-NZ 2.94Å
140	F	91.2	Very high	94.2	Very high	104 Å²	104	30 Å²	30	46%	0.456	15%	0.154	S	C	.	.	G	3₁₀ helix	trans	-79.3	-7.2	177	-73.8	-90.4	0	0	0	114	F86 N137 P138 E142	F86-F140 HydrophobicContact CE1-CB 3.92Å; N137-F140 HydrophobicContact CB-CD2 4.19Å; N137-F140 VanDerWaalsContact CG-CD2 3.46Å; N137-F140 WeakPolarHBondContact ND2-CD2 3.42Å; N137-F140 WeakPolarHBondContact ND2-CE2 3.24Å; N137-F140 PolarHBondContact O-N 3.06Å; P138-F140 VanDerWaalsContact C-N 3.29Å; P138-F140 PolarHBondContact O-N 3.11Å; F140-E142 PolarHBondContact O-N 3.42Å
141	I	94.4	Very high	94.4	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.01	16%	0.156	C	C	.	.			trans	-75.5	124.1	175.3	-53.5	174.4	0	0	0	108.3	F86 Y134 P138 D139 D143 M146 K147 A150	F86-I141 HydrophobicContact CZ-CG1 4.3Å; Y134-I141 HydrophobicContact CD1-CD1 4.05Å; Y134-I141 HydrophobicContact CD1-CG1 4.28Å; Y134-I141 WeakPolarHBondContact O-CD1 3.19Å; P138-I141 HydrophobicContact CB-CD1 4.35Å; P138-I141 WeakPolarHBondContact O-CB 3.48Å; P138-I141 PolarHBondContact O-N 3.39Å; P138-I141 VanDerWaalsContact O-N 3.17Å; D139-I141 VanDerWaalsContact C-N 3.3Å; D139-I141 PolarHBondContact O-N 3.43Å; I141-D143 HydrophobicContact CG2-CB 4.4Å; I141-M146 HydrophobicContact CD1-CG 4.47Å; I141-M146 HydrophobicContact CG2-CB 4Å; I141-M146 HydrophobicContact CG2-CG 4.23Å; I141-K147 HydrophobicContact CB-CB 4.02Å; I141-K147 HydrophobicContact CB-CG 4.35Å; I141-K147 HydrophobicContact CG2-CB 3.91Å; I141-K147 WeakPolarHBondContact O-CD 3.23Å; I141-K147 PolarHBondContact O-NZ 2.86Å; I141-K147 VanDerWaalsContact O-NZ 3.07Å; I141-A150 HydrophobicContact CD1-CB 3.95Å
142	E	95.1	Very high	94.6	Very high	118 Å²	118	30 Å²	30	55%	0.551	15%	0.154	S	C	*	.			trans	-93.7	-33.5	177.6	-66	179.9	-161	0	0	111.6	I97 K98 F140 P144	I97-E142 HydrophobicContact CD1-CG 4.46Å; I97-E142 WeakPolarHBondContact O-CA 3.39Å; I97-E142 WeakPolarHBondContact O-CB 3.46Å; I97-E142 PolarHBondContact O-N 3.47Å; K98-E142 HydrophobicContact CB-CB 3.93Å; K98-E142 WeakPolarHBondContact CD-OE2 3.27Å; F140-E142 PolarHBondContact O-N 3.42Å; E142-P144 VanDerWaalsContact O-CD 3.29Å; E142-P144 WeakPolarHBondContact O-CD 3.36Å
143	D	96	Very high	94.8	Very high	22 Å²	22	30 Å²	30	12%	0.118	15%	0.154	C	C	.	.			trans	-62.2	117.8	174.6	-176.3	-88.7	0	0	0	111.3	I97 L100 I141 A145 M146 K147	I97-D143 PolarHBondContact O-N 3.45Å; L100-D143 HydrophobicContact CD1-CB 3.94Å; I141-D143 HydrophobicContact CG2-CB 4.4Å; D143-A145 VanDerWaalsContact C-N 3.33Å; D143-A145 PolarHBondContact O-N 2.97Å; D143-A145 WeakPolarHBondContact OD1-CB 3.41Å; D143-A145 PolarHBondContact OD1-N 2.95Å; D143-M146 HydrophobicContact CB-CB 4.1Å; D143-M146 PolarHBondContact O-N 2.81Å; D143-M146 WeakPolarHBondContact OD1-CB 3.24Å; D143-M146 PolarHBondContact OD1-N 3.46Å; D143-K147 WeakPolarHBondContact O-CB 3.46Å; D143-K147 PolarHBondContact O-N 3.06Å
144	P	95.4	Very high	95	Very high	89 Å²	89	29.9 Å²	29.9	58%	0.578	15%	0.153	S	C	*	.	H	α-helix	trans	-63.2	-37	-174	-24.4	34.4	0	0	0	113.5	E142 A148 V200	E142-P144 VanDerWaalsContact O-CD 3.29Å; E142-P144 WeakPolarHBondContact O-CD 3.36Å; P144-A148 WeakPolarHBondContact O-CB 3.02Å; P144-A148 PolarHBondContact O-N 3.34Å; P144-V200 HydrophobicContact CB-CG2 4.3Å
145	A	96.1	Very high	95.1	Very high	5 Å²	5	30.5 Å²	30.5	4%	0.041	16%	0.156	C	C	.	.	H	α-helix	trans	-70.3	-46.7	-177.3	0	0	0	0	0	110.9	L105 D143 F149 V200	L105-A145 HydrophobicContact CD1-CB 4.29Å; D143-A145 VanDerWaalsContact C-N 3.33Å; D143-A145 PolarHBondContact O-N 2.97Å; D143-A145 WeakPolarHBondContact OD1-CB 3.41Å; D143-A145 PolarHBondContact OD1-N 2.95Å; A145-F149 VanDerWaalsContact O-CB 3.24Å; A145-F149 WeakPolarHBondContact O-CB 3.49Å; A145-F149 PolarHBondContact O-N 2.82Å; A145-V200 HydrophobicContact CB-CG1 3.67Å
146	M	96.6	Very high	95.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-65.1	-40.6	177	-167.7	60.7	-128.8	0	0	111.6	L100 L105 I108 Y134 I141 D143 F149 A150	L100-M146 HydrophobicContact CD1-CB 3.67Å; L100-M146 HydrophobicContact CD1-CG 3.8Å; L105-M146 HydrophobicContact CD2-CB 3.87Å; L105-M146 HydrophobicContact CD2-CG 4.49Å; L105-M146 HydrophobicContact CD2-SD 4.2Å; I108-M146 HydrophobicContact CB-SD 4.48Å; I108-M146 HydrophobicContact CG2-CE 3.77Å; I108-M146 HydrophobicContact CG2-SD 3.77Å; Y134-M146 HydrophobicContact CD1-CG 4.12Å; Y134-M146 HydrophobicContact CD2-CE 4.3Å; Y134-M146 HydrophobicContact CE1-CG 4.36Å; Y134-M146 HydrophobicContact CG-CE 4.08Å; Y134-M146 HydrophobicContact CG-CG 4.4Å; I141-M146 HydrophobicContact CD1-CG 4.47Å; I141-M146 HydrophobicContact CG2-CB 4Å; I141-M146 HydrophobicContact CG2-CG 4.23Å; D143-M146 HydrophobicContact CB-CB 4.1Å; D143-M146 PolarHBondContact O-N 2.81Å; D143-M146 WeakPolarHBondContact OD1-CB 3.24Å; D143-M146 PolarHBondContact OD1-N 3.46Å; M146-F149 HydrophobicContact CE-CD1 3.77Å; M146-F149 HydrophobicContact CE-CE1 4.44Å; M146-F149 PolarHBondContact O-N 2.81Å; M146-A150 HydrophobicContact CE-CB 4.23Å; M146-A150 VanDerWaalsContact O-CB 3.27Å; M146-A150 WeakPolarHBondContact O-CB 3.35Å; M146-A150 PolarHBondContact O-N 3.28Å
147	K	96.7	Very high	95.6	Very high	53 Å²	53	28 Å²	28	23%	0.23	14%	0.144	C	C	.	.	H	α-helix	trans	-62.3	-50.3	177.1	-172.1	176.5	-154	139.6	0	112.1	P138 D139 I141 D143 F149 A150 L151 M196	P138-K147 VanDerWaalsContact O-CE 3.28Å; P138-K147 WeakPolarHBondContact O-CE 3.47Å; D139-K147 PolarHBondContact O-NZ 2.94Å; I141-K147 HydrophobicContact CB-CB 4.02Å; I141-K147 HydrophobicContact CB-CG 4.35Å; I141-K147 HydrophobicContact CG2-CB 3.91Å; I141-K147 WeakPolarHBondContact O-CD 3.23Å; I141-K147 PolarHBondContact O-NZ 2.86Å; I141-K147 VanDerWaalsContact O-NZ 3.07Å; D143-K147 WeakPolarHBondContact O-CB 3.46Å; D143-K147 PolarHBondContact O-N 3.06Å; K147-F149 VanDerWaalsContact C-N 3.33Å; K147-F149 PolarHBondContact O-N 3.02Å; K147-A150 PolarHBondContact O-N 3.05Å; K147-L151 HydrophobicContact CG-CD1 4.36Å; K147-L151 WeakPolarHBondContact O-CG 3.28Å; K147-L151 PolarHBondContact O-N 3.31Å; K147-L151 VanDerWaalsContact O-N 3.11Å; K147-M196 HydrophobicContact CD-CE 4.27Å; K147-M196 HydrophobicContact CG-CE 4.28Å
148	A	97.3	Very high	95.9	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.008	14%	0.138	C	C	.	.	H	α-helix	trans	-62.8	-41.3	179.1	0	0	0	0	0	111.4	P144 G152 M196 L197 V200	P144-A148 WeakPolarHBondContact O-CB 3.02Å; P144-A148 PolarHBondContact O-N 3.34Å; A148-G152 PolarHBondContact O-N 2.91Å; A148-M196 HydrophobicContact CB-CB 4.07Å; A148-L197 HydrophobicContact CB-CD2 3.92Å; A148-L197 HydrophobicContact CB-CG 4.23Å; A148-L197 WeakPolarHBondContact O-CD2 3.34Å; A148-V200 HydrophobicContact CB-CG2 3.95Å
149	F	97.9	Very high	96.1	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-63.9	-47.4	176.3	178.6	-94.8	0	0	0	112.6	M109 C112 F113 A145 M146 K147 L151 G152 I153 T240	M109-F149 HydrophobicContact CB-CD2 4.49Å; M109-F149 HydrophobicContact CB-CE1 4.04Å; M109-F149 HydrophobicContact CB-CE2 3.89Å; M109-F149 HydrophobicContact CB-CZ 3.64Å; M109-F149 HydrophobicContact CE-CB 3.94Å; M109-F149 HydrophobicContact CE-CD2 4.18Å; M109-F149 HydrophobicContact CE-CG 3.99Å; M109-F149 HydrophobicContact CG-CD1 3.81Å; M109-F149 HydrophobicContact CG-CD2 3.78Å; M109-F149 HydrophobicContact CG-CE1 3.71Å; M109-F149 HydrophobicContact CG-CE2 3.68Å; M109-F149 HydrophobicContact CG-CG 3.84Å; M109-F149 HydrophobicContact CG-CZ 3.65Å; M109-F149 HydrophobicContact SD-CD2 4.05Å; M109-F149 HydrophobicContact SD-CE2 4.29Å; M109-F149 HydrophobicContact SD-CG 4.35Å; C112-F149 HydrophobicContact CB-CE1 3.71Å; C112-F149 HydrophobicContact CB-CZ 3.9Å; F113-F149 AromaticContact CE1-CE2 3.98Å; F113-F149 HydrophobicContact CE1-CE2 3.98Å; F113-F149 HydrophobicContact CE1-CZ 4.23Å; F113-F149 HydrophobicContact CE2-CE2 4.33Å; F113-F149 AromaticContact CZ-CE2 3.74Å; F113-F149 HydrophobicContact CZ-CE2 3.74Å; F113-F149 HydrophobicContact CZ-CZ 4.26Å; A145-F149 VanDerWaalsContact O-CB 3.24Å; A145-F149 WeakPolarHBondContact O-CB 3.49Å; A145-F149 PolarHBondContact O-N 2.82Å; M146-F149 HydrophobicContact CE-CD1 3.77Å; M146-F149 HydrophobicContact CE-CE1 4.44Å; M146-F149 PolarHBondContact O-N 2.81Å; K147-F149 VanDerWaalsContact C-N 3.33Å; K147-F149 PolarHBondContact O-N 3.02Å; F149-L151 PolarHBondContact O-N 3.03Å; F149-G152 WeakPolarHBondContact O-CA 3.45Å; F149-G152 PolarHBondContact O-N 3.28Å; F149-I153 HydrophobicContact CD1-CG1 4.15Å; F149-I153 HydrophobicContact CE1-CD1 4.29Å; F149-I153 HydrophobicContact CE1-CG1 3.64Å; F149-I153 HydrophobicContact CE2-CD1 4.14Å; F149-I153 HydrophobicContact CE2-CG1 4.14Å; F149-I153 HydrophobicContact CZ-CD1 3.77Å; F149-I153 HydrophobicContact CZ-CG1 3.64Å; F149-I153 PolarHBondContact O-N 3.26Å; F149-T240 HydrophobicContact CD2-CG2 4.1Å; F149-T240 WeakPolarHBondContact CD2-OG1 3.48Å; F149-T240 HydrophobicContact CE2-CG2 4.3Å; F149-T240 VanDerWaalsContact CE2-OG1 3.24Å; F149-T240 WeakPolarHBondContact CE2-OG1 3.33Å
150	A	97.1	Very high	96.4	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-58	-46.3	178.5	0	0	0	0	0	111.9	I135 P138 I141 M146 K147 G152 I153 L154	I135-A150 HydrophobicContact CG2-CB 3.99Å; P138-A150 HydrophobicContact CB-CB 4.48Å; I141-A150 HydrophobicContact CD1-CB 3.95Å; M146-A150 HydrophobicContact CE-CB 4.23Å; M146-A150 VanDerWaalsContact O-CB 3.27Å; M146-A150 WeakPolarHBondContact O-CB 3.35Å; M146-A150 PolarHBondContact O-N 3.28Å; K147-A150 PolarHBondContact O-N 3.05Å; A150-G152 VanDerWaalsContact C-N 3.33Å; A150-G152 PolarHBondContact O-N 3.3Å; A150-I153 PolarHBondContact O-N 3.42Å; A150-L154 WeakPolarHBondContact O-CG 3.49Å; A150-L154 PolarHBondContact O-N 3.35Å; A150-L154 VanDerWaalsContact O-N 3.11Å
151	L	97.6	Very high	96.6	Very high	7 Å²	7	19.6 Å²	19.6	4%	0.037	10%	0.099	C	C	.	.	H	α-helix	trans	-62.8	-39.3	173.9	-69	171.7	0	0	0	111.9	P138 K147 F149 L154 K155 A185 V188 V193 M196	P138-L151 HydrophobicContact CB-CD2 3.85Å; P138-L151 HydrophobicContact CB-CG 4.09Å; P138-L151 HydrophobicContact CG-CD2 4.04Å; K147-L151 HydrophobicContact CG-CD1 4.36Å; K147-L151 WeakPolarHBondContact O-CG 3.28Å; K147-L151 PolarHBondContact O-N 3.31Å; K147-L151 VanDerWaalsContact O-N 3.11Å; F149-L151 PolarHBondContact O-N 3.03Å; L151-L154 PolarHBondContact O-N 3.5Å; L151-K155 WeakPolarHBondContact O-CG 3.34Å; L151-K155 PolarHBondContact O-N 3.45Å; L151-A185 HydrophobicContact CD2-CB 3.66Å; L151-V188 HydrophobicContact CD2-CG2 4.45Å; L151-V193 HydrophobicContact CB-CG1 3.96Å; L151-V193 HydrophobicContact CB-CG2 4.08Å; L151-M196 HydrophobicContact CD1-CE 3.85Å; L151-M196 HydrophobicContact CD1-SD 4.05Å
152	G	97.8	Very high	96.6	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-59.4	-46.7	175.5	0	0	0	0	0	112.9	A148 F149 A150 K155 I156	A148-G152 PolarHBondContact O-N 2.91Å; F149-G152 WeakPolarHBondContact O-CA 3.45Å; F149-G152 PolarHBondContact O-N 3.28Å; A150-G152 VanDerWaalsContact C-N 3.33Å; A150-G152 PolarHBondContact O-N 3.3Å; G152-K155 PolarHBondContact O-N 3.03Å; G152-I156 VanDerWaalsContact O-CG1 3.29Å; G152-I156 WeakPolarHBondContact O-CG1 3.49Å; G152-I156 PolarHBondContact O-N 3.45Å
153	I	97.8	Very high	96.6	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-62.7	-44.8	177.2	-67.8	-63.1	0	0	0	111.5	F113 V129 F149 A150 K155 I156 C157	F113-I153 HydrophobicContact CD1-CD1 4.09Å; F113-I153 HydrophobicContact CE1-CD1 3.95Å; V129-I153 HydrophobicContact CG1-CG2 4.16Å; F149-I153 HydrophobicContact CD1-CG1 4.15Å; F149-I153 HydrophobicContact CE1-CD1 4.29Å; F149-I153 HydrophobicContact CE1-CG1 3.64Å; F149-I153 HydrophobicContact CE2-CD1 4.14Å; F149-I153 HydrophobicContact CE2-CG1 4.14Å; F149-I153 HydrophobicContact CZ-CD1 3.77Å; F149-I153 HydrophobicContact CZ-CG1 3.64Å; F149-I153 PolarHBondContact O-N 3.26Å; A150-I153 PolarHBondContact O-N 3.42Å; I153-K155 VanDerWaalsContact C-N 3.31Å; I153-K155 PolarHBondContact O-N 2.89Å; I153-I156 PolarHBondContact O-N 2.97Å; I153-C157 PolarHBondContact O-N 3.29Å; I153-C157 PolarHBondContact O-SG 3.29Å
154	L	97	Very high	96.6	Very high	2 Å²	2	17.9 Å²	17.9	1%	0.01	9%	0.09	C	C	.	.	H	α-helix	trans	-59	-43.1	176.7	-72.7	170.3	0	0	0	111.8	F130 I135 P138 A150 L151 C157 D158 M184 A185	F130-L154 HydrophobicContact CE1-CD2 3.88Å; F130-L154 HydrophobicContact CZ-CD2 4.27Å; I135-L154 HydrophobicContact CB-CD1 4.36Å; I135-L154 HydrophobicContact CB-CD2 4.07Å; I135-L154 HydrophobicContact CB-CG 4.12Å; I135-L154 HydrophobicContact CD1-CD2 4.24Å; P138-L154 HydrophobicContact CG-CD1 3.72Å; A150-L154 WeakPolarHBondContact O-CG 3.49Å; A150-L154 PolarHBondContact O-N 3.35Å; A150-L154 VanDerWaalsContact O-N 3.11Å; L151-L154 PolarHBondContact O-N 3.5Å; L154-C157 PolarHBondContact O-N 3.18Å; L154-D158 PolarHBondContact O-N 3.07Å; L154-M184 HydrophobicContact CD2-SD 4.31Å; L154-A185 HydrophobicContact CB-CB 4.01Å; L154-A185 HydrophobicContact CD1-CB 3.87Å
155	K	97.4	Very high	96.5	Very high	13 Å²	13	16.3 Å²	16.3	6%	0.057	8%	0.077	C	C	.	.	H	α-helix	trans	-67.1	-40	176.8	-71.4	-60.7	-169.2	162.2	0	113.4	L151 G152 I153 C157 D158 I159 A185 V188 D190 V193 L244	L151-K155 WeakPolarHBondContact O-CG 3.34Å; L151-K155 PolarHBondContact O-N 3.45Å; G152-K155 PolarHBondContact O-N 3.03Å; I153-K155 VanDerWaalsContact C-N 3.31Å; I153-K155 PolarHBondContact O-N 2.89Å; K155-C157 VanDerWaalsContact C-N 3.3Å; K155-C157 PolarHBondContact O-N 3.38Å; K155-D158 PolarHBondContact O-N 2.92Å; K155-I159 WeakPolarHBondContact O-CG1 3.37Å; K155-I159 PolarHBondContact O-N 3.21Å; K155-A185 WeakPolarHBondContact CE-O 3.43Å; K155-V188 WeakPolarHBondContact CE-O 3.48Å; K155-V188 PolarHBondContact NZ-O 3.32Å; K155-D190 WeakPolarHBondContact CD-OD1 3.46Å; K155-D190 VanDerWaalsContact CE-OD1 3.28Å; K155-D190 WeakPolarHBondContact CE-OD1 3.28Å; K155-D190 IonicContact NZ-OD1 3.83Å; K155-D190 PolarHBondContact NZ-OD1 3.44Å; K155-V193 HydrophobicContact CG-CB 4.45Å; K155-V193 HydrophobicContact CG-CG1 4.39Å; K155-V193 HydrophobicContact CG-CG2 4.08Å; K155-L244 HydrophobicContact CB-CD1 3.71Å; K155-L244 HydrophobicContact CB-CD2 4.2Å
156	I	97.7	Very high	96.4	Very high	4 Å²	4	20.6 Å²	20.6	2%	0.021	9%	0.094	C	C	.	.	H	α-helix	trans	-59.5	-45.1	173.1	-72.5	164.5	0	0	0	110	L116 G152 I153 A160 T240 L243 L244 L247	L116-I156 HydrophobicContact CD1-CG2 4.15Å; L116-I156 HydrophobicContact CD2-CG2 3.91Å; G152-I156 VanDerWaalsContact O-CG1 3.29Å; G152-I156 WeakPolarHBondContact O-CG1 3.49Å; G152-I156 PolarHBondContact O-N 3.45Å; I153-I156 PolarHBondContact O-N 2.97Å; I156-A160 WeakPolarHBondContact O-CB 3.3Å; I156-A160 PolarHBondContact O-N 3.42Å; I156-T240 HydrophobicContact CD1-CG2 3.91Å; I156-L243 HydrophobicContact CD1-CB 4.46Å; I156-L243 HydrophobicContact CD1-CD2 4.08Å; I156-L243 HydrophobicContact CD1-CG 4.22Å; I156-L244 HydrophobicContact CD1-CB 4.28Å; I156-L244 HydrophobicContact CG1-CB 3.98Å; I156-L244 HydrophobicContact CG1-CD1 4.15Å; I156-L247 HydrophobicContact CB-CD1 4.33Å; I156-L247 HydrophobicContact CG1-CD1 4.26Å; I156-L247 HydrophobicContact CG2-CD1 3.84Å
157	C	97	Very high	96.2	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-62.4	-43.9	177.2	-64.2	0	0	0	0	111.9	W119 I153 L154 K155 R161 M184	W119-C157 HydrophobicContact CH2-CB 4.14Å; W119-C157 VanDerWaalsContact CH2-O 3.3Å; W119-C157 WeakPolarHBondContact CH2-O 3.29Å; W119-C157 HydrophobicContact CZ3-CB 3.96Å; I153-C157 PolarHBondContact O-N 3.29Å; I153-C157 PolarHBondContact O-SG 3.29Å; L154-C157 PolarHBondContact O-N 3.18Å; K155-C157 VanDerWaalsContact C-N 3.3Å; K155-C157 PolarHBondContact O-N 3.38Å; C157-R161 VanDerWaalsContact O-CB 3.22Å; C157-R161 WeakPolarHBondContact O-CB 3.33Å; C157-R161 PolarHBondContact O-N 3.48Å; C157-M184 HydrophobicContact CB-SD 4.24Å
158	D	95.9	Very high	96.1	Very high	26 Å²	26	20.5 Å²	20.5	14%	0.139	10%	0.104	C	C	.	.	H	α-helix	trans	-62.8	-49.7	-179.9	-156.8	27.3	0	0	0	112.3	L154 K155 A160 R161 E162 M184	L154-D158 PolarHBondContact O-N 3.07Å; K155-D158 PolarHBondContact O-N 2.92Å; D158-A160 PolarHBondContact O-N 2.91Å; D158-R161 PolarHBondContact O-N 3.29Å; D158-R161 IonicContact OD1-CZ 3.81Å; D158-R161 IonicContact OD1-NE 2.82Å; D158-R161 IonicContact OD1-NH2 3.52Å; D158-R161 PolarHBondContact OD1-NH2 2.97Å; D158-E162 WeakPolarHBondContact O-CB 3.43Å; D158-E162 PolarHBondContact O-N 3.14Å; D158-M184 HydrophobicContact CB-CB 3.67Å; D158-M184 HydrophobicContact CB-CG 4.08Å
159	I	96.1	Very high	95.9	Very high	4 Å²	4	20.5 Å²	20.5	2%	0.021	10%	0.103	C	C	.	.	H	α-helix	trans	-65.4	-43.2	-179	-61.7	168.2	0	0	0	110.2	K155 R161 E162 K163 L244 L247 I248 T251	K155-I159 WeakPolarHBondContact O-CG1 3.37Å; K155-I159 PolarHBondContact O-N 3.21Å; I159-R161 PolarHBondContact O-N 3.46Å; I159-E162 PolarHBondContact O-N 3.29Å; I159-K163 HydrophobicContact CG2-CG 4.22Å; I159-K163 WeakPolarHBondContact O-CB 3.41Å; I159-K163 VanDerWaalsContact O-CG 3.25Å; I159-K163 WeakPolarHBondContact O-CG 3.39Å; I159-K163 PolarHBondContact O-N 3.05Å; I159-L244 HydrophobicContact CD1-CD1 3.78Å; I159-L247 HydrophobicContact CB-CB 4.44Å; I159-L247 HydrophobicContact CD1-CB 4.44Å; I159-L247 HydrophobicContact CG2-CB 3.87Å; I159-I248 HydrophobicContact CD1-CG1 3.69Å; I159-T251 HydrophobicContact CG2-CG2 3.82Å
160	A	96.6	Very high	95.7	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.008	11%	0.111	C	C	.	.	H	α-helix	trans	-59	-47.7	176.7	0	0	0	0	0	111.3	W119 L120 I156 D158 K163 V164 L366	W119-A160 HydrophobicContact CH2-CB 4.17Å; W119-A160 HydrophobicContact CZ3-CB 4.13Å; L120-A160 HydrophobicContact CD2-CB 4.4Å; I156-A160 WeakPolarHBondContact O-CB 3.3Å; I156-A160 PolarHBondContact O-N 3.42Å; D158-A160 PolarHBondContact O-N 2.91Å; A160-K163 PolarHBondContact O-N 3.47Å; A160-V164 VanDerWaalsContact O-CG2 3.27Å; A160-V164 WeakPolarHBondContact O-CG2 3.4Å; A160-V164 PolarHBondContact O-N 2.7Å; A160-L366 HydrophobicContact CB-CD1 3.87Å; A160-L366 HydrophobicContact CB-CD2 4.44Å
161	R	95.8	Very high	95.3	Very high	64 Å²	64	25.3 Å²	25.3	24%	0.242	13%	0.125	C	C	.	.	H	α-helix	trans	-60.7	-46.6	176.9	-177.2	-170.4	66.1	88	5.8	111.8	W119 C157 D158 I159 K163 V164 N165 S177	W119-R161 HydrophobicContact CH2-CB 4.01Å; W119-R161 HydrophobicContact CZ2-CB 4.1Å; C157-R161 VanDerWaalsContact O-CB 3.22Å; C157-R161 WeakPolarHBondContact O-CB 3.33Å; C157-R161 PolarHBondContact O-N 3.48Å; D158-R161 PolarHBondContact O-N 3.29Å; D158-R161 IonicContact OD1-CZ 3.81Å; D158-R161 IonicContact OD1-NE 2.82Å; D158-R161 IonicContact OD1-NH2 3.52Å; D158-R161 PolarHBondContact OD1-NH2 2.97Å; I159-R161 PolarHBondContact O-N 3.46Å; R161-K163 VanDerWaalsContact C-N 3.33Å; R161-K163 PolarHBondContact O-N 3.4Å; R161-V164 PolarHBondContact O-N 3.36Å; R161-N165 VanDerWaalsContact O-CB 3.31Å; R161-N165 WeakPolarHBondContact O-CB 3.22Å; R161-N165 VanDerWaalsContact O-CG 3.29Å; R161-N165 PolarHBondContact O-N 3.08Å; R161-N165 PolarHBondContact O-ND2 3.19Å; R161-S177 WeakPolarHBondContact CD-O 3.41Å
162	E	94.4	Very high	94.5	Very high	93 Å²	93	33.3 Å²	33.3	44%	0.435	16%	0.162	S	C	.	.	H	α-helix	trans	-58.5	-46.1	177.4	-171.6	-164.4	150.2	0	0	110.9	D158 I159 N165 K166	D158-E162 WeakPolarHBondContact O-CB 3.43Å; D158-E162 PolarHBondContact O-N 3.14Å; I159-E162 PolarHBondContact O-N 3.29Å; E162-N165 PolarHBondContact O-N 3.48Å; E162-K166 VanDerWaalsContact O-CB 3.22Å; E162-K166 WeakPolarHBondContact O-CB 3.35Å; E162-K166 PolarHBondContact O-N 2.9Å
163	K	94.1	Very high	93.7	Very high	12 Å²	12	38.8 Å²	38.8	5%	0.052	19%	0.188	C	C	.	.	H	α-helix	trans	-64.6	-44.3	179.7	-70.9	-61.2	-174.3	-179.6	0	112.8	I159 A160 R161 K166 A167 F250 L370 T373	I159-K163 HydrophobicContact CG2-CG 4.22Å; I159-K163 WeakPolarHBondContact O-CB 3.41Å; I159-K163 VanDerWaalsContact O-CG 3.25Å; I159-K163 WeakPolarHBondContact O-CG 3.39Å; I159-K163 PolarHBondContact O-N 3.05Å; A160-K163 PolarHBondContact O-N 3.47Å; R161-K163 VanDerWaalsContact C-N 3.33Å; R161-K163 PolarHBondContact O-N 3.4Å; K163-K166 PolarHBondContact O-N 2.96Å; K163-A167 WeakPolarHBondContact O-CB 3.46Å; K163-A167 PolarHBondContact O-N 3.37Å; K163-F250 VanDerWaalsContact CE-O 3.27Å; K163-F250 WeakPolarHBondContact CE-O 3.19Å; K163-F250 PolarHBondContact NZ-O 3.43Å; K163-L370 HydrophobicContact CB-CD2 4.4Å; K163-L370 HydrophobicContact CD-CD2 4.47Å; K163-L370 HydrophobicContact CG-CD2 4.07Å; K163-T373 HydrophobicContact CD-CG2 4.48Å
164	V	95.6	Very high	93.1	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.6	-46.5	177.5	174.5	0	0	0	0	111.1	A160 R161 K166 A167 A168 F170 F175 V365 S369	A160-V164 VanDerWaalsContact O-CG2 3.27Å; A160-V164 WeakPolarHBondContact O-CG2 3.4Å; A160-V164 PolarHBondContact O-N 2.7Å; R161-V164 PolarHBondContact O-N 3.36Å; V164-K166 PolarHBondContact O-N 3.38Å; V164-A167 PolarHBondContact O-N 2.84Å; V164-A168 PolarHBondContact O-N 3.46Å; V164-A168 VanDerWaalsContact O-N 3.15Å; V164-F170 HydrophobicContact CG1-CB 4.28Å; V164-F170 HydrophobicContact CG1-CD1 3.37Å; V164-F170 HydrophobicContact CG1-CD2 4.48Å; V164-F170 HydrophobicContact CG1-CE1 3.76Å; V164-F170 HydrophobicContact CG1-CG 3.79Å; V164-F170 HydrophobicContact CG1-CZ 4.45Å; V164-F175 HydrophobicContact CB-CD1 4.16Å; V164-F175 HydrophobicContact CB-CE1 3.85Å; V164-F175 HydrophobicContact CB-CZ 4.25Å; V164-F175 HydrophobicContact CG1-CB 4.41Å; V164-F175 HydrophobicContact CG1-CD1 3.35Å; V164-F175 HydrophobicContact CG1-CE1 3.56Å; V164-F175 HydrophobicContact CG1-CG 3.91Å; V164-F175 HydrophobicContact CG1-CZ 4.29Å; V164-F175 HydrophobicContact CG2-CE1 4.41Å; V164-F175 HydrophobicContact CG2-CZ 4.37Å; V164-V365 HydrophobicContact CG1-CG2 3.72Å; V164-V365 HydrophobicContact CG2-CG1 4.39Å; V164-V365 HydrophobicContact CG2-CG2 4.18Å; V164-S369 WeakPolarHBondContact CA-OG 3.35Å
165	N	94.6	Very high	92.9	Very high	57 Å²	57	40.2 Å²	40.2	31%	0.305	20%	0.196	S	C	.	.	H	α-helix	trans	-62.3	-42	176.3	-74.6	-22.6	0	0	0	112.6	R161 E162 A168 F170 S177	R161-N165 VanDerWaalsContact O-CB 3.31Å; R161-N165 WeakPolarHBondContact O-CB 3.22Å; R161-N165 VanDerWaalsContact O-CG 3.29Å; R161-N165 PolarHBondContact O-N 3.08Å; R161-N165 PolarHBondContact O-ND2 3.19Å; E162-N165 PolarHBondContact O-N 3.48Å; N165-A168 PolarHBondContact O-N 3Å; N165-F170 WeakPolarHBondContact OD1-CZ 3.29Å; N165-S177 WeakPolarHBondContact OD1-CB 3.22Å; N165-S177 PolarHBondContact OD1-OG 2.93Å
166	K	93	Very high	92.5	Very high	94 Å²	94	42.3 Å²	42.3	41%	0.409	21%	0.206	S	C	.	.	H	α-helix	trans	-67.8	-36.9	179.7	-174.2	171	-176.6	177	0	112.4	E162 K163 V164 A168 T373 V377 D378	E162-K166 VanDerWaalsContact O-CB 3.22Å; E162-K166 WeakPolarHBondContact O-CB 3.35Å; E162-K166 PolarHBondContact O-N 2.9Å; K163-K166 PolarHBondContact O-N 2.96Å; V164-K166 PolarHBondContact O-N 3.38Å; K166-A168 VanDerWaalsContact C-N 3.31Å; K166-T373 HydrophobicContact CB-CG2 4.19Å; K166-T373 HydrophobicContact CD-CG2 4.46Å; K166-T373 HydrophobicContact CG-CG2 4.12Å; K166-V377 WeakPolarHBondContact CE-O 3.3Å; K166-V377 PolarHBondContact NZ-O 2.99Å; K166-D378 IonicContact NZ-OD1 2.93Å; K166-D378 PolarHBondContact NZ-OD1 3.24Å
167	A	93.3	Very high	92.1	Very high	3 Å²	3	43.7 Å²	43.7	3%	0.025	22%	0.216	C	C	.	.	H	α-helix	trans	-67.2	-35.2	177	0	0	0	0	0	112	K163 V164 V169 Q372 T373 Q437	K163-A167 WeakPolarHBondContact O-CB 3.46Å; K163-A167 PolarHBondContact O-N 3.37Å; V164-A167 PolarHBondContact O-N 2.84Å; A167-V169 HydrophobicContact CB-CG1 4.39Å; A167-V169 HydrophobicContact CB-CG2 3.81Å; A167-V169 WeakPolarHBondContact O-CG1 3.32Å; A167-V169 PolarHBondContact O-N 3.47Å; A167-Q372 HydrophobicContact CB-CB 3.96Å; A167-Q372 HydrophobicContact CB-CG 4.14Å; A167-T373 HydrophobicContact CB-CG2 3.96Å; A167-Q437 PolarHBondContact O-NE2 2.81Å; A167-Q437 VanDerWaalsContact O-NE2 3.07Å
168	A	93.5	Very high	91.7	Very high	49 Å²	49	49.2 Å²	49.2	41%	0.405	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	41.6	-176.5	0	0	0	0	0	112.6	V164 N165 K166 H441	V164-A168 PolarHBondContact O-N 3.46Å; V164-A168 VanDerWaalsContact O-N 3.15Å; N165-A168 PolarHBondContact O-N 3Å; K166-A168 VanDerWaalsContact C-N 3.31Å; A168-H441 PolarHBondContact O-CE1 3.41Å
169	V	93.8	Very high	91.3	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.247	C	C	.	.			trans	-112.8	27.7	-179.2	-61.6	0	0	0	0	113.2	A167 R368 Q372 Q437 G440 H441	A167-V169 HydrophobicContact CB-CG1 4.39Å; A167-V169 HydrophobicContact CB-CG2 3.81Å; A167-V169 WeakPolarHBondContact O-CG1 3.32Å; A167-V169 PolarHBondContact O-N 3.47Å; V169-R368 HydrophobicContact CG2-CB 4.33Å; V169-R368 PolarHBondContact O-NH1 2.93Å; V169-Q372 HydrophobicContact CG1-CB 4.48Å; V169-Q372 HydrophobicContact CG1-CG 4.06Å; V169-Q437 HydrophobicContact CG1-CG 3.77Å; V169-G440 WeakPolarHBondContact CB-O 3.44Å; V169-G440 WeakPolarHBondContact CG2-O 3.36Å; V169-H441 VanDerWaalsContact CA-CE1 3.48Å; V169-H441 WeakPolarHBondContact CA-CE1 3.16Å; V169-H441 PolarHBondContact O-ND1 2.69Å
170	F	93.9	Very high	90.9	Very high	36 Å²	36	51.5 Å²	51.5	16%	0.158	25%	0.254	C	S	.	.			trans	-133.9	158.3	-179.4	76.1	-79.3	0	0	0	110.1	V164 N165 D174 F175 V365	V164-F170 HydrophobicContact CG1-CB 4.28Å; V164-F170 HydrophobicContact CG1-CD1 3.37Å; V164-F170 HydrophobicContact CG1-CD2 4.48Å; V164-F170 HydrophobicContact CG1-CE1 3.76Å; V164-F170 HydrophobicContact CG1-CG 3.79Å; V164-F170 HydrophobicContact CG1-CZ 4.45Å; N165-F170 WeakPolarHBondContact OD1-CZ 3.29Å; F170-D174 HydrophobicContact CB-CB 4.18Å; F170-F175 HydrophobicContact CB-CB 4.23Å; F170-F175 HydrophobicContact CD2-CB 3.72Å; F170-F175 AromaticContact CD2-CD1 3.99Å; F170-F175 HydrophobicContact CD2-CD1 3.99Å; F170-F175 HydrophobicContact CD2-CG 4.37Å; F170-F175 VanDerWaalsContact CD2-O 3.3Å; F170-F175 WeakPolarHBondContact CD2-O 3.45Å; F170-F175 HydrophobicContact CE2-CB 4.39Å; F170-F175 AromaticContact CE2-CD1 3.93Å; F170-F175 HydrophobicContact CE2-CD1 3.93Å; F170-F175 VanDerWaalsContact CE2-O 3.28Å; F170-F175 WeakPolarHBondContact CE2-O 3.31Å; F170-F175 HydrophobicContact CG-CB 4.13Å; F170-F175 HydrophobicContact CG-CD1 4.4Å; F170-F175 HydrophobicContact CZ-CD1 4.29Å; F170-V365 HydrophobicContact CB-CG2 3.74Å
171	E	88.3	Confident	90.4	Very high	66 Å²	66	54.8 Å²	54.8	31%	0.308	29%	0.288	S	S	.	.			trans	-116.4	167.2	166.8	-59.2	-65.7	161.5	0	0	108.4	E173 D174 F175 R445 K449	E171-E173 HydrophobicContact CB-CG 4.24Å; E171-E173 PolarHBondContact O-N 3.46Å; E171-E173 VanDerWaalsContact O-N 3.07Å; E171-D174 WeakPolarHBondContact O-CB 3.13Å; E171-D174 PolarHBondContact O-N 2.91Å; E171-F175 PolarHBondContact O-N 3.36Å; E171-R445 HydrophobicContact CG-CG 3.9Å; E171-K449 IonicContact OE1-NZ 3.03Å
172	E	80.4	Confident	90	Very high	174 Å²	174	53.6 Å²	53.6	81%	0.813	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-23.6	-176.3	-65.5	-169.2	160.1	0	0	113.8
173	E	81.9	Confident	89.6	Confident	115 Å²	115	57.7 Å²	57.7	54%	0.537	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-27.9	173	70.4	-168.7	158.7	0	0	113.5	E171 R445	E171-E173 HydrophobicContact CB-CG 4.24Å; E171-E173 PolarHBondContact O-N 3.46Å; E171-E173 VanDerWaalsContact O-N 3.07Å; E173-R445 IonicContact OE1-CZ 2.82Å; E173-R445 IonicContact OE1-NE 3.07Å; E173-R445 PolarHBondContact OE1-NE 3.31Å; E173-R445 IonicContact OE1-NH2 2.9Å; E173-R445 PolarHBondContact OE1-NH2 3.42Å; E173-R445 IonicContact OE2-NH2 3.37Å
174	D	85	Confident	89.3	Confident	32 Å²	32	57.3 Å²	57.3	17%	0.171	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-36.6	-178.5	-74.2	-16.3	0	0	0	111.9	G122 F170 E171 R368 N442	G122-D174 VanDerWaalsContact CA-O 3.3Å; G122-D174 WeakPolarHBondContact CA-O 3.37Å; G122-D174 PolarHBondContact N-O 2.84Å; F170-D174 HydrophobicContact CB-CB 4.18Å; E171-D174 WeakPolarHBondContact O-CB 3.13Å; E171-D174 PolarHBondContact O-N 2.91Å; D174-R368 IonicContact OD2-NH2 3.49Å; D174-N442 PolarHBondContact OD1-ND2 3.43Å; D174-N442 PolarHBondContact OD2-ND2 3.2Å
175	F	92.4	Very high	88.8	Confident	1 Å²	1	57.8 Å²	57.8	0%	0.004	30%	0.304	C	S	.	.			trans	-160.6	129.3	-172.5	-179.4	-104.3	0	0	0	112.3	W119 L120 V164 F170 E171 V365	W119-F175 HydrophobicContact CD2-CE2 4.05Å; W119-F175 AromaticContact CE2-CE2 3.38Å; W119-F175 AromaticContact CE2-CZ 3.6Å; W119-F175 HydrophobicContact CH2-CE2 4.11Å; W119-F175 AromaticContact CH2-CZ 3.89Å; W119-F175 HydrophobicContact CH2-CZ 3.89Å; W119-F175 HydrophobicContact CZ2-CE1 4.36Å; W119-F175 AromaticContact CZ2-CE2 3.49Å; W119-F175 HydrophobicContact CZ2-CE2 3.49Å; W119-F175 VanDerWaalsContact CZ2-CE2 3.49Å; W119-F175 AromaticContact CZ2-CZ 3.22Å; W119-F175 HydrophobicContact CZ2-CZ 3.22Å; W119-F175 AromaticContact NE1-CE2 3.47Å; W119-F175 AromaticContact NE1-CZ 3.81Å; L120-F175 HydrophobicContact CD2-CE2 4.21Å; V164-F175 HydrophobicContact CB-CD1 4.16Å; V164-F175 HydrophobicContact CB-CE1 3.85Å; V164-F175 HydrophobicContact CB-CZ 4.25Å; V164-F175 HydrophobicContact CG1-CB 4.41Å; V164-F175 HydrophobicContact CG1-CD1 3.35Å; V164-F175 HydrophobicContact CG1-CE1 3.56Å; V164-F175 HydrophobicContact CG1-CG 3.91Å; V164-F175 HydrophobicContact CG1-CZ 4.29Å; V164-F175 HydrophobicContact CG2-CE1 4.41Å; V164-F175 HydrophobicContact CG2-CZ 4.37Å; F170-F175 HydrophobicContact CB-CB 4.23Å; F170-F175 HydrophobicContact CD2-CB 3.72Å; F170-F175 AromaticContact CD2-CD1 3.99Å; F170-F175 HydrophobicContact CD2-CD1 3.99Å; F170-F175 HydrophobicContact CD2-CG 4.37Å; F170-F175 VanDerWaalsContact CD2-O 3.3Å; F170-F175 WeakPolarHBondContact CD2-O 3.45Å; F170-F175 HydrophobicContact CE2-CB 4.39Å; F170-F175 AromaticContact CE2-CD1 3.93Å; F170-F175 HydrophobicContact CE2-CD1 3.93Å; F170-F175 VanDerWaalsContact CE2-O 3.28Å; F170-F175 WeakPolarHBondContact CE2-O 3.31Å; F170-F175 HydrophobicContact CG-CB 4.13Å; F170-F175 HydrophobicContact CG-CD1 4.4Å; F170-F175 HydrophobicContact CZ-CD1 4.29Å; E171-F175 PolarHBondContact O-N 3.36Å; F175-V365 HydrophobicContact CB-CG1 4.23Å; F175-V365 HydrophobicContact CB-CG2 4.07Å; F175-V365 HydrophobicContact CD2-CG1 3.96Å; F175-V365 HydrophobicContact CG-CG1 4.31Å
176	Q	90.2	Very high	88.3	Confident	57 Å²	57	60.6 Å²	60.6	27%	0.266	32%	0.319	S	S	.	.			trans	-102.2	106.4	176.2	-168.4	160.8	4.5	0	0	110.9	W119 M178 Y180	W119-Q176 PolarHBondContact NE1-O 2.85Å; Q176-M178 HydrophobicContact CG-CB 4.4Å; Q176-Y180 PolarHBondContact NE2-OH 3.47Å
177	S	88.3	Confident	88.1	Confident	33 Å²	33	60.9 Å²	60.9	23%	0.231	33%	0.333	C	S	.	.			trans	-84.8	-7.4	-174.3	68.6	0	0	0	0	114.5	R161 N165 T179	R161-S177 WeakPolarHBondContact CD-O 3.41Å; N165-S177 WeakPolarHBondContact OD1-CB 3.22Å; N165-S177 PolarHBondContact OD1-OG 2.93Å; S177-T179 PolarHBondContact O-N 3.32Å
178	M	89.1	Confident	88	Confident	116 Å²	116	61.4 Å²	61.4	57%	0.571	34%	0.335	S	S	*	.			trans	-63	129.1	-177.3	-70.1	-64.1	-78.2	0	0	111.9	Q176 Y180	Q176-M178 HydrophobicContact CG-CB 4.4Å; M178-Y180 HydrophobicContact CB-CD2 4.29Å; M178-Y180 HydrophobicContact CB-CE2 3.89Å; M178-Y180 VanDerWaalsContact O-CD2 3.31Å; M178-Y180 WeakPolarHBondContact O-CD2 3.18Å; M178-Y180 WeakPolarHBondContact O-CE2 3.35Å
179	T	88.1	Confident	88.1	Confident	38 Å²	38	63.4 Å²	63.4	23%	0.233	34%	0.343	C	S	.	.			trans	-96.6	-6.1	-178.3	61.6	0	0	0	0	113.7	L125 S177 G181 F182 M184	L125-T179 HydrophobicContact CD1-CG2 4.43Å; S177-T179 PolarHBondContact O-N 3.32Å; T179-G181 PolarHBondContact O-N 2.93Å; T179-F182 WeakPolarHBondContact O-CB 3.25Å; T179-F182 WeakPolarHBondContact O-CD2 3.42Å; T179-F182 PolarHBondContact O-N 2.94Å; T179-M184 HydrophobicContact CG2-CE 3.75Å
180	Y	86.8	Confident	88.2	Confident	40 Å²	40	65.8 Å²	65.8	16%	0.157	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	29.1	177.7	-58.4	-88.8	0	0	0	114.5	S124 A126 Q176 M178 F182 L308 L309	S124-Y180 WeakPolarHBondContact CB-OH 3.29Å; A126-Y180 HydrophobicContact CB-CD1 4.4Å; A126-Y180 HydrophobicContact CB-CD2 3.67Å; A126-Y180 HydrophobicContact CB-CE1 4.5Å; A126-Y180 HydrophobicContact CB-CE2 3.81Å; A126-Y180 HydrophobicContact CB-CG 3.97Å; Q176-Y180 PolarHBondContact NE2-OH 3.47Å; M178-Y180 HydrophobicContact CB-CD2 4.29Å; M178-Y180 HydrophobicContact CB-CE2 3.89Å; M178-Y180 VanDerWaalsContact O-CD2 3.31Å; M178-Y180 WeakPolarHBondContact O-CD2 3.18Å; M178-Y180 WeakPolarHBondContact O-CE2 3.35Å; Y180-F182 VanDerWaalsContact C-N 3.28Å; Y180-F182 PolarHBondContact O-N 3.49Å; Y180-L308 HydrophobicContact CD1-CB 4.24Å; Y180-L308 VanDerWaalsContact CD1-O 3.28Å; Y180-L308 WeakPolarHBondContact CD1-O 3.3Å; Y180-L308 WeakPolarHBondContact CE1-O 3.41Å; Y180-L309 HydrophobicContact CE1-CD2 4.37Å
181	G	85.8	Confident	88.2	Confident	71 Å²	71	70.8 Å²	70.8	73%	0.732	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.4	1.1	-177.9	0	0	0	0	0	115.2	T179	T179-G181 PolarHBondContact O-N 2.93Å
182	F	87.7	Confident	88.6	Confident	39 Å²	39	75.1 Å²	75.1	17%	0.171	40%	0.397	C	S	.	.			trans	-67.8	142.7	174.9	-69.6	-71.5	0	0	0	112.2	F130 T179 Y180 N305 L308	F130-F182 HydrophobicContact CB-CD2 4.12Å; F130-F182 HydrophobicContact CB-CE1 4.38Å; F130-F182 HydrophobicContact CB-CE2 3.86Å; F130-F182 HydrophobicContact CB-CZ 4.02Å; F130-F182 HydrophobicContact CD1-CB 4.09Å; F130-F182 AromaticContact CD1-CD1 3.7Å; F130-F182 HydrophobicContact CD1-CD1 3.7Å; F130-F182 HydrophobicContact CD1-CD2 4.03Å; F130-F182 HydrophobicContact CD1-CE1 4.16Å; F130-F182 HydrophobicContact CD1-CE2 4.47Å; F130-F182 AromaticContact CD1-CG 3.66Å; F130-F182 HydrophobicContact CD1-CG 3.66Å; F130-F182 HydrophobicContact CD2-CB 4.13Å; F130-F182 AromaticContact CD2-CD2 3.38Å; F130-F182 HydrophobicContact CD2-CD2 3.38Å; F130-F182 AromaticContact CD2-CE2 3.95Å; F130-F182 HydrophobicContact CD2-CE2 3.95Å; F130-F182 AromaticContact CD2-CG 3.77Å; F130-F182 HydrophobicContact CD2-CG 3.77Å; F130-F182 HydrophobicContact CE1-CB 3.55Å; F130-F182 AromaticContact CE1-CD1 3.92Å; F130-F182 HydrophobicContact CE1-CD1 3.92Å; F130-F182 HydrophobicContact CE1-CD2 4.31Å; F130-F182 AromaticContact CE1-CG 3.67Å; F130-F182 HydrophobicContact CE1-CG 3.67Å; F130-F182 HydrophobicContact CE2-CB 3.59Å; F130-F182 AromaticContact CE2-CD2 3.71Å; F130-F182 HydrophobicContact CE2-CD2 3.71Å; F130-F182 AromaticContact CE2-CG 3.77Å; F130-F182 HydrophobicContact CE2-CG 3.77Å; F130-F182 HydrophobicContact CG-CB 4.38Å; F130-F182 HydrophobicContact CG-CD1 4.06Å; F130-F182 AromaticContact CG-CD2 3.58Å; F130-F182 HydrophobicContact CG-CD2 3.58Å; F130-F182 HydrophobicContact CG-CE1 4.29Å; F130-F182 AromaticContact CG-CE2 3.85Å; F130-F182 HydrophobicContact CG-CE2 3.85Å; F130-F182 AromaticContact CG-CG 3.74Å; F130-F182 HydrophobicContact CG-CG 3.74Å; F130-F182 HydrophobicContact CG-CZ 4.22Å; F130-F182 HydrophobicContact CZ-CB 3.28Å; F130-F182 HydrophobicContact CZ-CD1 4.44Å; F130-F182 HydrophobicContact CZ-CD2 4.17Å; F130-F182 AromaticContact CZ-CG 3.74Å; F130-F182 HydrophobicContact CZ-CG 3.74Å; T179-F182 WeakPolarHBondContact O-CB 3.25Å; T179-F182 WeakPolarHBondContact O-CD2 3.42Å; T179-F182 PolarHBondContact O-N 2.94Å; Y180-F182 VanDerWaalsContact C-N 3.28Å; Y180-F182 PolarHBondContact O-N 3.49Å; F182-N305 VanDerWaalsContact CZ-OD1 3.3Å; F182-N305 WeakPolarHBondContact CZ-OD1 3.36Å; F182-L308 HydrophobicContact CE2-CD1 3.73Å; F182-L308 HydrophobicContact CZ-CD1 3.67Å
183	K	85.6	Confident	89.4	Confident	178 Å²	178	66.9 Å²	66.9	77%	0.774	36%	0.358	S	S	*	.			trans	-90.9	133.2	177.2	-63.3	-180	-177.7	175.4	0	110.3	A185	K183-A185 VanDerWaalsContact C-N 3.32Å; K183-A185 PolarHBondContact O-N 3.48Å
184	M	87.8	Confident	90.2	Very high	5 Å²	5	62.4 Å²	62.4	3%	0.025	34%	0.339	C	S	.	.			trans	-94.2	41.3	-178.6	-58.5	-64.3	-177.7	0	0	113.6	L125 F130 L154 C157 D158 T179 N186	L125-M184 HydrophobicContact CD1-CE 3.78Å; F130-M184 HydrophobicContact CE2-CE 3.78Å; F130-M184 HydrophobicContact CE2-SD 4.48Å; F130-M184 HydrophobicContact CZ-CE 3.65Å; F130-M184 HydrophobicContact CZ-SD 3.79Å; L154-M184 HydrophobicContact CD2-SD 4.31Å; C157-M184 HydrophobicContact CB-SD 4.24Å; D158-M184 HydrophobicContact CB-CB 3.67Å; D158-M184 HydrophobicContact CB-CG 4.08Å; T179-M184 HydrophobicContact CG2-CE 3.75Å; M184-N186 VanDerWaalsContact C-N 3.29Å; M184-N186 PolarHBondContact O-N 3.03Å; M184-N186 PolarHBondContact O-OD1 3.32Å
185	A	86.6	Confident	90.8	Very high	10 Å²	10	62.2 Å²	62.2	8%	0.083	34%	0.344	C	S	.	.	S	Bend	trans	55.9	36.9	-176	0	0	0	0	0	114.7	L151 L154 K155 K183 S187 V188	L151-A185 HydrophobicContact CD2-CB 3.66Å; L154-A185 HydrophobicContact CB-CB 4.01Å; L154-A185 HydrophobicContact CD1-CB 3.87Å; K155-A185 WeakPolarHBondContact CE-O 3.43Å; K183-A185 VanDerWaalsContact C-N 3.32Å; K183-A185 PolarHBondContact O-N 3.48Å; A185-S187 PolarHBondContact O-N 3.27Å; A185-S187 VanDerWaalsContact O-N 3.09Å; A185-V188 PolarHBondContact O-N 2.92Å; A185-V188 VanDerWaalsContact O-N 3.08Å
186	N	83.6	Confident	91	Very high	116 Å²	116	64.3 Å²	64.3	62%	0.62	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-17.9	-178.8	-61.1	-0.8	0	0	0	113.8	M184 V188	M184-N186 VanDerWaalsContact C-N 3.29Å; M184-N186 PolarHBondContact O-N 3.03Å; M184-N186 PolarHBondContact O-OD1 3.32Å; N186-V188 PolarHBondContact O-N 2.92Å
187	S	87.3	Confident	91.4	Very high	100 Å²	100	61.6 Å²	61.6	70%	0.699	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-16.3	175.8	51.3	0	0	0	0	113.6	A185	A185-S187 PolarHBondContact O-N 3.27Å; A185-S187 VanDerWaalsContact O-N 3.09Å
188	V	93.1	Very high	91.9	Very high	13 Å²	13	63.3 Å²	63.3	8%	0.079	35%	0.345	C	S	.	.	S	Bend	trans	-117.7	134.2	-177.7	-168.9	0	0	0	0	109.2	L151 K155 A185 N186 R192 V193	L151-V188 HydrophobicContact CD2-CG2 4.45Å; K155-V188 WeakPolarHBondContact CE-O 3.48Å; K155-V188 PolarHBondContact NZ-O 3.32Å; A185-V188 PolarHBondContact O-N 2.92Å; A185-V188 VanDerWaalsContact O-N 3.08Å; N186-V188 PolarHBondContact O-N 2.92Å; V188-R192 HydrophobicContact CG1-CB 3.9Å; V188-R192 HydrophobicContact CG1-CG 3.75Å; V188-V193 HydrophobicContact CB-CG2 4.13Å; V188-V193 HydrophobicContact CG1-CG2 3.6Å
189	T	95.5	Very high	92.3	Very high	92 Å²	92	63 Å²	63	56%	0.564	35%	0.346	S	S	*	.			trans	-74.8	152.6	178.8	63.7	0	0	0	0	111.5	L191 R192 V193	T189-L191 VanDerWaalsContact C-N 3.25Å; T189-L191 PolarHBondContact O-N 2.9Å; T189-R192 PolarHBondContact O-N 3.38Å; T189-R192 WeakPolarHBondContact OG1-CB 3.24Å; T189-R192 PolarHBondContact OG1-N 3.32Å; T189-V193 PolarHBondContact O-N 2.89Å
190	D	94.8	Very high	92.7	Very high	49 Å²	49	61.8 Å²	61.8	26%	0.262	34%	0.338	S	S	.	.	H	α-helix	trans	-59.1	-40.1	179.1	-56.2	-11.6	0	0	0	111.4	K155 R192 V193 T194 I248	K155-D190 WeakPolarHBondContact CD-OD1 3.46Å; K155-D190 VanDerWaalsContact CE-OD1 3.28Å; K155-D190 WeakPolarHBondContact CE-OD1 3.28Å; K155-D190 IonicContact NZ-OD1 3.83Å; K155-D190 PolarHBondContact NZ-OD1 3.44Å; D190-R192 VanDerWaalsContact C-N 3.34Å; D190-R192 PolarHBondContact O-N 2.9Å; D190-V193 PolarHBondContact O-N 3.06Å; D190-T194 WeakPolarHBondContact O-CG2 3.47Å; D190-T194 PolarHBondContact O-N 2.93Å; D190-T194 PolarHBondContact O-OG1 2.82Å; D190-I248 HydrophobicContact CB-CD1 3.73Å; D190-I248 HydrophobicContact CB-CG1 4.22Å
191	L	95.1	Very high	93.1	Very high	142 Å²	142	60.1 Å²	60.1	74%	0.743	33%	0.332	S	S	*	.	H	α-helix	trans	-58.4	-45	174.8	-176.5	64.1	0	0	0	111.5	T189 T194 G195	T189-L191 VanDerWaalsContact C-N 3.25Å; T189-L191 PolarHBondContact O-N 2.9Å; L191-T194 WeakPolarHBondContact CA-OG1 2.87Å; L191-T194 PolarHBondContact O-N 3.47Å; L191-T194 PolarHBondContact O-OG1 3.16Å; L191-G195 PolarHBondContact O-N 3.2Å
192	R	96.8	Very high	93.7	Very high	157 Å²	157	59.3 Å²	59.3	59%	0.592	31%	0.311	S	S	*	.	H	α-helix	trans	-65	-43.2	178.7	179.2	168.1	174.8	-167.9	4.5	111.7	V188 T189 D190 G195 M196	V188-R192 HydrophobicContact CG1-CB 3.9Å; V188-R192 HydrophobicContact CG1-CG 3.75Å; T189-R192 PolarHBondContact O-N 3.38Å; T189-R192 WeakPolarHBondContact OG1-CB 3.24Å; T189-R192 PolarHBondContact OG1-N 3.32Å; D190-R192 VanDerWaalsContact C-N 3.34Å; D190-R192 PolarHBondContact O-N 2.9Å; R192-G195 PolarHBondContact O-N 3.03Å; R192-M196 HydrophobicContact CG-SD 4.32Å; R192-M196 WeakPolarHBondContact O-CG 3.49Å; R192-M196 PolarHBondContact O-N 3.41Å
193	V	97.1	Very high	94	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-63.3	-44.5	176.6	178.6	0	0	0	0	111.1	L151 K155 V188 T189 D190 G195 M196 L197 L244	L151-V193 HydrophobicContact CB-CG1 3.96Å; L151-V193 HydrophobicContact CB-CG2 4.08Å; K155-V193 HydrophobicContact CG-CB 4.45Å; K155-V193 HydrophobicContact CG-CG1 4.39Å; K155-V193 HydrophobicContact CG-CG2 4.08Å; V188-V193 HydrophobicContact CB-CG2 4.13Å; V188-V193 HydrophobicContact CG1-CG2 3.6Å; T189-V193 PolarHBondContact O-N 2.89Å; D190-V193 PolarHBondContact O-N 3.06Å; V193-G195 VanDerWaalsContact C-N 3.29Å; V193-G195 PolarHBondContact O-N 2.91Å; V193-M196 PolarHBondContact O-N 2.89Å; V193-L197 HydrophobicContact CG1-CD1 4.23Å; V193-L197 WeakPolarHBondContact O-CG 3.37Å; V193-L197 PolarHBondContact O-N 2.81Å; V193-L244 HydrophobicContact CB-CD2 4.47Å; V193-L244 HydrophobicContact CG1-CD2 3.9Å
194	T	97.1	Very high	94.3	Very high	22 Å²	22	52 Å²	52	14%	0.135	28%	0.281	C	S	.	.	H	α-helix	trans	-63	-35.1	175.6	57.9	0	0	0	0	112.8	D190 L191 K198 L244 I248	D190-T194 WeakPolarHBondContact O-CG2 3.47Å; D190-T194 PolarHBondContact O-N 2.93Å; D190-T194 PolarHBondContact O-OG1 2.82Å; L191-T194 WeakPolarHBondContact CA-OG1 2.87Å; L191-T194 PolarHBondContact O-N 3.47Å; L191-T194 PolarHBondContact O-OG1 3.16Å; T194-K198 WeakPolarHBondContact O-CB 3.38Å; T194-K198 PolarHBondContact O-N 2.79Å; T194-L244 HydrophobicContact CG2-CD2 3.8Å; T194-L244 HydrophobicContact CG2-CG 4.02Å; T194-I248 HydrophobicContact CG2-CD1 3.81Å
195	G	97.9	Very high	94.6	Very high	27 Å²	27	55 Å²	55	28%	0.278	30%	0.295	S	S	.	.	H	α-helix	trans	-64.2	-48.2	172.4	0	0	0	0	0	112.3	L191 R192 V193 L197 K198 D199	L191-G195 PolarHBondContact O-N 3.2Å; R192-G195 PolarHBondContact O-N 3.03Å; V193-G195 VanDerWaalsContact C-N 3.29Å; V193-G195 PolarHBondContact O-N 2.91Å; G195-L197 VanDerWaalsContact C-N 3.34Å; G195-L197 PolarHBondContact O-N 3.39Å; G195-K198 CarbonylContact O-C 3.24Å; G195-K198 WeakPolarHBondContact O-CA 3.31Å; G195-K198 WeakPolarHBondContact O-CB 3.45Å; G195-K198 PolarHBondContact O-N 2.98Å; G195-D199 PolarHBondContact O-N 2.86Å
196	M	97.8	Very high	94.9	Very high	46 Å²	46	61.9 Å²	61.9	23%	0.227	32%	0.319	C	S	.	.	H	α-helix	trans	-59.3	-43.4	176.5	-69.3	174	66.9	0	0	112.3	K147 A148 L151 R192 V193 K198 D199 V200	K147-M196 HydrophobicContact CD-CE 4.27Å; K147-M196 HydrophobicContact CG-CE 4.28Å; A148-M196 HydrophobicContact CB-CB 4.07Å; L151-M196 HydrophobicContact CD1-CE 3.85Å; L151-M196 HydrophobicContact CD1-SD 4.05Å; R192-M196 HydrophobicContact CG-SD 4.32Å; R192-M196 WeakPolarHBondContact O-CG 3.49Å; R192-M196 PolarHBondContact O-N 3.41Å; V193-M196 PolarHBondContact O-N 2.89Å; M196-K198 VanDerWaalsContact C-N 3.25Å; M196-K198 PolarHBondContact O-N 3.47Å; M196-D199 PolarHBondContact O-N 2.9Å; M196-V200 WeakPolarHBondContact O-CG2 3.37Å; M196-V200 PolarHBondContact O-N 2.99Å; M196-V200 VanDerWaalsContact O-N 3.11Å
197	L	98.1	Very high	95.2	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-62.8	-34.5	174.4	-74	166.6	0	0	0	112	A148 V193 G195 E201 V237 T240 R241 L244	A148-L197 HydrophobicContact CB-CD2 3.92Å; A148-L197 HydrophobicContact CB-CG 4.23Å; A148-L197 WeakPolarHBondContact O-CD2 3.34Å; V193-L197 HydrophobicContact CG1-CD1 4.23Å; V193-L197 WeakPolarHBondContact O-CG 3.37Å; V193-L197 PolarHBondContact O-N 2.81Å; G195-L197 VanDerWaalsContact C-N 3.34Å; G195-L197 PolarHBondContact O-N 3.39Å; L197-E201 WeakPolarHBondContact O-CB 3.39Å; L197-E201 PolarHBondContact O-N 3.03Å; L197-V237 HydrophobicContact CD2-CG1 3.96Å; L197-T240 HydrophobicContact CD1-CG2 4.36Å; L197-T240 HydrophobicContact CD2-CG2 4.49Å; L197-R241 HydrophobicContact CB-CB 3.89Å; L197-R241 HydrophobicContact CB-CG 3.92Å; L197-R241 HydrophobicContact CD1-CB 4.09Å; L197-R241 HydrophobicContact CD1-CG 4.38Å; L197-L244 HydrophobicContact CD1-CD2 4.16Å
198	K	98	Very high	95.3	Very high	69 Å²	69	58.6 Å²	58.6	30%	0.3	29%	0.285	S	S	.	.	H	α-helix	trans	-70.9	-40.4	177.1	-176.9	55.4	-178.8	148.2	0	111.9	T194 G195 M196 V200 E201 D202	T194-K198 WeakPolarHBondContact O-CB 3.38Å; T194-K198 PolarHBondContact O-N 2.79Å; G195-K198 CarbonylContact O-C 3.24Å; G195-K198 WeakPolarHBondContact O-CA 3.31Å; G195-K198 WeakPolarHBondContact O-CB 3.45Å; G195-K198 PolarHBondContact O-N 2.98Å; M196-K198 VanDerWaalsContact C-N 3.25Å; M196-K198 PolarHBondContact O-N 3.47Å; K198-V200 VanDerWaalsContact C-N 3.33Å; K198-V200 PolarHBondContact O-N 3.38Å; K198-E201 HydrophobicContact CD-CB 4.48Å; K198-E201 IonicContact NZ-OE1 3.54Å; K198-E201 PolarHBondContact NZ-OE1 3.2Å; K198-E201 IonicContact NZ-OE2 2.67Å; K198-E201 WeakPolarHBondContact O-CB 3.43Å; K198-E201 PolarHBondContact O-N 3.22Å; K198-D202 WeakPolarHBondContact CE-OD1 3.42Å; K198-D202 WeakPolarHBondContact CE-OD2 3.38Å; K198-D202 IonicContact NZ-OD1 2.81Å; K198-D202 PolarHBondContact NZ-OD1 3.35Å; K198-D202 IonicContact NZ-OD2 3.58Å; K198-D202 PolarHBondContact O-N 3.11Å
199	D	97.9	Very high	95.1	Very high	109 Å²	109	64.3 Å²	64.3	58%	0.583	31%	0.309	S	S	*	.	H	α-helix	trans	-61.4	-43.3	175.9	-64.1	-26.8	0	0	0	111.2	G195 M196 D202 D203	G195-D199 PolarHBondContact O-N 2.86Å; M196-D199 PolarHBondContact O-N 2.9Å; D199-D202 PolarHBondContact O-N 3.4Å; D199-D203 PolarHBondContact O-N 3.38Å
200	V	97.2	Very high	94.6	Very high	12 Å²	12	64.5 Å²	64.5	7%	0.073	31%	0.314	C	S	.	.	H	α-helix	trans	-65.1	-43	173.9	175.5	0	0	0	0	111.1	P144 A145 A148 M196 K198 D202 D203 M204 V237	P144-V200 HydrophobicContact CB-CG2 4.3Å; A145-V200 HydrophobicContact CB-CG1 3.67Å; A148-V200 HydrophobicContact CB-CG2 3.95Å; M196-V200 WeakPolarHBondContact O-CG2 3.37Å; M196-V200 PolarHBondContact O-N 2.99Å; M196-V200 VanDerWaalsContact O-N 3.11Å; K198-V200 VanDerWaalsContact C-N 3.33Å; K198-V200 PolarHBondContact O-N 3.38Å; V200-D202 VanDerWaalsContact C-N 3.29Å; V200-D202 PolarHBondContact O-N 2.98Å; V200-D203 PolarHBondContact O-N 3.35Å; V200-M204 HydrophobicContact CG1-CG 4.23Å; V200-M204 WeakPolarHBondContact O-CB 3.4Å; V200-M204 VanDerWaalsContact O-CG 3.31Å; V200-M204 WeakPolarHBondContact O-CG 3.42Å; V200-M204 PolarHBondContact O-N 3Å; V200-V237 HydrophobicContact CB-CG1 4.14Å; V200-V237 HydrophobicContact CG1-CG1 3.85Å; V200-V237 HydrophobicContact CG1-CG2 4.13Å
201	E	95.9	Very high	94	Very high	5 Å²	5	62.9 Å²	62.9	2%	0.023	31%	0.306	C	S	.	.	H	α-helix	trans	-55.2	-45.6	174.4	178.4	-170.4	155.1	0	0	111	L197 K198 M204 Q205 F234 K238 R241	L197-E201 WeakPolarHBondContact O-CB 3.39Å; L197-E201 PolarHBondContact O-N 3.03Å; K198-E201 HydrophobicContact CD-CB 4.48Å; K198-E201 IonicContact NZ-OE1 3.54Å; K198-E201 PolarHBondContact NZ-OE1 3.2Å; K198-E201 IonicContact NZ-OE2 2.67Å; K198-E201 WeakPolarHBondContact O-CB 3.43Å; K198-E201 PolarHBondContact O-N 3.22Å; E201-M204 PolarHBondContact O-N 2.87Å; E201-Q205 VanDerWaalsContact O-CB 3.28Å; E201-Q205 WeakPolarHBondContact O-CB 3.42Å; E201-Q205 PolarHBondContact O-N 3.06Å; E201-F234 HydrophobicContact CG-CD2 4.05Å; E201-F234 HydrophobicContact CG-CE2 3.41Å; E201-F234 VanDerWaalsContact CG-CE2 3.41Å; E201-F234 HydrophobicContact CG-CZ 4.15Å; E201-K238 HydrophobicContact CG-CB 4.3Å; E201-K238 HydrophobicContact CG-CD 4.25Å; E201-K238 HydrophobicContact CG-CG 4.36Å; E201-K238 WeakPolarHBondContact OE1-CD 3.42Å; E201-K238 WeakPolarHBondContact OE1-CE 3.36Å; E201-K238 IonicContact OE1-NZ 3.17Å; E201-R241 IonicContact OE1-NH2 3Å; E201-R241 IonicContact OE2-CZ 3.78Å; E201-R241 IonicContact OE2-NE 3.56Å; E201-R241 PolarHBondContact OE2-NE 2.97Å; E201-R241 IonicContact OE2-NH2 2.78Å; E201-R241 PolarHBondContact OE2-NH2 2.91Å
202	D	96.4	Very high	93.2	Very high	55 Å²	55	65.2 Å²	65.2	29%	0.294	31%	0.305	S	S	.	.	H	α-helix	trans	-72.4	-32.8	-178	-70.5	-20.1	0	0	0	112.7	K198 D199 V200 R206	K198-D202 WeakPolarHBondContact CE-OD1 3.42Å; K198-D202 WeakPolarHBondContact CE-OD2 3.38Å; K198-D202 IonicContact NZ-OD1 2.81Å; K198-D202 PolarHBondContact NZ-OD1 3.35Å; K198-D202 IonicContact NZ-OD2 3.58Å; K198-D202 PolarHBondContact O-N 3.11Å; D199-D202 PolarHBondContact O-N 3.4Å; V200-D202 VanDerWaalsContact C-N 3.29Å; V200-D202 PolarHBondContact O-N 2.98Å; D202-R206 WeakPolarHBondContact O-CG 3.42Å; D202-R206 PolarHBondContact O-N 3.09Å; D202-R206 PolarHBondContact O-NE 3.36Å
203	D	94.8	Very high	91.9	Very high	46 Å²	46	59.5 Å²	59.5	25%	0.246	29%	0.289	C	S	.	.	H	α-helix	trans	-65.4	-50.2	169.8	-165.7	62.3	0	0	0	111.8	D199 V200 Q205 R206 R207	D199-D203 PolarHBondContact O-N 3.38Å; V200-D203 PolarHBondContact O-N 3.35Å; D203-Q205 VanDerWaalsContact C-N 3.29Å; D203-Q205 PolarHBondContact O-N 3.47Å; D203-R206 WeakPolarHBondContact O-CB 3.3Å; D203-R206 PolarHBondContact O-N 2.78Å; D203-R206 VanDerWaalsContact O-N 3.09Å; D203-R206 IonicContact OD1-CZ 2.82Å; D203-R206 IonicContact OD1-NH2 3.59Å; D203-R206 PolarHBondContact OD1-NH2 3.41Å; D203-R207 PolarHBondContact O-N 3.31Å; D203-R207 VanDerWaalsContact O-N 3.1Å; D203-R207 IonicContact OD2-CZ 3.53Å; D203-R207 IonicContact OD2-NE 3.65Å; D203-R207 PolarHBondContact OD2-NE 3.15Å; D203-R207 IonicContact OD2-NH2 2.71Å; D203-R207 PolarHBondContact OD2-NH2 3.06Å
204	M	92.6	Very high	90.8	Very high	16 Å²	16	68.7 Å²	68.7	8%	0.079	32%	0.324	C	S	.	.	H	α-helix	trans	-62.1	-38	177.8	-67.9	-60.9	115.9	0	0	111.4	V200 E201 R206 R207 V208 V233 F234	V200-M204 HydrophobicContact CG1-CG 4.23Å; V200-M204 WeakPolarHBondContact O-CB 3.4Å; V200-M204 VanDerWaalsContact O-CG 3.31Å; V200-M204 WeakPolarHBondContact O-CG 3.42Å; V200-M204 PolarHBondContact O-N 3Å; E201-M204 PolarHBondContact O-N 2.87Å; M204-R206 VanDerWaalsContact C-N 3.3Å; M204-R206 PolarHBondContact O-N 3.07Å; M204-R207 PolarHBondContact O-N 2.7Å; M204-V208 VanDerWaalsContact O-CG2 3.3Å; M204-V208 WeakPolarHBondContact O-CG2 3.39Å; M204-V208 PolarHBondContact O-N 3.04Å; M204-V233 HydrophobicContact CG-CG1 4.43Å; M204-V233 HydrophobicContact SD-CG1 4.16Å; M204-F234 HydrophobicContact CB-CB 4.01Å; M204-F234 HydrophobicContact CB-CD2 4.07Å
205	Q	93.5	Very high	89.1	Confident	69 Å²	69	77.5 Å²	77.5	32%	0.322	36%	0.364	S	S	.	.	H	α-helix	trans	-63.8	-35.5	176	-166.4	175.8	19.2	0	0	112.4	E201 D203 K209 F234	E201-Q205 VanDerWaalsContact O-CB 3.28Å; E201-Q205 WeakPolarHBondContact O-CB 3.42Å; E201-Q205 PolarHBondContact O-N 3.06Å; D203-Q205 VanDerWaalsContact C-N 3.29Å; D203-Q205 PolarHBondContact O-N 3.47Å; Q205-K209 VanDerWaalsContact O-CG 3.32Å; Q205-K209 WeakPolarHBondContact O-CG 3.25Å; Q205-K209 PolarHBondContact O-N 3.09Å; Q205-F234 HydrophobicContact CB-CD2 4.27Å; Q205-F234 HydrophobicContact CB-CE2 3.86Å; Q205-F234 HydrophobicContact CG-CE2 4.29Å
206	R	93.3	Very high	87.5	Confident	154 Å²	154	80.3 Å²	80.3	58%	0.581	39%	0.392	S	S	*	.	H	α-helix	trans	-65.1	-43.8	173.6	-76.5	178.6	-77.6	153.9	-0.3	111.1	D202 D203 M204 K209 S210	D202-R206 WeakPolarHBondContact O-CG 3.42Å; D202-R206 PolarHBondContact O-N 3.09Å; D202-R206 PolarHBondContact O-NE 3.36Å; D203-R206 WeakPolarHBondContact O-CB 3.3Å; D203-R206 PolarHBondContact O-N 2.78Å; D203-R206 VanDerWaalsContact O-N 3.09Å; D203-R206 IonicContact OD1-CZ 2.82Å; D203-R206 IonicContact OD1-NH2 3.59Å; D203-R206 PolarHBondContact OD1-NH2 3.41Å; M204-R206 VanDerWaalsContact C-N 3.3Å; M204-R206 PolarHBondContact O-N 3.07Å; R206-K209 PolarHBondContact O-N 3.3Å; R206-S210 PolarHBondContact O-N 3.4Å; R206-S210 PolarHBondContact O-OG 2.93Å
207	R	88.8	Confident	86.4	Confident	126 Å²	126	83.9 Å²	83.9	48%	0.475	41%	0.409	S	S	.	.	H	α-helix	trans	-63.5	-40.7	175.5	-62.3	-176.2	-164.4	-157.3	3.7	113	D203 M204 K209 S210 T211	D203-R207 PolarHBondContact O-N 3.31Å; D203-R207 VanDerWaalsContact O-N 3.1Å; D203-R207 IonicContact OD2-CZ 3.53Å; D203-R207 IonicContact OD2-NE 3.65Å; D203-R207 PolarHBondContact OD2-NE 3.15Å; D203-R207 IonicContact OD2-NH2 2.71Å; D203-R207 PolarHBondContact OD2-NH2 3.06Å; M204-R207 PolarHBondContact O-N 2.7Å; R207-K209 VanDerWaalsContact C-N 3.3Å; R207-K209 PolarHBondContact O-N 2.77Å; R207-S210 WeakPolarHBondContact CA-OG 3.36Å; R207-S210 PolarHBondContact O-N 3.21Å; R207-S210 PolarHBondContact O-OG 3.38Å; R207-T211 WeakPolarHBondContact O-CB 3.48Å; R207-T211 WeakPolarHBondContact O-CG2 3.43Å; R207-T211 PolarHBondContact O-N 3.12Å; R207-T211 PolarHBondContact O-OG1 3.18Å
208	V	89.4	Confident	84.6	Confident	22 Å²	22	93.6 Å²	93.6	13%	0.133	45%	0.454	C	S	.	.	H	α-helix	trans	-62.7	-38.5	174.4	169.9	0	0	0	0	111	M204 T211 R212 H227 C230 L231	M204-V208 VanDerWaalsContact O-CG2 3.3Å; M204-V208 WeakPolarHBondContact O-CG2 3.39Å; M204-V208 PolarHBondContact O-N 3.04Å; V208-T211 WeakPolarHBondContact CA-OG1 3.37Å; V208-T211 PolarHBondContact O-OG1 3.04Å; V208-R212 PolarHBondContact O-N 3.14Å; V208-H227 PolarHBondContact O-CE1 3.26Å; V208-H227 VanDerWaalsContact O-CE1 3.26Å; V208-H227 PolarHBondContact O-ND1 3.49Å; V208-C230 HydrophobicContact CG2-CB 3.89Å; V208-L231 HydrophobicContact CG1-CD1 4.17Å; V208-L231 HydrophobicContact CG2-CB 4.41Å; V208-L231 HydrophobicContact CG2-CD1 4.48Å
209	K	89	Confident	83.3	Confident	132 Å²	132	94.4 Å²	94.4	57%	0.574	46%	0.455	S	S	*	.	H	α-helix	trans	-69.8	-37.8	176.2	-74.7	173.3	-178.1	174.8	0	112.6	Q205 R206 R207 T211 R212	Q205-K209 VanDerWaalsContact O-CG 3.32Å; Q205-K209 WeakPolarHBondContact O-CG 3.25Å; Q205-K209 PolarHBondContact O-N 3.09Å; R206-K209 PolarHBondContact O-N 3.3Å; R207-K209 VanDerWaalsContact C-N 3.3Å; R207-K209 PolarHBondContact O-N 2.77Å; K209-T211 VanDerWaalsContact C-N 3.35Å; K209-R212 WeakPolarHBondContact O-CB 3.48Å; K209-R212 PolarHBondContact O-N 2.99Å
210	S	85.4	Confident	82.5	Confident	96 Å²	96	93.5 Å²	93.5	67%	0.671	45%	0.45	S	S	*	.	H	α-helix	trans	-71.8	-29.7	179	60.2	0	0	0	0	113	R206 R207 R212	R206-S210 PolarHBondContact O-N 3.4Å; R206-S210 PolarHBondContact O-OG 2.93Å; R207-S210 WeakPolarHBondContact CA-OG 3.36Å; R207-S210 PolarHBondContact O-N 3.21Å; R207-S210 PolarHBondContact O-OG 3.38Å; S210-R212 VanDerWaalsContact C-N 3.33Å
211	T	82.4	Confident	81.9	Confident	16 Å²	16	98 Å²	98	10%	0.098	48%	0.48	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	3.2	176.9	53.9	0	0	0	0	113.2	R207 V208 K209 R219 E226 H227	R207-T211 WeakPolarHBondContact O-CB 3.48Å; R207-T211 WeakPolarHBondContact O-CG2 3.43Å; R207-T211 PolarHBondContact O-N 3.12Å; R207-T211 PolarHBondContact O-OG1 3.18Å; V208-T211 WeakPolarHBondContact CA-OG1 3.37Å; V208-T211 PolarHBondContact O-OG1 3.04Å; K209-T211 VanDerWaalsContact C-N 3.35Å; T211-R219 PolarHBondContact O-NH2 3.44Å; T211-E226 HydrophobicContact CG2-CG 4.48Å; T211-H227 PolarHBondContact O-ND1 3.27Å; T211-H227 PolarHBondContact OG1-ND1 2.93Å
212	R	78.3	Confident	81.4	Confident	190 Å²	190	105 Å²	105	72%	0.717	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-79.1	123.6	-179.3	-169.8	179.7	-177.6	-176.7	1.7	110.7	V208 K209 S210	V208-R212 PolarHBondContact O-N 3.14Å; K209-R212 WeakPolarHBondContact O-CB 3.48Å; K209-R212 PolarHBondContact O-N 2.99Å; S210-R212 VanDerWaalsContact C-N 3.33Å
213	S	69.6	Low	80.8	Confident	37 Å²	37	105.2 Å²	105.2	26%	0.259	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-72.5	151.5	174	-179.6	0	0	0	0	112.6
214	R	72.7	Confident	80.5	Confident	194 Å²	194	105.2 Å²	105.2	73%	0.732	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-77.6	150.1	171	-69.1	179.2	176.6	-179.4	0.5	109.9	G216 E217	R214-G216 PolarHBondContact O-N 3Å; R214-G216 VanDerWaalsContact O-N 3.14Å; R214-E217 PolarHBondContact O-N 3.3Å
215	Q	61.9	Low	80.4	Confident	207 Å²	207	108.2 Å²	108.2	97%	0.967	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	119.6	178.6	-92.2	-178.8	-18.9	0	0	110.7
216	G	65.2	Low	80.2	Confident	86 Å²	86	109.8 Å²	109.8	89%	0.887	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	105.2	-0.7	173.4	0	0	0	0	0	116.4	R214	R214-G216 PolarHBondContact O-N 3Å; R214-G216 VanDerWaalsContact O-N 3.14Å
217	E	74.6	Confident	80.1	Confident	121 Å²	121	103.7 Å²	103.7	57%	0.565	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-95	127.8	175.9	-70.7	173.9	178.2	0	0	111.2	R214	R214-E217 PolarHBondContact O-N 3.3Å
218	E	60	Low	80.2	Confident	203 Å²	203	101 Å²	101	95%	0.949	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-66.1	135.7	167.7	-83.8	-171.8	157.9	0	0	110
219	R	70.6	Confident	80.5	Confident	87 Å²	87	101.6 Å²	101.6	33%	0.328	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-92.2	143.5	-169.6	-117.2	164.8	170.5	176.5	-10.1	111.5	T211 P221 E224 H227	T211-R219 PolarHBondContact O-NH2 3.44Å; R219-P221 VanDerWaalsContact O-CD 3.3Å; R219-P221 WeakPolarHBondContact O-CD 3.27Å; R219-E224 HydrophobicContact CB-CB 4.41Å; R219-E224 VanDerWaalsContact CD-OE2 3.32Å; R219-E224 WeakPolarHBondContact CD-OE2 3.45Å; R219-E224 HydrophobicContact CG-CB 4.36Å; R219-E224 IonicContact CZ-OE2 3.68Å; R219-E224 IonicContact NE-OE2 2.94Å; R219-E224 PolarHBondContact NE-OE2 3.24Å; R219-E224 VanDerWaalsContact NE-OE2 3.13Å; R219-E224 IonicContact NH1-OE1 3.31Å; R219-E224 IonicContact NH1-OE2 3.15Å; R219-E224 PolarHBondContact NH1-OE2 3.5Å; R219-E224 IonicContact NH2-OE2 3.34Å; R219-E224 PolarHBondContact NH2-OE2 2.86Å; R219-H227 PolarHBondContact NH2-CD2 2.74Å; R219-H227 VanDerWaalsContact NH2-CD2 3.33Å; R219-H227 VanDerWaalsContact NH2-CG 3.31Å
220	D	81	Confident	80.7	Confident	90 Å²	90	95.6 Å²	95.6	48%	0.481	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-65.9	125.8	159.3	-176	-16.8	0	0	0	109.9	E222 V223 E224	D220-E222 VanDerWaalsContact C-N 3.28Å; D220-E222 PolarHBondContact O-N 2.81Å; D220-E222 VanDerWaalsContact O-N 3.16Å; D220-E222 PolarHBondContact OD1-N 3.49Å; D220-E222 VanDerWaalsContact OD1-N 3.14Å; D220-V223 HydrophobicContact CB-CB 4.38Å; D220-V223 HydrophobicContact CB-CG2 4.08Å; D220-V223 PolarHBondContact O-N 3.46Å; D220-E224 PolarHBondContact O-N 3.35Å; D220-E224 VanDerWaalsContact O-N 3.12Å
221	P	84.4	Confident	81.1	Confident	106 Å²	106	94.4 Å²	94.4	69%	0.688	47%	0.47	S	S	*	.	H	α-helix	trans	-3.3	-73.3	153	43.7	-26.4	0	0	0	117.9	R219 L225	R219-P221 VanDerWaalsContact O-CD 3.3Å; R219-P221 WeakPolarHBondContact O-CD 3.27Å; P221-L225 PolarHBondContact O-N 3.45Å
222	E	84.9	Confident	81.8	Confident	153 Å²	153	93.7 Å²	93.7	72%	0.715	47%	0.466	S	S	*	.	H	α-helix	trans	-78.2	-39.7	-163.6	-64.7	-174.9	167.1	0	0	111.2	D220 E224 L225 E226	D220-E222 VanDerWaalsContact C-N 3.28Å; D220-E222 PolarHBondContact O-N 2.81Å; D220-E222 VanDerWaalsContact O-N 3.16Å; D220-E222 PolarHBondContact OD1-N 3.49Å; D220-E222 VanDerWaalsContact OD1-N 3.14Å; E222-E224 VanDerWaalsContact C-N 3.29Å; E222-E224 PolarHBondContact O-N 2.98Å; E222-L225 PolarHBondContact O-N 3.44Å; E222-E226 WeakPolarHBondContact O-CB 3.36Å; E222-E226 PolarHBondContact O-N 3.15Å
223	V	85.1	Confident	82.6	Confident	58 Å²	58	84.7 Å²	84.7	35%	0.352	43%	0.431	S	S	.	.	H	α-helix	trans	-67	-35	177.3	-177.4	0	0	0	0	110.7	D220 H227	D220-V223 HydrophobicContact CB-CB 4.38Å; D220-V223 HydrophobicContact CB-CG2 4.08Å; D220-V223 PolarHBondContact O-N 3.46Å; V223-H227 WeakPolarHBondContact O-CB 3.26Å; V223-H227 PolarHBondContact O-N 2.97Å
224	E	87.8	Confident	84	Confident	47 Å²	47	84 Å²	84	22%	0.22	42%	0.424	C	S	.	.	H	α-helix	trans	-66.9	-44.4	173.6	176.4	52.9	177.4	0	0	112.1	R219 D220 E222 E226 H227 Q228	R219-E224 HydrophobicContact CB-CB 4.41Å; R219-E224 VanDerWaalsContact CD-OE2 3.32Å; R219-E224 WeakPolarHBondContact CD-OE2 3.45Å; R219-E224 HydrophobicContact CG-CB 4.36Å; R219-E224 IonicContact CZ-OE2 3.68Å; R219-E224 IonicContact NE-OE2 2.94Å; R219-E224 PolarHBondContact NE-OE2 3.24Å; R219-E224 VanDerWaalsContact NE-OE2 3.13Å; R219-E224 IonicContact NH1-OE1 3.31Å; R219-E224 IonicContact NH1-OE2 3.15Å; R219-E224 PolarHBondContact NH1-OE2 3.5Å; R219-E224 IonicContact NH2-OE2 3.34Å; R219-E224 PolarHBondContact NH2-OE2 2.86Å; D220-E224 PolarHBondContact O-N 3.35Å; D220-E224 VanDerWaalsContact O-N 3.12Å; E222-E224 VanDerWaalsContact C-N 3.29Å; E222-E224 PolarHBondContact O-N 2.98Å; E224-E226 PolarHBondContact O-N 3.37Å; E224-H227 WeakPolarHBondContact O-CB 3.4Å; E224-H227 PolarHBondContact O-N 3.43Å; E224-Q228 VanDerWaalsContact O-CG 3.32Å; E224-Q228 WeakPolarHBondContact O-CG 3.41Å; E224-Q228 PolarHBondContact O-N 2.7Å; E224-Q228 PolarHBondContact OE1-NE2 3.5Å
225	L	89.8	Confident	85.1	Confident	79 Å²	79	74.9 Å²	74.9	41%	0.414	39%	0.39	S	S	.	.	H	α-helix	trans	-61.7	-44.6	176.7	-177.6	62.2	0	0	0	111.3	P221 E222 H227 Q228 Q229	P221-L225 PolarHBondContact O-N 3.45Å; E222-L225 PolarHBondContact O-N 3.44Å; L225-H227 VanDerWaalsContact C-N 3.33Å; L225-H227 PolarHBondContact O-N 3.26Å; L225-Q228 PolarHBondContact O-N 3.07Å; L225-Q229 HydrophobicContact CD1-CG 4.34Å; L225-Q229 WeakPolarHBondContact O-CB 3.45Å; L225-Q229 VanDerWaalsContact O-CG 3.26Å; L225-Q229 WeakPolarHBondContact O-CG 3.38Å; L225-Q229 PolarHBondContact O-N 3.03Å
226	E	89.2	Confident	86.9	Confident	102 Å²	102	65 Å²	65	48%	0.477	34%	0.344	S	S	.	.	H	α-helix	trans	-59.6	-43.7	175.6	-173	-174.2	-177.2	0	0	111.3	T211 E222 E224 Q229 C230	T211-E226 HydrophobicContact CG2-CG 4.48Å; E222-E226 WeakPolarHBondContact O-CB 3.36Å; E222-E226 PolarHBondContact O-N 3.15Å; E224-E226 PolarHBondContact O-N 3.37Å; E226-Q229 PolarHBondContact O-N 3.42Å; E226-C230 WeakPolarHBondContact O-CB 3.44Å; E226-C230 PolarHBondContact O-N 3.32Å; E226-C230 PolarHBondContact O-SG 3.27Å
227	H	91.1	Very high	88.4	Confident	25 Å²	25	61 Å²	61	12%	0.116	30%	0.302	C	S	.	.	H	α-helix	trans	-59.9	-48.5	176.7	-178	72.9	0	0	0	111.9	V208 T211 R219 V223 E224 L225 C230 L231	V208-H227 PolarHBondContact O-CE1 3.26Å; V208-H227 VanDerWaalsContact O-CE1 3.26Å; V208-H227 PolarHBondContact O-ND1 3.49Å; T211-H227 PolarHBondContact O-ND1 3.27Å; T211-H227 PolarHBondContact OG1-ND1 2.93Å; R219-H227 PolarHBondContact NH2-CD2 2.74Å; R219-H227 VanDerWaalsContact NH2-CD2 3.33Å; R219-H227 VanDerWaalsContact NH2-CG 3.31Å; V223-H227 WeakPolarHBondContact O-CB 3.26Å; V223-H227 PolarHBondContact O-N 2.97Å; E224-H227 WeakPolarHBondContact O-CB 3.4Å; E224-H227 PolarHBondContact O-N 3.43Å; L225-H227 VanDerWaalsContact C-N 3.33Å; L225-H227 PolarHBondContact O-N 3.26Å; H227-C230 PolarHBondContact O-N 3.5Å; H227-L231 WeakPolarHBondContact O-CB 3.44Å; H227-L231 PolarHBondContact O-N 3.46Å
228	Q	92.7	Very high	89.5	Confident	70 Å²	70	56.7 Å²	56.7	33%	0.327	28%	0.281	S	S	.	.	H	α-helix	trans	-62.5	-43.1	178.9	-70.6	177.3	5.1	0	0	111.7	E224 L225 L231 A232 H281	E224-Q228 VanDerWaalsContact O-CG 3.32Å; E224-Q228 WeakPolarHBondContact O-CG 3.41Å; E224-Q228 PolarHBondContact O-N 2.7Å; E224-Q228 PolarHBondContact OE1-NE2 3.5Å; L225-Q228 PolarHBondContact O-N 3.07Å; Q228-L231 PolarHBondContact O-N 3.43Å; Q228-A232 WeakPolarHBondContact O-CB 3.47Å; Q228-A232 PolarHBondContact O-N 2.85Å; Q228-H281 PolarHBondContact OE1-NE2 3.16Å
229	Q	94.3	Very high	91.4	Very high	35 Å²	35	47.1 Å²	47.1	16%	0.164	24%	0.237	C	C	.	.	H	α-helix	trans	-66.1	-41.8	177.3	-72	177.4	1.1	0	0	112.3	L225 E226 L231 A232 V233 H281	L225-Q229 HydrophobicContact CD1-CG 4.34Å; L225-Q229 WeakPolarHBondContact O-CB 3.45Å; L225-Q229 VanDerWaalsContact O-CG 3.26Å; L225-Q229 WeakPolarHBondContact O-CG 3.38Å; L225-Q229 PolarHBondContact O-N 3.03Å; E226-Q229 PolarHBondContact O-N 3.42Å; Q229-L231 VanDerWaalsContact C-N 3.33Å; Q229-L231 PolarHBondContact O-N 3.45Å; Q229-A232 WeakPolarHBondContact O-CB 3.49Å; Q229-A232 PolarHBondContact O-N 3.2Å; Q229-V233 WeakPolarHBondContact O-CG2 3.32Å; Q229-V233 PolarHBondContact O-N 3.49Å; Q229-H281 HydrophobicContact CG-CB 4.24Å
230	C	92.8	Very high	92.7	Very high	6 Å²	6	43 Å²	43	4%	0.041	22%	0.221	C	C	.	.	H	α-helix	trans	-61.3	-42.1	174	-73.1	0	0	0	0	111.6	V208 E226 H227 A232 V233 F234	V208-C230 HydrophobicContact CG2-CB 3.89Å; E226-C230 WeakPolarHBondContact O-CB 3.44Å; E226-C230 PolarHBondContact O-N 3.32Å; E226-C230 PolarHBondContact O-SG 3.27Å; H227-C230 PolarHBondContact O-N 3.5Å; C230-A232 VanDerWaalsContact C-N 3.31Å; C230-A232 PolarHBondContact O-N 2.94Å; C230-V233 PolarHBondContact O-N 3.23Å; C230-F234 VanDerWaalsContact O-CB 3.32Å; C230-F234 WeakPolarHBondContact O-CB 3.36Å; C230-F234 PolarHBondContact O-N 3.39Å
231	L	94.6	Very high	93.5	Very high	71 Å²	71	40.3 Å²	40.3	37%	0.372	20%	0.204	S	C	.	.	H	α-helix	trans	-64.6	-36.9	176	-172.8	67.8	0	0	0	111.6	V208 H227 Q228 Q229 F234 S235	V208-L231 HydrophobicContact CG1-CD1 4.17Å; V208-L231 HydrophobicContact CG2-CB 4.41Å; V208-L231 HydrophobicContact CG2-CD1 4.48Å; H227-L231 WeakPolarHBondContact O-CB 3.44Å; H227-L231 PolarHBondContact O-N 3.46Å; Q228-L231 PolarHBondContact O-N 3.43Å; Q229-L231 VanDerWaalsContact C-N 3.33Å; Q229-L231 PolarHBondContact O-N 3.45Å; L231-F234 HydrophobicContact CD1-CD1 4.31Å; L231-F234 PolarHBondContact O-N 2.87Å; L231-S235 WeakPolarHBondContact O-CB 3.27Å; L231-S235 PolarHBondContact O-N 3.46Å; L231-S235 PolarHBondContact O-OG 3.4Å
232	A	96.5	Very high	94.2	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.008	17%	0.171	C	C	.	.	H	α-helix	trans	-65.2	-44.2	177.3	0	0	0	0	0	112.5	I106 Q228 Q229 C230 S235 R236	I106-A232 HydrophobicContact CD1-CB 3.58Å; I106-A232 HydrophobicContact CG1-CB 4.09Å; Q228-A232 WeakPolarHBondContact O-CB 3.47Å; Q228-A232 PolarHBondContact O-N 2.85Å; Q229-A232 WeakPolarHBondContact O-CB 3.49Å; Q229-A232 PolarHBondContact O-N 3.2Å; C230-A232 VanDerWaalsContact C-N 3.31Å; C230-A232 PolarHBondContact O-N 2.94Å; A232-S235 PolarHBondContact O-N 3.02Å; A232-R236 WeakPolarHBondContact O-CG 3.42Å; A232-R236 PolarHBondContact O-N 2.67Å; A232-R236 PolarHBondContact O-NH1 3.39Å
233	V	96.8	Very high	94.8	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-64.8	-48	173.7	176.5	0	0	0	0	110.5	L105 I106 M204 Q229 C230 S235 R236 V237	L105-V233 HydrophobicContact CB-CG2 4.19Å; L105-V233 HydrophobicContact CD1-CG1 4.22Å; L105-V233 HydrophobicContact CD1-CG2 4.41Å; I106-V233 HydrophobicContact CD1-CG2 4.17Å; I106-V233 HydrophobicContact CG1-CG2 3.76Å; M204-V233 HydrophobicContact CG-CG1 4.43Å; M204-V233 HydrophobicContact SD-CG1 4.16Å; Q229-V233 WeakPolarHBondContact O-CG2 3.32Å; Q229-V233 PolarHBondContact O-N 3.49Å; C230-V233 PolarHBondContact O-N 3.23Å; V233-S235 VanDerWaalsContact C-N 3.26Å; V233-S235 PolarHBondContact O-N 3.48Å; V233-R236 PolarHBondContact O-N 2.92Å; V233-V237 HydrophobicContact CG1-CG2 4.27Å; V233-V237 WeakPolarHBondContact O-CG2 3.24Å; V233-V237 PolarHBondContact O-N 3.23Å
234	F	96.9	Very high	95.4	Very high	22 Å²	22	25.6 Å²	25.6	10%	0.096	12%	0.123	C	C	.	.	H	α-helix	trans	-51.8	-46.6	176.2	169.7	-95.6	0	0	0	111.7	E201 M204 Q205 C230 L231 R236 V237 K238	E201-F234 HydrophobicContact CG-CD2 4.05Å; E201-F234 HydrophobicContact CG-CE2 3.41Å; E201-F234 VanDerWaalsContact CG-CE2 3.41Å; E201-F234 HydrophobicContact CG-CZ 4.15Å; M204-F234 HydrophobicContact CB-CB 4.01Å; M204-F234 HydrophobicContact CB-CD2 4.07Å; Q205-F234 HydrophobicContact CB-CD2 4.27Å; Q205-F234 HydrophobicContact CB-CE2 3.86Å; Q205-F234 HydrophobicContact CG-CE2 4.29Å; C230-F234 VanDerWaalsContact O-CB 3.32Å; C230-F234 WeakPolarHBondContact O-CB 3.36Å; C230-F234 PolarHBondContact O-N 3.39Å; L231-F234 HydrophobicContact CD1-CD1 4.31Å; L231-F234 PolarHBondContact O-N 2.87Å; F234-R236 PolarHBondContact O-N 3.37Å; F234-V237 PolarHBondContact O-N 3.23Å; F234-K238 HydrophobicContact CE1-CD 3.87Å; F234-K238 HydrophobicContact CE2-CD 4.32Å; F234-K238 HydrophobicContact CZ-CD 3.59Å; F234-K238 WeakPolarHBondContact O-CB 3.38Å; F234-K238 PolarHBondContact O-N 3.38Å
235	S	97.6	Very high	95.8	Very high	4 Å²	4	25.3 Å²	25.3	3%	0.028	12%	0.124	C	C	.	.	H	α-helix	trans	-64.3	-40.2	-176.2	-58.3	0	0	0	0	111.8	L231 A232 V233 F239	L231-S235 WeakPolarHBondContact O-CB 3.27Å; L231-S235 PolarHBondContact O-N 3.46Å; L231-S235 PolarHBondContact O-OG 3.4Å; A232-S235 PolarHBondContact O-N 3.02Å; V233-S235 VanDerWaalsContact C-N 3.26Å; V233-S235 PolarHBondContact O-N 3.48Å; S235-F239 WeakPolarHBondContact O-CB 3.27Å; S235-F239 PolarHBondContact O-N 3.21Å
236	R	98	Very high	96.2	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-70.5	-44.7	178.5	-70.1	165.6	173.3	76.2	-3	112.9	M109 D110 F113 A232 V233 F234 F239 T240 I275 S278	M109-R236 HydrophobicContact CB-CB 4.47Å; M109-R236 HydrophobicContact SD-CB 3.69Å; D110-R236 IonicContact OD1-CZ 2.74Å; D110-R236 IonicContact OD1-NE 3.06Å; D110-R236 PolarHBondContact OD1-NE 3.49Å; D110-R236 IonicContact OD1-NH2 3.52Å; D110-R236 PolarHBondContact OD1-NH2 2.74Å; D110-R236 IonicContact OD2-CZ 2.81Å; D110-R236 IonicContact OD2-NE 3.42Å; D110-R236 PolarHBondContact OD2-NE 3.48Å; D110-R236 IonicContact OD2-NH2 3.49Å; D110-R236 PolarHBondContact OD2-NH2 3.48Å; F113-R236 HydrophobicContact CE2-CB 4.4Å; F113-R236 HydrophobicContact CE2-CG 4.36Å; A232-R236 WeakPolarHBondContact O-CG 3.42Å; A232-R236 PolarHBondContact O-N 2.67Å; A232-R236 PolarHBondContact O-NH1 3.39Å; V233-R236 PolarHBondContact O-N 2.92Å; F234-R236 PolarHBondContact O-N 3.37Å; R236-F239 PolarHBondContact O-N 3.44Å; R236-T240 WeakPolarHBondContact O-CB 3.47Å; R236-T240 PolarHBondContact O-N 3.29Å; R236-T240 PolarHBondContact O-OG1 2.94Å; R236-I275 HydrophobicContact CG-CD1 4.28Å; R236-I275 HydrophobicContact CG-CG1 4.07Å; R236-S278 PolarHBondContact NH1-OG 2.91Å; R236-S278 PolarHBondContact NH2-O 3.35Å
237	V	98.1	Very high	96.5	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-62.5	-47.6	176.1	173.4	0	0	0	0	110.2	M109 L197 V200 V233 F234 F239 T240 R241	M109-V237 HydrophobicContact CE-CG2 3.81Å; M109-V237 HydrophobicContact SD-CG2 4.31Å; L197-V237 HydrophobicContact CD2-CG1 3.96Å; V200-V237 HydrophobicContact CB-CG1 4.14Å; V200-V237 HydrophobicContact CG1-CG1 3.85Å; V200-V237 HydrophobicContact CG1-CG2 4.13Å; V233-V237 HydrophobicContact CG1-CG2 4.27Å; V233-V237 WeakPolarHBondContact O-CG2 3.24Å; V233-V237 PolarHBondContact O-N 3.23Å; F234-V237 PolarHBondContact O-N 3.23Å; V237-F239 PolarHBondContact O-N 2.99Å; V237-T240 WeakPolarHBondContact O-CB 3.19Å; V237-T240 PolarHBondContact O-N 3.38Å; V237-R241 PolarHBondContact O-N 2.92Å
238	K	97.9	Very high	96.7	Very high	31 Å²	31	17 Å²	17	14%	0.135	8%	0.084	C	C	.	.	H	α-helix	trans	-64.5	-41.6	178.6	-173.3	170.9	176.2	169.8	0	111.9	E201 F234 T240 R241 V242 Q267 L271	E201-K238 HydrophobicContact CG-CB 4.3Å; E201-K238 HydrophobicContact CG-CD 4.25Å; E201-K238 HydrophobicContact CG-CG 4.36Å; E201-K238 WeakPolarHBondContact OE1-CD 3.42Å; E201-K238 WeakPolarHBondContact OE1-CE 3.36Å; E201-K238 IonicContact OE1-NZ 3.17Å; F234-K238 HydrophobicContact CE1-CD 3.87Å; F234-K238 HydrophobicContact CE2-CD 4.32Å; F234-K238 HydrophobicContact CZ-CD 3.59Å; F234-K238 WeakPolarHBondContact O-CB 3.38Å; F234-K238 PolarHBondContact O-N 3.38Å; K238-T240 VanDerWaalsContact C-N 3.34Å; K238-T240 PolarHBondContact O-N 3.49Å; K238-R241 PolarHBondContact O-N 2.89Å; K238-V242 HydrophobicContact CG-CG2 4.39Å; K238-V242 WeakPolarHBondContact O-CB 3.47Å; K238-V242 VanDerWaalsContact O-CG2 3.27Å; K238-V242 WeakPolarHBondContact O-CG2 3.31Å; K238-V242 PolarHBondContact O-N 3.49Å; K238-Q267 VanDerWaalsContact CE-NE2 3.31Å; K238-L271 HydrophobicContact CB-CD1 4.3Å; K238-L271 HydrophobicContact CB-CD2 4.32Å; K238-L271 HydrophobicContact CD-CD1 4.16Å; K238-L271 HydrophobicContact CD-CD2 3.88Å; K238-L271 HydrophobicContact CG-CD1 3.78Å; K238-L271 HydrophobicContact CG-CD2 4.19Å
239	F	98.4	Very high	96.8	Very high	3 Å²	3	14.1 Å²	14.1	1%	0.013	7%	0.072	C	C	.	.	H	α-helix	trans	-59.7	-44.9	174.7	-178.3	-96.1	0	0	0	111.5	F113 S235 R236 V237 R241 V242 L243 A268 L271 L272 I275 F329 I333	F113-F239 HydrophobicContact CE1-CD1 4.34Å; F113-F239 HydrophobicContact CE2-CD1 4.43Å; F113-F239 AromaticContact CZ-CD1 3.9Å; F113-F239 HydrophobicContact CZ-CD1 3.9Å; F113-F239 HydrophobicContact CZ-CE1 4.49Å; S235-F239 WeakPolarHBondContact O-CB 3.27Å; S235-F239 PolarHBondContact O-N 3.21Å; R236-F239 PolarHBondContact O-N 3.44Å; V237-F239 PolarHBondContact O-N 2.99Å; F239-R241 VanDerWaalsContact C-N 3.34Å; F239-R241 PolarHBondContact O-N 3.28Å; F239-V242 PolarHBondContact O-N 2.92Å; F239-L243 HydrophobicContact CE1-CD2 4.25Å; F239-L243 WeakPolarHBondContact O-CB 3.39Å; F239-L243 PolarHBondContact O-N 2.84Å; F239-A268 HydrophobicContact CD2-CB 4.32Å; F239-A268 HydrophobicContact CE2-CB 4.05Å; F239-L271 HydrophobicContact CB-CB 4.42Å; F239-L271 HydrophobicContact CB-CD1 4.47Å; F239-L271 HydrophobicContact CD2-CB 4.21Å; F239-L272 HydrophobicContact CE2-CB 4.5Å; F239-I275 HydrophobicContact CB-CD1 3.77Å; F239-I275 HydrophobicContact CD1-CD1 4.23Å; F239-I275 HydrophobicContact CD2-CD1 4.23Å; F239-I275 HydrophobicContact CG-CD1 3.82Å; F239-F329 HydrophobicContact CE1-CD1 4.24Å; F239-F329 HydrophobicContact CE1-CD2 4.07Å; F239-F329 HydrophobicContact CE1-CE1 4.23Å; F239-F329 HydrophobicContact CE1-CE2 4.02Å; F239-F329 HydrophobicContact CE1-CG 4.19Å; F239-F329 HydrophobicContact CE1-CZ 4.13Å; F239-F329 HydrophobicContact CZ-CB 4.16Å; F239-F329 HydrophobicContact CZ-CD1 4.02Å; F239-F329 HydrophobicContact CZ-CD2 4.12Å; F239-F329 HydrophobicContact CZ-CE1 4.45Å; F239-F329 AromaticContact CZ-CG 3.87Å; F239-F329 HydrophobicContact CZ-CG 3.87Å; F239-I333 HydrophobicContact CE2-CD1 4.07Å
240	T	98.4	Very high	96.7	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-58.5	-45.7	175.6	-53.1	0	0	0	0	111.3	F113 F149 I156 L197 R236 V237 K238 L244	F113-T240 WeakPolarHBondContact CZ-OG1 3.27Å; F149-T240 HydrophobicContact CD2-CG2 4.1Å; F149-T240 WeakPolarHBondContact CD2-OG1 3.48Å; F149-T240 HydrophobicContact CE2-CG2 4.3Å; F149-T240 VanDerWaalsContact CE2-OG1 3.24Å; F149-T240 WeakPolarHBondContact CE2-OG1 3.33Å; I156-T240 HydrophobicContact CD1-CG2 3.91Å; L197-T240 HydrophobicContact CD1-CG2 4.36Å; L197-T240 HydrophobicContact CD2-CG2 4.49Å; R236-T240 WeakPolarHBondContact O-CB 3.47Å; R236-T240 PolarHBondContact O-N 3.29Å; R236-T240 PolarHBondContact O-OG1 2.94Å; V237-T240 WeakPolarHBondContact O-CB 3.19Å; V237-T240 PolarHBondContact O-N 3.38Å; K238-T240 VanDerWaalsContact C-N 3.34Å; K238-T240 PolarHBondContact O-N 3.49Å; T240-L244 VanDerWaalsContact O-CB 3.31Å; T240-L244 WeakPolarHBondContact O-CB 3.49Å; T240-L244 PolarHBondContact O-N 2.86Å
241	R	98.3	Very high	96.5	Very high	33 Å²	33	15.3 Å²	15.3	13%	0.125	8%	0.081	C	C	.	.	H	α-helix	trans	-61.1	-48.4	176.3	-168	-175.9	57.4	65.5	-0.4	111.7	L197 E201 V237 K238 F239 L244 T245	L197-R241 HydrophobicContact CB-CB 3.89Å; L197-R241 HydrophobicContact CB-CG 3.92Å; L197-R241 HydrophobicContact CD1-CB 4.09Å; L197-R241 HydrophobicContact CD1-CG 4.38Å; E201-R241 IonicContact OE1-NH2 3Å; E201-R241 IonicContact OE2-CZ 3.78Å; E201-R241 IonicContact OE2-NE 3.56Å; E201-R241 PolarHBondContact OE2-NE 2.97Å; E201-R241 IonicContact OE2-NH2 2.78Å; E201-R241 PolarHBondContact OE2-NH2 2.91Å; V237-R241 PolarHBondContact O-N 2.92Å; K238-R241 PolarHBondContact O-N 2.89Å; F239-R241 VanDerWaalsContact C-N 3.34Å; F239-R241 PolarHBondContact O-N 3.28Å; R241-L244 PolarHBondContact O-N 3.21Å; R241-T245 WeakPolarHBondContact O-CB 3.3Å; R241-T245 PolarHBondContact O-N 2.84Å; R241-T245 PolarHBondContact O-OG1 3.27Å
242	V	98.2	Very high	96.1	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-60.5	-48	-179.9	169.1	0	0	0	0	110.6	K238 F239 L244 T245 V246 L264 Q267 A268 L271	K238-V242 HydrophobicContact CG-CG2 4.39Å; K238-V242 WeakPolarHBondContact O-CB 3.47Å; K238-V242 VanDerWaalsContact O-CG2 3.27Å; K238-V242 WeakPolarHBondContact O-CG2 3.31Å; K238-V242 PolarHBondContact O-N 3.49Å; F239-V242 PolarHBondContact O-N 2.92Å; V242-L244 PolarHBondContact O-N 3.1Å; V242-T245 PolarHBondContact O-N 3.39Å; V242-V246 WeakPolarHBondContact O-CG2 3.28Å; V242-V246 PolarHBondContact O-N 2.88Å; V242-L264 HydrophobicContact CG1-CB 4.09Å; V242-L264 HydrophobicContact CG1-CD2 4.49Å; V242-L264 VanDerWaalsContact CG1-O 3.29Å; V242-L264 WeakPolarHBondContact CG1-O 3.39Å; V242-Q267 HydrophobicContact CG2-CG 4.49Å; V242-A268 HydrophobicContact CG1-CB 3.95Å; V242-L271 HydrophobicContact CG2-CD1 4.13Å
243	L	97.9	Very high	95.1	Very high	9 Å²	9	24.7 Å²	24.7	5%	0.047	12%	0.119	C	C	.	.	H	α-helix	trans	-60	-47.4	177.6	-179.8	58.8	0	0	0	111.5	I156 F239 V246 L247 M265 F329	I156-L243 HydrophobicContact CD1-CB 4.46Å; I156-L243 HydrophobicContact CD1-CD2 4.08Å; I156-L243 HydrophobicContact CD1-CG 4.22Å; F239-L243 HydrophobicContact CE1-CD2 4.25Å; F239-L243 WeakPolarHBondContact O-CB 3.39Å; F239-L243 PolarHBondContact O-N 2.84Å; L243-V246 PolarHBondContact O-N 3.44Å; L243-L247 WeakPolarHBondContact O-CG 3.42Å; L243-L247 PolarHBondContact O-N 3.43Å; L243-M265 HydrophobicContact CD1-CE 4.1Å; L243-F329 HydrophobicContact CD2-CE1 4.15Å
244	L	97.8	Very high	94.1	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-60.2	-46.7	176.1	176.3	57.5	0	0	0	111.6	K155 I156 I159 V193 T194 L197 T240 R241 V242 V246 L247 I248	K155-L244 HydrophobicContact CB-CD1 3.71Å; K155-L244 HydrophobicContact CB-CD2 4.2Å; I156-L244 HydrophobicContact CD1-CB 4.28Å; I156-L244 HydrophobicContact CG1-CB 3.98Å; I156-L244 HydrophobicContact CG1-CD1 4.15Å; I159-L244 HydrophobicContact CD1-CD1 3.78Å; V193-L244 HydrophobicContact CB-CD2 4.47Å; V193-L244 HydrophobicContact CG1-CD2 3.9Å; T194-L244 HydrophobicContact CG2-CD2 3.8Å; T194-L244 HydrophobicContact CG2-CG 4.02Å; L197-L244 HydrophobicContact CD1-CD2 4.16Å; T240-L244 VanDerWaalsContact O-CB 3.31Å; T240-L244 WeakPolarHBondContact O-CB 3.49Å; T240-L244 PolarHBondContact O-N 2.86Å; R241-L244 PolarHBondContact O-N 3.21Å; V242-L244 PolarHBondContact O-N 3.1Å; L244-V246 VanDerWaalsContact C-N 3.3Å; L244-V246 PolarHBondContact O-N 3.35Å; L244-L247 PolarHBondContact O-N 3.3Å; L244-I248 HydrophobicContact CD1-CD1 3.9Å; L244-I248 HydrophobicContact CD1-CG1 4.15Å; L244-I248 HydrophobicContact CG-CD1 3.8Å; L244-I248 HydrophobicContact CG-CG1 4.5Å; L244-I248 WeakPolarHBondContact O-CD1 3.47Å; L244-I248 VanDerWaalsContact O-CG1 3.24Å; L244-I248 WeakPolarHBondContact O-CG1 3.47Å; L244-I248 PolarHBondContact O-N 3.01Å
245	T	97.1	Very high	93.3	Very high	41 Å²	41	32.8 Å²	32.8	25%	0.252	16%	0.161	S	C	.	.	H	α-helix	trans	-60.9	-38.6	177.8	-58	0	0	0	0	112	R241 V242 I248 A249 L264	R241-T245 WeakPolarHBondContact O-CB 3.3Å; R241-T245 PolarHBondContact O-N 2.84Å; R241-T245 PolarHBondContact O-OG1 3.27Å; V242-T245 PolarHBondContact O-N 3.39Å; T245-I248 PolarHBondContact O-N 3.3Å; T245-A249 PolarHBondContact O-N 2.77Å; T245-L264 HydrophobicContact CG2-CD1 3.61Å
246	V	97.3	Very high	92.5	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-65	-46.5	175.1	170.1	0	0	0	0	111.1	V242 L243 L244 I248 A249 F250 A261 L264 M265 I336	V242-V246 WeakPolarHBondContact O-CG2 3.28Å; V242-V246 PolarHBondContact O-N 2.88Å; L243-V246 PolarHBondContact O-N 3.44Å; L244-V246 VanDerWaalsContact C-N 3.3Å; L244-V246 PolarHBondContact O-N 3.35Å; V246-I248 VanDerWaalsContact C-N 3.3Å; V246-I248 PolarHBondContact O-N 2.94Å; V246-A249 VanDerWaalsContact O-CB 3.3Å; V246-A249 WeakPolarHBondContact O-CB 3.44Å; V246-A249 PolarHBondContact O-N 2.75Å; V246-F250 HydrophobicContact CG1-CD2 4.04Å; V246-F250 HydrophobicContact CG1-CE2 3.78Å; V246-F250 VanDerWaalsContact O-CD2 3.26Å; V246-F250 WeakPolarHBondContact O-CD2 3.44Å; V246-F250 PolarHBondContact O-N 3.03Å; V246-A261 HydrophobicContact CG1-CB 3.9Å; V246-A261 HydrophobicContact CG2-CB 4.36Å; V246-L264 HydrophobicContact CG2-CB 3.44Å; V246-L264 VanDerWaalsContact CG2-CB 3.44Å; V246-L264 HydrophobicContact CG2-CD1 3.93Å; V246-L264 HydrophobicContact CG2-CG 4.36Å; V246-M265 HydrophobicContact CB-CE 3.67Å; V246-M265 HydrophobicContact CG1-CE 3.38Å; V246-M265 HydrophobicContact CG1-CG 4.31Å; V246-M265 HydrophobicContact CG2-CE 3.79Å; V246-M265 HydrophobicContact CG2-CG 4.29Å; V246-I336 HydrophobicContact CG1-CG2 4.13Å
247	L	96.6	Very high	91.9	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-61.3	-39	177.2	-68.1	177.9	0	0	0	112.1	I156 I159 L243 L244 A249 F250 T251 L366 L370	I156-L247 HydrophobicContact CB-CD1 4.33Å; I156-L247 HydrophobicContact CG1-CD1 4.26Å; I156-L247 HydrophobicContact CG2-CD1 3.84Å; I159-L247 HydrophobicContact CB-CB 4.44Å; I159-L247 HydrophobicContact CD1-CB 4.44Å; I159-L247 HydrophobicContact CG2-CB 3.87Å; L243-L247 WeakPolarHBondContact O-CG 3.42Å; L243-L247 PolarHBondContact O-N 3.43Å; L244-L247 PolarHBondContact O-N 3.3Å; L247-A249 VanDerWaalsContact C-N 3.33Å; L247-A249 PolarHBondContact O-N 2.9Å; L247-F250 PolarHBondContact O-N 3.28Å; L247-T251 PolarHBondContact O-N 3.39Å; L247-L366 HydrophobicContact CD2-CD1 4.48Å; L247-L366 HydrophobicContact CD2-CD2 4.44Å; L247-L370 HydrophobicContact CD2-CD1 4.13Å; L247-L370 HydrophobicContact CD2-CD2 4.33Å
248	I	95.1	Very high	91.4	Very high	30 Å²	30	37 Å²	37	15%	0.154	19%	0.19	C	C	.	.	H	α-helix	trans	-63.3	-37.9	172.5	-66	161.4	0	0	0	111.2	I159 D190 T194 L244 T245 V246 F250 T251	I159-I248 HydrophobicContact CD1-CG1 3.69Å; D190-I248 HydrophobicContact CB-CD1 3.73Å; D190-I248 HydrophobicContact CB-CG1 4.22Å; T194-I248 HydrophobicContact CG2-CD1 3.81Å; L244-I248 HydrophobicContact CD1-CD1 3.9Å; L244-I248 HydrophobicContact CD1-CG1 4.15Å; L244-I248 HydrophobicContact CG-CD1 3.8Å; L244-I248 HydrophobicContact CG-CG1 4.5Å; L244-I248 WeakPolarHBondContact O-CD1 3.47Å; L244-I248 VanDerWaalsContact O-CG1 3.24Å; L244-I248 WeakPolarHBondContact O-CG1 3.47Å; L244-I248 PolarHBondContact O-N 3.01Å; T245-I248 PolarHBondContact O-N 3.3Å; V246-I248 VanDerWaalsContact C-N 3.3Å; V246-I248 PolarHBondContact O-N 2.94Å; I248-F250 PolarHBondContact O-N 2.7Å; I248-T251 PolarHBondContact O-N 3.29Å; I248-T251 PolarHBondContact O-OG1 3.17Å
249	A	93.9	Very high	90.9	Very high	10 Å²	10	38 Å²	38	8%	0.083	21%	0.205	C	C	.	.	H	α-helix	trans	-59.4	-37.6	176.8	0	0	0	0	0	111.5	T245 V246 L247 T251 K252 A257 A261	T245-A249 PolarHBondContact O-N 2.77Å; V246-A249 VanDerWaalsContact O-CB 3.3Å; V246-A249 WeakPolarHBondContact O-CB 3.44Å; V246-A249 PolarHBondContact O-N 2.75Å; L247-A249 VanDerWaalsContact C-N 3.33Å; L247-A249 PolarHBondContact O-N 2.9Å; A249-T251 VanDerWaalsContact C-N 3.29Å; A249-T251 PolarHBondContact O-N 2.64Å; A249-K252 WeakPolarHBondContact O-CB 3.37Å; A249-K252 PolarHBondContact O-N 2.96Å; A249-A257 HydrophobicContact CB-CB 4.14Å; A249-A257 WeakPolarHBondContact O-CB 3.32Å; A249-A261 HydrophobicContact CB-CB 4.04Å
250	F	92.2	Very high	90.6	Very high	8 Å²	8	42.2 Å²	42.2	4%	0.035	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-13.7	174.8	-76.2	-75	0	0	0	114.3	K163 V246 L247 I248 K252 V258 A261 I336 V339 L370 T374	K163-F250 VanDerWaalsContact CE-O 3.27Å; K163-F250 WeakPolarHBondContact CE-O 3.19Å; K163-F250 PolarHBondContact NZ-O 3.43Å; V246-F250 HydrophobicContact CG1-CD2 4.04Å; V246-F250 HydrophobicContact CG1-CE2 3.78Å; V246-F250 VanDerWaalsContact O-CD2 3.26Å; V246-F250 WeakPolarHBondContact O-CD2 3.44Å; V246-F250 PolarHBondContact O-N 3.03Å; L247-F250 PolarHBondContact O-N 3.28Å; I248-F250 PolarHBondContact O-N 2.7Å; F250-K252 VanDerWaalsContact C-N 3.33Å; F250-V258 HydrophobicContact CE1-CG1 4.43Å; F250-V258 HydrophobicContact CE1-CG2 4.44Å; F250-A261 HydrophobicContact CE2-CB 4.13Å; F250-I336 HydrophobicContact CE2-CG2 3.75Å; F250-I336 HydrophobicContact CZ-CG2 4.04Å; F250-V339 HydrophobicContact CE1-CG1 3.9Å; F250-V339 HydrophobicContact CZ-CG1 4.12Å; F250-L370 HydrophobicContact CB-CD2 3.85Å; F250-L370 HydrophobicContact CD1-CD2 4.41Å; F250-L370 HydrophobicContact CD2-CD1 4.36Å; F250-L370 HydrophobicContact CD2-CD2 4.15Å; F250-L370 HydrophobicContact CE2-CD1 4.44Å; F250-L370 HydrophobicContact CG-CD2 3.89Å; F250-T374 WeakPolarHBondContact CD1-OG1 3.4Å; F250-T374 HydrophobicContact CE1-CG2 4.45Å; F250-T374 WeakPolarHBondContact CE1-OG1 3.42Å
251	T	89.5	Confident	90.3	Very high	57 Å²	57	42.2 Å²	42.2	35%	0.35	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-18.9	172.6	69.9	0	0	0	0	112.6	I159 L247 I248 A249	I159-T251 HydrophobicContact CG2-CG2 3.82Å; L247-T251 PolarHBondContact O-N 3.39Å; I248-T251 PolarHBondContact O-N 3.29Å; I248-T251 PolarHBondContact O-OG1 3.17Å; A249-T251 VanDerWaalsContact C-N 3.29Å; A249-T251 PolarHBondContact O-N 2.64Å
252	K	85.7	Confident	90.1	Very high	131 Å²	131	44 Å²	44	57%	0.57	23%	0.234	S	C	*	.	S	Bend	trans	-73	145.4	177.6	-60.3	-177.4	-179.9	179.2	0	110.6	A249 F250 E254 A257	A249-K252 WeakPolarHBondContact O-CB 3.37Å; A249-K252 PolarHBondContact O-N 2.96Å; F250-K252 VanDerWaalsContact C-N 3.33Å; K252-E254 VanDerWaalsContact C-N 3.32Å; K252-A257 HydrophobicContact CB-CB 4.03Å; K252-A257 HydrophobicContact CD-CB 3.72Å; K252-A257 HydrophobicContact CG-CB 4.38Å
253	K	76.7	Confident	89.9	Confident	139 Å²	139	50.6 Å²	50.6	60%	0.604	26%	0.263	S	S	*	.	S	Bend	trans	-76.4	-20.7	178.4	-64.1	-171.7	177.9	-169	0	113.3
254	E	74.5	Confident	89.8	Confident	134 Å²	134	51 Å²	51	63%	0.626	27%	0.265	S	S	*	.	S	Bend	trans	-88.7	134.9	-175.9	-63.1	177.6	-172.3	0	0	111.5	K252 S256 A257	K252-E254 VanDerWaalsContact C-N 3.32Å; E254-S256 WeakPolarHBondContact CB-OG 3.45Å; E254-S256 PolarHBondContact O-N 3.31Å; E254-S256 PolarHBondContact OE2-OG 2.91Å; E254-A257 PolarHBondContact O-N 3.09Å
255	T	79.7	Confident	89.7	Confident	57 Å²	57	51 Å²	51	35%	0.35	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-19.1	176	52	0	0	0	0	113.6	A257 V258 V343 F383	T255-A257 PolarHBondContact O-N 2.95Å; T255-V258 VanDerWaalsContact O-CB 3.32Å; T255-V258 WeakPolarHBondContact O-CB 3.41Å; T255-V258 PolarHBondContact O-N 3.28Å; T255-V343 HydrophobicContact CG2-CB 4.27Å; T255-V343 HydrophobicContact CG2-CG1 3.86Å; T255-F383 HydrophobicContact CG2-CB 3.61Å; T255-F383 HydrophobicContact CG2-CD1 4.29Å; T255-F383 HydrophobicContact CG2-CG 4.06Å
256	S	81.2	Confident	89.6	Confident	75 Å²	75	52.8 Å²	52.8	52%	0.524	28%	0.276	S	S	.	.	H	α-helix	trans	-55.7	-34.3	176.5	61.1	0	0	0	0	112.4	E254 V258	E254-S256 WeakPolarHBondContact CB-OG 3.45Å; E254-S256 PolarHBondContact O-N 3.31Å; E254-S256 PolarHBondContact OE2-OG 2.91Å; S256-V258 VanDerWaalsContact C-N 3.3Å; S256-V258 PolarHBondContact O-N 3.1Å
257	A	85.5	Confident	89.5	Confident	10 Å²	10	55.7 Å²	55.7	8%	0.083	29%	0.29	C	S	.	.	H	α-helix	trans	-69.4	-27.1	178.6	0	0	0	0	0	113.1	A249 K252 E254 T255 E260 A261	A249-A257 HydrophobicContact CB-CB 4.14Å; A249-A257 WeakPolarHBondContact O-CB 3.32Å; K252-A257 HydrophobicContact CB-CB 4.03Å; K252-A257 HydrophobicContact CD-CB 3.72Å; K252-A257 HydrophobicContact CG-CB 4.38Å; E254-A257 PolarHBondContact O-N 3.09Å; T255-A257 PolarHBondContact O-N 2.95Å; A257-E260 PolarHBondContact O-N 3.3Å; A257-A261 PolarHBondContact O-N 3.24Å
258	V	87.6	Confident	89.5	Confident	7 Å²	7	55.8 Å²	55.8	4%	0.042	29%	0.29	C	S	.	.	H	α-helix	trans	-69.3	-35	-179.4	-178.4	0	0	0	0	111.3	F250 T255 S256 E260 A261 Q262 C340 V343 T374	F250-V258 HydrophobicContact CE1-CG1 4.43Å; F250-V258 HydrophobicContact CE1-CG2 4.44Å; T255-V258 VanDerWaalsContact O-CB 3.32Å; T255-V258 WeakPolarHBondContact O-CB 3.41Å; T255-V258 PolarHBondContact O-N 3.28Å; S256-V258 VanDerWaalsContact C-N 3.3Å; S256-V258 PolarHBondContact O-N 3.1Å; V258-E260 VanDerWaalsContact C-N 3.31Å; V258-E260 PolarHBondContact O-N 2.99Å; V258-A261 WeakPolarHBondContact O-CB 3.46Å; V258-A261 PolarHBondContact O-N 3.31Å; V258-Q262 PolarHBondContact O-N 3.15Å; V258-C340 HydrophobicContact CG1-CB 3.66Å; V258-V343 HydrophobicContact CB-CG1 4.31Å; V258-V343 HydrophobicContact CG1-CG1 4.15Å; V258-V343 HydrophobicContact CG1-CG2 4.47Å; V258-V343 HydrophobicContact CG2-CG1 4.26Å; V258-T374 HydrophobicContact CG2-CG2 4.24Å
259	A	88.4	Confident	89.6	Confident	53 Å²	53	56.5 Å²	56.5	44%	0.438	30%	0.296	S	S	.	.	H	α-helix	trans	-64.1	-37.2	175	0	0	0	0	0	112.1	Q262 K263	A259-Q262 PolarHBondContact O-N 3.43Å; A259-K263 PolarHBondContact O-N 2.79Å
260	E	90.7	Very high	89.6	Confident	92 Å²	92	61.5 Å²	61.5	43%	0.43	32%	0.322	S	S	.	.	H	α-helix	trans	-70.2	-39.1	174.6	-170.9	58.1	-158.7	0	0	111.3	A257 V258 Q262 K263 L264	A257-E260 PolarHBondContact O-N 3.3Å; V258-E260 VanDerWaalsContact C-N 3.31Å; V258-E260 PolarHBondContact O-N 2.99Å; E260-Q262 VanDerWaalsContact C-N 3.26Å; E260-Q262 PolarHBondContact O-N 3.38Å; E260-K263 PolarHBondContact O-N 3.27Å; E260-K263 IonicContact OE2-NZ 3.71Å; E260-L264 HydrophobicContact CG-CD1 4.33Å; E260-L264 WeakPolarHBondContact O-CG 3.36Å; E260-L264 PolarHBondContact O-N 3.34Å
261	A	93.1	Very high	89.8	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-57.3	-39.9	173.8	0	0	0	0	0	112.4	V246 A249 F250 A257 V258 L264 M265	V246-A261 HydrophobicContact CG1-CB 3.9Å; V246-A261 HydrophobicContact CG2-CB 4.36Å; A249-A261 HydrophobicContact CB-CB 4.04Å; F250-A261 HydrophobicContact CE2-CB 4.13Å; A257-A261 PolarHBondContact O-N 3.24Å; V258-A261 WeakPolarHBondContact O-CB 3.46Å; V258-A261 PolarHBondContact O-N 3.31Å; A261-L264 PolarHBondContact O-N 3.1Å; A261-M265 WeakPolarHBondContact O-CG 3.33Å; A261-M265 PolarHBondContact O-N 3.33Å
262	Q	93.5	Very high	90.1	Very high	70 Å²	70	59.6 Å²	59.6	33%	0.327	31%	0.309	S	S	.	.	H	α-helix	trans	-61.6	-44.4	177.1	-166.3	178.4	13.9	0	0	112.2	V258 A259 E260 M265 T266 C340	V258-Q262 PolarHBondContact O-N 3.15Å; A259-Q262 PolarHBondContact O-N 3.43Å; E260-Q262 VanDerWaalsContact C-N 3.26Å; E260-Q262 PolarHBondContact O-N 3.38Å; Q262-M265 PolarHBondContact O-N 3.43Å; Q262-T266 PolarHBondContact O-N 3.45Å; Q262-T266 PolarHBondContact O-OG1 3.38Å; Q262-C340 HydrophobicContact CB-CB 3.96Å; Q262-C340 HydrophobicContact CG-CB 4.18Å
263	K	93.6	Very high	90.5	Very high	138 Å²	138	56.5 Å²	56.5	60%	0.6	30%	0.304	S	S	*	.	H	α-helix	trans	-63.4	-43.1	176.6	-66.1	177.4	-170.2	165	0	111.9	A259 E260 M265 T266 Q267	A259-K263 PolarHBondContact O-N 2.79Å; E260-K263 PolarHBondContact O-N 3.27Å; E260-K263 IonicContact OE2-NZ 3.71Å; K263-M265 VanDerWaalsContact C-N 3.28Å; K263-M265 PolarHBondContact O-N 3.43Å; K263-T266 WeakPolarHBondContact O-CB 3.33Å; K263-T266 PolarHBondContact O-N 3.43Å; K263-Q267 PolarHBondContact O-N 3.48Å
264	L	96	Very high	91.4	Very high	17 Å²	17	51.5 Å²	51.5	9%	0.089	29%	0.289	C	S	.	.	H	α-helix	trans	-63.3	-34.9	177.4	-73.8	174.4	0	0	0	112	V242 T245 V246 E260 A261 Q267 A268	V242-L264 HydrophobicContact CG1-CB 4.09Å; V242-L264 HydrophobicContact CG1-CD2 4.49Å; V242-L264 VanDerWaalsContact CG1-O 3.29Å; V242-L264 WeakPolarHBondContact CG1-O 3.39Å; T245-L264 HydrophobicContact CG2-CD1 3.61Å; V246-L264 HydrophobicContact CG2-CB 3.44Å; V246-L264 VanDerWaalsContact CG2-CB 3.44Å; V246-L264 HydrophobicContact CG2-CD1 3.93Å; V246-L264 HydrophobicContact CG2-CG 4.36Å; E260-L264 HydrophobicContact CG-CD1 4.33Å; E260-L264 WeakPolarHBondContact O-CG 3.36Å; E260-L264 PolarHBondContact O-N 3.34Å; A261-L264 PolarHBondContact O-N 3.1Å; L264-Q267 CarbonylContact O-C 3.53Å; L264-Q267 WeakPolarHBondContact O-CB 3.36Å; L264-Q267 PolarHBondContact O-N 2.97Å; L264-A268 PolarHBondContact O-N 3.46Å
265	M	95.8	Very high	92.4	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-68.7	-31.4	174.7	-78.4	-67.1	156.2	0	0	113.3	L243 V246 A261 Q262 K263 A268 T269 I333 I336 K337	L243-M265 HydrophobicContact CD1-CE 4.1Å; V246-M265 HydrophobicContact CB-CE 3.67Å; V246-M265 HydrophobicContact CG1-CE 3.38Å; V246-M265 HydrophobicContact CG1-CG 4.31Å; V246-M265 HydrophobicContact CG2-CE 3.79Å; V246-M265 HydrophobicContact CG2-CG 4.29Å; A261-M265 WeakPolarHBondContact O-CG 3.33Å; A261-M265 PolarHBondContact O-N 3.33Å; Q262-M265 PolarHBondContact O-N 3.43Å; K263-M265 VanDerWaalsContact C-N 3.28Å; K263-M265 PolarHBondContact O-N 3.43Å; M265-A268 PolarHBondContact O-N 3.47Å; M265-A268 HydrophobicContact SD-CB 4.34Å; M265-T269 PolarHBondContact O-N 3.01Å; M265-T269 PolarHBondContact O-OG1 3.37Å; M265-I333 HydrophobicContact CB-CG2 4.23Å; M265-I333 WeakPolarHBondContact O-CG2 3.24Å; M265-I333 HydrophobicContact SD-CB 4.11Å; M265-I333 HydrophobicContact SD-CG1 3.83Å; M265-I333 HydrophobicContact SD-CG2 3.97Å; M265-I336 HydrophobicContact CE-CB 4.45Å; M265-I336 HydrophobicContact CE-CD1 3.67Å; M265-I336 HydrophobicContact CE-CG2 4.12Å; M265-I336 HydrophobicContact CG-CB 4.32Å; M265-I336 HydrophobicContact CG-CG2 3.81Å; M265-I336 HydrophobicContact SD-CB 4.28Å; M265-I336 HydrophobicContact SD-CD1 4.34Å; M265-I336 HydrophobicContact SD-CG2 4.23Å; M265-K337 HydrophobicContact CB-CG 3.82Å
266	T	94.8	Very high	93.2	Very high	77 Å²	77	47 Å²	47	47%	0.472	26%	0.264	S	S	.	.	H	α-helix	trans	-62.1	-46.9	167.9	-55.7	0	0	0	0	110.5	Q262 K263 A268 T269	Q262-T266 PolarHBondContact O-N 3.45Å; Q262-T266 PolarHBondContact O-OG1 3.38Å; K263-T266 WeakPolarHBondContact O-CB 3.33Å; K263-T266 PolarHBondContact O-N 3.43Å; T266-A268 VanDerWaalsContact C-N 3.31Å; T266-A268 PolarHBondContact O-N 3.22Å; T266-T269 VanDerWaalsContact O-CB 3.27Å; T266-T269 WeakPolarHBondContact O-CB 3.21Å; T266-T269 PolarHBondContact O-N 3.15Å; T266-T269 VanDerWaalsContact O-N 3.1Å; T266-T269 PolarHBondContact O-OG1 2.83Å
267	Q	95.6	Very high	93.9	Very high	62 Å²	62	48.8 Å²	48.8	29%	0.29	27%	0.267	S	S	.	.	H	α-helix	trans	-60.9	-37.6	174.9	178	173.9	57.4	0	0	112.8	K238 V242 K263 L264 T269 D270 L271	K238-Q267 VanDerWaalsContact CE-NE2 3.31Å; V242-Q267 HydrophobicContact CG2-CG 4.49Å; K263-Q267 PolarHBondContact O-N 3.48Å; L264-Q267 CarbonylContact O-C 3.53Å; L264-Q267 WeakPolarHBondContact O-CB 3.36Å; L264-Q267 PolarHBondContact O-N 2.97Å; Q267-T269 PolarHBondContact O-N 3.14Å; Q267-D270 PolarHBondContact O-N 3.37Å; Q267-L271 HydrophobicContact CG-CD1 4.08Å; Q267-L271 WeakPolarHBondContact O-CG 3.48Å; Q267-L271 PolarHBondContact O-N 2.92Å
268	A	96.9	Very high	94.4	Very high	2 Å²	2	48.7 Å²	48.7	2%	0.017	27%	0.266	C	S	.	.	H	α-helix	trans	-62.2	-32.3	176.5	0	0	0	0	0	112.4	F239 V242 L264 M265 T266 L271 L272 I333	F239-A268 HydrophobicContact CD2-CB 4.32Å; F239-A268 HydrophobicContact CE2-CB 4.05Å; V242-A268 HydrophobicContact CG1-CB 3.95Å; L264-A268 PolarHBondContact O-N 3.46Å; M265-A268 PolarHBondContact O-N 3.47Å; M265-A268 HydrophobicContact SD-CB 4.34Å; T266-A268 VanDerWaalsContact C-N 3.31Å; T266-A268 PolarHBondContact O-N 3.22Å; A268-L271 PolarHBondContact O-N 3.25Å; A268-L272 WeakPolarHBondContact O-CB 3.4Å; A268-L272 PolarHBondContact O-N 3.49Å; A268-I333 HydrophobicContact CB-CD1 3.92Å; A268-I333 HydrophobicContact CB-CG1 4.22Å
269	T	95.9	Very high	94.7	Very high	46 Å²	46	49.3 Å²	49.3	28%	0.282	27%	0.269	S	S	.	.	H	α-helix	trans	-63.7	-44.9	177.8	-50.7	0	0	0	0	111	M265 T266 Q267 L272 S273 I333 K337	M265-T269 PolarHBondContact O-N 3.01Å; M265-T269 PolarHBondContact O-OG1 3.37Å; T266-T269 VanDerWaalsContact O-CB 3.27Å; T266-T269 WeakPolarHBondContact O-CB 3.21Å; T266-T269 PolarHBondContact O-N 3.15Å; T266-T269 VanDerWaalsContact O-N 3.1Å; T266-T269 PolarHBondContact O-OG1 2.83Å; Q267-T269 PolarHBondContact O-N 3.14Å; T269-L272 PolarHBondContact O-N 2.93Å; T269-S273 PolarHBondContact O-N 3.37Å; T269-S273 PolarHBondContact O-OG 3.43Å; T269-I333 WeakPolarHBondContact OG1-CG2 3.46Å; T269-K337 PolarHBondContact OG1-NZ 3.24Å
270	D	94	Very high	94.9	Very high	115 Å²	115	53.1 Å²	53.1	62%	0.615	28%	0.278	S	S	*	.	H	α-helix	trans	-65.4	-42.3	177.8	-61.4	-28.5	0	0	0	111.5	Q267 L272 S273 A274	Q267-D270 PolarHBondContact O-N 3.37Å; D270-L272 VanDerWaalsContact C-N 3.33Å; D270-L272 PolarHBondContact O-N 2.74Å; D270-S273 WeakPolarHBondContact O-CB 3.3Å; D270-S273 PolarHBondContact O-N 2.98Å; D270-A274 PolarHBondContact O-N 3.41Å
271	L	96.1	Very high	95.1	Very high	16 Å²	16	49.6 Å²	49.6	8%	0.084	26%	0.261	C	S	.	.	H	α-helix	trans	-64.6	-38	178.2	-68.1	168	0	0	0	112.1	K238 F239 V242 Q267 A268 S273 A274 I275	K238-L271 HydrophobicContact CB-CD1 4.3Å; K238-L271 HydrophobicContact CB-CD2 4.32Å; K238-L271 HydrophobicContact CD-CD1 4.16Å; K238-L271 HydrophobicContact CD-CD2 3.88Å; K238-L271 HydrophobicContact CG-CD1 3.78Å; K238-L271 HydrophobicContact CG-CD2 4.19Å; F239-L271 HydrophobicContact CB-CB 4.42Å; F239-L271 HydrophobicContact CB-CD1 4.47Å; F239-L271 HydrophobicContact CD2-CB 4.21Å; V242-L271 HydrophobicContact CG2-CD1 4.13Å; Q267-L271 HydrophobicContact CG-CD1 4.08Å; Q267-L271 WeakPolarHBondContact O-CG 3.48Å; Q267-L271 PolarHBondContact O-N 2.92Å; A268-L271 PolarHBondContact O-N 3.25Å; L271-S273 VanDerWaalsContact C-N 3.26Å; L271-S273 PolarHBondContact O-N 2.7Å; L271-A274 WeakPolarHBondContact O-CB 3.45Å; L271-A274 PolarHBondContact O-N 2.81Å; L271-A274 VanDerWaalsContact O-N 3.14Å; L271-I275 WeakPolarHBondContact O-CG1 3.44Å; L271-I275 PolarHBondContact O-N 3.07Å
272	L	96.1	Very high	95	Very high	8 Å²	8	49.9 Å²	49.9	4%	0.042	26%	0.264	C	S	.	.	H	α-helix	trans	-63.8	-34.8	179	-171.9	62.7	0	0	0	111.8	F239 A268 T269 D270 A274 I275 H276 V326 F329 S330 I333	F239-L272 HydrophobicContact CE2-CB 4.5Å; A268-L272 WeakPolarHBondContact O-CB 3.4Å; A268-L272 PolarHBondContact O-N 3.49Å; T269-L272 PolarHBondContact O-N 2.93Å; D270-L272 VanDerWaalsContact C-N 3.33Å; D270-L272 PolarHBondContact O-N 2.74Å; L272-A274 VanDerWaalsContact C-N 3.34Å; L272-A274 PolarHBondContact O-N 2.77Å; L272-I275 PolarHBondContact O-N 3.07Å; L272-H276 PolarHBondContact O-N 2.73Å; L272-V326 HydrophobicContact CD1-CB 4.47Å; L272-V326 HydrophobicContact CD1-CG1 4.03Å; L272-V326 HydrophobicContact CD2-CG1 4.32Å; L272-V326 HydrophobicContact CG-CG1 3.93Å; L272-F329 HydrophobicContact CD1-CB 3.96Å; L272-F329 HydrophobicContact CD1-CD2 4.48Å; L272-F329 HydrophobicContact CD2-CB 3.95Å; L272-S330 VanDerWaalsContact CD2-N 3.33Å; L272-I333 HydrophobicContact CB-CD1 4.49Å; L272-I333 HydrophobicContact CD2-CD1 3.9Å
273	S	95.2	Very high	95	Very high	67 Å²	67	49.1 Å²	49.1	47%	0.469	26%	0.261	S	S	.	.	H	α-helix	trans	-63.5	-40	173.9	-58.4	0	0	0	0	111.7	T269 D270 L271 N277	T269-S273 PolarHBondContact O-N 3.37Å; T269-S273 PolarHBondContact O-OG 3.43Å; D270-S273 WeakPolarHBondContact O-CB 3.3Å; D270-S273 PolarHBondContact O-N 2.98Å; L271-S273 VanDerWaalsContact C-N 3.26Å; L271-S273 PolarHBondContact O-N 2.7Å; S273-N277 PolarHBondContact O-N 3.06Å; S273-N277 PolarHBondContact O-ND2 3.15Å
274	A	94.4	Very high	94.5	Very high	34 Å²	34	48.2 Å²	48.2	28%	0.281	26%	0.26	S	S	.	.	H	α-helix	trans	-67.7	-37.1	174.4	0	0	0	0	0	112.5	D270 L271 L272 S278	D270-A274 PolarHBondContact O-N 3.41Å; L271-A274 WeakPolarHBondContact O-CB 3.45Å; L271-A274 PolarHBondContact O-N 2.81Å; L271-A274 VanDerWaalsContact O-N 3.14Å; L272-A274 VanDerWaalsContact C-N 3.34Å; L272-A274 PolarHBondContact O-N 2.77Å; A274-S278 WeakPolarHBondContact O-CB 3.48Å; A274-S278 PolarHBondContact O-N 2.92Å; A274-S278 PolarHBondContact O-OG 3.45Å
275	I	96.7	Very high	93.6	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-63.3	-48.1	175	-68.1	169.8	0	0	0	110.3	R236 F239 L271 L272 N277 S278 L279 M325	R236-I275 HydrophobicContact CG-CD1 4.28Å; R236-I275 HydrophobicContact CG-CG1 4.07Å; F239-I275 HydrophobicContact CB-CD1 3.77Å; F239-I275 HydrophobicContact CD1-CD1 4.23Å; F239-I275 HydrophobicContact CD2-CD1 4.23Å; F239-I275 HydrophobicContact CG-CD1 3.82Å; L271-I275 WeakPolarHBondContact O-CG1 3.44Å; L271-I275 PolarHBondContact O-N 3.07Å; L272-I275 PolarHBondContact O-N 3.07Å; I275-N277 VanDerWaalsContact C-N 3.34Å; I275-N277 PolarHBondContact O-N 3.37Å; I275-S278 CarbonylContact O-C 3.15Å; I275-S278 PolarHBondContact O-N 3.21Å; I275-S278 VanDerWaalsContact O-N 3.07Å; I275-S278 PolarHBondContact O-OG 2.95Å; I275-L279 HydrophobicContact CG2-CD2 4.26Å; I275-L279 PolarHBondContact O-N 3.32Å; I275-M325 HydrophobicContact CG2-CE 4.16Å
276	H	96.3	Very high	92.3	Very high	94 Å²	94	56.1 Å²	56.1	44%	0.435	30%	0.301	S	S	.	.	H	α-helix	trans	-54.8	-48.2	178.7	-179.7	-99.6	0	0	0	112.4	L272 S278 L279 V326	L272-H276 PolarHBondContact O-N 2.73Å; H276-S278 PolarHBondContact O-N 3Å; H276-L279 WeakPolarHBondContact O-CG 3.27Å; H276-L279 PolarHBondContact O-N 3.18Å; H276-V326 HydrophobicContact CB-CG1 3.88Å; H276-V326 HydrophobicContact CB-CG2 4.22Å
277	N	95.4	Very high	90.4	Very high	113 Å²	113	58.8 Å²	58.8	60%	0.604	31%	0.312	S	S	*	.	H	α-helix	trans	-71.5	-13	-177.8	-64.2	-17.1	0	0	0	113.4	S273 I275 H280	S273-N277 PolarHBondContact O-N 3.06Å; S273-N277 PolarHBondContact O-ND2 3.15Å; I275-N277 VanDerWaalsContact C-N 3.34Å; I275-N277 PolarHBondContact O-N 3.37Å; N277-H280 PolarHBondContact O-CE1 3.4Å; N277-H280 VanDerWaalsContact O-CE1 3.24Å; N277-H280 PolarHBondContact O-ND1 2.95Å
278	S	95.7	Very high	88	Confident	9 Å²	9	63.3 Å²	63.3	6%	0.063	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.8	17.5	-177.7	61.4	0	0	0	0	114.1	R236 A274 I275 H276 H280 H281	R236-S278 PolarHBondContact NH1-OG 2.91Å; R236-S278 PolarHBondContact NH2-O 3.35Å; A274-S278 WeakPolarHBondContact O-CB 3.48Å; A274-S278 PolarHBondContact O-N 2.92Å; A274-S278 PolarHBondContact O-OG 3.45Å; I275-S278 CarbonylContact O-C 3.15Å; I275-S278 PolarHBondContact O-N 3.21Å; I275-S278 VanDerWaalsContact O-N 3.07Å; I275-S278 PolarHBondContact O-OG 2.95Å; H276-S278 PolarHBondContact O-N 3Å; S278-H280 VanDerWaalsContact C-N 3.25Å; S278-H280 PolarHBondContact O-N 3.27Å; S278-H281 WeakPolarHBondContact CA-ND1 3.4Å; S278-H281 PolarHBondContact O-N 3.12Å
279	L	94.2	Very high	85.5	Confident	20 Å²	20	65.7 Å²	65.7	11%	0.105	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-62.8	-32	177.2	-70.8	179.5	0	0	0	113	I275 H276 H281 R322 E323 M325 V326	I275-L279 HydrophobicContact CG2-CD2 4.26Å; I275-L279 PolarHBondContact O-N 3.32Å; H276-L279 WeakPolarHBondContact O-CG 3.27Å; H276-L279 PolarHBondContact O-N 3.18Å; L279-H281 VanDerWaalsContact C-N 3.3Å; L279-H281 PolarHBondContact O-N 3.3Å; L279-R322 HydrophobicContact CD1-CB 4.32Å; L279-R322 HydrophobicContact CD2-CB 4.15Å; L279-E323 HydrophobicContact CD1-CG 4.42Å; L279-M325 HydrophobicContact CD2-CE 3.93Å; L279-V326 HydrophobicContact CD1-CG2 4.11Å
280	H	93.5	Very high	82.7	Confident	133 Å²	133	69.9 Å²	69.9	62%	0.616	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-74.9	-17.3	-176.4	66.3	-85.5	0	0	0	113.6	N277 S278 G282	N277-H280 PolarHBondContact O-CE1 3.4Å; N277-H280 VanDerWaalsContact O-CE1 3.24Å; N277-H280 PolarHBondContact O-ND1 2.95Å; S278-H280 VanDerWaalsContact C-N 3.25Å; S278-H280 PolarHBondContact O-N 3.27Å; H280-G282 VanDerWaalsContact C-N 3.28Å; H280-G282 PolarHBondContact O-N 3.14Å
281	H	94.1	Very high	80.1	Confident	18 Å²	18	73.6 Å²	73.6	8%	0.083	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-76.2	-13.7	178.7	-65.1	93.6	0	0	0	113.7	P103 I106 Q228 Q229 S278 L279	P103-H281 WeakPolarHBondContact CA-O 3.01Å; P103-H281 WeakPolarHBondContact CB-O 3.39Å; I106-H281 HydrophobicContact CD1-CB 3.84Å; Q228-H281 PolarHBondContact OE1-NE2 3.16Å; Q229-H281 HydrophobicContact CG-CB 4.24Å; S278-H281 WeakPolarHBondContact CA-ND1 3.4Å; S278-H281 PolarHBondContact O-N 3.12Å; L279-H281 VanDerWaalsContact C-N 3.3Å; L279-H281 PolarHBondContact O-N 3.3Å
282	G	92	Very high	77.6	Confident	5 Å²	5	76.8 Å²	76.8	5%	0.052	43%	0.425	C	S	.	.	S	Bend	trans	-83	145.8	177.9	0	0	0	0	0	112.7	P103 H280 Q284	P103-G282 WeakPolarHBondContact O-CA 3.46Å; H280-G282 VanDerWaalsContact C-N 3.28Å; H280-G282 PolarHBondContact O-N 3.14Å; G282-Q284 PolarHBondContact O-NE2 2.82Å; G282-Q284 VanDerWaalsContact O-NE2 3.12Å
283	I	91.9	Very high	75.5	Confident	54 Å²	54	78.7 Å²	78.7	28%	0.277	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-57.5	149.6	170.1	65.4	172.7	0	0	0	110.3	P103 E104 M297 M298 R322	P103-I283 HydrophobicContact CB-CG2 3.79Å; P103-I283 PolarHBondContact O-N 3.04Å; E104-I283 HydrophobicContact CB-CD1 4.32Å; E104-I283 HydrophobicContact CG-CD1 3.92Å; E104-I283 HydrophobicContact CG-CG2 4.36Å; I283-M297 HydrophobicContact CD1-CE 3.36Å; I283-M297 HydrophobicContact CD1-SD 4.28Å; I283-M297 HydrophobicContact CG1-CE 3.25Å; I283-M297 HydrophobicContact CG1-SD 3.96Å; I283-M298 HydrophobicContact CD1-CB 4.04Å; I283-M298 HydrophobicContact CD1-SD 4.39Å; I283-R322 PolarHBondContact O-NH1 2.94Å; I283-R322 PolarHBondContact O-NH2 2.93Å
284	Q	83.7	Confident	73.7	Confident	120 Å²	120	79.8 Å²	79.8	56%	0.561	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-100.7	156.7	179.5	-58.7	-58.5	-37.7	0	0	110.1	G282 R322	G282-Q284 PolarHBondContact O-NE2 2.82Å; G282-Q284 VanDerWaalsContact O-NE2 3.12Å; Q284-R322 VanDerWaalsContact NE2-NH1 3.18Å
285	A	77.6	Confident	72.1	Confident	28 Å²	28	81.4 Å²	81.4	23%	0.231	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-64.3	143.1	172.9	0	0	0	0	0	110.2	P295 I296 M297	A285-P295 HydrophobicContact CB-CB 3.39Å; A285-I296 WeakPolarHBondContact CA-O 3.46Å; A285-M297 HydrophobicContact CB-CB 4.43Å
286	Q	68.4	Low	71.2	Confident	156 Å²	156	83.3 Å²	83.3	73%	0.729	45%	0.451	S	S	*	.	B	Isolated β-bridge	trans	-73.5	129.9	178.9	-65.3	-179.3	-2.8	0	0	109.4	P295 I296	Q286-P295 WeakPolarHBondContact O-CA 3.41Å; Q286-I296 PolarHBondContact N-O 3.38Å; Q286-I296 VanDerWaalsContact N-O 3.1Å; Q286-I296 PolarHBondContact O-N 3.37Å
287	N	55.6	Low	70.7	Confident	133 Å²	133	79.1 Å²	79.1	71%	0.711	43%	0.432	S	S	*	.			trans	-90.8	4.7	-178.2	-71.8	-23.7	0	0	0	113.5	T289 P295	N287-T289 PolarHBondContact O-N 3.48Å; N287-P295 WeakPolarHBondContact OD1-CG 3.29Å
288	D	44	Very low	70.4	Confident	158 Å²	158	75.7 Å²	75.7	85%	0.845	41%	0.412	S	S	*	.			trans	-83.4	33.3	-163.8	-107.9	-2.8	0	0	0	115
289	T	45.1	Very low	70.1	Confident	51 Å²	51	75.5 Å²	75.5	31%	0.313	41%	0.412	S	S	.	.			trans	-107.5	98.6	178.8	51	0	0	0	0	111.2	N287 K291 D293	N287-T289 PolarHBondContact O-N 3.48Å; T289-K291 PolarHBondContact O-N 3.17Å; T289-K291 VanDerWaalsContact O-N 3.14Å; T289-D293 HydrophobicContact CG2-CB 3.84Å; T289-D293 WeakPolarHBondContact OG1-CB 3.44Å; T289-D293 PolarHBondContact OG1-O 2.91Å
290	T	37.1	Very low	70	Confident	135 Å²	135	75.2 Å²	75.2	83%	0.828	41%	0.41	S	S	*	.	S	Bend	trans	-61.9	112.7	167.5	51.4	0	0	0	0	109.3
291	K	38.8	Very low	69.8	Low	193 Å²	193	69.7 Å²	69.7	84%	0.839	38%	0.384	S	S	*	.	S	Bend	trans	91.1	95.1	178.1	-55.7	175.2	176.9	-179.9	0	115.3	T289 D293	T289-K291 PolarHBondContact O-N 3.17Å; T289-K291 VanDerWaalsContact O-N 3.14Å; K291-D293 PolarHBondContact O-N 2.95Å
292	G	44.3	Very low	69.4	Low	82 Å²	82	71.2 Å²	71.2	85%	0.845	40%	0.396	S	S	*	.	S	Bend	trans	68.6	-8.1	153.5	0	0	0	0	0	118.2
293	D	51.8	Low	69	Low	48 Å²	48	71.7 Å²	71.7	26%	0.257	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-76.3	130.9	179.2	-98	-24.8	0	0	0	110.9	R81 T289 K291	R81-D293 IonicContact NH1-OD1 3.2Å; R81-D293 PolarHBondContact NH1-OD1 3.07Å; R81-D293 IonicContact NH1-OD2 3Å; R81-D293 PolarHBondContact NH1-OD2 3.18Å; T289-D293 HydrophobicContact CG2-CB 3.84Å; T289-D293 WeakPolarHBondContact OG1-CB 3.44Å; T289-D293 PolarHBondContact OG1-O 2.91Å; K291-D293 PolarHBondContact O-N 2.95Å
294	H	56.8	Low	68.8	Low	90 Å²	90	70.7 Å²	70.7	42%	0.417	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-65.7	144.7	172.5	-70.4	-100.5	0	0	0	110.3	I296	H294-I296 WeakPolarHBondContact O-CG1 3.35Å; H294-I296 PolarHBondContact O-N 3.39Å
295	P	61.2	Low	68.9	Low	68 Å²	68	65.4 Å²	65.4	44%	0.442	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-53.7	132.1	176	-25.2	33.7	0	0	0	111.5	A285 Q286 N287	A285-P295 HydrophobicContact CB-CB 3.39Å; Q286-P295 WeakPolarHBondContact O-CA 3.41Å; N287-P295 WeakPolarHBondContact OD1-CG 3.29Å
296	I	77.7	Confident	69	Low	41 Å²	41	65.7 Å²	65.7	21%	0.21	37%	0.366	C	S	.	.	B	Isolated β-bridge	trans	-103.5	123.1	-176.7	-61.2	170.9	0	0	0	110.2	R81 A285 Q286 H294 F300	R81-I296 VanDerWaalsContact NH1-CD1 3.25Å; R81-I296 VanDerWaalsContact NH2-CD1 3.27Å; A285-I296 WeakPolarHBondContact CA-O 3.46Å; Q286-I296 PolarHBondContact N-O 3.38Å; Q286-I296 VanDerWaalsContact N-O 3.1Å; Q286-I296 PolarHBondContact O-N 3.37Å; H294-I296 WeakPolarHBondContact O-CG1 3.35Å; H294-I296 PolarHBondContact O-N 3.39Å; I296-F300 WeakPolarHBondContact CG2-O 3.45Å
297	M	86.9	Confident	69.5	Low	7 Å²	7	70.1 Å²	70.1	3%	0.034	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-82.6	141.9	172.2	-179.3	66.2	-158.1	0	0	109.6	I108 T111 I283 A285 G299 F300	I108-M297 HydrophobicContact CB-CE 4.47Å; I108-M297 HydrophobicContact CG1-CE 3.73Å; I108-M297 VanDerWaalsContact N-CE 3.33Å; T111-M297 HydrophobicContact CG2-CB 4.13Å; T111-M297 HydrophobicContact CG2-CG 4.22Å; T111-M297 WeakPolarHBondContact OG1-CG 3.29Å; I283-M297 HydrophobicContact CD1-CE 3.36Å; I283-M297 HydrophobicContact CD1-SD 4.28Å; I283-M297 HydrophobicContact CG1-CE 3.25Å; I283-M297 HydrophobicContact CG1-SD 3.96Å; A285-M297 HydrophobicContact CB-CB 4.43Å; M297-G299 PolarHBondContact O-N 3.45Å; M297-F300 HydrophobicContact CB-CB 4.46Å; M297-F300 HydrophobicContact CB-CD2 3.86Å; M297-F300 HydrophobicContact CB-CG 4.34Å; M297-F300 HydrophobicContact CG-CD2 3.81Å; M297-F300 HydrophobicContact CG-CE2 4.07Å; M297-F300 PolarHBondContact O-N 3.49Å
298	M	88.4	Confident	70.7	Confident	40 Å²	40	67.7 Å²	67.7	20%	0.197	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	129.7	172.6	174.5	-176.1	147.8	0	0	110.8	K96 L100 E104 I108 Y134 I283 F300	K96-M298 HydrophobicContact CB-CE 4.02Å; K96-M298 HydrophobicContact CD-CE 4.44Å; K96-M298 HydrophobicContact CG-CE 4.27Å; L100-M298 HydrophobicContact CD2-CE 3.44Å; L100-M298 VanDerWaalsContact CD2-CE 3.44Å; E104-M298 HydrophobicContact CG-SD 4.13Å; I108-M298 HydrophobicContact CD1-CE 4.15Å; Y134-M298 WeakPolarHBondContact OH-CE 3.49Å; I283-M298 HydrophobicContact CD1-CB 4.04Å; I283-M298 HydrophobicContact CD1-SD 4.39Å; M298-F300 WeakPolarHBondContact O-CD2 3.41Å
299	G	89.8	Confident	72.2	Confident	6 Å²	6	62 Å²	62	6%	0.062	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	86	-0.1	-179.3	0	0	0	0	0	115.7	L133 M297	L133-G299 PolarHBondContact N-O 3.32Å; M297-G299 PolarHBondContact O-N 3.45Å
300	F	91.4	Very high	73.5	Confident	13 Å²	13	62.3 Å²	62.3	6%	0.057	33%	0.334	C	S	.	.	B	Isolated β-bridge	trans	-114.4	132.6	178.2	-68.6	-107	0	0	0	110.9	I108 T111 C112 T131 C132 I296 M297 M298	I108-F300 HydrophobicContact CG2-CE2 4.18Å; T111-F300 HydrophobicContact CG2-CD1 3.86Å; T111-F300 HydrophobicContact CG2-CD2 4.07Å; T111-F300 HydrophobicContact CG2-CE1 3.53Å; T111-F300 HydrophobicContact CG2-CE2 3.77Å; T111-F300 HydrophobicContact CG2-CG 4.13Å; T111-F300 HydrophobicContact CG2-CZ 3.5Å; T111-F300 VanDerWaalsContact CG2-CZ 3.5Å; C112-F300 HydrophobicContact CB-CZ 4.46Å; C112-F300 VanDerWaalsContact SG-CZ 3.59Å; T131-F300 CarbonylContact O-C 3.6Å; T131-F300 VanDerWaalsContact O-CA 3.29Å; T131-F300 WeakPolarHBondContact O-CA 3.47Å; C132-F300 HydrophobicContact CB-CD1 3.97Å; C132-F300 HydrophobicContact CB-CE1 3.57Å; C132-F300 HydrophobicContact CB-CE2 4.5Å; C132-F300 HydrophobicContact CB-CZ 3.86Å; I296-F300 WeakPolarHBondContact CG2-O 3.45Å; M297-F300 HydrophobicContact CB-CB 4.46Å; M297-F300 HydrophobicContact CB-CD2 3.86Å; M297-F300 HydrophobicContact CB-CG 4.34Å; M297-F300 HydrophobicContact CG-CD2 3.81Å; M297-F300 HydrophobicContact CG-CE2 4.07Å; M297-F300 PolarHBondContact O-N 3.49Å; M298-F300 WeakPolarHBondContact O-CD2 3.41Å
301	E	89.2	Confident	74.8	Confident	17 Å²	17	60 Å²	60	8%	0.079	32%	0.322	C	S	.	.			trans	-129.9	100.4	173.4	177.7	51.3	-96.3	0	0	109.2	R81 V83 T131 L133 L303 V304	R81-E301 IonicContact CZ-OE1 3.75Å; R81-E301 IonicContact NE-OE1 3.93Å; R81-E301 IonicContact NE-OE2 3.54Å; R81-E301 IonicContact NH2-OE1 3.67Å; R81-E301 PolarHBondContact NH2-OE1 3.35Å; R81-E301 IonicContact NH2-OE2 2.67Å; V83-E301 HydrophobicContact CG1-CG 3.64Å; T131-E301 PolarHBondContact O-N 3.01Å; L133-E301 HydrophobicContact CD1-CB 4.11Å; L133-E301 HydrophobicContact CD2-CB 4.35Å; L133-E301 HydrophobicContact CG-CB 4.34Å; E301-L303 PolarHBondContact O-N 3.08Å; E301-L303 VanDerWaalsContact O-N 3.17Å; E301-L303 PolarHBondContact OE1-N 3.44Å; E301-V304 HydrophobicContact CB-CB 4.06Å; E301-V304 HydrophobicContact CB-CG1 4.47Å; E301-V304 HydrophobicContact CG-CB 3.83Å; E301-V304 WeakPolarHBondContact O-CG1 3.45Å; E301-V304 PolarHBondContact O-N 2.98Å
302	P	85.5	Confident	76	Confident	51 Å²	51	54.3 Å²	54.3	33%	0.331	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-28.5	-176.6	-27.9	35.7	0	0	0	114.8
303	L	84.3	Confident	77	Confident	14 Å²	14	56.2 Å²	56.2	7%	0.073	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-1.3	-174.1	-59.5	177.9	0	0	0	113.6	V79 V83 E301 N305 Q306 Y316	V79-L303 HydrophobicContact CB-CD1 4.15Å; V79-L303 HydrophobicContact CG1-CD1 4.39Å; V79-L303 HydrophobicContact CG2-CD1 3.59Å; V83-L303 HydrophobicContact CG1-CB 4.27Å; V83-L303 HydrophobicContact CG2-CB 3.82Å; V83-L303 HydrophobicContact CG2-CD1 4.3Å; E301-L303 PolarHBondContact O-N 3.08Å; E301-L303 VanDerWaalsContact O-N 3.17Å; E301-L303 PolarHBondContact OE1-N 3.44Å; L303-N305 PolarHBondContact O-N 2.85Å; L303-Q306 WeakPolarHBondContact O-CB 3.32Å; L303-Q306 PolarHBondContact O-N 3.13Å; L303-Q306 VanDerWaalsContact O-N 3.1Å; L303-Y316 HydrophobicContact CD2-CE1 4.2Å
304	V	86.4	Confident	77.4	Confident	34 Å²	34	56 Å²	56	21%	0.206	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-30.2	-175	68	0	0	0	0	112.8	V83 L133 E301	V83-V304 HydrophobicContact CG1-CB 4.42Å; L133-V304 HydrophobicContact CD2-CB 4.26Å; L133-V304 HydrophobicContact CD2-CG1 4.22Å; L133-V304 HydrophobicContact CD2-CG2 3.86Å; E301-V304 HydrophobicContact CB-CB 4.06Å; E301-V304 HydrophobicContact CB-CG1 4.47Å; E301-V304 HydrophobicContact CG-CB 3.83Å; E301-V304 WeakPolarHBondContact O-CG1 3.45Å; E301-V304 PolarHBondContact O-N 2.98Å
305	N	86.6	Confident	77.8	Confident	9 Å²	9	60.8 Å²	60.8	5%	0.048	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	11.4	-175.4	-58.8	-34.4	0	0	0	114	A126 F130 F182 L303 R307 L308	A126-N305 HydrophobicContact CB-CB 3.99Å; A126-N305 PolarHBondContact O-ND2 2.8Å; F130-N305 WeakPolarHBondContact CB-ND2 3.4Å; F130-N305 PolarHBondContact O-ND2 3.49Å; F182-N305 VanDerWaalsContact CZ-OD1 3.3Å; F182-N305 WeakPolarHBondContact CZ-OD1 3.36Å; L303-N305 PolarHBondContact O-N 2.85Å; N305-R307 PolarHBondContact O-N 2.94Å; N305-R307 VanDerWaalsContact O-N 3.13Å; N305-L308 HydrophobicContact CB-CD1 4.11Å; N305-L308 WeakPolarHBondContact O-CB 3.45Å; N305-L308 PolarHBondContact O-N 2.97Å
306	Q	79.4	Confident	78.1	Confident	33 Å²	33	63 Å²	63	15%	0.154	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-56	-35.8	-175	-173.5	171.3	19.9	0	0	112.8	A72 L303 L308 L309	A72-Q306 PolarHBondContact O-NE2 2.71Å; L303-Q306 WeakPolarHBondContact O-CB 3.32Å; L303-Q306 PolarHBondContact O-N 3.13Å; L303-Q306 VanDerWaalsContact O-N 3.1Å; Q306-L308 VanDerWaalsContact C-N 3.28Å; Q306-L308 PolarHBondContact O-N 3.45Å; Q306-L309 PolarHBondContact O-N 2.86Å
307	R	79.8	Confident	78.1	Confident	249 Å²	249	61.7 Å²	61.7	94%	0.94	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-74.7	-11.6	177.6	-62.7	-178.2	179.5	178.1	-1.4	114.5	N305	N305-R307 PolarHBondContact O-N 2.94Å; N305-R307 VanDerWaalsContact O-N 3.13Å
308	L	79.9	Confident	78.1	Confident	82 Å²	82	69.1 Å²	69.1	43%	0.429	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-90.4	-15.7	176.1	-61.9	176.8	0	0	0	112.2	Y180 F182 N305 Q306	Y180-L308 HydrophobicContact CD1-CB 4.24Å; Y180-L308 VanDerWaalsContact CD1-O 3.28Å; Y180-L308 WeakPolarHBondContact CD1-O 3.3Å; Y180-L308 WeakPolarHBondContact CE1-O 3.41Å; F182-L308 HydrophobicContact CE2-CD1 3.73Å; F182-L308 HydrophobicContact CZ-CD1 3.67Å; N305-L308 HydrophobicContact CB-CD1 4.11Å; N305-L308 WeakPolarHBondContact O-CB 3.45Å; N305-L308 PolarHBondContact O-N 2.97Å; Q306-L308 VanDerWaalsContact C-N 3.28Å; Q306-L308 PolarHBondContact O-N 3.45Å
309	L	76.6	Confident	78.2	Confident	39 Å²	39	69.9 Å²	69.9	20%	0.204	34%	0.336	C	S	.	.	S	Bend	trans	-72.2	142.7	-178.7	-58.1	177	0	0	0	109.8	A126 Q127 Y180 Q306	A126-L309 HydrophobicContact CB-CD2 3.8Å; Q127-L309 HydrophobicContact CG-CD1 3.79Å; Q127-L309 HydrophobicContact CG-CD2 3.75Å; Q127-L309 HydrophobicContact CG-CG 4.4Å; Q127-L309 VanDerWaalsContact NE2-CD1 3.33Å; Y180-L309 HydrophobicContact CE1-CD2 4.37Å; Q306-L309 PolarHBondContact O-N 2.86Å
310	P	71.1	Confident	78.2	Confident	57 Å²	57	71.5 Å²	71.5	37%	0.37	34%	0.343	S	S	.	.			trans	-60.4	151.5	174.4	28.1	-34.8	0	0	0	109.7	T312	P310-T312 HydrophobicContact CB-CG2 4Å; P310-T312 HydrophobicContact CG-CG2 3.88Å; P310-T312 PolarHBondContact O-N 3.4Å; P310-T312 PolarHBondContact O-OG1 2.92Å
311	P	65	Low	78.2	Confident	87 Å²	87	77.5 Å²	77.5	57%	0.565	37%	0.369	S	S	*	.	S	Bend	trans	-64.1	88.7	175.7	28.9	-34	0	0	0	108.3	I63	I63-P311 HydrophobicContact CB-CB 4.41Å; I63-P311 HydrophobicContact CD1-CB 3.49Å; I63-P311 VanDerWaalsContact CD1-CB 3.49Å; I63-P311 HydrophobicContact CG1-CB 3.88Å; I63-P311 VanDerWaalsContact CG2-C 3.48Å; I63-P311 HydrophobicContact CG2-CB 3.72Å; I63-P311 VanDerWaalsContact CG2-O 3.25Å; I63-P311 WeakPolarHBondContact CG2-O 3.47Å
312	T	64.8	Low	78.3	Confident	74 Å²	74	78.3 Å²	78.3	45%	0.454	37%	0.371	S	S	.	.	S	Bend	trans	-143.7	157.7	-173	53.3	0	0	0	0	107.3	P310	P310-T312 HydrophobicContact CB-CG2 4Å; P310-T312 HydrophobicContact CG-CG2 3.88Å; P310-T312 PolarHBondContact O-N 3.4Å; P310-T312 PolarHBondContact O-OG1 2.92Å
313	F	63.8	Low	78.7	Confident	122 Å²	122	82.4 Å²	82.4	54%	0.535	39%	0.386	S	S	.	.			trans	-47.4	125.1	176.1	-60.6	-83.7	0	0	0	110.5	K69 M70 R315	K69-F313 VanDerWaalsContact O-CD1 3.26Å; K69-F313 WeakPolarHBondContact O-CD1 3.48Å; M70-F313 HydrophobicContact CG-CD1 3.96Å; M70-F313 HydrophobicContact CG-CE1 3.48Å; M70-F313 VanDerWaalsContact CG-CE1 3.48Å; M70-F313 HydrophobicContact CG-CZ 4.29Å; M70-F313 HydrophobicContact SD-CE1 4.05Å; M70-F313 HydrophobicContact SD-CZ 4.39Å; F313-R315 PolarHBondContact O-N 3.35Å
314	P	60.9	Low	79.1	Confident	42 Å²	42	86.3 Å²	86.3	27%	0.273	40%	0.404	S	S	.	.			trans	-60.7	106.2	-179.1	-25.7	37	0	0	0	110.8	K69 A72 I75	K69-P314 WeakPolarHBondContact O-CD 3.25Å; A72-P314 HydrophobicContact CB-CG 4.23Å; I75-P314 HydrophobicContact CD1-CB 3.35Å; I75-P314 HydrophobicContact CD1-CG 3.57Å
315	R	65.3	Low	79.6	Confident	192 Å²	192	84.7 Å²	84.7	73%	0.725	39%	0.394	S	S	*	.			trans	-105	119.2	174	-65.8	-176.4	-167.2	-174.8	4.4	109	Q127 F313	Q127-R315 PolarHBondContact NE2-O 3.33Å; F313-R315 PolarHBondContact O-N 3.35Å
316	Y	66.9	Low	80	Confident	114 Å²	114	84.8 Å²	84.8	45%	0.447	40%	0.395	S	S	.	.			trans	-78.5	127.1	171.9	-76.3	-84.3	0	0	0	110.6	I75 L303 K318	I75-Y316 WeakPolarHBondContact CG2-OH 3.24Å; L303-Y316 HydrophobicContact CD2-CE1 4.2Å; Y316-K318 PolarHBondContact O-N 3.28Å
317	A	78.1	Confident	80.9	Confident	14 Å²	14	88 Å²	88	12%	0.116	41%	0.413	C	S	.	.			trans	-71.7	109.3	169.2	0	0	0	0	0	108.5	H123 Q127 T128 I319	H123-A317 HydrophobicContact CB-CB 4.14Å; Q127-A317 HydrophobicContact CB-CB 3.95Å; T128-A317 HydrophobicContact CG2-CB 3.8Å; A317-I319 HydrophobicContact CB-CD1 4.47Å; A317-I319 PolarHBondContact O-N 2.97Å
318	K	86.1	Confident	81.7	Confident	162 Å²	162	77.3 Å²	77.3	70%	0.704	37%	0.373	S	S	*	.			trans	-75.2	99.2	173.1	-177	179.1	176.5	-176.7	0	108.3	Y316 I320	Y316-K318 PolarHBondContact O-N 3.28Å; K318-I320 PolarHBondContact O-N 3.34Å
319	I	90.4	Very high	82.5	Confident	56 Å²	56	73.5 Å²	73.5	29%	0.287	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-60.4	131	176.4	-52.1	-54.8	0	0	0	109.4	C114 T118 T128 A317	C114-I319 HydrophobicContact CB-CG2 3.63Å; T118-I319 HydrophobicContact CG2-CD1 4.09Å; T128-I319 HydrophobicContact CG2-CD1 3.98Å; A317-I319 HydrophobicContact CB-CD1 4.47Å; A317-I319 PolarHBondContact O-N 2.97Å
320	I	91.6	Very high	83.5	Confident	40 Å²	40	74 Å²	74	21%	0.205	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-63.3	160.3	179.1	64.6	160.4	0	0	0	112	C114 I117 T118 K318 E324 M325	C114-I320 HydrophobicContact CB-CG1 3.89Å; I117-I320 HydrophobicContact CB-CD1 3.69Å; I117-I320 HydrophobicContact CD1-CD1 3.88Å; I117-I320 HydrophobicContact CG1-CD1 4.42Å; I117-I320 HydrophobicContact CG2-CD1 3.49Å; I117-I320 VanDerWaalsContact CG2-CD1 3.49Å; I117-I320 HydrophobicContact CG2-CG1 4.5Å; T118-I320 PolarHBondContact OG1-N 3.28Å; K318-I320 PolarHBondContact O-N 3.34Å; I320-E324 HydrophobicContact CB-CB 4.48Å; I320-M325 HydrophobicContact CD1-CB 4.06Å
321	K	91.5	Very high	84.8	Confident	139 Å²	139	77.4 Å²	77.4	60%	0.604	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-79.1	156.9	177.9	-64.2	179.9	179.5	179.3	0	111.9	E323 E324 M325	K321-E323 VanDerWaalsContact C-N 3.29Å; K321-E323 PolarHBondContact O-N 3.46Å; K321-E324 HydrophobicContact CB-CG 4.32Å; K321-E324 PolarHBondContact N-OE2 3.49Å; K321-E324 WeakPolarHBondContact O-CB 3.36Å; K321-E324 PolarHBondContact O-N 3.32Å; K321-E324 VanDerWaalsContact O-N 3.1Å; K321-M325 PolarHBondContact O-N 3.37Å
322	R	91.3	Very high	86.3	Confident	34 Å²	34	73.4 Å²	73.4	13%	0.128	34%	0.343	C	S	.	.	H	α-helix	trans	-58.9	-34.9	178.5	-64.3	-174.3	-176.3	170.5	6.3	113.6	D110 L279 I283 Q284 M325 V326	D110-R322 HydrophobicContact CB-CG 4.21Å; L279-R322 HydrophobicContact CD1-CB 4.32Å; L279-R322 HydrophobicContact CD2-CB 4.15Å; I283-R322 PolarHBondContact O-NH1 2.94Å; I283-R322 PolarHBondContact O-NH2 2.93Å; Q284-R322 VanDerWaalsContact NE2-NH1 3.18Å; R322-M325 WeakPolarHBondContact O-CB 3.43Å; R322-M325 PolarHBondContact O-N 2.62Å; R322-V326 PolarHBondContact O-N 3.5Å
323	E	92.2	Very high	87.9	Confident	137 Å²	137	70.1 Å²	70.1	64%	0.64	32%	0.322	S	S	*	.	H	α-helix	trans	-68.7	-40	176	-64.7	175.7	179.5	0	0	111.9	L279 K321 M325 V326 N327	L279-E323 HydrophobicContact CD1-CG 4.42Å; K321-E323 VanDerWaalsContact C-N 3.29Å; K321-E323 PolarHBondContact O-N 3.46Å; E323-M325 VanDerWaalsContact C-N 3.3Å; E323-M325 PolarHBondContact O-N 3.3Å; E323-V326 PolarHBondContact O-N 3.04Å; E323-N327 PolarHBondContact O-N 3.26Å; E323-N327 PolarHBondContact O-ND2 3.41Å
324	E	94.3	Very high	89.4	Confident	96 Å²	96	68.1 Å²	68.1	45%	0.449	32%	0.317	S	S	.	.	H	α-helix	trans	-66.6	-33.6	176	-65.6	168.6	-173.6	0	0	111.4	I320 K321 V326 N327 Y328	I320-E324 HydrophobicContact CB-CB 4.48Å; K321-E324 HydrophobicContact CB-CG 4.32Å; K321-E324 PolarHBondContact N-OE2 3.49Å; K321-E324 WeakPolarHBondContact O-CB 3.36Å; K321-E324 PolarHBondContact O-N 3.32Å; K321-E324 VanDerWaalsContact O-N 3.1Å; E324-V326 VanDerWaalsContact C-N 3.33Å; E324-V326 PolarHBondContact O-N 3.23Å; E324-N327 PolarHBondContact O-N 3.1Å; E324-Y328 WeakPolarHBondContact O-CB 3.13Å; E324-Y328 PolarHBondContact O-N 3.23Å
325	M	95.6	Very high	91.2	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-57.1	-44.5	174.1	168	-81	-72.7	0	0	112	F113 I117 I275 L279 I320 K321 R322 E323 Y328 F329	F113-M325 HydrophobicContact CB-CG 3.88Å; F113-M325 HydrophobicContact CB-SD 4.38Å; I117-M325 HydrophobicContact CD1-CB 3.89Å; I117-M325 HydrophobicContact CD1-CG 3.59Å; I275-M325 HydrophobicContact CG2-CE 4.16Å; L279-M325 HydrophobicContact CD2-CE 3.93Å; I320-M325 HydrophobicContact CD1-CB 4.06Å; K321-M325 PolarHBondContact O-N 3.37Å; R322-M325 WeakPolarHBondContact O-CB 3.43Å; R322-M325 PolarHBondContact O-N 2.62Å; E323-M325 VanDerWaalsContact C-N 3.3Å; E323-M325 PolarHBondContact O-N 3.3Å; M325-Y328 PolarHBondContact O-N 2.93Å; M325-F329 HydrophobicContact CG-CD2 3.85Å; M325-F329 HydrophobicContact CG-CE2 3.73Å; M325-F329 WeakPolarHBondContact O-CD2 3.33Å; M325-F329 PolarHBondContact O-N 3.42Å; M325-F329 HydrophobicContact SD-CD2 3.51Å; M325-F329 VanDerWaalsContact SD-CD2 3.51Å; M325-F329 HydrophobicContact SD-CE2 3.7Å
326	V	96.4	Very high	92.7	Very high	11 Å²	11	58.7 Å²	58.7	7%	0.067	28%	0.276	C	S	.	.	H	α-helix	trans	-63.6	-46.7	178	178.1	0	0	0	0	110.6	L272 H276 L279 R322 E323 E324 Y328 F329 S330	L272-V326 HydrophobicContact CD1-CB 4.47Å; L272-V326 HydrophobicContact CD1-CG1 4.03Å; L272-V326 HydrophobicContact CD2-CG1 4.32Å; L272-V326 HydrophobicContact CG-CG1 3.93Å; H276-V326 HydrophobicContact CB-CG1 3.88Å; H276-V326 HydrophobicContact CB-CG2 4.22Å; L279-V326 HydrophobicContact CD1-CG2 4.11Å; R322-V326 PolarHBondContact O-N 3.5Å; E323-V326 PolarHBondContact O-N 3.04Å; E324-V326 VanDerWaalsContact C-N 3.33Å; E324-V326 PolarHBondContact O-N 3.23Å; V326-Y328 VanDerWaalsContact C-N 3.28Å; V326-Y328 PolarHBondContact O-N 3.21Å; V326-F329 PolarHBondContact O-N 3.43Å; V326-S330 WeakPolarHBondContact O-CB 3.35Å; V326-S330 PolarHBondContact O-N 2.98Å
327	N	96.5	Very high	94.1	Very high	100 Å²	100	55.2 Å²	55.2	54%	0.535	26%	0.263	S	S	.	.	H	α-helix	trans	-61	-39	178.6	-71.4	-33.6	0	0	0	112.3	E323 E324 K331	E323-N327 PolarHBondContact O-N 3.26Å; E323-N327 PolarHBondContact O-ND2 3.41Å; E324-N327 PolarHBondContact O-N 3.1Å; N327-K331 WeakPolarHBondContact O-CG 3.29Å; N327-K331 PolarHBondContact O-N 3.3Å
328	Y	97.3	Very high	94.9	Very high	25 Å²	25	56 Å²	56	10%	0.098	27%	0.267	C	S	.	.	H	α-helix	trans	-66.1	-49.7	176.9	-177.4	-88.3	0	0	0	111.8	I117 E121 E324 M325 V326 S330 K331 L332 C364	I117-Y328 HydrophobicContact CB-CD1 4.13Å; I117-Y328 HydrophobicContact CB-CE1 4.28Å; I117-Y328 HydrophobicContact CB-CG 4.48Å; I117-Y328 HydrophobicContact CD1-CD1 3.59Å; I117-Y328 HydrophobicContact CD1-CE1 4.4Å; I117-Y328 HydrophobicContact CD1-CG 4.04Å; I117-Y328 HydrophobicContact CG1-CD1 3.48Å; I117-Y328 VanDerWaalsContact CG1-CD1 3.48Å; I117-Y328 HydrophobicContact CG1-CE1 3.79Å; I117-Y328 HydrophobicContact CG1-CG 4.19Å; I117-Y328 HydrophobicContact CG2-CD1 3.54Å; I117-Y328 HydrophobicContact CG2-CD2 3.7Å; I117-Y328 HydrophobicContact CG2-CE1 3.76Å; I117-Y328 HydrophobicContact CG2-CE2 3.95Å; I117-Y328 HydrophobicContact CG2-CG 3.49Å; I117-Y328 VanDerWaalsContact CG2-CG 3.49Å; E121-Y328 HydrophobicContact CG-CE2 4.25Å; E121-Y328 WeakPolarHBondContact OE1-CE2 3.41Å; E324-Y328 WeakPolarHBondContact O-CB 3.13Å; E324-Y328 PolarHBondContact O-N 3.23Å; M325-Y328 PolarHBondContact O-N 2.93Å; V326-Y328 VanDerWaalsContact C-N 3.28Å; V326-Y328 PolarHBondContact O-N 3.21Å; Y328-S330 VanDerWaalsContact C-N 3.29Å; Y328-S330 PolarHBondContact O-N 3.11Å; Y328-K331 PolarHBondContact O-N 3.23Å; Y328-L332 HydrophobicContact CE1-CB 4.41Å; Y328-L332 HydrophobicContact CE1-CD2 4.2Å; Y328-L332 WeakPolarHBondContact O-CB 3.32Å; Y328-L332 PolarHBondContact O-N 2.94Å; Y328-C364 HydrophobicContact CE2-CB 4.3Å; Y328-C364 VanDerWaalsContact OH-CB 3.3Å; Y328-C364 WeakPolarHBondContact OH-CB 3.38Å; Y328-C364 PolarHBondContact OH-SG 3.04Å
329	F	97.9	Very high	95.4	Very high	3 Å²	3	48.3 Å²	48.3	1%	0.013	23%	0.234	C	C	.	.	H	α-helix	trans	-63	-36.6	178.1	-80	-50.1	0	0	0	112.5	F113 L116 I117 F239 L243 L272 M325 V326 K331 L332 I333	F113-F329 HydrophobicContact CB-CE2 3.84Å; F113-F329 HydrophobicContact CB-CZ 4.23Å; F113-F329 HydrophobicContact CD1-CE2 4.05Å; F113-F329 AromaticContact CD1-CZ 3.93Å; F113-F329 HydrophobicContact CD1-CZ 3.93Å; F113-F329 HydrophobicContact CD2-CE2 4.43Å; F113-F329 AromaticContact CG-CE2 3.87Å; F113-F329 HydrophobicContact CG-CE2 3.87Å; F113-F329 HydrophobicContact CG-CZ 4.2Å; L116-F329 HydrophobicContact CD2-CZ 4.43Å; I117-F329 HydrophobicContact CD1-CD2 4.06Å; I117-F329 HydrophobicContact CD1-CE1 4.31Å; I117-F329 HydrophobicContact CD1-CE2 3.81Å; I117-F329 HydrophobicContact CD1-CG 4.43Å; I117-F329 HydrophobicContact CD1-CZ 3.92Å; I117-F329 HydrophobicContact CG1-CE1 4.34Å; I117-F329 HydrophobicContact CG1-CZ 4.13Å; F239-F329 HydrophobicContact CE1-CD1 4.24Å; F239-F329 HydrophobicContact CE1-CD2 4.07Å; F239-F329 HydrophobicContact CE1-CE1 4.23Å; F239-F329 HydrophobicContact CE1-CE2 4.02Å; F239-F329 HydrophobicContact CE1-CG 4.19Å; F239-F329 HydrophobicContact CE1-CZ 4.13Å; F239-F329 HydrophobicContact CZ-CB 4.16Å; F239-F329 HydrophobicContact CZ-CD1 4.02Å; F239-F329 HydrophobicContact CZ-CD2 4.12Å; F239-F329 HydrophobicContact CZ-CE1 4.45Å; F239-F329 AromaticContact CZ-CG 3.87Å; F239-F329 HydrophobicContact CZ-CG 3.87Å; L243-F329 HydrophobicContact CD2-CE1 4.15Å; L272-F329 HydrophobicContact CD1-CB 3.96Å; L272-F329 HydrophobicContact CD1-CD2 4.48Å; L272-F329 HydrophobicContact CD2-CB 3.95Å; M325-F329 HydrophobicContact CG-CD2 3.85Å; M325-F329 HydrophobicContact CG-CE2 3.73Å; M325-F329 WeakPolarHBondContact O-CD2 3.33Å; M325-F329 PolarHBondContact O-N 3.42Å; M325-F329 HydrophobicContact SD-CD2 3.51Å; M325-F329 VanDerWaalsContact SD-CD2 3.51Å; M325-F329 HydrophobicContact SD-CE2 3.7Å; V326-F329 PolarHBondContact O-N 3.43Å; F329-K331 PolarHBondContact O-N 3.47Å; F329-L332 HydrophobicContact CD1-CD2 4.16Å; F329-L332 HydrophobicContact CE1-CD2 4.46Å; F329-L332 PolarHBondContact O-N 3.05Å; F329-I333 WeakPolarHBondContact O-CB 3.43Å; F329-I333 WeakPolarHBondContact O-CD1 3.07Å; F329-I333 WeakPolarHBondContact O-CG1 3.34Å; F329-I333 PolarHBondContact O-N 2.79Å
330	S	97.4	Very high	95.6	Very high	49 Å²	49	45.8 Å²	45.8	34%	0.343	22%	0.221	S	C	.	.	H	α-helix	trans	-56.8	-51.4	174.6	-176.8	0	0	0	0	110.8	L272 V326 Y328 L332 I333 D334	L272-S330 VanDerWaalsContact CD2-N 3.33Å; V326-S330 WeakPolarHBondContact O-CB 3.35Å; V326-S330 PolarHBondContact O-N 2.98Å; Y328-S330 VanDerWaalsContact C-N 3.29Å; Y328-S330 PolarHBondContact O-N 3.11Å; S330-L332 PolarHBondContact O-N 3.23Å; S330-I333 PolarHBondContact O-N 3.42Å; S330-D334 PolarHBondContact O-N 3.09Å; S330-D334 VanDerWaalsContact O-N 3.12Å
331	K	97.1	Very high	95.8	Very high	128 Å²	128	48.1 Å²	48.1	56%	0.557	23%	0.231	S	C	*	.	H	α-helix	trans	-62	-40.3	175.3	-68.7	175.8	-178	178.5	0	112.7	N327 Y328 F329 D334 R335	N327-K331 WeakPolarHBondContact O-CG 3.29Å; N327-K331 PolarHBondContact O-N 3.3Å; Y328-K331 PolarHBondContact O-N 3.23Å; F329-K331 PolarHBondContact O-N 3.47Å; K331-D334 PolarHBondContact O-N 3.47Å; K331-R335 WeakPolarHBondContact O-CB 3.35Å; K331-R335 WeakPolarHBondContact O-CD 3.29Å; K331-R335 WeakPolarHBondContact O-CG 3.35Å; K331-R335 PolarHBondContact O-N 2.77Å
332	L	97.4	Very high	95.9	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.021	20%	0.202	C	C	.	.	H	α-helix	trans	-64.1	-43.2	178.2	177.9	60.5	0	0	0	111.6	Y328 F329 S330 R335 I336 L366	Y328-L332 HydrophobicContact CE1-CB 4.41Å; Y328-L332 HydrophobicContact CE1-CD2 4.2Å; Y328-L332 WeakPolarHBondContact O-CB 3.32Å; Y328-L332 PolarHBondContact O-N 2.94Å; F329-L332 HydrophobicContact CD1-CD2 4.16Å; F329-L332 HydrophobicContact CE1-CD2 4.46Å; F329-L332 PolarHBondContact O-N 3.05Å; S330-L332 PolarHBondContact O-N 3.23Å; L332-R335 PolarHBondContact O-N 3.18Å; L332-I336 HydrophobicContact CD1-CD1 3.88Å; L332-I336 HydrophobicContact CD1-CG1 4.09Å; L332-I336 HydrophobicContact CG-CD1 3.88Å; L332-I336 HydrophobicContact CG-CG1 4.45Å; L332-I336 VanDerWaalsContact O-CG1 3.29Å; L332-I336 WeakPolarHBondContact O-CG1 3.38Å; L332-I336 PolarHBondContact O-N 3.02Å; L332-L366 HydrophobicContact CD2-CD2 4.41Å
333	I	97.5	Very high	95.9	Very high	5 Å²	5	41.5 Å²	41.5	3%	0.026	21%	0.206	C	C	.	.	H	α-helix	trans	-59.5	-48.4	177.2	-72	162.7	0	0	0	110	F239 M265 A268 T269 L272 F329 S330 R335 I336 K337	F239-I333 HydrophobicContact CE2-CD1 4.07Å; M265-I333 HydrophobicContact CB-CG2 4.23Å; M265-I333 WeakPolarHBondContact O-CG2 3.24Å; M265-I333 HydrophobicContact SD-CB 4.11Å; M265-I333 HydrophobicContact SD-CG1 3.83Å; M265-I333 HydrophobicContact SD-CG2 3.97Å; A268-I333 HydrophobicContact CB-CD1 3.92Å; A268-I333 HydrophobicContact CB-CG1 4.22Å; T269-I333 WeakPolarHBondContact OG1-CG2 3.46Å; L272-I333 HydrophobicContact CB-CD1 4.49Å; L272-I333 HydrophobicContact CD2-CD1 3.9Å; F329-I333 WeakPolarHBondContact O-CB 3.43Å; F329-I333 WeakPolarHBondContact O-CD1 3.07Å; F329-I333 WeakPolarHBondContact O-CG1 3.34Å; F329-I333 PolarHBondContact O-N 2.79Å; S330-I333 PolarHBondContact O-N 3.42Å; I333-R335 PolarHBondContact O-N 3.17Å; I333-I336 PolarHBondContact O-N 3.01Å; I333-K337 HydrophobicContact CG2-CD 4.4Å; I333-K337 WeakPolarHBondContact O-CG 3.19Å; I333-K337 PolarHBondContact O-N 3.3Å
334	D	96.8	Very high	95.9	Very high	79 Å²	79	40.7 Å²	40.7	42%	0.422	21%	0.206	S	C	.	.	H	α-helix	trans	-64.8	-41.2	179.7	-70.8	-20.8	0	0	0	111.9	S330 K331 I336 K337 T338	S330-D334 PolarHBondContact O-N 3.09Å; S330-D334 VanDerWaalsContact O-N 3.12Å; K331-D334 PolarHBondContact O-N 3.47Å; D334-I336 PolarHBondContact O-N 3.44Å; D334-K337 WeakPolarHBondContact O-CB 3.26Å; D334-K337 PolarHBondContact O-N 2.73Å; D334-K337 IonicContact OD1-NZ 3.29Å; D334-K337 PolarHBondContact OD1-NZ 3.28Å; D334-T338 PolarHBondContact O-N 2.98Å; D334-T338 PolarHBondContact O-OG1 3.27Å
335	R	96.9	Very high	95.7	Very high	36 Å²	36	38.3 Å²	38.3	14%	0.136	20%	0.196	C	C	.	.	H	α-helix	trans	-59.3	-44.7	172.9	-71.1	162.6	-178.1	176.8	-8.1	111.7	K331 L332 I333 K337 T338 V339 F358 S362	K331-R335 WeakPolarHBondContact O-CB 3.35Å; K331-R335 WeakPolarHBondContact O-CD 3.29Å; K331-R335 WeakPolarHBondContact O-CG 3.35Å; K331-R335 PolarHBondContact O-N 2.77Å; L332-R335 PolarHBondContact O-N 3.18Å; I333-R335 PolarHBondContact O-N 3.17Å; R335-K337 VanDerWaalsContact C-N 3.35Å; R335-T338 WeakPolarHBondContact O-CB 3.3Å; R335-T338 PolarHBondContact O-N 3.15Å; R335-V339 WeakPolarHBondContact O-CG2 3.38Å; R335-V339 PolarHBondContact O-N 3.1Å; R335-F358 HydrophobicContact CB-CE2 4.18Å; R335-F358 HydrophobicContact CB-CZ 4.24Å; R335-F358 HydrophobicContact CG-CE2 4.5Å; R335-S362 PolarHBondContact NH2-O 3.07Å
336	I	97.1	Very high	95.4	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65.3	-38.5	178.2	-67.6	170.5	0	0	0	110.9	V246 F250 M265 L332 I333 D334 T338 V339 C340 L370	V246-I336 HydrophobicContact CG1-CG2 4.13Å; F250-I336 HydrophobicContact CE2-CG2 3.75Å; F250-I336 HydrophobicContact CZ-CG2 4.04Å; M265-I336 HydrophobicContact CE-CB 4.45Å; M265-I336 HydrophobicContact CE-CD1 3.67Å; M265-I336 HydrophobicContact CE-CG2 4.12Å; M265-I336 HydrophobicContact CG-CB 4.32Å; M265-I336 HydrophobicContact CG-CG2 3.81Å; M265-I336 HydrophobicContact SD-CB 4.28Å; M265-I336 HydrophobicContact SD-CD1 4.34Å; M265-I336 HydrophobicContact SD-CG2 4.23Å; L332-I336 HydrophobicContact CD1-CD1 3.88Å; L332-I336 HydrophobicContact CD1-CG1 4.09Å; L332-I336 HydrophobicContact CG-CD1 3.88Å; L332-I336 HydrophobicContact CG-CG1 4.45Å; L332-I336 VanDerWaalsContact O-CG1 3.29Å; L332-I336 WeakPolarHBondContact O-CG1 3.38Å; L332-I336 PolarHBondContact O-N 3.02Å; I333-I336 PolarHBondContact O-N 3.01Å; D334-I336 PolarHBondContact O-N 3.44Å; I336-T338 VanDerWaalsContact C-N 3.33Å; I336-T338 PolarHBondContact O-N 3.37Å; I336-V339 WeakPolarHBondContact O-CB 3.49Å; I336-V339 PolarHBondContact O-N 3.15Å; I336-C340 PolarHBondContact O-N 3.2Å; I336-C340 PolarHBondContact O-SG 3.21Å; I336-L370 HydrophobicContact CD1-CD1 4.13Å; I336-L370 HydrophobicContact CG1-CD1 4.03Å
337	K	96.1	Very high	95.1	Very high	41 Å²	41	45.8 Å²	45.8	18%	0.178	24%	0.24	C	C	.	.	H	α-helix	trans	-58.6	-45.5	173	-70.9	171.7	-171.2	157.1	0	111.1	M265 T269 I333 D334 R335 C340	M265-K337 HydrophobicContact CB-CG 3.82Å; T269-K337 PolarHBondContact OG1-NZ 3.24Å; I333-K337 HydrophobicContact CG2-CD 4.4Å; I333-K337 WeakPolarHBondContact O-CG 3.19Å; I333-K337 PolarHBondContact O-N 3.3Å; D334-K337 WeakPolarHBondContact O-CB 3.26Å; D334-K337 PolarHBondContact O-N 2.73Å; D334-K337 IonicContact OD1-NZ 3.29Å; D334-K337 PolarHBondContact OD1-NZ 3.28Å; R335-K337 VanDerWaalsContact C-N 3.35Å; K337-C340 WeakPolarHBondContact O-CB 3.4Å; K337-C340 PolarHBondContact O-N 3.29Å; K337-C340 VanDerWaalsContact O-N 3.15Å
338	T	96	Very high	95	Very high	32 Å²	32	41 Å²	41	20%	0.196	22%	0.215	C	C	.	.	H	α-helix	trans	-60.5	-45.8	174.1	-56.9	0	0	0	0	111	D334 R335 I336 C340 E341 F354 F358	D334-T338 PolarHBondContact O-N 2.98Å; D334-T338 PolarHBondContact O-OG1 3.27Å; R335-T338 WeakPolarHBondContact O-CB 3.3Å; R335-T338 PolarHBondContact O-N 3.15Å; I336-T338 VanDerWaalsContact C-N 3.33Å; I336-T338 PolarHBondContact O-N 3.37Å; T338-C340 PolarHBondContact O-N 3.15Å; T338-E341 VanDerWaalsContact O-CB 3.3Å; T338-E341 WeakPolarHBondContact O-CB 3.36Å; T338-E341 PolarHBondContact O-N 3.07Å; T338-F354 HydrophobicContact CG2-CE2 4.09Å; T338-F354 HydrophobicContact CG2-CZ 3.77Å; T338-F354 VanDerWaalsContact O-CZ 3.3Å; T338-F354 WeakPolarHBondContact O-CZ 3.31Å; T338-F358 HydrophobicContact CG2-CD2 3.9Å; T338-F358 HydrophobicContact CG2-CE2 4.32Å
339	V	96.4	Very high	94.9	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-54.6	-37.8	175	172.2	0	0	0	0	111.8	F250 R335 I336 E341 V342 F358 L370 L371	F250-V339 HydrophobicContact CE1-CG1 3.9Å; F250-V339 HydrophobicContact CZ-CG1 4.12Å; R335-V339 WeakPolarHBondContact O-CG2 3.38Å; R335-V339 PolarHBondContact O-N 3.1Å; I336-V339 WeakPolarHBondContact O-CB 3.49Å; I336-V339 PolarHBondContact O-N 3.15Å; V339-E341 PolarHBondContact O-N 3.05Å; V339-V342 WeakPolarHBondContact O-CG1 3.45Å; V339-V342 PolarHBondContact O-N 3.23Å; V339-F358 HydrophobicContact CG2-CE1 4.33Å; V339-F358 HydrophobicContact CG2-CE2 3.83Å; V339-F358 HydrophobicContact CG2-CZ 3.62Å; V339-L370 HydrophobicContact CG1-CB 4.41Å; V339-L371 HydrophobicContact CG1-CB 4.22Å; V339-L371 HydrophobicContact CG1-CD1 4.31Å; V339-L371 HydrophobicContact CG2-CB 3.89Å
340	C	95	Very high	94.7	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.014	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-17.6	176.3	-64.7	0	0	0	0	114.1	V258 Q262 I336 K337 T338 V343	V258-C340 HydrophobicContact CG1-CB 3.66Å; Q262-C340 HydrophobicContact CB-CB 3.96Å; Q262-C340 HydrophobicContact CG-CB 4.18Å; I336-C340 PolarHBondContact O-N 3.2Å; I336-C340 PolarHBondContact O-SG 3.21Å; K337-C340 WeakPolarHBondContact O-CB 3.4Å; K337-C340 PolarHBondContact O-N 3.29Å; K337-C340 VanDerWaalsContact O-N 3.15Å; T338-C340 PolarHBondContact O-N 3.15Å; C340-V343 WeakPolarHBondContact O-CG2 3.33Å
341	E	94.4	Very high	94.6	Very high	89 Å²	89	41.2 Å²	41.2	42%	0.416	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-21.2	-179.2	-63.2	171.7	173.6	0	0	112.6	T338 V339 V343 N344 F354	T338-E341 VanDerWaalsContact O-CB 3.3Å; T338-E341 WeakPolarHBondContact O-CB 3.36Å; T338-E341 PolarHBondContact O-N 3.07Å; V339-E341 PolarHBondContact O-N 3.05Å; E341-V343 PolarHBondContact O-N 3.49Å; E341-V343 VanDerWaalsContact O-N 3.14Å; E341-N344 WeakPolarHBondContact O-CB 3.47Å; E341-N344 PolarHBondContact O-N 3.5Å; E341-N344 PolarHBondContact O-ND2 3.37Å; E341-F354 HydrophobicContact CB-CE2 4.42Å
342	V	93.6	Very high	94.5	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-59	-30.5	-176.8	77.5	0	0	0	0	112.5	V339 N344 L345 I351 F354 F355 L371 T374 F383	V339-V342 WeakPolarHBondContact O-CG1 3.45Å; V339-V342 PolarHBondContact O-N 3.23Å; V342-N344 PolarHBondContact O-N 3.17Å; V342-N344 VanDerWaalsContact O-N 3.14Å; V342-L345 WeakPolarHBondContact O-CB 3.48Å; V342-L345 PolarHBondContact O-N 3.36Å; V342-I351 HydrophobicContact CG2-CD1 3.69Å; V342-F354 HydrophobicContact CB-CD1 4.27Å; V342-F354 HydrophobicContact CB-CE1 3.87Å; V342-F354 HydrophobicContact CB-CZ 4.11Å; V342-F354 HydrophobicContact CG2-CD1 3.9Å; V342-F354 HydrophobicContact CG2-CE1 3.98Å; V342-F354 HydrophobicContact CG2-CG 4.49Å; V342-F355 HydrophobicContact CG2-CE2 4.43Å; V342-L371 HydrophobicContact CB-CD1 3.94Å; V342-L371 HydrophobicContact CG1-CD1 3.99Å; V342-L371 HydrophobicContact CG2-CD1 3.91Å; V342-T374 HydrophobicContact CG1-CG2 4.15Å; V342-F383 HydrophobicContact CG1-CE1 4.05Å; V342-F383 HydrophobicContact CG2-CZ 4.44Å; V342-F383 VanDerWaalsContact O-CZ 3.31Å; V342-F383 WeakPolarHBondContact O-CZ 3.25Å
343	V	91.7	Very high	94.3	Very high	35 Å²	35	37.6 Å²	37.6	21%	0.212	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-67	-14.9	-179.3	-58.9	0	0	0	0	113.1	T255 V258 C340 E341 L345 T374 F383	T255-V343 HydrophobicContact CG2-CB 4.27Å; T255-V343 HydrophobicContact CG2-CG1 3.86Å; V258-V343 HydrophobicContact CB-CG1 4.31Å; V258-V343 HydrophobicContact CG1-CG1 4.15Å; V258-V343 HydrophobicContact CG1-CG2 4.47Å; V258-V343 HydrophobicContact CG2-CG1 4.26Å; C340-V343 WeakPolarHBondContact O-CG2 3.33Å; E341-V343 PolarHBondContact O-N 3.49Å; E341-V343 VanDerWaalsContact O-N 3.14Å; V343-L345 VanDerWaalsContact C-N 3.29Å; V343-T374 HydrophobicContact CG1-CG2 4.17Å; V343-F383 HydrophobicContact CG1-CD1 4.22Å; V343-F383 HydrophobicContact CG1-CE1 4.18Å
344	N	92.1	Very high	94.3	Very high	120 Å²	120	38.6 Å²	38.6	64%	0.642	21%	0.208	S	C	*	.	G	3₁₀ helix	trans	-84	-6.8	176.6	-58	-50.9	0	0	0	112.5	E341 V342	E341-N344 WeakPolarHBondContact O-CB 3.47Å; E341-N344 PolarHBondContact O-N 3.5Å; E341-N344 PolarHBondContact O-ND2 3.37Å; V342-N344 PolarHBondContact O-N 3.17Å; V342-N344 VanDerWaalsContact O-N 3.14Å
345	L	91.5	Very high	94.3	Very high	45 Å²	45	34.9 Å²	34.9	24%	0.236	19%	0.188	C	C	.	.			trans	-96.9	127.9	-177.6	-57.4	-180	0	0	0	110.6	V342 V343 C350 I351 F354 F383	V342-L345 WeakPolarHBondContact O-CB 3.48Å; V342-L345 PolarHBondContact O-N 3.36Å; V343-L345 VanDerWaalsContact C-N 3.29Å; L345-C350 HydrophobicContact CD2-CB 4.41Å; L345-I351 HydrophobicContact CB-CD1 3.57Å; L345-I351 HydrophobicContact CB-CG1 4.18Å; L345-I351 HydrophobicContact CD1-CD1 4.06Å; L345-I351 HydrophobicContact CG-CD1 4.44Å; L345-F354 HydrophobicContact CD1-CB 3.69Å; L345-F354 HydrophobicContact CD1-CD2 3.75Å; L345-F354 HydrophobicContact CD1-CG 3.81Å; L345-F383 WeakPolarHBondContact O-CE2 3.36Å
346	T	88.5	Confident	94.2	Very high	123 Å²	123	33.9 Å²	33.9	76%	0.755	19%	0.187	S	C	*	.			trans	-114.9	-11.2	-180	56.4	0	0	0	0	113.5	M391	T346-M391 WeakPolarHBondContact O-CE 3.47Å
347	N	90.6	Very high	94	Very high	45 Å²	45	39 Å²	39	24%	0.241	21%	0.21	C	C	.	.			trans	-99.2	133.1	-178	179.6	-74.6	0	0	0	110.9	H349 C350 I351 S398	N347-H349 PolarHBondContact O-N 3.48Å; N347-H349 WeakPolarHBondContact OD1-CA 3.22Å; N347-H349 WeakPolarHBondContact OD1-CB 3.17Å; N347-H349 PolarHBondContact OD1-N 3.39Å; N347-C350 HydrophobicContact CB-CB 4.18Å; N347-C350 PolarHBondContact O-N 3.2Å; N347-C350 PolarHBondContact OD1-N 3.26Å; N347-I351 WeakPolarHBondContact O-CG1 3.39Å; N347-I351 PolarHBondContact O-N 3.44Å; N347-S398 PolarHBondContact ND2-OG 3.06Å
348	L	94.2	Very high	94	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-59.9	-41.8	-177.7	-178.3	58.2	0	0	0	113.3	I351 L352 M388 M391 V392 A395 F432 I436 W491	L348-I351 WeakPolarHBondContact O-CB 3.43Å; L348-I351 PolarHBondContact O-N 3.35Å; L348-L352 HydrophobicContact CG-CD1 4.3Å; L348-L352 WeakPolarHBondContact O-CG 3.32Å; L348-L352 PolarHBondContact O-N 3.44Å; L348-M388 HydrophobicContact CD1-CE 3.66Å; L348-M391 HydrophobicContact CB-CG 4.09Å; L348-M391 HydrophobicContact CB-SD 4.42Å; L348-M391 HydrophobicContact CD1-SD 4.17Å; L348-V392 HydrophobicContact CD2-CG2 4.19Å; L348-A395 HydrophobicContact CB-CB 3.79Å; L348-A395 HydrophobicContact CD2-CB 3.95Å; L348-A395 HydrophobicContact CG-CB 4.5Å; L348-F432 HydrophobicContact CD2-CD1 3.89Å; L348-F432 HydrophobicContact CD2-CE1 4.04Å; L348-F432 HydrophobicContact CD2-CG 4.47Å; L348-I436 HydrophobicContact CD1-CD1 4.17Å; L348-W491 HydrophobicContact CD2-CZ2 4.13Å
349	H	93.8	Very high	93.9	Very high	20 Å²	20	35.9 Å²	35.9	9%	0.093	20%	0.195	C	C	.	.	H	α-helix	trans	-66.7	-41.2	179.7	-61.4	159.4	0	0	0	110.7	N347 I351 L352 D353 F399 W491 Y494 H495	N347-H349 PolarHBondContact O-N 3.48Å; N347-H349 WeakPolarHBondContact OD1-CA 3.22Å; N347-H349 WeakPolarHBondContact OD1-CB 3.17Å; N347-H349 PolarHBondContact OD1-N 3.39Å; H349-I351 VanDerWaalsContact C-N 3.31Å; H349-I351 PolarHBondContact O-N 3.27Å; H349-L352 PolarHBondContact O-N 2.84Å; H349-D353 PolarHBondContact O-N 3.41Å; H349-F399 AromaticContact CE1-CD2 3.39Å; H349-F399 WeakPolarHBondContact CE1-CD2 3.47Å; H349-F399 AromaticContact CE1-CG 3.75Å; H349-F399 AromaticContact ND1-CD2 3.76Å; H349-W491 AromaticContact CE1-NE1 3.64Å; H349-W491 AromaticContact NE2-NE1 3.41Å; H349-W491 PolarHBondContact NE2-NE1 3.25Å; H349-Y494 AromaticContact NE2-CE1 3.91Å; H349-H495 AromaticContact CD2-CE1 3.46Å; H349-H495 PolarHBondContact CD2-CE1 3.24Å; H349-H495 VanDerWaalsContact CD2-CE1 3.46Å; H349-H495 AromaticContact CD2-NE2 3.72Å; H349-H495 AromaticContact NE2-CE1 3.25Å; H349-H495 PolarHBondContact NE2-CE1 3.14Å; H349-H495 VanDerWaalsContact NE2-CE1 3.25Å; H349-H495 AromaticContact NE2-NE2 3.05Å; H349-H495 PolarHBondContact NE2-NE2 2.89Å
350	C	93.6	Very high	93.7	Very high	61 Å²	61	39.3 Å²	39.3	41%	0.412	21%	0.211	S	C	.	.	H	α-helix	trans	-61.9	-37.2	172.3	-61.7	0	0	0	0	112.8	L345 N347 F354	L345-C350 HydrophobicContact CD2-CB 4.41Å; N347-C350 HydrophobicContact CB-CB 4.18Å; N347-C350 PolarHBondContact O-N 3.2Å; N347-C350 PolarHBondContact OD1-N 3.26Å; C350-F354 VanDerWaalsContact O-CB 3.25Å; C350-F354 WeakPolarHBondContact O-CB 3.44Å; C350-F354 PolarHBondContact O-N 2.75Å
351	I	95.3	Very high	93.5	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-65	-47.5	174.6	-70.6	-70.1	0	0	0	110.8	V342 L345 N347 L348 H349 D353 F354 F355 F375 F383 M391 I436	V342-I351 HydrophobicContact CG2-CD1 3.69Å; L345-I351 HydrophobicContact CB-CD1 3.57Å; L345-I351 HydrophobicContact CB-CG1 4.18Å; L345-I351 HydrophobicContact CD1-CD1 4.06Å; L345-I351 HydrophobicContact CG-CD1 4.44Å; N347-I351 WeakPolarHBondContact O-CG1 3.39Å; N347-I351 PolarHBondContact O-N 3.44Å; L348-I351 WeakPolarHBondContact O-CB 3.43Å; L348-I351 PolarHBondContact O-N 3.35Å; H349-I351 VanDerWaalsContact C-N 3.31Å; H349-I351 PolarHBondContact O-N 3.27Å; I351-D353 VanDerWaalsContact C-N 3.32Å; I351-D353 PolarHBondContact O-N 2.94Å; I351-F354 WeakPolarHBondContact O-CB 3.44Å; I351-F354 PolarHBondContact O-N 3.04Å; I351-F355 HydrophobicContact CG2-CD2 3.85Å; I351-F355 HydrophobicContact CG2-CE2 3.92Å; I351-F355 WeakPolarHBondContact O-CD2 3.22Å; I351-F355 PolarHBondContact O-N 2.99Å; I351-F375 HydrophobicContact CB-CE2 4.37Å; I351-F375 HydrophobicContact CD1-CD2 3.9Å; I351-F375 HydrophobicContact CD1-CE2 3.8Å; I351-F375 HydrophobicContact CG1-CD2 4.42Å; I351-F375 HydrophobicContact CG1-CE2 3.84Å; I351-F375 HydrophobicContact CG1-CZ 4.45Å; I351-F375 HydrophobicContact CG2-CD1 4.38Å; I351-F375 HydrophobicContact CG2-CD2 4.1Å; I351-F375 HydrophobicContact CG2-CE1 4.08Å; I351-F375 HydrophobicContact CG2-CE2 3.71Å; I351-F375 HydrophobicContact CG2-CG 4.44Å; I351-F375 HydrophobicContact CG2-CZ 3.73Å; I351-F383 HydrophobicContact CD1-CZ 4.17Å; I351-M391 HydrophobicContact CG1-CE 3.67Å; I351-I436 HydrophobicContact CG2-CD1 4.29Å
352	L	95.8	Very high	93.3	Very high	5 Å²	5	43.7 Å²	43.7	3%	0.026	24%	0.24	C	C	.	.	H	α-helix	trans	-58.7	-46.7	178.3	-73.6	168.4	0	0	0	111	L348 H349 F354 F355 C356 F432 L435 I436	L348-L352 HydrophobicContact CG-CD1 4.3Å; L348-L352 WeakPolarHBondContact O-CG 3.32Å; L348-L352 PolarHBondContact O-N 3.44Å; H349-L352 PolarHBondContact O-N 2.84Å; L352-F354 PolarHBondContact O-N 2.97Å; L352-F355 PolarHBondContact O-N 2.89Å; L352-C356 PolarHBondContact O-N 3.18Å; L352-C356 PolarHBondContact O-SG 3.24Å; L352-F432 HydrophobicContact CD1-CD1 4.47Å; L352-F432 HydrophobicContact CD1-CE1 4.41Å; L352-L435 HydrophobicContact CD2-CD2 3.95Å; L352-L435 HydrophobicContact CD2-CG 4.13Å; L352-I436 HydrophobicContact CD2-CD1 4.38Å; L352-I436 HydrophobicContact CD2-CG1 3.61Å
353	D	93.9	Very high	93.3	Very high	51 Å²	51	44.1 Å²	44.1	27%	0.273	24%	0.242	S	C	.	.	H	α-helix	trans	-63.2	-41.1	177.2	-67.5	-16.9	0	0	0	111.4	H349 I351 F355 C356 E357 R498	H349-D353 PolarHBondContact O-N 3.41Å; I351-D353 VanDerWaalsContact C-N 3.32Å; I351-D353 PolarHBondContact O-N 2.94Å; D353-F355 PolarHBondContact O-N 3.37Å; D353-C356 WeakPolarHBondContact O-CB 3.48Å; D353-C356 PolarHBondContact O-N 3.26Å; D353-E357 WeakPolarHBondContact O-CB 3.38Å; D353-E357 VanDerWaalsContact O-CG 3.32Å; D353-E357 WeakPolarHBondContact O-CG 3.16Å; D353-E357 PolarHBondContact O-N 3.5Å; D353-R498 IonicContact OD1-CZ 3.69Å; D353-R498 VanDerWaalsContact OD1-CZ 3.31Å; D353-R498 IonicContact OD1-NH1 3.78Å; D353-R498 PolarHBondContact OD1-NH1 3.43Å; D353-R498 IonicContact OD1-NH2 2.79Å; D353-R498 PolarHBondContact OD1-NH2 3.04Å
354	F	96.4	Very high	93.4	Very high	25 Å²	25	42.8 Å²	42.8	11%	0.11	24%	0.235	C	C	.	.	H	α-helix	trans	-60.2	-44.3	175.2	-177.6	-82.6	0	0	0	112.3	T338 E341 V342 L345 C350 I351 L352 E357 F358 L371	T338-F354 HydrophobicContact CG2-CE2 4.09Å; T338-F354 HydrophobicContact CG2-CZ 3.77Å; T338-F354 VanDerWaalsContact O-CZ 3.3Å; T338-F354 WeakPolarHBondContact O-CZ 3.31Å; E341-F354 HydrophobicContact CB-CE2 4.42Å; V342-F354 HydrophobicContact CB-CD1 4.27Å; V342-F354 HydrophobicContact CB-CE1 3.87Å; V342-F354 HydrophobicContact CB-CZ 4.11Å; V342-F354 HydrophobicContact CG2-CD1 3.9Å; V342-F354 HydrophobicContact CG2-CE1 3.98Å; V342-F354 HydrophobicContact CG2-CG 4.49Å; L345-F354 HydrophobicContact CD1-CB 3.69Å; L345-F354 HydrophobicContact CD1-CD2 3.75Å; L345-F354 HydrophobicContact CD1-CG 3.81Å; C350-F354 VanDerWaalsContact O-CB 3.25Å; C350-F354 WeakPolarHBondContact O-CB 3.44Å; C350-F354 PolarHBondContact O-N 2.75Å; I351-F354 WeakPolarHBondContact O-CB 3.44Å; I351-F354 PolarHBondContact O-N 3.04Å; L352-F354 PolarHBondContact O-N 2.97Å; F354-E357 PolarHBondContact O-N 2.81Å; F354-F358 HydrophobicContact CE1-CB 4.47Å; F354-F358 WeakPolarHBondContact O-CB 3.48Å; F354-F358 PolarHBondContact O-N 3.16Å; F354-L371 HydrophobicContact CD1-CD1 4.22Å; F354-L371 HydrophobicContact CD1-CD2 4.32Å; F354-L371 HydrophobicContact CE1-CD1 3.65Å; F354-L371 HydrophobicContact CE1-CD2 3.99Å; F354-L371 HydrophobicContact CE1-CG 4.49Å
355	F	97	Very high	93.5	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.009	21%	0.205	C	C	.	.	H	α-helix	trans	-64.7	-41.5	176.7	-91.8	-105.1	0	0	0	111.9	V342 I351 L352 D353 S359 L371 F375 I436 H439	V342-F355 HydrophobicContact CG2-CE2 4.43Å; I351-F355 HydrophobicContact CG2-CD2 3.85Å; I351-F355 HydrophobicContact CG2-CE2 3.92Å; I351-F355 WeakPolarHBondContact O-CD2 3.22Å; I351-F355 PolarHBondContact O-N 2.99Å; L352-F355 PolarHBondContact O-N 2.89Å; D353-F355 PolarHBondContact O-N 3.37Å; F355-S359 WeakPolarHBondContact O-CB 3.05Å; F355-S359 PolarHBondContact O-N 3.18Å; F355-L371 HydrophobicContact CD1-CD2 3.95Å; F355-L371 HydrophobicContact CD1-CG 4.27Å; F355-L371 HydrophobicContact CD2-CD2 4.3Å; F355-L371 HydrophobicContact CD2-CG 4.49Å; F355-L371 HydrophobicContact CE1-CD2 3.92Å; F355-L371 HydrophobicContact CE1-CG 3.71Å; F355-L371 HydrophobicContact CE2-CD1 4Å; F355-L371 HydrophobicContact CE2-CD2 4.29Å; F355-L371 HydrophobicContact CE2-CG 3.99Å; F355-L371 HydrophobicContact CG-CD2 4.15Å; F355-L371 HydrophobicContact CZ-CD1 3.99Å; F355-L371 HydrophobicContact CZ-CD2 4.11Å; F355-L371 HydrophobicContact CZ-CG 3.58Å; F355-F375 HydrophobicContact CE2-CB 4.03Å; F355-F375 HydrophobicContact CE2-CD1 4.15Å; F355-F375 HydrophobicContact CE2-CG 4.02Å; F355-F375 HydrophobicContact CZ-CB 3.84Å; F355-F375 HydrophobicContact CZ-CD1 4.12Å; F355-F375 HydrophobicContact CZ-CG 4.15Å; F355-I436 HydrophobicContact CD1-CG2 3.85Å; F355-I436 HydrophobicContact CD2-CG2 4.23Å; F355-I436 HydrophobicContact CE1-CG2 3.56Å; F355-I436 HydrophobicContact CE2-CG2 3.96Å; F355-I436 HydrophobicContact CG-CG2 4.17Å; F355-I436 HydrophobicContact CZ-CG2 3.61Å; F355-H439 HydrophobicContact CB-CB 3.88Å; F355-H439 HydrophobicContact CD1-CB 4.32Å
356	C	94.6	Very high	93.8	Very high	15 Å²	15	35.3 Å²	35.3	10%	0.101	20%	0.195	C	C	.	.	H	α-helix	trans	-58.3	-57.1	172.5	-69.4	0	0	0	0	111	L352 D353 F358 S359 E360 H439	L352-C356 PolarHBondContact O-N 3.18Å; L352-C356 PolarHBondContact O-SG 3.24Å; D353-C356 WeakPolarHBondContact O-CB 3.48Å; D353-C356 PolarHBondContact O-N 3.26Å; C356-F358 VanDerWaalsContact C-N 3.31Å; C356-F358 PolarHBondContact O-N 3.36Å; C356-S359 WeakPolarHBondContact O-CB 3.4Å; C356-S359 PolarHBondContact O-N 3.21Å; C356-S359 VanDerWaalsContact O-N 3.09Å; C356-E360 VanDerWaalsContact O-CG 3.3Å; C356-E360 WeakPolarHBondContact O-CG 3.48Å; C356-E360 PolarHBondContact O-N 3.36Å; C356-H439 PolarHBondContact SG-CD2 3.01Å; C356-H439 PolarHBondContact SG-NE2 3.22Å
357	E	93.6	Very high	94.2	Very high	106 Å²	106	29.5 Å²	29.5	50%	0.495	16%	0.159	S	C	.	.	H	α-helix	trans	-59.6	-40.8	-177.6	-72.8	177.5	-173.4	0	0	112.1	D353 F354 E360	D353-E357 WeakPolarHBondContact O-CB 3.38Å; D353-E357 VanDerWaalsContact O-CG 3.32Å; D353-E357 WeakPolarHBondContact O-CG 3.16Å; D353-E357 PolarHBondContact O-N 3.5Å; F354-E357 PolarHBondContact O-N 2.81Å; E357-E360 PolarHBondContact O-N 3.3Å
358	F	96	Very high	94.4	Very high	6 Å²	6	28.1 Å²	28.1	3%	0.026	15%	0.15	C	C	.	.	H	α-helix	trans	-63.2	-45.2	175.1	-174.9	-102.5	0	0	0	111.1	R335 T338 V339 F354 C356 E360 Q361 P363 R368 L371	R335-F358 HydrophobicContact CB-CE2 4.18Å; R335-F358 HydrophobicContact CB-CZ 4.24Å; R335-F358 HydrophobicContact CG-CE2 4.5Å; T338-F358 HydrophobicContact CG2-CD2 3.9Å; T338-F358 HydrophobicContact CG2-CE2 4.32Å; V339-F358 HydrophobicContact CG2-CE1 4.33Å; V339-F358 HydrophobicContact CG2-CE2 3.83Å; V339-F358 HydrophobicContact CG2-CZ 3.62Å; F354-F358 HydrophobicContact CE1-CB 4.47Å; F354-F358 WeakPolarHBondContact O-CB 3.48Å; F354-F358 PolarHBondContact O-N 3.16Å; C356-F358 VanDerWaalsContact C-N 3.31Å; C356-F358 PolarHBondContact O-N 3.36Å; F358-E360 VanDerWaalsContact C-N 3.29Å; F358-E360 PolarHBondContact O-N 3.44Å; F358-Q361 WeakPolarHBondContact O-CB 3.36Å; F358-Q361 PolarHBondContact O-N 3.08Å; F358-P363 HydrophobicContact CD1-CB 4.2Å; F358-P363 HydrophobicContact CD1-CG 3.69Å; F358-P363 HydrophobicContact CE1-CB 3.53Å; F358-P363 HydrophobicContact CE1-CG 3.49Å; F358-P363 VanDerWaalsContact CE1-CG 3.49Å; F358-P363 HydrophobicContact CE2-CB 4.5Å; F358-P363 HydrophobicContact CG-CG 4.48Å; F358-P363 HydrophobicContact CZ-CB 3.71Å; F358-P363 HydrophobicContact CZ-CG 4.14Å; F358-P363 VanDerWaalsContact O-CD 3.23Å; F358-P363 WeakPolarHBondContact O-CD 3.13Å; F358-P363 WeakPolarHBondContact O-CG 3.42Å; F358-R368 HydrophobicContact CE1-CG 4.39Å; F358-L371 HydrophobicContact CB-CD2 4.02Å; F358-L371 HydrophobicContact CD1-CD2 3.36Å; F358-L371 HydrophobicContact CE1-CB 4.36Å; F358-L371 HydrophobicContact CE1-CD2 3.93Å; F358-L371 HydrophobicContact CG-CD2 3.74Å
359	S	94.7	Very high	94.5	Very high	3 Å²	3	28 Å²	28	2%	0.021	15%	0.15	C	C	.	.	H	α-helix	trans	-62	-34.7	177.5	175.6	0	0	0	0	113.1	F355 C356 Q361 S362 P363 H439 R443 Q446	F355-S359 WeakPolarHBondContact O-CB 3.05Å; F355-S359 PolarHBondContact O-N 3.18Å; C356-S359 WeakPolarHBondContact O-CB 3.4Å; C356-S359 PolarHBondContact O-N 3.21Å; C356-S359 VanDerWaalsContact O-N 3.09Å; S359-Q361 PolarHBondContact O-N 3.05Å; S359-S362 PolarHBondContact O-N 3.26Å; S359-P363 WeakPolarHBondContact O-CD 3.49Å; S359-H439 WeakPolarHBondContact CB-O 3.26Å; S359-R443 WeakPolarHBondContact OG-CD 3.48Å; S359-R443 PolarHBondContact OG-NH1 3.43Å; S359-Q446 PolarHBondContact OG-NE2 3.28Å
360	E	90.8	Very high	94.6	Very high	72 Å²	72	27.1 Å²	27.1	34%	0.336	15%	0.146	S	C	.	.	H	α-helix	trans	-65.2	-18.8	-179.5	-70.8	-179.6	170.5	0	0	113.1	C356 E357 F358 S362 K717	C356-E360 VanDerWaalsContact O-CG 3.3Å; C356-E360 WeakPolarHBondContact O-CG 3.48Å; C356-E360 PolarHBondContact O-N 3.36Å; E357-E360 PolarHBondContact O-N 3.3Å; F358-E360 VanDerWaalsContact C-N 3.29Å; F358-E360 PolarHBondContact O-N 3.44Å; E360-S362 PolarHBondContact O-N 3.37Å; E360-K717 IonicContact OE1-NZ 3.59Å; E360-K717 PolarHBondContact OE1-NZ 3.14Å; E360-K717 IonicContact OE2-NZ 2.64Å; E360-K717 PolarHBondContact OE2-NZ 3.03Å
361	Q	90.6	Very high	94.7	Very high	104 Å²	104	24.3 Å²	24.3	49%	0.486	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	4.1	174.7	-57	174.4	22.1	0	0	113	F358 S359	F358-Q361 WeakPolarHBondContact O-CB 3.36Å; F358-Q361 PolarHBondContact O-N 3.08Å; S359-Q361 PolarHBondContact O-N 3.05Å
362	S	90.3	Very high	94.6	Very high	79 Å²	79	24.6 Å²	24.6	55%	0.552	13%	0.128	S	C	*	.			trans	47.5	58.3	-173	-59.8	0	0	0	0	113	R335 S359 E360	R335-S362 PolarHBondContact NH2-O 3.07Å; S359-S362 PolarHBondContact O-N 3.26Å; E360-S362 PolarHBondContact O-N 3.37Å
363	P	93.8	Very high	94.5	Very high	8 Å²	8	24.7 Å²	24.7	5%	0.052	13%	0.129	C	C	.	.			trans	-67.3	146.7	-178.7	25.2	-31	0	0	0	112.3	F358 S359 S367 R368	F358-P363 HydrophobicContact CD1-CB 4.2Å; F358-P363 HydrophobicContact CD1-CG 3.69Å; F358-P363 HydrophobicContact CE1-CB 3.53Å; F358-P363 HydrophobicContact CE1-CG 3.49Å; F358-P363 VanDerWaalsContact CE1-CG 3.49Å; F358-P363 HydrophobicContact CE2-CB 4.5Å; F358-P363 HydrophobicContact CG-CG 4.48Å; F358-P363 HydrophobicContact CZ-CB 3.71Å; F358-P363 HydrophobicContact CZ-CG 4.14Å; F358-P363 VanDerWaalsContact O-CD 3.23Å; F358-P363 WeakPolarHBondContact O-CD 3.13Å; F358-P363 WeakPolarHBondContact O-CG 3.42Å; S359-P363 WeakPolarHBondContact O-CD 3.49Å; P363-S367 WeakPolarHBondContact CB-OG 3.49Å; P363-R368 HydrophobicContact CB-CG 3.88Å; P363-R368 HydrophobicContact CG-CG 3.5Å; P363-R368 WeakPolarHBondContact O-CD 3.32Å; P363-R368 PolarHBondContact O-NE 3.22Å
364	C	93.9	Very high	94.4	Very high	8 Å²	8	23 Å²	23	5%	0.054	12%	0.12	C	C	.	.			trans	-68.8	159.2	177.3	65.8	0	0	0	0	111.5	Y328 L366 S367 R368	Y328-C364 HydrophobicContact CE2-CB 4.3Å; Y328-C364 VanDerWaalsContact OH-CB 3.3Å; Y328-C364 WeakPolarHBondContact OH-CB 3.38Å; Y328-C364 PolarHBondContact OH-SG 3.04Å; C364-L366 VanDerWaalsContact C-N 3.26Å; C364-L366 PolarHBondContact O-N 2.85Å; C364-L366 VanDerWaalsContact O-N 3.15Å; C364-S367 PolarHBondContact N-OG 3.48Å; C364-S367 PolarHBondContact O-N 2.97Å; C364-S367 PolarHBondContact O-OG 2.75Å; C364-S367 PolarHBondContact SG-OG 3.3Å; C364-S367 VanDerWaalsContact SG-OG 3.41Å; C364-R368 PolarHBondContact O-N 3.45Å
365	V	95.6	Very high	94.2	Very high	4 Å²	4	21.8 Å²	21.8	2%	0.024	12%	0.115	C	C	.	.	H	α-helix	trans	-53.5	-39.6	-172.8	69.6	0	0	0	0	113.5	L120 V164 F170 F175 S369	L120-V365 VanDerWaalsContact O-CG1 3.25Å; L120-V365 WeakPolarHBondContact O-CG1 3.5Å; V164-V365 HydrophobicContact CG1-CG2 3.72Å; V164-V365 HydrophobicContact CG2-CG1 4.39Å; V164-V365 HydrophobicContact CG2-CG2 4.18Å; F170-V365 HydrophobicContact CB-CG2 3.74Å; F175-V365 HydrophobicContact CB-CG1 4.23Å; F175-V365 HydrophobicContact CB-CG2 4.07Å; F175-V365 HydrophobicContact CD2-CG1 3.96Å; F175-V365 HydrophobicContact CG-CG1 4.31Å; V365-S369 VanDerWaalsContact O-CB 3.29Å; V365-S369 WeakPolarHBondContact O-CB 3.21Å; V365-S369 PolarHBondContact O-N 3.42Å; V365-S369 PolarHBondContact O-OG 3.22Å
366	L	96.7	Very high	93.6	Very high	4 Å²	4	22 Å²	22	2%	0.021	12%	0.116	C	C	.	.	H	α-helix	trans	-62.9	-51	178.3	179.2	57.7	0	0	0	111.1	L120 A160 L247 L332 C364 R368 S369 L370	L120-L366 HydrophobicContact CD1-CD2 4.1Å; L120-L366 HydrophobicContact CD2-CB 4.24Å; L120-L366 HydrophobicContact CD2-CD2 4.45Å; A160-L366 HydrophobicContact CB-CD1 3.87Å; A160-L366 HydrophobicContact CB-CD2 4.44Å; L247-L366 HydrophobicContact CD2-CD1 4.48Å; L247-L366 HydrophobicContact CD2-CD2 4.44Å; L332-L366 HydrophobicContact CD2-CD2 4.41Å; C364-L366 VanDerWaalsContact C-N 3.26Å; C364-L366 PolarHBondContact O-N 2.85Å; C364-L366 VanDerWaalsContact O-N 3.15Å; L366-R368 PolarHBondContact O-N 3.49Å; L366-S369 PolarHBondContact O-N 3.25Å; L366-S369 VanDerWaalsContact O-N 3.13Å; L366-L370 HydrophobicContact CD1-CD1 4.38Å; L366-L370 HydrophobicContact CD1-CG 4.21Å; L366-L370 HydrophobicContact CG-CD1 4.23Å; L366-L370 HydrophobicContact CG-CG 4.46Å; L366-L370 WeakPolarHBondContact O-CG 3.37Å; L366-L370 PolarHBondContact O-N 2.92Å
367	S	96.6	Very high	92.5	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-64.6	-38.7	-178	62.9	0	0	0	0	112.8	P363 C364 S369 L370 L371	P363-S367 WeakPolarHBondContact CB-OG 3.49Å; C364-S367 PolarHBondContact N-OG 3.48Å; C364-S367 PolarHBondContact O-N 2.97Å; C364-S367 PolarHBondContact O-OG 2.75Å; C364-S367 PolarHBondContact SG-OG 3.3Å; C364-S367 VanDerWaalsContact SG-OG 3.41Å; S367-S369 VanDerWaalsContact C-N 3.34Å; S367-S369 PolarHBondContact O-N 3.12Å; S367-L370 PolarHBondContact O-N 2.83Å; S367-L371 PolarHBondContact O-N 3.34Å; S367-L371 VanDerWaalsContact O-N 3.08Å
368	R	95.9	Very high	91.4	Very high	16 Å²	16	21.4 Å²	21.4	6%	0.06	12%	0.116	C	C	.	.	H	α-helix	trans	-59.1	-44.2	170.3	-68	-174.7	-69	114.1	-11.1	112	V169 D174 F358 P363 C364 L366 L371 Q372 G440	V169-R368 HydrophobicContact CG2-CB 4.33Å; V169-R368 PolarHBondContact O-NH1 2.93Å; D174-R368 IonicContact OD2-NH2 3.49Å; F358-R368 HydrophobicContact CE1-CG 4.39Å; P363-R368 HydrophobicContact CB-CG 3.88Å; P363-R368 HydrophobicContact CG-CG 3.5Å; P363-R368 WeakPolarHBondContact O-CD 3.32Å; P363-R368 PolarHBondContact O-NE 3.22Å; C364-R368 PolarHBondContact O-N 3.45Å; L366-R368 PolarHBondContact O-N 3.49Å; R368-L371 PolarHBondContact O-N 2.92Å; R368-Q372 PolarHBondContact O-N 3.26Å; R368-G440 WeakPolarHBondContact CB-O 3.43Å; R368-G440 VanDerWaalsContact CD-O 3.29Å; R368-G440 WeakPolarHBondContact CD-O 3.38Å; R368-G440 PolarHBondContact NH1-O 3.13Å
369	S	96	Very high	89.9	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-70.3	-36.4	-178.9	-57.7	0	0	0	0	112.9	V164 V365 L366 S367 Q372 T373	V164-S369 WeakPolarHBondContact CA-OG 3.35Å; V365-S369 VanDerWaalsContact O-CB 3.29Å; V365-S369 WeakPolarHBondContact O-CB 3.21Å; V365-S369 PolarHBondContact O-N 3.42Å; V365-S369 PolarHBondContact O-OG 3.22Å; L366-S369 PolarHBondContact O-N 3.25Å; L366-S369 VanDerWaalsContact O-N 3.13Å; S367-S369 VanDerWaalsContact C-N 3.34Å; S367-S369 PolarHBondContact O-N 3.12Å; S369-Q372 PolarHBondContact O-N 2.98Å; S369-T373 WeakPolarHBondContact O-CB 3.47Å; S369-T373 WeakPolarHBondContact O-CG2 3.23Å; S369-T373 PolarHBondContact O-N 3.32Å; S369-T373 PolarHBondContact O-OG1 3.39Å
370	L	95.9	Very high	88.7	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62.5	-45.3	172.5	-69.6	177	0	0	0	110.7	K163 L247 F250 I336 V339 L366 S367 T373 T374	K163-L370 HydrophobicContact CB-CD2 4.4Å; K163-L370 HydrophobicContact CD-CD2 4.47Å; K163-L370 HydrophobicContact CG-CD2 4.07Å; L247-L370 HydrophobicContact CD2-CD1 4.13Å; L247-L370 HydrophobicContact CD2-CD2 4.33Å; F250-L370 HydrophobicContact CB-CD2 3.85Å; F250-L370 HydrophobicContact CD1-CD2 4.41Å; F250-L370 HydrophobicContact CD2-CD1 4.36Å; F250-L370 HydrophobicContact CD2-CD2 4.15Å; F250-L370 HydrophobicContact CE2-CD1 4.44Å; F250-L370 HydrophobicContact CG-CD2 3.89Å; I336-L370 HydrophobicContact CD1-CD1 4.13Å; I336-L370 HydrophobicContact CG1-CD1 4.03Å; V339-L370 HydrophobicContact CG1-CB 4.41Å; L366-L370 HydrophobicContact CD1-CD1 4.38Å; L366-L370 HydrophobicContact CD1-CG 4.21Å; L366-L370 HydrophobicContact CG-CD1 4.23Å; L366-L370 HydrophobicContact CG-CG 4.46Å; L366-L370 WeakPolarHBondContact O-CG 3.37Å; L366-L370 PolarHBondContact O-N 2.92Å; S367-L370 PolarHBondContact O-N 2.83Å; L370-T373 PolarHBondContact O-N 3.5Å; L370-T373 PolarHBondContact O-OG1 2.81Å; L370-T374 VanDerWaalsContact O-CB 3.24Å; L370-T374 WeakPolarHBondContact O-CB 3.16Å; L370-T374 PolarHBondContact O-N 2.62Å; L370-T374 PolarHBondContact O-OG1 3.38Å
371	L	95.6	Very high	88.5	Confident	3 Å²	3	34.2 Å²	34.2	2%	0.016	18%	0.175	C	C	.	.	H	α-helix	trans	-58.4	-51.6	175.6	-179.5	55.1	0	0	0	111.8	V339 V342 F354 F355 F358 S367 R368 T373 T374 F375	V339-L371 HydrophobicContact CG1-CB 4.22Å; V339-L371 HydrophobicContact CG1-CD1 4.31Å; V339-L371 HydrophobicContact CG2-CB 3.89Å; V342-L371 HydrophobicContact CB-CD1 3.94Å; V342-L371 HydrophobicContact CG1-CD1 3.99Å; V342-L371 HydrophobicContact CG2-CD1 3.91Å; F354-L371 HydrophobicContact CD1-CD1 4.22Å; F354-L371 HydrophobicContact CD1-CD2 4.32Å; F354-L371 HydrophobicContact CE1-CD1 3.65Å; F354-L371 HydrophobicContact CE1-CD2 3.99Å; F354-L371 HydrophobicContact CE1-CG 4.49Å; F355-L371 HydrophobicContact CD1-CD2 3.95Å; F355-L371 HydrophobicContact CD1-CG 4.27Å; F355-L371 HydrophobicContact CD2-CD2 4.3Å; F355-L371 HydrophobicContact CD2-CG 4.49Å; F355-L371 HydrophobicContact CE1-CD2 3.92Å; F355-L371 HydrophobicContact CE1-CG 3.71Å; F355-L371 HydrophobicContact CE2-CD1 4Å; F355-L371 HydrophobicContact CE2-CD2 4.29Å; F355-L371 HydrophobicContact CE2-CG 3.99Å; F355-L371 HydrophobicContact CG-CD2 4.15Å; F355-L371 HydrophobicContact CZ-CD1 3.99Å; F355-L371 HydrophobicContact CZ-CD2 4.11Å; F355-L371 HydrophobicContact CZ-CG 3.58Å; F358-L371 HydrophobicContact CB-CD2 4.02Å; F358-L371 HydrophobicContact CD1-CD2 3.36Å; F358-L371 HydrophobicContact CE1-CB 4.36Å; F358-L371 HydrophobicContact CE1-CD2 3.93Å; F358-L371 HydrophobicContact CG-CD2 3.74Å; S367-L371 PolarHBondContact O-N 3.34Å; S367-L371 VanDerWaalsContact O-N 3.08Å; R368-L371 PolarHBondContact O-N 2.92Å; L371-T373 PolarHBondContact O-N 3.31Å; L371-T374 PolarHBondContact O-N 3.33Å; L371-F375 PolarHBondContact O-N 3.11Å; L371-F375 VanDerWaalsContact O-N 3.1Å
372	Q	94.1	Very high	88.3	Confident	6 Å²	6	29.5 Å²	29.5	3%	0.028	15%	0.153	C	C	.	.	H	α-helix	trans	-57	-49.9	-179	-170.2	65.8	31.2	0	0	111.8	A167 V169 R368 S369 T374 F375 L376 I436	A167-Q372 HydrophobicContact CB-CB 3.96Å; A167-Q372 HydrophobicContact CB-CG 4.14Å; V169-Q372 HydrophobicContact CG1-CB 4.48Å; V169-Q372 HydrophobicContact CG1-CG 4.06Å; R368-Q372 PolarHBondContact O-N 3.26Å; S369-Q372 PolarHBondContact O-N 2.98Å; Q372-T374 VanDerWaalsContact C-N 3.35Å; Q372-T374 PolarHBondContact O-N 3.36Å; Q372-F375 PolarHBondContact O-N 3.4Å; Q372-L376 PolarHBondContact O-N 3.22Å; Q372-I436 PolarHBondContact OE1-O 3.22Å
373	T	92.5	Very high	88.1	Confident	6 Å²	6	26.5 Å²	26.5	4%	0.037	13%	0.13	C	C	.	.	H	α-helix	trans	-76.1	-21.8	-176.1	57.1	0	0	0	0	113.6	K163 K166 A167 S369 L370 L371 V377	K163-T373 HydrophobicContact CD-CG2 4.48Å; K166-T373 HydrophobicContact CB-CG2 4.19Å; K166-T373 HydrophobicContact CD-CG2 4.46Å; K166-T373 HydrophobicContact CG-CG2 4.12Å; A167-T373 HydrophobicContact CB-CG2 3.96Å; S369-T373 WeakPolarHBondContact O-CB 3.47Å; S369-T373 WeakPolarHBondContact O-CG2 3.23Å; S369-T373 PolarHBondContact O-N 3.32Å; S369-T373 PolarHBondContact O-OG1 3.39Å; L370-T373 PolarHBondContact O-N 3.5Å; L370-T373 PolarHBondContact O-OG1 2.81Å; L371-T373 PolarHBondContact O-N 3.31Å; T373-V377 WeakPolarHBondContact O-CG2 3.33Å
374	T	92.3	Very high	87.6	Confident	15 Å²	15	27.2 Å²	27.2	9%	0.092	14%	0.139	C	C	.	.	H	α-helix	trans	-72.1	-44.5	172.7	-59.1	0	0	0	0	110.6	F250 V258 V342 V343 L370 L371 Q372 F383	F250-T374 WeakPolarHBondContact CD1-OG1 3.4Å; F250-T374 HydrophobicContact CE1-CG2 4.45Å; F250-T374 WeakPolarHBondContact CE1-OG1 3.42Å; V258-T374 HydrophobicContact CG2-CG2 4.24Å; V342-T374 HydrophobicContact CG1-CG2 4.15Å; V343-T374 HydrophobicContact CG1-CG2 4.17Å; L370-T374 VanDerWaalsContact O-CB 3.24Å; L370-T374 WeakPolarHBondContact O-CB 3.16Å; L370-T374 PolarHBondContact O-N 2.62Å; L370-T374 PolarHBondContact O-OG1 3.38Å; L371-T374 PolarHBondContact O-N 3.33Å; Q372-T374 VanDerWaalsContact C-N 3.35Å; Q372-T374 PolarHBondContact O-N 3.36Å; T374-F383 WeakPolarHBondContact O-CD1 3.43Å
375	F	91.2	Very high	87.2	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-74.6	-50	-179.7	178.4	-106.6	0	0	0	112.2	I351 F355 L371 Q372 V382 F383 M391 I436	I351-F375 HydrophobicContact CB-CE2 4.37Å; I351-F375 HydrophobicContact CD1-CD2 3.9Å; I351-F375 HydrophobicContact CD1-CE2 3.8Å; I351-F375 HydrophobicContact CG1-CD2 4.42Å; I351-F375 HydrophobicContact CG1-CE2 3.84Å; I351-F375 HydrophobicContact CG1-CZ 4.45Å; I351-F375 HydrophobicContact CG2-CD1 4.38Å; I351-F375 HydrophobicContact CG2-CD2 4.1Å; I351-F375 HydrophobicContact CG2-CE1 4.08Å; I351-F375 HydrophobicContact CG2-CE2 3.71Å; I351-F375 HydrophobicContact CG2-CG 4.44Å; I351-F375 HydrophobicContact CG2-CZ 3.73Å; F355-F375 HydrophobicContact CE2-CB 4.03Å; F355-F375 HydrophobicContact CE2-CD1 4.15Å; F355-F375 HydrophobicContact CE2-CG 4.02Å; F355-F375 HydrophobicContact CZ-CB 3.84Å; F355-F375 HydrophobicContact CZ-CD1 4.12Å; F355-F375 HydrophobicContact CZ-CG 4.15Å; L371-F375 PolarHBondContact O-N 3.11Å; L371-F375 VanDerWaalsContact O-N 3.1Å; Q372-F375 PolarHBondContact O-N 3.4Å; F375-V382 HydrophobicContact CD2-CG1 4.13Å; F375-V382 HydrophobicContact CE2-CG1 3.53Å; F375-V382 HydrophobicContact CE2-CG2 4.35Å; F375-V382 HydrophobicContact CZ-CG1 4.09Å; F375-V382 HydrophobicContact CZ-CG2 4.06Å; F375-V382 WeakPolarHBondContact O-CA 3.41Å; F375-F383 HydrophobicContact CB-CE1 4.3Å; F375-F383 HydrophobicContact CD2-CD1 4.44Å; F375-F383 AromaticContact CD2-CE1 3.71Å; F375-F383 HydrophobicContact CD2-CE1 3.71Å; F375-F383 HydrophobicContact CD2-CE2 4.32Å; F375-F383 AromaticContact CD2-CZ 3.64Å; F375-F383 HydrophobicContact CD2-CZ 3.64Å; F375-F383 HydrophobicContact CE2-CE2 4.49Å; F375-F383 HydrophobicContact CE2-CZ 4.19Å; F375-F383 HydrophobicContact CG-CE1 4.49Å; F375-F383 PolarHBondContact O-N 3.41Å; F375-M391 HydrophobicContact CE2-CE 4.2Å; F375-M391 HydrophobicContact CE2-SD 4.19Å; F375-M391 HydrophobicContact CZ-SD 3.97Å; F375-I436 HydrophobicContact CD1-CD1 4.27Å; F375-I436 HydrophobicContact CD1-CG2 3.84Å; F375-I436 HydrophobicContact CE1-CD1 3.4Å; F375-I436 HydrophobicContact CE1-CG1 4.5Å; F375-I436 HydrophobicContact CE1-CG2 4.07Å; F375-I436 HydrophobicContact CZ-CD1 3.98Å
376	L	85.3	Confident	86.8	Confident	6 Å²	6	36.5 Å²	36.5	3%	0.031	19%	0.187	C	C	.	.	B	Isolated β-bridge	trans	-118.2	88.1	-178.7	-75	165.5	0	0	0	111.1	Q372 C433 I436	Q372-L376 PolarHBondContact O-N 3.22Å; L376-C433 HydrophobicContact CD1-CB 4.14Å; L376-I436 HydrophobicContact CD1-CB 4.48Å; L376-I436 HydrophobicContact CD1-CG2 4.27Å
377	V	72.3	Confident	86.5	Confident	21 Å²	21	39.9 Å²	39.9	13%	0.127	20%	0.204	C	C	.	.	S	Bend	trans	-66.2	-45	-177.6	-176.2	0	0	0	0	111.8	K166 T373	K166-V377 WeakPolarHBondContact CE-O 3.3Å; K166-V377 PolarHBondContact NZ-O 2.99Å; T373-V377 WeakPolarHBondContact O-CG2 3.33Å
378	D	68.8	Low	86.4	Confident	88 Å²	88	40 Å²	40	47%	0.471	21%	0.205	S	C	.	.	S	Bend	trans	-136.5	34	-176.1	-59.4	-35.8	0	0	0	112	K166 K380	K166-D378 IonicContact NZ-OD1 2.93Å; K166-D378 PolarHBondContact NZ-OD1 3.24Å; D378-K380 PolarHBondContact O-N 3.48Å
379	N	65.8	Low	86.3	Confident	94 Å²	94	42 Å²	42	50%	0.503	22%	0.215	S	C	.	.	S	Bend	trans	54.2	13.8	179	-66.9	-17.9	0	0	0	117.1
380	K	70.1	Confident	86.2	Confident	156 Å²	156	45.3 Å²	45.3	68%	0.678	23%	0.233	S	C	*	.	S	Bend	trans	-135.2	-27.8	-179.9	-65.4	-177	179.6	-178.8	0	113.7	D378 M388	D378-K380 PolarHBondContact O-N 3.48Å; K380-M388 PolarHBondContact O-N 3.03Å
381	K	84.6	Confident	86.2	Confident	101 Å²	101	46 Å²	46	44%	0.439	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	119.9	-177.4	-64.8	-172.9	179.6	-174.5	0	111	G384 H386 L387	K381-G384 WeakPolarHBondContact CD-O 3.17Å; K381-H386 CarbonylContact C-O 3.56Å; K381-H386 WeakPolarHBondContact CA-O 3.41Å; K381-L387 HydrophobicContact CG-CD2 4.49Å
382	V	86.9	Confident	86.2	Confident	5 Å²	5	45.9 Å²	45.9	3%	0.03	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	123.9	170.7	176.7	0	0	0	0	107.9	F375 G384 T385 H386 M388 M391	F375-V382 HydrophobicContact CD2-CG1 4.13Å; F375-V382 HydrophobicContact CE2-CG1 3.53Å; F375-V382 HydrophobicContact CE2-CG2 4.35Å; F375-V382 HydrophobicContact CZ-CG1 4.09Å; F375-V382 HydrophobicContact CZ-CG2 4.06Å; F375-V382 WeakPolarHBondContact O-CA 3.41Å; V382-G384 PolarHBondContact O-N 3.38Å; V382-T385 PolarHBondContact O-N 2.83Å; V382-T385 VanDerWaalsContact O-N 3.1Å; V382-H386 PolarHBondContact N-O 3.06Å; V382-H386 PolarHBondContact O-N 2.73Å; V382-H386 VanDerWaalsContact O-N 3.17Å; V382-M388 HydrophobicContact CG2-CB 4.37Å; V382-M388 HydrophobicContact CG2-SD 3.68Å; V382-M391 HydrophobicContact CG1-CE 4.45Å; V382-M391 HydrophobicContact CG1-SD 4.19Å; V382-M391 HydrophobicContact CG2-SD 3.95Å
383	F	87.3	Confident	86.2	Confident	16 Å²	16	47.3 Å²	47.3	7%	0.07	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	25.8	-177.2	-55.5	-52.5	0	0	0	114.4	T255 V342 V343 L345 I351 T374 F375 T385	T255-F383 HydrophobicContact CG2-CB 3.61Å; T255-F383 HydrophobicContact CG2-CD1 4.29Å; T255-F383 HydrophobicContact CG2-CG 4.06Å; V342-F383 HydrophobicContact CG1-CE1 4.05Å; V342-F383 HydrophobicContact CG2-CZ 4.44Å; V342-F383 VanDerWaalsContact O-CZ 3.31Å; V342-F383 WeakPolarHBondContact O-CZ 3.25Å; V343-F383 HydrophobicContact CG1-CD1 4.22Å; V343-F383 HydrophobicContact CG1-CE1 4.18Å; L345-F383 WeakPolarHBondContact O-CE2 3.36Å; I351-F383 HydrophobicContact CD1-CZ 4.17Å; T374-F383 WeakPolarHBondContact O-CD1 3.43Å; F375-F383 HydrophobicContact CB-CE1 4.3Å; F375-F383 HydrophobicContact CD2-CD1 4.44Å; F375-F383 AromaticContact CD2-CE1 3.71Å; F375-F383 HydrophobicContact CD2-CE1 3.71Å; F375-F383 HydrophobicContact CD2-CE2 4.32Å; F375-F383 AromaticContact CD2-CZ 3.64Å; F375-F383 HydrophobicContact CD2-CZ 3.64Å; F375-F383 HydrophobicContact CE2-CE2 4.49Å; F375-F383 HydrophobicContact CE2-CZ 4.19Å; F375-F383 HydrophobicContact CG-CE1 4.49Å; F375-F383 PolarHBondContact O-N 3.41Å; F383-T385 PolarHBondContact O-N 3.37Å; F383-T385 VanDerWaalsContact O-N 3.15Å
384	G	82.9	Confident	86.3	Confident	22 Å²	22	51 Å²	51	23%	0.227	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.6	-6.3	-178.4	0	0	0	0	0	115.7	K381 V382	K381-G384 WeakPolarHBondContact CD-O 3.17Å; V382-G384 PolarHBondContact O-N 3.38Å
385	T	84.3	Confident	86.5	Confident	88 Å²	88	50.4 Å²	50.4	54%	0.54	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.6	-45.5	-170.9	54.2	0	0	0	0	114.2	V382 F383	V382-T385 PolarHBondContact O-N 2.83Å; V382-T385 VanDerWaalsContact O-N 3.1Å; F383-T385 PolarHBondContact O-N 3.37Å; F383-T385 VanDerWaalsContact O-N 3.15Å
386	H	87.3	Confident	86.7	Confident	119 Å²	119	50.4 Å²	50.4	55%	0.551	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105	146.9	-171.7	-58.9	-71.6	0	0	0	112.1	K381 V382	K381-H386 CarbonylContact C-O 3.56Å; K381-H386 WeakPolarHBondContact CA-O 3.41Å; V382-H386 PolarHBondContact N-O 3.06Å; V382-H386 PolarHBondContact O-N 2.73Å; V382-H386 VanDerWaalsContact O-N 3.17Å
387	L	91.7	Very high	87	Confident	75 Å²	75	54.4 Å²	54.4	39%	0.393	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	141	174.8	-64.5	174.1	0	0	0	110.3	K381 Q389 D390 M391	K381-L387 HydrophobicContact CG-CD2 4.49Å; L387-Q389 HydrophobicContact CB-CB 4.44Å; L387-Q389 PolarHBondContact O-N 2.88Å; L387-D390 WeakPolarHBondContact O-CB 3.36Å; L387-D390 PolarHBondContact O-N 3.5Å; L387-M391 PolarHBondContact O-N 3.36Å
388	M	92.9	Very high	87.9	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-58	-31.3	174.1	-173.3	62.8	179.7	0	0	112.1	L348 K380 V382 D390 M391 V392 V429 F432 I436	L348-M388 HydrophobicContact CD1-CE 3.66Å; K380-M388 PolarHBondContact O-N 3.03Å; V382-M388 HydrophobicContact CG2-CB 4.37Å; V382-M388 HydrophobicContact CG2-SD 3.68Å; M388-D390 VanDerWaalsContact C-N 3.29Å; M388-D390 PolarHBondContact O-N 3.25Å; M388-M391 PolarHBondContact O-N 2.89Å; M388-M391 HydrophobicContact SD-SD 4.3Å; M388-V392 HydrophobicContact CE-CG2 4.36Å; M388-V392 HydrophobicContact CG-CG2 4.49Å; M388-V392 WeakPolarHBondContact O-CG2 3.4Å; M388-V392 PolarHBondContact O-N 3.24Å; M388-V429 HydrophobicContact CB-CG1 3.99Å; M388-V429 HydrophobicContact CB-CG2 4.31Å; M388-V429 HydrophobicContact CG-CG1 4.05Å; M388-V429 HydrophobicContact CG-CG2 4.39Å; M388-F432 HydrophobicContact CE-CB 3.82Å; M388-I436 HydrophobicContact CE-CD1 4.08Å
389	Q	94.6	Very high	89	Confident	59 Å²	59	51.5 Å²	51.5	28%	0.276	26%	0.26	S	S	.	.	H	α-helix	trans	-57.7	-40.4	175	-65.9	168.6	-26.2	0	0	112.5	L387 V392 K393 V425 T426 V429	L387-Q389 HydrophobicContact CB-CB 4.44Å; L387-Q389 PolarHBondContact O-N 2.88Å; Q389-V392 PolarHBondContact O-N 2.94Å; Q389-K393 WeakPolarHBondContact O-CG 3.39Å; Q389-K393 PolarHBondContact O-N 3.44Å; Q389-V425 HydrophobicContact CB-CG1 3.71Å; Q389-V425 HydrophobicContact CG-CG1 4.09Å; Q389-V425 WeakPolarHBondContact O-CG1 3.3Å; Q389-T426 PolarHBondContact NE2-OG1 3.45Å; Q389-V429 HydrophobicContact CG-CG2 3.56Å
390	D	94.3	Very high	90.3	Very high	69 Å²	69	47 Å²	47	37%	0.369	24%	0.236	S	C	.	.	H	α-helix	trans	-68.2	-42.6	-179.9	-62.9	-37.7	0	0	0	110.4	L387 M388 V392 K393 D394	L387-D390 WeakPolarHBondContact O-CB 3.36Å; L387-D390 PolarHBondContact O-N 3.5Å; M388-D390 VanDerWaalsContact C-N 3.29Å; M388-D390 PolarHBondContact O-N 3.25Å; D390-V392 VanDerWaalsContact C-N 3.34Å; D390-V392 PolarHBondContact O-N 3.47Å; D390-K393 PolarHBondContact O-N 3.37Å; D390-D394 PolarHBondContact O-N 3.17Å
391	M	94.6	Very high	91.3	Very high	15 Å²	15	41.1 Å²	41.1	7%	0.074	21%	0.214	C	C	.	.	H	α-helix	trans	-62.3	-40.1	175.9	-168.1	178.7	-141.5	0	0	112.2	T346 L348 I351 F375 V382 L387 M388 D394 A395	T346-M391 WeakPolarHBondContact O-CE 3.47Å; L348-M391 HydrophobicContact CB-CG 4.09Å; L348-M391 HydrophobicContact CB-SD 4.42Å; L348-M391 HydrophobicContact CD1-SD 4.17Å; I351-M391 HydrophobicContact CG1-CE 3.67Å; F375-M391 HydrophobicContact CE2-CE 4.2Å; F375-M391 HydrophobicContact CE2-SD 4.19Å; F375-M391 HydrophobicContact CZ-SD 3.97Å; V382-M391 HydrophobicContact CG1-CE 4.45Å; V382-M391 HydrophobicContact CG1-SD 4.19Å; V382-M391 HydrophobicContact CG2-SD 3.95Å; L387-M391 PolarHBondContact O-N 3.36Å; M388-M391 PolarHBondContact O-N 2.89Å; M388-M391 HydrophobicContact SD-SD 4.3Å; M391-D394 PolarHBondContact O-N 2.92Å; M391-A395 WeakPolarHBondContact O-CB 3.35Å; M391-A395 PolarHBondContact O-N 3.4Å
392	V	95.7	Very high	91.7	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-64.9	-44.3	174.5	168.9	0	0	0	0	111.2	L348 M388 Q389 D390 D394 A395 L396 V425 C428 W491	L348-V392 HydrophobicContact CD2-CG2 4.19Å; M388-V392 HydrophobicContact CE-CG2 4.36Å; M388-V392 HydrophobicContact CG-CG2 4.49Å; M388-V392 WeakPolarHBondContact O-CG2 3.4Å; M388-V392 PolarHBondContact O-N 3.24Å; Q389-V392 PolarHBondContact O-N 2.94Å; D390-V392 VanDerWaalsContact C-N 3.34Å; D390-V392 PolarHBondContact O-N 3.47Å; V392-D394 VanDerWaalsContact C-N 3.31Å; V392-D394 PolarHBondContact O-N 3.34Å; V392-A395 WeakPolarHBondContact O-CB 3.46Å; V392-A395 PolarHBondContact O-N 3.32Å; V392-L396 HydrophobicContact CG1-CD1 4.3Å; V392-L396 WeakPolarHBondContact O-CG 3.38Å; V392-L396 PolarHBondContact O-N 3.34Å; V392-V425 HydrophobicContact CB-CG1 4.25Å; V392-V425 HydrophobicContact CG1-CG1 4.12Å; V392-V425 HydrophobicContact CG1-CG2 4.35Å; V392-C428 HydrophobicContact CG1-CB 3.97Å; V392-C428 HydrophobicContact CG2-CB 4.49Å; V392-W491 HydrophobicContact CG1-CH2 3.75Å; V392-W491 HydrophobicContact CG1-CZ2 4.49Å; V392-W491 HydrophobicContact CG1-CZ3 4.31Å
393	K	95.5	Very high	91.9	Very high	37 Å²	37	36.4 Å²	36.4	16%	0.161	19%	0.194	C	C	.	.	H	α-helix	trans	-60.1	-41.6	175.1	-77.9	172.2	177.4	177.5	0	111.8	Q389 D390 L396 R397 D422 V425	Q389-K393 WeakPolarHBondContact O-CG 3.39Å; Q389-K393 PolarHBondContact O-N 3.44Å; D390-K393 PolarHBondContact O-N 3.37Å; K393-L396 PolarHBondContact O-N 3.39Å; K393-R397 WeakPolarHBondContact O-CG 3.46Å; K393-R397 PolarHBondContact O-N 3.1Å; K393-D422 VanDerWaalsContact CE-OD1 3.22Å; K393-D422 WeakPolarHBondContact CE-OD1 3.4Å; K393-D422 IonicContact NZ-OD1 3.26Å; K393-D422 PolarHBondContact NZ-OD1 3.12Å; K393-V425 HydrophobicContact CD-CG1 4.46Å; K393-V425 HydrophobicContact CG-CB 4.46Å; K393-V425 HydrophobicContact CG-CG1 4Å; K393-V425 HydrophobicContact CG-CG2 3.76Å
394	D	94.8	Very high	92.2	Very high	83 Å²	83	35.9 Å²	35.9	44%	0.444	19%	0.192	S	C	.	.	H	α-helix	trans	-68	-38.4	177.1	-73.1	-18.1	0	0	0	112	D390 M391 V392 R397 S398	D390-D394 PolarHBondContact O-N 3.17Å; M391-D394 PolarHBondContact O-N 2.92Å; V392-D394 VanDerWaalsContact C-N 3.31Å; V392-D394 PolarHBondContact O-N 3.34Å; D394-R397 PolarHBondContact O-N 3.13Å; D394-R397 IonicContact OD1-CZ 3.56Å; D394-R397 IonicContact OD1-NH1 3.59Å; D394-R397 PolarHBondContact OD1-NH1 2.93Å; D394-S398 VanDerWaalsContact O-CB 3.29Å; D394-S398 WeakPolarHBondContact O-CB 3.26Å; D394-S398 PolarHBondContact O-N 3.5Å; D394-S398 PolarHBondContact O-OG 3.14Å
395	A	94.9	Very high	92.6	Very high	2 Å²	2	35.5 Å²	35.5	2%	0.017	19%	0.185	C	C	.	.	H	α-helix	trans	-58.8	-48.7	172.3	0	0	0	0	0	111.3	L348 M391 V392 R397 S398 F399 W491	L348-A395 HydrophobicContact CB-CB 3.79Å; L348-A395 HydrophobicContact CD2-CB 3.95Å; L348-A395 HydrophobicContact CG-CB 4.5Å; M391-A395 WeakPolarHBondContact O-CB 3.35Å; M391-A395 PolarHBondContact O-N 3.4Å; V392-A395 WeakPolarHBondContact O-CB 3.46Å; V392-A395 PolarHBondContact O-N 3.32Å; A395-R397 PolarHBondContact O-N 3.42Å; A395-S398 PolarHBondContact O-N 3.14Å; A395-S398 PolarHBondContact O-OG 2.97Å; A395-F399 WeakPolarHBondContact O-CB 3.45Å; A395-F399 PolarHBondContact O-N 3.4Å; A395-W491 HydrophobicContact CB-CZ2 4.05Å
396	L	95.3	Very high	92.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-56.8	-48.3	175.3	-76.7	167.3	0	0	0	112.2	V392 K393 S398 F399 V400 S401 P402 L405 F424 V425 L488 W491	V392-L396 HydrophobicContact CG1-CD1 4.3Å; V392-L396 WeakPolarHBondContact O-CG 3.38Å; V392-L396 PolarHBondContact O-N 3.34Å; K393-L396 PolarHBondContact O-N 3.39Å; L396-S398 VanDerWaalsContact C-N 3.3Å; L396-S398 PolarHBondContact O-N 3.31Å; L396-F399 PolarHBondContact O-N 3.18Å; L396-V400 HydrophobicContact CD2-CG2 4.07Å; L396-V400 WeakPolarHBondContact O-CG2 3.33Å; L396-V400 PolarHBondContact O-N 3.35Å; L396-S401 PolarHBondContact O-N 2.53Å; L396-S401 VanDerWaalsContact O-N 3.08Å; L396-P402 HydrophobicContact CB-CG 4.37Å; L396-P402 WeakPolarHBondContact O-CD 3.32Å; L396-L405 HydrophobicContact CB-CD1 4.1Å; L396-F424 HydrophobicContact CD1-CE1 4.44Å; L396-V425 HydrophobicContact CD1-CG2 4.14Å; L396-L488 HydrophobicContact CD1-CD2 4.14Å; L396-L488 HydrophobicContact CD2-CD2 3.79Å; L396-W491 HydrophobicContact CD2-CB 3.85Å; L396-W491 HydrophobicContact CD2-CD2 3.41Å; L396-W491 VanDerWaalsContact CD2-CD2 3.41Å; L396-W491 HydrophobicContact CD2-CE3 3.55Å; L396-W491 HydrophobicContact CD2-CG 3.56Å; L396-W491 HydrophobicContact CD2-CZ3 4.25Å; L396-W491 HydrophobicContact CG-CD2 4.1Å; L396-W491 HydrophobicContact CG-CE3 4.22Å; L396-W491 HydrophobicContact CG-CZ3 4.47Å
397	R	92.9	Very high	92.9	Very high	90 Å²	90	30.5 Å²	30.5	34%	0.34	17%	0.165	S	C	.	.	H	α-helix	trans	-57.5	-44.8	176	-72.7	175.9	-174.1	117.7	4	111.7	K393 D394 A395 F399 S401 L405	K393-R397 WeakPolarHBondContact O-CG 3.46Å; K393-R397 PolarHBondContact O-N 3.1Å; D394-R397 PolarHBondContact O-N 3.13Å; D394-R397 IonicContact OD1-CZ 3.56Å; D394-R397 IonicContact OD1-NH1 3.59Å; D394-R397 PolarHBondContact OD1-NH1 2.93Å; A395-R397 PolarHBondContact O-N 3.42Å; R397-F399 VanDerWaalsContact C-N 3.35Å; R397-S401 WeakPolarHBondContact O-CA 3.13Å; R397-S401 PolarHBondContact O-N 3.15Å; R397-S401 PolarHBondContact O-OG 3.2Å; R397-L405 HydrophobicContact CG-CB 4.03Å; R397-L405 HydrophobicContact CG-CD1 3.92Å
398	S	91.2	Very high	92.6	Very high	46 Å²	46	30.6 Å²	30.6	32%	0.322	16%	0.162	S	C	.	.	H	α-helix	trans	-76.4	-17.3	-174.6	75.2	0	0	0	0	114.7	N347 D394 A395 L396 Q544	N347-S398 PolarHBondContact ND2-OG 3.06Å; D394-S398 VanDerWaalsContact O-CB 3.29Å; D394-S398 WeakPolarHBondContact O-CB 3.26Å; D394-S398 PolarHBondContact O-N 3.5Å; D394-S398 PolarHBondContact O-OG 3.14Å; A395-S398 PolarHBondContact O-N 3.14Å; A395-S398 PolarHBondContact O-OG 2.97Å; L396-S398 VanDerWaalsContact C-N 3.3Å; L396-S398 PolarHBondContact O-N 3.31Å; S398-Q544 VanDerWaalsContact C-NE2 3.31Å; S398-Q544 PolarHBondContact O-NE2 3.44Å
399	F	92.3	Very high	92.4	Very high	2 Å²	2	30.8 Å²	30.8	1%	0.009	16%	0.164	C	C	.	.	H	α-helix	trans	-109.3	-49.4	-175.6	-170.6	-94.2	0	0	0	113.2	H349 A395 L396 R397 W491 Y494 L537 A540 Q544 L572	H349-F399 AromaticContact CE1-CD2 3.39Å; H349-F399 WeakPolarHBondContact CE1-CD2 3.47Å; H349-F399 AromaticContact CE1-CG 3.75Å; H349-F399 AromaticContact ND1-CD2 3.76Å; A395-F399 WeakPolarHBondContact O-CB 3.45Å; A395-F399 PolarHBondContact O-N 3.4Å; L396-F399 PolarHBondContact O-N 3.18Å; R397-F399 VanDerWaalsContact C-N 3.35Å; F399-W491 HydrophobicContact CD1-CB 4.43Å; F399-W491 AromaticContact CD1-CD1 3.55Å; F399-W491 HydrophobicContact CD1-CG 4.39Å; F399-W491 AromaticContact CG-CD1 3.87Å; F399-Y494 HydrophobicContact CE1-CD1 4.45Å; F399-Y494 HydrophobicContact CE1-CG 4.16Å; F399-Y494 HydrophobicContact CE2-CD1 4.19Å; F399-Y494 HydrophobicContact CE2-CD2 4.25Å; F399-Y494 HydrophobicContact CE2-CE1 4.24Å; F399-Y494 HydrophobicContact CE2-CE2 4.3Å; F399-Y494 HydrophobicContact CE2-CG 4.2Å; F399-Y494 AromaticContact CZ-CD1 3.9Å; F399-Y494 HydrophobicContact CZ-CD1 3.9Å; F399-Y494 AromaticContact CZ-CD2 3.74Å; F399-Y494 HydrophobicContact CZ-CD2 3.74Å; F399-Y494 HydrophobicContact CZ-CE1 4.39Å; F399-Y494 HydrophobicContact CZ-CE2 4.24Å; F399-Y494 AromaticContact CZ-CG 3.55Å; F399-Y494 HydrophobicContact CZ-CG 3.55Å; F399-L537 HydrophobicContact CE2-CD2 4.2Å; F399-L537 HydrophobicContact CZ-CD2 4.02Å; F399-A540 HydrophobicContact CD1-CB 4.01Å; F399-A540 HydrophobicContact CE1-CB 3.61Å; F399-A540 HydrophobicContact CZ-CB 4.06Å; F399-Q544 VanDerWaalsContact O-CD 3.27Å; F399-Q544 WeakPolarHBondContact O-CG 3.3Å; F399-Q544 PolarHBondContact O-NE2 3.18Å; F399-L572 HydrophobicContact CD2-CD1 4.41Å; F399-L572 HydrophobicContact CD2-CD2 3.54Å; F399-L572 HydrophobicContact CE2-CD1 4.18Å; F399-L572 HydrophobicContact CE2-CD2 3.47Å; F399-L572 VanDerWaalsContact CE2-CD2 3.47Å; F399-L572 HydrophobicContact CE2-CG 4.49Å; F399-L572 HydrophobicContact CZ-CD1 4.48Å; F399-L572 HydrophobicContact CZ-CD2 4.48Å
400	V	92.3	Very high	92.1	Very high	1 Å²	1	30 Å²	30	1%	0.006	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.7	-9.8	-175.7	-83.5	0	0	0	0	114	L396 T490 W491 A540	L396-V400 HydrophobicContact CD2-CG2 4.07Å; L396-V400 WeakPolarHBondContact O-CG2 3.33Å; L396-V400 PolarHBondContact O-N 3.35Å; V400-T490 HydrophobicContact CG1-CG2 4.13Å; V400-W491 HydrophobicContact CG1-CB 4.45Å; V400-W491 HydrophobicContact CG2-CB 3.96Å; V400-W491 HydrophobicContact CG2-CG 4.46Å; V400-A540 HydrophobicContact CG1-CB 3.99Å
401	S	91.4	Very high	92	Very high	32 Å²	32	26.8 Å²	26.8	22%	0.224	15%	0.147	C	C	.	.			trans	47.4	56.2	177.4	-57.1	0	0	0	0	113.5	L396 R397	L396-S401 PolarHBondContact O-N 2.53Å; L396-S401 VanDerWaalsContact O-N 3.08Å; R397-S401 WeakPolarHBondContact O-CA 3.13Å; R397-S401 PolarHBondContact O-N 3.15Å; R397-S401 PolarHBondContact O-OG 3.2Å
402	P	92.8	Very high	91.8	Very high	2 Å²	2	30 Å²	30	1%	0.013	16%	0.159	C	C	.	.			trans	-64.7	133.8	-172	28	-33.6	0	0	0	110.8	L396 V404 L405 C487	L396-P402 HydrophobicContact CB-CG 4.37Å; L396-P402 WeakPolarHBondContact O-CD 3.32Å; P402-V404 HydrophobicContact CB-CG1 4.45Å; P402-V404 PolarHBondContact O-N 3.31Å; P402-V404 VanDerWaalsContact O-N 3.12Å; P402-L405 HydrophobicContact CG-CB 4.14Å; P402-L405 HydrophobicContact CG-CD1 3.66Å; P402-L405 HydrophobicContact CG-CG 3.89Å; P402-L405 PolarHBondContact O-N 3.19Å; P402-C487 HydrophobicContact CB-CB 3.97Å
403	P	91.7	Very high	91.5	Very high	5 Å²	5	35.9 Å²	35.9	3%	0.032	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-53.3	-36.6	-176.6	-28.4	31.1	0	0	0	114.5	L405 S406 C409 L475 R482 Q483 H484	P403-L405 PolarHBondContact O-N 3.47Å; P403-L405 VanDerWaalsContact O-N 3.14Å; P403-S406 VanDerWaalsContact O-CB 3.25Å; P403-S406 WeakPolarHBondContact O-CB 3.46Å; P403-S406 PolarHBondContact O-N 3.29Å; P403-C409 WeakPolarHBondContact O-CB 3.42Å; P403-L475 HydrophobicContact CB-CD2 4.06Å; P403-L475 HydrophobicContact CG-CD2 4.22Å; P403-R482 HydrophobicContact CG-CG 4.44Å; P403-Q483 VanDerWaalsContact CG-O 3.29Å; P403-Q483 WeakPolarHBondContact CG-O 3.35Å; P403-H484 VanDerWaalsContact CD-CD2 3.47Å; P403-H484 WeakPolarHBondContact CD-CD2 3.43Å; P403-H484 HydrophobicContact CG-CB 4.28Å
404	V	92.3	Very high	91.4	Very high	5 Å²	5	36.1 Å²	36.1	3%	0.03	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-59.8	-26.8	-179.5	72.5	0	0	0	0	113	P402 L411 A417 I421 L471 H484	P402-V404 HydrophobicContact CB-CG1 4.45Å; P402-V404 PolarHBondContact O-N 3.31Å; P402-V404 VanDerWaalsContact O-N 3.12Å; V404-L411 HydrophobicContact CG2-CB 4.33Å; V404-A417 HydrophobicContact CG2-CB 4.06Å; V404-I421 HydrophobicContact CG1-CB 4.31Å; V404-I421 HydrophobicContact CG1-CD1 4.2Å; V404-I421 HydrophobicContact CG1-CG1 4.08Å; V404-I421 HydrophobicContact CG2-CG2 4.43Å; V404-L471 HydrophobicContact CB-CD1 4.19Å; V404-L471 HydrophobicContact CG1-CD1 4.01Å; V404-L471 HydrophobicContact CG2-CD1 4.35Å; V404-L471 HydrophobicContact CG2-CD2 4.01Å; V404-H484 VanDerWaalsContact CG1-NE2 3.33Å; V404-H484 WeakPolarHBondContact CG1-NE2 3.4Å
405	L	92.6	Very high	91.4	Very high	13 Å²	13	38.7 Å²	38.7	7%	0.068	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-92.2	-2.3	177.9	-63.1	-176	0	0	0	113.5	L396 R397 P402 P403 I421	L396-L405 HydrophobicContact CB-CD1 4.1Å; R397-L405 HydrophobicContact CG-CB 4.03Å; R397-L405 HydrophobicContact CG-CD1 3.92Å; P402-L405 HydrophobicContact CG-CB 4.14Å; P402-L405 HydrophobicContact CG-CD1 3.66Å; P402-L405 HydrophobicContact CG-CG 3.89Å; P402-L405 PolarHBondContact O-N 3.19Å; P403-L405 PolarHBondContact O-N 3.47Å; P403-L405 VanDerWaalsContact O-N 3.14Å; L405-I421 HydrophobicContact CD2-CG1 3.89Å; L405-I421 HydrophobicContact CG-CG1 4.43Å
406	S	90.4	Very high	91.4	Very high	11 Å²	11	43.4 Å²	43.4	8%	0.077	22%	0.224	C	C	.	.			trans	-86	121.2	-179.9	-178.6	0	0	0	0	110	P403 K408 C409 Y412 R482 E547	P403-S406 VanDerWaalsContact O-CB 3.25Å; P403-S406 WeakPolarHBondContact O-CB 3.46Å; P403-S406 PolarHBondContact O-N 3.29Å; S406-K408 PolarHBondContact O-N 3.2Å; S406-C409 WeakPolarHBondContact O-CB 3.41Å; S406-C409 PolarHBondContact O-N 3.21Å; S406-Y412 WeakPolarHBondContact O-CB 3.31Å; S406-Y412 WeakPolarHBondContact O-CD2 3.46Å; S406-R482 VanDerWaalsContact CB-NH2 3.26Å; S406-R482 PolarHBondContact OG-NH2 3.28Å; S406-E547 WeakPolarHBondContact CB-OE1 3.43Å; S406-E547 PolarHBondContact OG-OE1 2.88Å
407	P	87.3	Confident	91.3	Very high	92 Å²	92	43.4 Å²	43.4	60%	0.597	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-17	-179	-26.5	34.9	0	0	0	115.1	Y412	P407-Y412 HydrophobicContact CB-CE1 4.5Å; P407-Y412 HydrophobicContact CB-CE2 4.44Å; P407-Y412 HydrophobicContact CG-CE2 4.16Å
408	K	85.5	Confident	91.4	Very high	76 Å²	76	42.9 Å²	42.9	33%	0.33	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-1.9	178.7	-59.6	-168.8	-175.2	178	0	113.7	S406 M551	S406-K408 PolarHBondContact O-N 3.2Å; K408-M551 PolarHBondContact NZ-O 3.48Å
409	C	88.3	Confident	91.7	Very high	7 Å²	7	44.4 Å²	44.4	5%	0.047	23%	0.229	C	C	.	.	S	Bend	trans	-83.1	139	175.4	-173.6	0	0	0	0	111.1	P403 S406 L411 Y412	P403-C409 WeakPolarHBondContact O-CB 3.42Å; S406-C409 WeakPolarHBondContact O-CB 3.41Å; S406-C409 PolarHBondContact O-N 3.21Å; C409-L411 PolarHBondContact O-N 2.94Å; C409-L411 PolarHBondContact SG-N 3.36Å; C409-Y412 VanDerWaalsContact O-CB 3.22Å; C409-Y412 WeakPolarHBondContact O-CB 3.41Å; C409-Y412 PolarHBondContact O-N 2.85Å
410	C	88.7	Confident	91.9	Very high	43 Å²	43	48.4 Å²	48.4	29%	0.291	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-54.2	-31	171.7	62.8	0	0	0	0	113.5	Y412 Q478 E479	C410-Y412 VanDerWaalsContact C-N 3.31Å; C410-Y412 PolarHBondContact O-N 3.21Å; C410-Q478 HydrophobicContact CB-CB 4.41Å; C410-Q478 VanDerWaalsContact CB-OE1 3.31Å; C410-Q478 PolarHBondContact SG-OE1 3.14Å; C410-E479 HydrophobicContact CB-CG 4.4Å; C410-E479 WeakPolarHBondContact CB-OE1 3.38Å; C410-E479 PolarHBondContact N-OE1 3.43Å; C410-E479 PolarHBondContact SG-OE1 3.29Å
411	L	91.1	Very high	92	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-76.3	-15.1	178.8	-60.1	-172.3	0	0	0	113.7	V404 C409 N413 N414 A417 M474 L475	V404-L411 HydrophobicContact CG2-CB 4.33Å; C409-L411 PolarHBondContact O-N 2.94Å; C409-L411 PolarHBondContact SG-N 3.36Å; L411-N413 PolarHBondContact O-N 3.36Å; L411-N413 VanDerWaalsContact O-N 3.14Å; L411-N414 HydrophobicContact CD2-CB 4.43Å; L411-N414 WeakPolarHBondContact O-CB 3.39Å; L411-N414 PolarHBondContact O-N 3.18Å; L411-A417 HydrophobicContact CB-CB 4.08Å; L411-M474 HydrophobicContact CD1-CB 4.29Å; L411-M474 HydrophobicContact CD2-CB 4.06Å; L411-L475 HydrophobicContact CD1-CB 3.83Å; L411-L475 HydrophobicContact CD1-CD1 4.12Å; L411-L475 HydrophobicContact CG-CD1 4.09Å
412	Y	90.1	Very high	92.3	Very high	83 Å²	83	50.1 Å²	50.1	33%	0.325	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-59.1	-31.9	-175.4	-175.7	-98	0	0	0	113.4	S406 P407 C409 C410 K418	S406-Y412 WeakPolarHBondContact O-CB 3.31Å; S406-Y412 WeakPolarHBondContact O-CD2 3.46Å; P407-Y412 HydrophobicContact CB-CE1 4.5Å; P407-Y412 HydrophobicContact CB-CE2 4.44Å; P407-Y412 HydrophobicContact CG-CE2 4.16Å; C409-Y412 VanDerWaalsContact O-CB 3.22Å; C409-Y412 WeakPolarHBondContact O-CB 3.41Å; C409-Y412 PolarHBondContact O-N 2.85Å; C410-Y412 VanDerWaalsContact C-N 3.31Å; C410-Y412 PolarHBondContact O-N 3.21Å; Y412-K418 WeakPolarHBondContact O-CE 3.2Å
413	N	89.8	Confident	92.5	Very high	123 Å²	123	52.5 Å²	52.5	66%	0.658	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-107.1	5.1	177.8	-72.5	-40	0	0	0	113.5	L411 H415	L411-N413 PolarHBondContact O-N 3.36Å; L411-N413 VanDerWaalsContact O-N 3.14Å; N413-H415 PolarHBondContact O-N 2.93Å
414	N	93.8	Very high	92.8	Very high	43 Å²	43	52.3 Å²	52.3	23%	0.23	27%	0.266	C	S	.	.			trans	-76.2	123.1	177.3	-177.8	-65.3	0	0	0	110	L411 Q416 A417 K418 M474	L411-N414 HydrophobicContact CD2-CB 4.43Å; L411-N414 WeakPolarHBondContact O-CB 3.39Å; L411-N414 PolarHBondContact O-N 3.18Å; N414-Q416 PolarHBondContact O-N 3.32Å; N414-Q416 WeakPolarHBondContact OD1-CB 3.41Å; N414-Q416 PolarHBondContact OD1-N 2.97Å; N414-A417 HydrophobicContact CB-CB 3.92Å; N414-A417 PolarHBondContact O-N 3.3Å; N414-A417 PolarHBondContact OD1-N 3.49Å; N414-K418 WeakPolarHBondContact O-CG 3.25Å; N414-K418 PolarHBondContact O-N 3.34Å; N414-M474 WeakPolarHBondContact OD1-CE 3.36Å
415	H	94.3	Very high	93	Very high	137 Å²	137	52.1 Å²	52.1	63%	0.634	27%	0.265	S	S	*	.	H	α-helix	trans	-61.1	-46.4	-176	-171.6	3.3	0	0	0	112.6	N413 A417 K418 D419	N413-H415 PolarHBondContact O-N 2.93Å; H415-A417 PolarHBondContact O-N 3.05Å; H415-K418 WeakPolarHBondContact O-CB 3.32Å; H415-K418 PolarHBondContact O-N 2.99Å; H415-D419 IonicContact CE1-OD1 2.89Å; H415-D419 PolarHBondContact CE1-OD1 3.46Å; H415-D419 IonicContact CE1-OD2 3.86Å; H415-D419 PolarHBondContact CE1-OD2 3.35Å; H415-D419 VanDerWaalsContact CE1-OD2 3.28Å; H415-D419 IonicContact ND1-OD1 2.71Å; H415-D419 PolarHBondContact ND1-OD1 3.01Å; H415-D419 IonicContact ND1-OD2 2.71Å; H415-D419 PolarHBondContact ND1-OD2 3.32Å; H415-D419 PolarHBondContact O-N 2.96Å
416	Q	95.3	Very high	93.2	Very high	101 Å²	101	54.5 Å²	54.5	47%	0.472	28%	0.281	S	S	.	.	H	α-helix	trans	-64.3	-40.5	179.9	-176.3	179.8	17.7	0	0	111.9	N414 K418 D419 Y420 M474	N414-Q416 PolarHBondContact O-N 3.32Å; N414-Q416 WeakPolarHBondContact OD1-CB 3.41Å; N414-Q416 PolarHBondContact OD1-N 2.97Å; Q416-K418 VanDerWaalsContact C-N 3.34Å; Q416-D419 PolarHBondContact O-N 3.27Å; Q416-Y420 HydrophobicContact CG-CD2 4.35Å; Q416-Y420 HydrophobicContact CG-CE2 3.74Å; Q416-Y420 PolarHBondContact NE2-OH 3.19Å; Q416-Y420 WeakPolarHBondContact O-CD2 3.35Å; Q416-Y420 PolarHBondContact O-N 3.44Å; Q416-Y420 VanDerWaalsContact O-N 3.12Å; Q416-M474 HydrophobicContact CB-CE 4.07Å; Q416-M474 HydrophobicContact CG-CE 4.2Å
417	A	94.3	Very high	93.5	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-65.8	-37.4	176.4	0	0	0	0	0	112	V404 L411 N414 H415 I421 L471 M474	V404-A417 HydrophobicContact CG2-CB 4.06Å; L411-A417 HydrophobicContact CB-CB 4.08Å; N414-A417 HydrophobicContact CB-CB 3.92Å; N414-A417 PolarHBondContact O-N 3.3Å; N414-A417 PolarHBondContact OD1-N 3.49Å; H415-A417 PolarHBondContact O-N 3.05Å; A417-I421 WeakPolarHBondContact O-CG2 3.5Å; A417-I421 PolarHBondContact O-N 3.41Å; A417-L471 HydrophobicContact CB-CD2 3.76Å; A417-M474 HydrophobicContact CB-CE 4.15Å
418	K	94.6	Very high	94	Very high	79 Å²	79	54 Å²	54	34%	0.343	27%	0.269	S	S	.	.	H	α-helix	trans	-62.3	-45.3	172.5	-76.3	-175.4	-176.2	179.8	0	111.8	Y412 N414 H415 Q416 Y420 I421 D422	Y412-K418 WeakPolarHBondContact O-CE 3.2Å; N414-K418 WeakPolarHBondContact O-CG 3.25Å; N414-K418 PolarHBondContact O-N 3.34Å; H415-K418 WeakPolarHBondContact O-CB 3.32Å; H415-K418 PolarHBondContact O-N 2.99Å; Q416-K418 VanDerWaalsContact C-N 3.34Å; K418-Y420 VanDerWaalsContact C-N 3.31Å; K418-Y420 PolarHBondContact O-N 3.04Å; K418-I421 VanDerWaalsContact O-CG2 3.24Å; K418-I421 WeakPolarHBondContact O-CG2 3.42Å; K418-I421 PolarHBondContact O-N 2.97Å; K418-D422 VanDerWaalsContact O-CB 3.25Å; K418-D422 WeakPolarHBondContact O-CB 3.49Å; K418-D422 VanDerWaalsContact O-CG 3.27Å; K418-D422 PolarHBondContact O-N 3.18Å
419	D	96.4	Very high	94.4	Very high	78 Å²	78	51.5 Å²	51.5	42%	0.417	26%	0.26	S	S	.	.	H	α-helix	trans	-62.4	-41.1	-179.1	-63.2	-14.2	0	0	0	111.3	H415 Q416 S423	H415-D419 IonicContact CE1-OD1 2.89Å; H415-D419 PolarHBondContact CE1-OD1 3.46Å; H415-D419 IonicContact CE1-OD2 3.86Å; H415-D419 PolarHBondContact CE1-OD2 3.35Å; H415-D419 VanDerWaalsContact CE1-OD2 3.28Å; H415-D419 IonicContact ND1-OD1 2.71Å; H415-D419 PolarHBondContact ND1-OD1 3.01Å; H415-D419 IonicContact ND1-OD2 2.71Å; H415-D419 PolarHBondContact ND1-OD2 3.32Å; H415-D419 PolarHBondContact O-N 2.96Å; Q416-D419 PolarHBondContact O-N 3.27Å; D419-S423 VanDerWaalsContact O-CB 3.22Å; D419-S423 WeakPolarHBondContact O-CB 3.43Å; D419-S423 PolarHBondContact O-N 3.38Å
420	Y	96.4	Very high	94.7	Very high	86 Å²	86	59.4 Å²	59.4	34%	0.337	29%	0.289	S	S	.	.	H	α-helix	trans	-61.4	-49.1	175	-68.1	-34	0	0	0	112.7	Q416 K418 F424 A470 L471 M474	Q416-Y420 HydrophobicContact CG-CD2 4.35Å; Q416-Y420 HydrophobicContact CG-CE2 3.74Å; Q416-Y420 PolarHBondContact NE2-OH 3.19Å; Q416-Y420 WeakPolarHBondContact O-CD2 3.35Å; Q416-Y420 PolarHBondContact O-N 3.44Å; Q416-Y420 VanDerWaalsContact O-N 3.12Å; K418-Y420 VanDerWaalsContact C-N 3.31Å; K418-Y420 PolarHBondContact O-N 3.04Å; Y420-F424 WeakPolarHBondContact O-CB 2.74Å; Y420-F424 PolarHBondContact O-N 3.47Å; Y420-A470 HydrophobicContact CD2-CB 4.4Å; Y420-A470 HydrophobicContact CE2-CB 4.08Å; Y420-L471 HydrophobicContact CD2-CD2 4.27Å; Y420-M474 HydrophobicContact CD2-SD 4.3Å; Y420-M474 HydrophobicContact CE2-SD 3.96Å
421	I	96	Very high	95.1	Very high	5 Å²	5	57.9 Å²	57.9	3%	0.026	28%	0.278	C	S	.	.	H	α-helix	trans	-70.6	-36.2	-178.5	-169	61.8	0	0	0	112.1	V404 L405 A417 K418 F424 V425 L488	V404-I421 HydrophobicContact CG1-CB 4.31Å; V404-I421 HydrophobicContact CG1-CD1 4.2Å; V404-I421 HydrophobicContact CG1-CG1 4.08Å; V404-I421 HydrophobicContact CG2-CG2 4.43Å; L405-I421 HydrophobicContact CD2-CG1 3.89Å; L405-I421 HydrophobicContact CG-CG1 4.43Å; A417-I421 WeakPolarHBondContact O-CG2 3.5Å; A417-I421 PolarHBondContact O-N 3.41Å; K418-I421 VanDerWaalsContact O-CG2 3.24Å; K418-I421 WeakPolarHBondContact O-CG2 3.42Å; K418-I421 PolarHBondContact O-N 2.97Å; I421-F424 HydrophobicContact CD1-CD1 4.25Å; I421-F424 PolarHBondContact O-N 3.04Å; I421-V425 HydrophobicContact CD1-CG2 4.35Å; I421-V425 HydrophobicContact CG1-CG2 4.35Å; I421-V425 WeakPolarHBondContact O-CB 3.35Å; I421-V425 WeakPolarHBondContact O-CG2 3.22Å; I421-V425 PolarHBondContact O-N 2.94Å; I421-L488 HydrophobicContact CD1-CD1 4.02Å; I421-L488 HydrophobicContact CD1-CD2 3.92Å
422	D	96	Very high	95.3	Very high	63 Å²	63	57.9 Å²	57.9	34%	0.337	28%	0.278	S	S	.	.	H	α-helix	trans	-70.4	-38.2	179.2	-73.4	-17.6	0	0	0	111.6	K393 K418 T426	K393-D422 VanDerWaalsContact CE-OD1 3.22Å; K393-D422 WeakPolarHBondContact CE-OD1 3.4Å; K393-D422 IonicContact NZ-OD1 3.26Å; K393-D422 PolarHBondContact NZ-OD1 3.12Å; K418-D422 VanDerWaalsContact O-CB 3.25Å; K418-D422 WeakPolarHBondContact O-CB 3.49Å; K418-D422 VanDerWaalsContact O-CG 3.27Å; K418-D422 PolarHBondContact O-N 3.18Å; D422-T426 WeakPolarHBondContact O-CB 3.48Å; D422-T426 PolarHBondContact O-N 3.22Å; D422-T426 PolarHBondContact O-OG1 3.28Å
423	S	97.6	Very high	95.5	Very high	53 Å²	53	54.5 Å²	54.5	37%	0.371	27%	0.266	S	S	.	.	H	α-helix	trans	-62	-51.5	171.7	-173.6	0	0	0	0	111	D419 V425 T426 H427	D419-S423 VanDerWaalsContact O-CB 3.22Å; D419-S423 WeakPolarHBondContact O-CB 3.43Å; D419-S423 PolarHBondContact O-N 3.38Å; S423-V425 PolarHBondContact O-N 3.39Å; S423-T426 WeakPolarHBondContact O-CB 3.42Å; S423-T426 PolarHBondContact O-N 2.94Å; S423-T426 VanDerWaalsContact O-N 3.09Å; S423-H427 PolarHBondContact O-N 3.36Å; S423-H427 PolarHBondContact OG-CE1 2.84Å
424	F	98	Very high	95.8	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-57.4	-49.2	179	174.3	-106.5	0	0	0	112.1	L396 Y420 I421 T426 H427 C428 L460 E463 A464 V467 L488 V492	L396-F424 HydrophobicContact CD1-CE1 4.44Å; Y420-F424 WeakPolarHBondContact O-CB 2.74Å; Y420-F424 PolarHBondContact O-N 3.47Å; I421-F424 HydrophobicContact CD1-CD1 4.25Å; I421-F424 PolarHBondContact O-N 3.04Å; F424-T426 PolarHBondContact O-N 2.95Å; F424-H427 PolarHBondContact O-N 2.98Å; F424-H427 VanDerWaalsContact O-N 3.11Å; F424-C428 PolarHBondContact O-N 3.19Å; F424-C428 PolarHBondContact O-SG 3.34Å; F424-L460 HydrophobicContact CD2-CD1 4.15Å; F424-L460 HydrophobicContact CE2-CD1 3.58Å; F424-L460 HydrophobicContact CE2-CG 4.1Å; F424-L460 HydrophobicContact CZ-CD1 4.25Å; F424-L460 HydrophobicContact CZ-CG 4.48Å; F424-E463 HydrophobicContact CD2-CG 4.09Å; F424-A464 HydrophobicContact CE2-CB 3.62Å; F424-A464 HydrophobicContact CZ-CB 3.81Å; F424-V467 HydrophobicContact CB-CG2 4.39Å; F424-L488 HydrophobicContact CD1-CD1 3.89Å; F424-L488 HydrophobicContact CD1-CD2 4.33Å; F424-L488 HydrophobicContact CE1-CB 4.11Å; F424-L488 HydrophobicContact CE1-CD1 4.04Å; F424-L488 HydrophobicContact CE1-CD2 4Å; F424-L488 HydrophobicContact CE1-CG 4.27Å; F424-L488 HydrophobicContact CG-CD1 4.32Å; F424-L488 HydrophobicContact CZ-CB 4.2Å; F424-V492 HydrophobicContact CE2-CG2 4.41Å; F424-V492 HydrophobicContact CZ-CG2 3.79Å
425	V	97.1	Very high	95.9	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.006	24%	0.235	C	C	.	.	H	α-helix	trans	-60.9	-36	177.5	167.5	0	0	0	0	111.5	Q389 V392 K393 L396 I421 S423 C428 V429	Q389-V425 HydrophobicContact CB-CG1 3.71Å; Q389-V425 HydrophobicContact CG-CG1 4.09Å; Q389-V425 WeakPolarHBondContact O-CG1 3.3Å; V392-V425 HydrophobicContact CB-CG1 4.25Å; V392-V425 HydrophobicContact CG1-CG1 4.12Å; V392-V425 HydrophobicContact CG1-CG2 4.35Å; K393-V425 HydrophobicContact CD-CG1 4.46Å; K393-V425 HydrophobicContact CG-CB 4.46Å; K393-V425 HydrophobicContact CG-CG1 4Å; K393-V425 HydrophobicContact CG-CG2 3.76Å; L396-V425 HydrophobicContact CD1-CG2 4.14Å; I421-V425 HydrophobicContact CD1-CG2 4.35Å; I421-V425 HydrophobicContact CG1-CG2 4.35Å; I421-V425 WeakPolarHBondContact O-CB 3.35Å; I421-V425 WeakPolarHBondContact O-CG2 3.22Å; I421-V425 PolarHBondContact O-N 2.94Å; S423-V425 PolarHBondContact O-N 3.39Å; V425-C428 WeakPolarHBondContact O-CB 3.5Å; V425-C428 PolarHBondContact O-N 2.63Å; V425-V429 PolarHBondContact O-N 3.46Å
426	T	96.3	Very high	96	Very high	64 Å²	64	41.8 Å²	41.8	39%	0.393	21%	0.205	S	C	.	.	H	α-helix	trans	-64.9	-42.1	175.8	-62.2	0	0	0	0	111.3	Q389 D422 S423 F424 C428 V429	Q389-T426 PolarHBondContact NE2-OG1 3.45Å; D422-T426 WeakPolarHBondContact O-CB 3.48Å; D422-T426 PolarHBondContact O-N 3.22Å; D422-T426 PolarHBondContact O-OG1 3.28Å; S423-T426 WeakPolarHBondContact O-CB 3.42Å; S423-T426 PolarHBondContact O-N 2.94Å; S423-T426 VanDerWaalsContact O-N 3.09Å; F424-T426 PolarHBondContact O-N 2.95Å; T426-C428 VanDerWaalsContact C-N 3.32Å; T426-C428 PolarHBondContact O-N 2.99Å; T426-V429 WeakPolarHBondContact O-CB 3.35Å; T426-V429 PolarHBondContact O-N 3.35Å
427	H	96.8	Very high	96	Very high	93 Å²	93	39.6 Å²	39.6	43%	0.431	20%	0.195	S	C	.	.	H	α-helix	trans	-67.7	-29.6	175.8	-61.8	157.4	0	0	0	112.9	S423 F424 V429 P431 E463	S423-H427 PolarHBondContact O-N 3.36Å; S423-H427 PolarHBondContact OG-CE1 2.84Å; F424-H427 PolarHBondContact O-N 2.98Å; F424-H427 VanDerWaalsContact O-N 3.11Å; H427-V429 VanDerWaalsContact C-N 3.28Å; H427-V429 PolarHBondContact O-N 3.48Å; H427-P431 WeakPolarHBondContact O-CD 3.24Å; H427-E463 IonicContact CE1-OE1 2.7Å; H427-E463 IonicContact CG-OE1 3.24Å; H427-E463 IonicContact CG-OE2 2.8Å; H427-E463 VanDerWaalsContact ND1-CD 3.3Å; H427-E463 IonicContact ND1-OE1 3.37Å; H427-E463 PolarHBondContact ND1-OE1 3.05Å; H427-E463 IonicContact ND1-OE2 2.81Å; H427-E463 PolarHBondContact ND1-OE2 2.9Å
428	C	96.8	Very high	96.1	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-62.1	-30.3	171.7	-66.9	0	0	0	0	113.5	V392 F424 V425 T426 R430 P431 F432	V392-C428 HydrophobicContact CG1-CB 3.97Å; V392-C428 HydrophobicContact CG2-CB 4.49Å; F424-C428 PolarHBondContact O-N 3.19Å; F424-C428 PolarHBondContact O-SG 3.34Å; V425-C428 WeakPolarHBondContact O-CB 3.5Å; V425-C428 PolarHBondContact O-N 2.63Å; T426-C428 VanDerWaalsContact C-N 3.32Å; T426-C428 PolarHBondContact O-N 2.99Å; C428-R430 PolarHBondContact O-N 3.17Å; C428-P431 WeakPolarHBondContact O-CD 3.48Å; C428-F432 HydrophobicContact CB-CD2 4Å; C428-F432 HydrophobicContact CB-CE2 4.24Å; C428-F432 VanDerWaalsContact O-CD2 3.26Å; C428-F432 WeakPolarHBondContact O-CD2 3.33Å; C428-F432 PolarHBondContact O-N 3.48Å; C428-F432 VanDerWaalsContact O-N 3.14Å
429	V	94.9	Very high	96.2	Very high	22 Å²	22	36.7 Å²	36.7	13%	0.133	18%	0.183	C	C	.	.	H	α-helix	trans	-56	-48.6	-169.8	173.2	0	0	0	0	112.2	M388 Q389 V425 T426 H427 C433	M388-V429 HydrophobicContact CB-CG1 3.99Å; M388-V429 HydrophobicContact CB-CG2 4.31Å; M388-V429 HydrophobicContact CG-CG1 4.05Å; M388-V429 HydrophobicContact CG-CG2 4.39Å; Q389-V429 HydrophobicContact CG-CG2 3.56Å; V425-V429 PolarHBondContact O-N 3.46Å; T426-V429 WeakPolarHBondContact O-CB 3.35Å; T426-V429 PolarHBondContact O-N 3.35Å; H427-V429 VanDerWaalsContact C-N 3.28Å; H427-V429 PolarHBondContact O-N 3.48Å; V429-C433 WeakPolarHBondContact O-CB 3.29Å; V429-C433 PolarHBondContact O-N 3.22Å; V429-C433 PolarHBondContact O-SG 3.46Å
430	R	94.6	Very high	96.1	Very high	174 Å²	174	33.1 Å²	33.1	66%	0.657	16%	0.164	S	C	*	.	H	α-helix	trans	-66.9	-51.4	-175.9	169.2	-174.6	170.3	130.8	2.7	112.7	C428 F432 C433 S434 E456	C428-R430 PolarHBondContact O-N 3.17Å; R430-F432 VanDerWaalsContact C-N 3.31Å; R430-F432 PolarHBondContact O-N 3.19Å; R430-C433 PolarHBondContact O-N 2.67Å; R430-S434 WeakPolarHBondContact O-CB 3.38Å; R430-S434 PolarHBondContact O-N 3.26Å; R430-S434 PolarHBondContact O-OG 3.36Å; R430-E456 IonicContact NE-OE1 3.33Å; R430-E456 IonicContact NE-OE2 3.22Å; R430-E456 IonicContact NH2-OE1 3.63Å
431	P	96.1	Very high	96	Very high	10 Å²	10	29.3 Å²	29.3	7%	0.065	15%	0.15	C	C	.	.	H	α-helix	trans	-57.3	-41.5	177	-28	35	0	0	0	112.8	H427 C428 S434 L435 E456 F457	H427-P431 WeakPolarHBondContact O-CD 3.24Å; C428-P431 WeakPolarHBondContact O-CD 3.48Å; P431-S434 PolarHBondContact O-N 2.92Å; P431-L435 WeakPolarHBondContact O-CB 3.15Å; P431-L435 PolarHBondContact O-N 2.88Å; P431-E456 HydrophobicContact CB-CB 4.47Å; P431-E456 HydrophobicContact CG-CB 4.33Å; P431-F457 HydrophobicContact CB-CD2 4.04Å; P431-F457 HydrophobicContact CB-CE2 3.64Å; P431-F457 HydrophobicContact CB-CZ 4.1Å
432	F	96.2	Very high	95.9	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-71.5	-38.9	178.8	-81.5	-85.1	0	0	0	113.3	L348 L352 M388 C428 R430 S434 L435 I436 F457 L460 W491 H495	L348-F432 HydrophobicContact CD2-CD1 3.89Å; L348-F432 HydrophobicContact CD2-CE1 4.04Å; L348-F432 HydrophobicContact CD2-CG 4.47Å; L352-F432 HydrophobicContact CD1-CD1 4.47Å; L352-F432 HydrophobicContact CD1-CE1 4.41Å; M388-F432 HydrophobicContact CE-CB 3.82Å; C428-F432 HydrophobicContact CB-CD2 4Å; C428-F432 HydrophobicContact CB-CE2 4.24Å; C428-F432 VanDerWaalsContact O-CD2 3.26Å; C428-F432 WeakPolarHBondContact O-CD2 3.33Å; C428-F432 PolarHBondContact O-N 3.48Å; C428-F432 VanDerWaalsContact O-N 3.14Å; R430-F432 VanDerWaalsContact C-N 3.31Å; R430-F432 PolarHBondContact O-N 3.19Å; F432-S434 VanDerWaalsContact C-N 3.3Å; F432-S434 PolarHBondContact O-N 3.46Å; F432-L435 PolarHBondContact O-N 2.92Å; F432-I436 VanDerWaalsContact O-CG1 3.3Å; F432-I436 WeakPolarHBondContact O-CG1 3.46Å; F432-I436 PolarHBondContact O-N 3.26Å; F432-F457 HydrophobicContact CD1-CZ 4.45Å; F432-F457 HydrophobicContact CD2-CZ 4.36Å; F432-F457 HydrophobicContact CE1-CE1 4.32Å; F432-F457 HydrophobicContact CE1-CZ 4.35Å; F432-F457 HydrophobicContact CE2-CE1 4.02Å; F432-F457 HydrophobicContact CE2-CZ 4.25Å; F432-F457 HydrophobicContact CG-CZ 4.47Å; F432-F457 AromaticContact CZ-CE1 3.89Å; F432-F457 HydrophobicContact CZ-CE1 3.89Å; F432-F457 HydrophobicContact CZ-CZ 4.25Å; F432-L460 HydrophobicContact CE2-CD2 4.2Å; F432-W491 HydrophobicContact CD2-CH2 4.14Å; F432-W491 AromaticContact CE1-CH2 3.99Å; F432-W491 HydrophobicContact CE1-CH2 3.99Å; F432-W491 HydrophobicContact CE1-CZ2 4.16Å; F432-W491 AromaticContact CE2-CH2 3.24Å; F432-W491 HydrophobicContact CE2-CH2 3.24Å; F432-W491 HydrophobicContact CE2-CZ2 4.19Å; F432-W491 AromaticContact CE2-CZ3 3.51Å; F432-W491 HydrophobicContact CE2-CZ3 3.51Å; F432-W491 HydrophobicContact CZ-CE3 4.44Å; F432-W491 AromaticContact CZ-CH2 3.13Å; F432-W491 HydrophobicContact CZ-CH2 3.13Å; F432-W491 AromaticContact CZ-CZ2 3.63Å; F432-W491 HydrophobicContact CZ-CZ2 3.63Å; F432-W491 AromaticContact CZ-CZ3 3.61Å; F432-W491 HydrophobicContact CZ-CZ3 3.61Å; F432-H495 AromaticContact CE1-CD2 3.73Å; F432-H495 AromaticContact CE1-CE1 3.72Å; F432-H495 AromaticContact CE1-CG 3.89Å; F432-H495 AromaticContact CE1-ND1 3.88Å; F432-H495 AromaticContact CE1-NE2 3.63Å; F432-H495 AromaticContact CZ-CD2 3.45Å; F432-H495 VanDerWaalsContact CZ-CD2 3.45Å; F432-H495 WeakPolarHBondContact CZ-CD2 3.49Å; F432-H495 AromaticContact CZ-CG 3.86Å; F432-H495 AromaticContact CZ-NE2 3.72Å
433	C	94.9	Very high	95.8	Very high	12 Å²	12	28.6 Å²	28.6	8%	0.081	14%	0.144	C	C	.	.	H	α-helix	trans	-61.6	-41	171.8	-75	0	0	0	0	111.5	L376 V429 R430 I436 Q437	L376-C433 HydrophobicContact CD1-CB 4.14Å; V429-C433 WeakPolarHBondContact O-CB 3.29Å; V429-C433 PolarHBondContact O-N 3.22Å; V429-C433 PolarHBondContact O-SG 3.46Å; R430-C433 PolarHBondContact O-N 2.67Å; C433-I436 PolarHBondContact O-N 2.83Å; C433-Q437 WeakPolarHBondContact O-CB 3.31Å; C433-Q437 PolarHBondContact O-N 3.48Å
434	S	95.5	Very high	95.6	Very high	30 Å²	30	28.3 Å²	28.3	21%	0.21	15%	0.145	C	C	.	.	H	α-helix	trans	-65.9	-42.7	177.1	-54.4	0	0	0	0	111	R430 P431 F432 I436 Q437 I438	R430-S434 WeakPolarHBondContact O-CB 3.38Å; R430-S434 PolarHBondContact O-N 3.26Å; R430-S434 PolarHBondContact O-OG 3.36Å; P431-S434 PolarHBondContact O-N 2.92Å; F432-S434 VanDerWaalsContact C-N 3.3Å; F432-S434 PolarHBondContact O-N 3.46Å; S434-I436 VanDerWaalsContact C-N 3.32Å; S434-I436 PolarHBondContact O-N 2.97Å; S434-Q437 WeakPolarHBondContact O-CB 3.29Å; S434-Q437 PolarHBondContact O-N 2.99Å; S434-Q437 VanDerWaalsContact O-N 3.17Å; S434-I438 VanDerWaalsContact O-CG1 3.27Å; S434-I438 WeakPolarHBondContact O-CG1 3.32Å; S434-I438 PolarHBondContact O-N 3.32Å
435	L	96.6	Very high	95.4	Very high	6 Å²	6	32.1 Å²	32.1	3%	0.031	16%	0.159	C	C	.	.	H	α-helix	trans	-59.7	-42.7	175.6	-176.4	62	0	0	0	111.6	L352 P431 F432 I438 H439 L450 I453 F457 I499	L352-L435 HydrophobicContact CD2-CD2 3.95Å; L352-L435 HydrophobicContact CD2-CG 4.13Å; P431-L435 WeakPolarHBondContact O-CB 3.15Å; P431-L435 PolarHBondContact O-N 2.88Å; F432-L435 PolarHBondContact O-N 2.92Å; L435-I438 WeakPolarHBondContact O-CB 3.27Å; L435-I438 PolarHBondContact O-N 2.87Å; L435-H439 PolarHBondContact O-N 3.1Å; L435-H439 PolarHBondContact O-ND1 2.8Å; L435-L450 HydrophobicContact CD1-CD2 4.2Å; L435-I453 HydrophobicContact CB-CD1 3.92Å; L435-I453 HydrophobicContact CD1-CD1 4.46Å; L435-F457 HydrophobicContact CB-CE2 4.37Å; L435-F457 HydrophobicContact CB-CZ 4.42Å; L435-F457 HydrophobicContact CD2-CE2 4.44Å; L435-F457 HydrophobicContact CD2-CZ 3.91Å; L435-I499 HydrophobicContact CD1-CD1 4.03Å; L435-I499 HydrophobicContact CD1-CG1 3.94Å; L435-I499 HydrophobicContact CD2-CD1 4.23Å; L435-I499 HydrophobicContact CD2-CG1 4.47Å
436	I	95.4	Very high	95.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-65.3	-42.9	176.4	-67.3	168.5	0	0	0	110.6	L348 I351 L352 F355 Q372 F375 L376 M388 F432 C433 S434 I438 H439 G440	L348-I436 HydrophobicContact CD1-CD1 4.17Å; I351-I436 HydrophobicContact CG2-CD1 4.29Å; L352-I436 HydrophobicContact CD2-CD1 4.38Å; L352-I436 HydrophobicContact CD2-CG1 3.61Å; F355-I436 HydrophobicContact CD1-CG2 3.85Å; F355-I436 HydrophobicContact CD2-CG2 4.23Å; F355-I436 HydrophobicContact CE1-CG2 3.56Å; F355-I436 HydrophobicContact CE2-CG2 3.96Å; F355-I436 HydrophobicContact CG-CG2 4.17Å; F355-I436 HydrophobicContact CZ-CG2 3.61Å; Q372-I436 PolarHBondContact OE1-O 3.22Å; F375-I436 HydrophobicContact CD1-CD1 4.27Å; F375-I436 HydrophobicContact CD1-CG2 3.84Å; F375-I436 HydrophobicContact CE1-CD1 3.4Å; F375-I436 HydrophobicContact CE1-CG1 4.5Å; F375-I436 HydrophobicContact CE1-CG2 4.07Å; F375-I436 HydrophobicContact CZ-CD1 3.98Å; L376-I436 HydrophobicContact CD1-CB 4.48Å; L376-I436 HydrophobicContact CD1-CG2 4.27Å; M388-I436 HydrophobicContact CE-CD1 4.08Å; F432-I436 VanDerWaalsContact O-CG1 3.3Å; F432-I436 WeakPolarHBondContact O-CG1 3.46Å; F432-I436 PolarHBondContact O-N 3.26Å; C433-I436 PolarHBondContact O-N 2.83Å; S434-I436 VanDerWaalsContact C-N 3.32Å; S434-I436 PolarHBondContact O-N 2.97Å; I436-I438 VanDerWaalsContact C-N 3.33Å; I436-I438 PolarHBondContact O-N 3.5Å; I436-H439 PolarHBondContact O-N 3.45Å; I436-G440 PolarHBondContact O-N 3.32Å
437	Q	95.4	Very high	95.4	Very high	55 Å²	55	30.4 Å²	30.4	26%	0.257	15%	0.146	S	C	.	.	H	α-helix	trans	-61.1	-39.4	175.5	-170.1	179.4	30.6	0	0	112.7	A167 V169 C433 S434 H439 G440 H441	A167-Q437 PolarHBondContact O-NE2 2.81Å; A167-Q437 VanDerWaalsContact O-NE2 3.07Å; V169-Q437 HydrophobicContact CG1-CG 3.77Å; C433-Q437 WeakPolarHBondContact O-CB 3.31Å; C433-Q437 PolarHBondContact O-N 3.48Å; S434-Q437 WeakPolarHBondContact O-CB 3.29Å; S434-Q437 PolarHBondContact O-N 2.99Å; S434-Q437 VanDerWaalsContact O-N 3.17Å; Q437-H439 VanDerWaalsContact C-N 3.3Å; Q437-H439 PolarHBondContact O-N 2.93Å; Q437-G440 WeakPolarHBondContact O-CA 3.39Å; Q437-G440 PolarHBondContact O-N 3.07Å; Q437-H441 PolarHBondContact O-CD2 2.91Å
438	I	96.7	Very high	95.2	Very high	11 Å²	11	29.4 Å²	29.4	6%	0.056	14%	0.143	C	C	.	.	H	α-helix	trans	-54.1	-49.1	175.7	-73.3	171.5	0	0	0	110.1	S434 L435 I436 G440 H441 Q446 K449 L450 I453	S434-I438 VanDerWaalsContact O-CG1 3.27Å; S434-I438 WeakPolarHBondContact O-CG1 3.32Å; S434-I438 PolarHBondContact O-N 3.32Å; L435-I438 WeakPolarHBondContact O-CB 3.27Å; L435-I438 PolarHBondContact O-N 2.87Å; I436-I438 VanDerWaalsContact C-N 3.33Å; I436-I438 PolarHBondContact O-N 3.5Å; I438-G440 PolarHBondContact O-N 3.11Å; I438-H441 WeakPolarHBondContact O-CB 3.23Å; I438-H441 PolarHBondContact O-N 3.37Å; I438-Q446 HydrophobicContact CG2-CB 4.41Å; I438-Q446 HydrophobicContact CG2-CG 4.13Å; I438-Q446 WeakPolarHBondContact O-CG 3.33Å; I438-K449 HydrophobicContact CD1-CB 3.79Å; I438-K449 HydrophobicContact CG1-CB 3.69Å; I438-K449 HydrophobicContact CG1-CD 4.3Å; I438-K449 HydrophobicContact CG2-CB 4.18Å; I438-L450 HydrophobicContact CG2-CD2 4.07Å; I438-L450 HydrophobicContact CG2-CG 4Å; I438-I453 HydrophobicContact CD1-CB 3.8Å; I438-I453 HydrophobicContact CD1-CD1 3.51Å; I438-I453 HydrophobicContact CD1-CG1 4.24Å; I438-I453 HydrophobicContact CD1-CG2 3.87Å
439	H	95.8	Very high	95.2	Very high	7 Å²	7	32.4 Å²	32.4	3%	0.032	16%	0.156	C	C	.	.	H	α-helix	trans	-63.4	-14.8	177.9	-65.2	96.9	0	0	0	114.1	F355 C356 S359 L435 I436 Q437 Q446 Q502	F355-H439 HydrophobicContact CB-CB 3.88Å; F355-H439 HydrophobicContact CD1-CB 4.32Å; C356-H439 PolarHBondContact SG-CD2 3.01Å; C356-H439 PolarHBondContact SG-NE2 3.22Å; S359-H439 WeakPolarHBondContact CB-O 3.26Å; L435-H439 PolarHBondContact O-N 3.1Å; L435-H439 PolarHBondContact O-ND1 2.8Å; I436-H439 PolarHBondContact O-N 3.45Å; Q437-H439 VanDerWaalsContact C-N 3.3Å; Q437-H439 PolarHBondContact O-N 2.93Å; H439-Q446 PolarHBondContact O-NE2 3.44Å; H439-Q502 PolarHBondContact CD2-NE2 3.06Å; H439-Q502 PolarHBondContact NE2-NE2 2.79Å; H439-Q502 PolarHBondContact NE2-OE1 2.87Å
440	G	94.7	Very high	95.4	Very high	3 Å²	3	31.4 Å²	31.4	3%	0.031	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-15.9	171.3	0	0	0	0	0	114.5	V169 R368 I436 Q437 I438	V169-G440 WeakPolarHBondContact CB-O 3.44Å; V169-G440 WeakPolarHBondContact CG2-O 3.36Å; R368-G440 WeakPolarHBondContact CB-O 3.43Å; R368-G440 VanDerWaalsContact CD-O 3.29Å; R368-G440 WeakPolarHBondContact CD-O 3.38Å; R368-G440 PolarHBondContact NH1-O 3.13Å; I436-G440 PolarHBondContact O-N 3.32Å; Q437-G440 WeakPolarHBondContact O-CA 3.39Å; Q437-G440 PolarHBondContact O-N 3.07Å; I438-G440 PolarHBondContact O-N 3.11Å
441	H	95.6	Very high	95.4	Very high	6 Å²	6	23.5 Å²	23.5	3%	0.028	12%	0.123	C	C	.	.	S	Bend	trans	-76.2	171.7	178.5	-77	-87.3	0	0	0	112.8	A168 V169 Q437 I438 R445 Q446 K449	A168-H441 PolarHBondContact O-CE1 3.41Å; V169-H441 VanDerWaalsContact CA-CE1 3.48Å; V169-H441 WeakPolarHBondContact CA-CE1 3.16Å; V169-H441 PolarHBondContact O-ND1 2.69Å; Q437-H441 PolarHBondContact O-CD2 2.91Å; I438-H441 WeakPolarHBondContact O-CB 3.23Å; I438-H441 PolarHBondContact O-N 3.37Å; H441-R445 HydrophobicContact CB-CB 4.07Å; H441-Q446 HydrophobicContact CB-CG 4.23Å; H441-Q446 PolarHBondContact O-NE2 2.92Å; H441-K449 WeakPolarHBondContact CE1-CE 3.27Å; H441-K449 WeakPolarHBondContact NE2-CE 3.42Å
442	N	93.6	Very high	95.4	Very high	28 Å²	28	29.1 Å²	29.1	15%	0.15	15%	0.148	C	C	.	.			trans	-64.4	161.9	167	76.1	54.3	0	0	0	111.3	D174 A444 R445 Q446	D174-N442 PolarHBondContact OD1-ND2 3.43Å; D174-N442 PolarHBondContact OD2-ND2 3.2Å; N442-A444 VanDerWaalsContact C-N 3.34Å; N442-A444 PolarHBondContact O-N 3.35Å; N442-A444 PolarHBondContact OD1-N 3.09Å; N442-A444 VanDerWaalsContact OD1-N 3.09Å; N442-R445 VanDerWaalsContact ND2-CG 3.33Å; N442-R445 WeakPolarHBondContact ND2-CG 3.26Å; N442-R445 PolarHBondContact O-N 3.02Å; N442-R445 WeakPolarHBondContact OD1-CG 3.1Å; N442-R445 PolarHBondContact OD1-N 2.86Å; N442-Q446 WeakPolarHBondContact O-CG 3.3Å; N442-Q446 PolarHBondContact O-N 3.43Å
443	R	93.6	Very high	95.5	Very high	26 Å²	26	29.5 Å²	29.5	10%	0.098	15%	0.15	C	C	.	.	H	α-helix	trans	-63	-35.5	-172.4	-61.2	-61.5	-67	167.6	-5.9	113.7	S359 Q446 R447 E509 L510	S359-R443 WeakPolarHBondContact OG-CD 3.48Å; S359-R443 PolarHBondContact OG-NH1 3.43Å; R443-Q446 WeakPolarHBondContact O-CB 3.42Å; R443-R447 PolarHBondContact O-N 2.67Å; R443-E509 IonicContact CZ-OE1 4Å; R443-E509 IonicContact CZ-OE2 2.68Å; R443-E509 IonicContact NE-OE1 3.73Å; R443-E509 PolarHBondContact NE-OE1 2.82Å; R443-E509 IonicContact NE-OE2 3.14Å; R443-E509 IonicContact NH2-OE1 3.78Å; R443-E509 PolarHBondContact NH2-OE1 3.45Å; R443-E509 IonicContact NH2-OE2 3.19Å; R443-E509 PolarHBondContact NH2-OE2 2.97Å; R443-L510 HydrophobicContact CB-CD2 4.24Å
444	A	93	Very high	95.6	Very high	46 Å²	46	29 Å²	29	38%	0.38	15%	0.146	S	C	.	.	H	α-helix	trans	-66.4	-49.2	177.4	0	0	0	0	0	111	N442 Q446 R447 D448 L510	N442-A444 VanDerWaalsContact C-N 3.34Å; N442-A444 PolarHBondContact O-N 3.35Å; N442-A444 PolarHBondContact OD1-N 3.09Å; N442-A444 VanDerWaalsContact OD1-N 3.09Å; A444-Q446 VanDerWaalsContact C-N 3.29Å; A444-Q446 PolarHBondContact O-N 3.42Å; A444-R447 WeakPolarHBondContact O-CB 3.43Å; A444-R447 PolarHBondContact O-N 2.74Å; A444-R447 VanDerWaalsContact O-N 3.17Å; A444-D448 PolarHBondContact O-N 3.3Å; A444-L510 HydrophobicContact CB-CD2 4.46Å
445	R	94.9	Very high	95.6	Very high	80 Å²	80	33.1 Å²	33.1	30%	0.302	16%	0.163	S	C	.	.	H	α-helix	trans	-67.1	-29.1	179	-62.9	-61.9	173.2	-178.1	6.2	113.3	E171 E173 H441 N442 D448 K449	E171-R445 HydrophobicContact CG-CG 3.9Å; E173-R445 IonicContact OE1-CZ 2.82Å; E173-R445 IonicContact OE1-NE 3.07Å; E173-R445 PolarHBondContact OE1-NE 3.31Å; E173-R445 IonicContact OE1-NH2 2.9Å; E173-R445 PolarHBondContact OE1-NH2 3.42Å; E173-R445 IonicContact OE2-NH2 3.37Å; H441-R445 HydrophobicContact CB-CB 4.07Å; N442-R445 VanDerWaalsContact ND2-CG 3.33Å; N442-R445 WeakPolarHBondContact ND2-CG 3.26Å; N442-R445 PolarHBondContact O-N 3.02Å; N442-R445 WeakPolarHBondContact OD1-CG 3.1Å; N442-R445 PolarHBondContact OD1-N 2.86Å; R445-D448 PolarHBondContact O-N 3.07Å; R445-K449 WeakPolarHBondContact O-CG 3.45Å; R445-K449 PolarHBondContact O-N 3.21Å; R445-K449 VanDerWaalsContact O-N 3.1Å
446	Q	96.2	Very high	95.6	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.009	18%	0.175	C	C	.	.	H	α-helix	trans	-57.2	-49	170.9	-84.1	178.8	41.6	0	0	111.6	S359 I438 H439 H441 N442 R443 A444 D448 K449 L450	S359-Q446 PolarHBondContact OG-NE2 3.28Å; I438-Q446 HydrophobicContact CG2-CB 4.41Å; I438-Q446 HydrophobicContact CG2-CG 4.13Å; I438-Q446 WeakPolarHBondContact O-CG 3.33Å; H439-Q446 PolarHBondContact O-NE2 3.44Å; H441-Q446 HydrophobicContact CB-CG 4.23Å; H441-Q446 PolarHBondContact O-NE2 2.92Å; N442-Q446 WeakPolarHBondContact O-CG 3.3Å; N442-Q446 PolarHBondContact O-N 3.43Å; R443-Q446 WeakPolarHBondContact O-CB 3.42Å; A444-Q446 VanDerWaalsContact C-N 3.29Å; A444-Q446 PolarHBondContact O-N 3.42Å; Q446-D448 VanDerWaalsContact C-N 3.33Å; Q446-D448 PolarHBondContact O-N 3.21Å; Q446-K449 PolarHBondContact O-N 2.97Å; Q446-L450 WeakPolarHBondContact O-CB 3.33Å; Q446-L450 WeakPolarHBondContact O-CG 3.3Å; Q446-L450 PolarHBondContact O-N 2.93Å
447	R	95.5	Very high	95.7	Very high	28 Å²	28	35.8 Å²	35.8	11%	0.106	18%	0.175	C	C	.	.	H	α-helix	trans	-57.3	-46.8	-179	179.4	175.9	177.7	-79.3	-0.1	112.1	R443 A444 L450 G451 Y503 S506 L510 L512	R443-R447 PolarHBondContact O-N 2.67Å; A444-R447 WeakPolarHBondContact O-CB 3.43Å; A444-R447 PolarHBondContact O-N 2.74Å; A444-R447 VanDerWaalsContact O-N 3.17Å; R447-L450 PolarHBondContact O-N 3.37Å; R447-G451 PolarHBondContact O-N 3.26Å; R447-Y503 HydrophobicContact CG-CD2 4.11Å; R447-Y503 HydrophobicContact CG-CE2 3.93Å; R447-Y503 PolarHBondContact NH2-OH 3.43Å; R447-Y503 WeakPolarHBondContact O-CD2 3.27Å; R447-Y503 WeakPolarHBondContact O-CE2 3.42Å; R447-S506 WeakPolarHBondContact CB-OG 3.45Å; R447-S506 VanDerWaalsContact CD-OG 3.31Å; R447-S506 WeakPolarHBondContact CD-OG 3.21Å; R447-S506 VanDerWaalsContact CG-OG 3.22Å; R447-S506 WeakPolarHBondContact CG-OG 3.46Å; R447-L510 HydrophobicContact CB-CD1 3.89Å; R447-L510 HydrophobicContact CG-CD1 4.5Å; R447-L512 VanDerWaalsContact CZ-CD1 3.46Å
448	D	93.9	Very high	95.8	Very high	71 Å²	71	34 Å²	34	38%	0.38	17%	0.169	S	C	.	.	H	α-helix	trans	-62.4	-48.6	-179.5	-65.2	-16.5	0	0	0	111	A444 R445 Q446 L450 G451 H452	A444-D448 PolarHBondContact O-N 3.3Å; R445-D448 PolarHBondContact O-N 3.07Å; Q446-D448 VanDerWaalsContact C-N 3.33Å; Q446-D448 PolarHBondContact O-N 3.21Å; D448-L450 PolarHBondContact O-N 3.4Å; D448-G451 PolarHBondContact O-N 2.93Å; D448-G451 VanDerWaalsContact O-N 3.15Å; D448-H452 PolarHBondContact O-CD2 3.35Å; D448-H452 VanDerWaalsContact O-CD2 3.24Å; D448-H452 PolarHBondContact O-N 3.48Å
449	K	97.1	Very high	95.8	Very high	63 Å²	63	38 Å²	38	27%	0.274	20%	0.195	S	C	.	.	H	α-helix	trans	-68.9	-31.3	-178.9	-63.7	173.4	-166.6	-88.9	0	112.9	E171 I438 H441 R445 Q446 G451 H452 I453	E171-K449 IonicContact OE1-NZ 3.03Å; I438-K449 HydrophobicContact CD1-CB 3.79Å; I438-K449 HydrophobicContact CG1-CB 3.69Å; I438-K449 HydrophobicContact CG1-CD 4.3Å; I438-K449 HydrophobicContact CG2-CB 4.18Å; H441-K449 WeakPolarHBondContact CE1-CE 3.27Å; H441-K449 WeakPolarHBondContact NE2-CE 3.42Å; R445-K449 WeakPolarHBondContact O-CG 3.45Å; R445-K449 PolarHBondContact O-N 3.21Å; R445-K449 VanDerWaalsContact O-N 3.1Å; Q446-K449 PolarHBondContact O-N 2.97Å; K449-G451 VanDerWaalsContact C-N 3.26Å; K449-G451 PolarHBondContact O-N 3.34Å; K449-H452 PolarHBondContact O-N 3.26Å; K449-I453 PolarHBondContact O-N 3.19Å
450	L	97.4	Very high	95.8	Very high	1 Å²	1	38 Å²	38	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-62.1	-34.7	172.3	-74.7	168.7	0	0	0	111.7	L435 I438 Q446 R447 D448 I453 I499 Q502 Y503	L435-L450 HydrophobicContact CD1-CD2 4.2Å; I438-L450 HydrophobicContact CG2-CD2 4.07Å; I438-L450 HydrophobicContact CG2-CG 4Å; Q446-L450 WeakPolarHBondContact O-CB 3.33Å; Q446-L450 WeakPolarHBondContact O-CG 3.3Å; Q446-L450 PolarHBondContact O-N 2.93Å; R447-L450 PolarHBondContact O-N 3.37Å; D448-L450 PolarHBondContact O-N 3.4Å; L450-I453 WeakPolarHBondContact O-CG2 3.42Å; L450-I499 HydrophobicContact CB-CG2 4.38Å; L450-I499 HydrophobicContact CD2-CG2 3.98Å; L450-Q502 HydrophobicContact CD1-CB 4.27Å; L450-Q502 HydrophobicContact CD1-CG 3.7Å; L450-Y503 HydrophobicContact CB-CD2 4.36Å
451	G	95.4	Very high	96	Very high	9 Å²	9	38.2 Å²	38.2	9%	0.093	20%	0.195	C	C	.	.	H	α-helix	trans	-63.9	-44.3	173.8	0	0	0	0	0	112.2	R447 D448 K449	R447-G451 PolarHBondContact O-N 3.26Å; D448-G451 PolarHBondContact O-N 2.93Å; D448-G451 VanDerWaalsContact O-N 3.15Å; K449-G451 VanDerWaalsContact C-N 3.26Å; K449-G451 PolarHBondContact O-N 3.34Å
452	H	96.3	Very high	96	Very high	128 Å²	128	41.2 Å²	41.2	59%	0.593	21%	0.211	S	C	*	.	H	α-helix	trans	-71.8	-38.6	-178.9	-68.3	-60.8	0	0	0	113.7	D448 K449 L454 E455	D448-H452 PolarHBondContact O-CD2 3.35Å; D448-H452 VanDerWaalsContact O-CD2 3.24Å; D448-H452 PolarHBondContact O-N 3.48Å; K449-H452 PolarHBondContact O-N 3.26Å; H452-L454 PolarHBondContact O-N 2.84Å; H452-L454 VanDerWaalsContact O-N 3.15Å; H452-E455 PolarHBondContact O-N 3.47Å; H452-E455 VanDerWaalsContact O-N 3.14Å
453	I	97.6	Very high	96.1	Very high	8 Å²	8	41.9 Å²	41.9	4%	0.041	21%	0.214	C	C	.	.	H	α-helix	trans	-67.4	-17.1	-176.1	-160.1	162.8	0	0	0	113.3	L435 I438 K449 L450 E455 E456 F457 I499	L435-I453 HydrophobicContact CB-CD1 3.92Å; L435-I453 HydrophobicContact CD1-CD1 4.46Å; I438-I453 HydrophobicContact CD1-CB 3.8Å; I438-I453 HydrophobicContact CD1-CD1 3.51Å; I438-I453 HydrophobicContact CD1-CG1 4.24Å; I438-I453 HydrophobicContact CD1-CG2 3.87Å; K449-I453 PolarHBondContact O-N 3.19Å; L450-I453 WeakPolarHBondContact O-CG2 3.42Å; I453-E455 PolarHBondContact O-N 3.23Å; I453-E456 PolarHBondContact O-N 2.97Å; I453-E456 VanDerWaalsContact O-N 3.16Å; I453-F457 HydrophobicContact CD1-CD2 4.48Å; I453-F457 HydrophobicContact CD1-CE2 4.02Å; I453-F457 HydrophobicContact CG1-CD2 3.9Å; I453-F457 HydrophobicContact CG1-CE2 3.94Å; I453-F457 PolarHBondContact O-N 2.99Å; I453-F457 VanDerWaalsContact O-N 3.08Å; I453-I499 HydrophobicContact CG2-CD1 4.32Å; I453-I499 HydrophobicContact CG2-CG2 4.07Å
454	L	96.9	Very high	96.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59.9	-30.3	173	-72.7	171	0	0	0	112.5	H452 F457 A458 I499 M500 P622 F623 V626	H452-L454 PolarHBondContact O-N 2.84Å; H452-L454 VanDerWaalsContact O-N 3.15Å; L454-F457 PolarHBondContact O-N 3.09Å; L454-A458 WeakPolarHBondContact O-CB 3.45Å; L454-A458 PolarHBondContact O-N 3.31Å; L454-I499 HydrophobicContact CD2-CB 3.94Å; L454-I499 HydrophobicContact CD2-CG2 3.51Å; L454-I499 HydrophobicContact CG-CG2 3.8Å; L454-M500 HydrophobicContact CD1-CG 4.25Å; L454-M500 HydrophobicContact CD2-CG 3.82Å; L454-P622 HydrophobicContact CD1-CB 4.32Å; L454-F623 HydrophobicContact CD1-CD1 3.67Å; L454-F623 HydrophobicContact CD1-CE1 3.91Å; L454-V626 HydrophobicContact CB-CG2 4.12Å; L454-V626 HydrophobicContact CD2-CG2 4.13Å
455	E	96.1	Very high	96.4	Very high	117 Å²	117	42.6 Å²	42.6	55%	0.547	21%	0.21	S	C	.	.	H	α-helix	trans	-65.2	-41.8	174.9	-65.3	175.9	-162.4	0	0	111.9	H452 I453 A458 T459	H452-E455 PolarHBondContact O-N 3.47Å; H452-E455 VanDerWaalsContact O-N 3.14Å; I453-E455 PolarHBondContact O-N 3.23Å; E455-A458 PolarHBondContact O-N 3.36Å; E455-T459 PolarHBondContact O-N 3.36Å; E455-T459 PolarHBondContact O-OG1 3.37Å; E455-T459 VanDerWaalsContact O-OG1 3.05Å
456	E	96.7	Very high	96.5	Very high	63 Å²	63	44.8 Å²	44.8	29%	0.294	22%	0.222	S	C	.	.	H	α-helix	trans	-66.6	-43.2	176.1	-65	-165	-163.6	0	0	111.1	R430 P431 I453 T459 L460	R430-E456 IonicContact NE-OE1 3.33Å; R430-E456 IonicContact NE-OE2 3.22Å; R430-E456 IonicContact NH2-OE1 3.63Å; P431-E456 HydrophobicContact CB-CB 4.47Å; P431-E456 HydrophobicContact CG-CB 4.33Å; I453-E456 PolarHBondContact O-N 2.97Å; I453-E456 VanDerWaalsContact O-N 3.16Å; E456-T459 PolarHBondContact O-N 3.03Å; E456-L460 PolarHBondContact O-N 3.3Å
457	F	97.8	Very high	96.5	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-73.7	-26	178.4	-84.9	-102.9	0	0	0	113.7	P431 F432 L435 I453 L454 L460 Q461 V492 H495 N496 I499	P431-F457 HydrophobicContact CB-CD2 4.04Å; P431-F457 HydrophobicContact CB-CE2 3.64Å; P431-F457 HydrophobicContact CB-CZ 4.1Å; F432-F457 HydrophobicContact CD1-CZ 4.45Å; F432-F457 HydrophobicContact CD2-CZ 4.36Å; F432-F457 HydrophobicContact CE1-CE1 4.32Å; F432-F457 HydrophobicContact CE1-CZ 4.35Å; F432-F457 HydrophobicContact CE2-CE1 4.02Å; F432-F457 HydrophobicContact CE2-CZ 4.25Å; F432-F457 HydrophobicContact CG-CZ 4.47Å; F432-F457 AromaticContact CZ-CE1 3.89Å; F432-F457 HydrophobicContact CZ-CE1 3.89Å; F432-F457 HydrophobicContact CZ-CZ 4.25Å; L435-F457 HydrophobicContact CB-CE2 4.37Å; L435-F457 HydrophobicContact CB-CZ 4.42Å; L435-F457 HydrophobicContact CD2-CE2 4.44Å; L435-F457 HydrophobicContact CD2-CZ 3.91Å; I453-F457 HydrophobicContact CD1-CD2 4.48Å; I453-F457 HydrophobicContact CD1-CE2 4.02Å; I453-F457 HydrophobicContact CG1-CD2 3.9Å; I453-F457 HydrophobicContact CG1-CE2 3.94Å; I453-F457 PolarHBondContact O-N 2.99Å; I453-F457 VanDerWaalsContact O-N 3.08Å; L454-F457 PolarHBondContact O-N 3.09Å; F457-L460 PolarHBondContact O-N 3.45Å; F457-Q461 WeakPolarHBondContact O-CB 3.49Å; F457-Q461 PolarHBondContact O-N 2.92Å; F457-V492 HydrophobicContact CD1-CG1 4.43Å; F457-H495 HydrophobicContact CD1-CB 4.03Å; F457-H495 HydrophobicContact CE1-CB 3.65Å; F457-N496 WeakPolarHBondContact CB-OD1 3.3Å; F457-N496 PolarHBondContact O-ND2 2.92Å; F457-I499 HydrophobicContact CD1-CD1 4.15Å; F457-I499 HydrophobicContact CD2-CD1 3.86Å; F457-I499 HydrophobicContact CE1-CD1 4.23Å; F457-I499 HydrophobicContact CE2-CD1 3.92Å; F457-I499 HydrophobicContact CG-CD1 3.97Å; F457-I499 HydrophobicContact CZ-CD1 4.11Å
458	A	96.3	Very high	96.5	Very high	17 Å²	17	44.2 Å²	44.2	14%	0.14	22%	0.221	C	C	.	.	H	α-helix	trans	-66.3	-41.7	170.8	0	0	0	0	0	111.2	L454 E455 L460 Q461 D462 S625 V626	L454-A458 WeakPolarHBondContact O-CB 3.45Å; L454-A458 PolarHBondContact O-N 3.31Å; E455-A458 PolarHBondContact O-N 3.36Å; A458-L460 VanDerWaalsContact C-N 3.32Å; A458-L460 PolarHBondContact O-N 2.94Å; A458-Q461 WeakPolarHBondContact O-CB 3.44Å; A458-Q461 PolarHBondContact O-N 2.94Å; A458-D462 PolarHBondContact O-N 3.31Å; A458-S625 WeakPolarHBondContact CB-O 3.5Å; A458-V626 HydrophobicContact CB-CG2 4.38Å
459	T	96.7	Very high	96.6	Very high	96 Å²	96	43.2 Å²	43.2	59%	0.589	22%	0.223	S	C	*	.	H	α-helix	trans	-61.5	-43.2	173.1	-55.5	0	0	0	0	110.9	E455 E456 Q461 D462 E463	E455-T459 PolarHBondContact O-N 3.36Å; E455-T459 PolarHBondContact O-OG1 3.37Å; E455-T459 VanDerWaalsContact O-OG1 3.05Å; E456-T459 PolarHBondContact O-N 3.03Å; T459-Q461 VanDerWaalsContact C-N 3.29Å; T459-Q461 PolarHBondContact O-N 3.32Å; T459-D462 PolarHBondContact O-N 2.97Å; T459-E463 PolarHBondContact O-N 3.27Å; T459-E463 VanDerWaalsContact O-N 3.11Å
460	L	97.3	Very high	96.5	Very high	5 Å²	5	41.8 Å²	41.8	3%	0.026	22%	0.223	C	C	.	.	H	α-helix	trans	-64.8	-33	177.6	-169.4	64.6	0	0	0	112.6	F424 F432 E456 F457 A458 A464 V492	F424-L460 HydrophobicContact CD2-CD1 4.15Å; F424-L460 HydrophobicContact CE2-CD1 3.58Å; F424-L460 HydrophobicContact CE2-CG 4.1Å; F424-L460 HydrophobicContact CZ-CD1 4.25Å; F424-L460 HydrophobicContact CZ-CG 4.48Å; F432-L460 HydrophobicContact CE2-CD2 4.2Å; E456-L460 PolarHBondContact O-N 3.3Å; F457-L460 PolarHBondContact O-N 3.45Å; A458-L460 VanDerWaalsContact C-N 3.32Å; A458-L460 PolarHBondContact O-N 2.94Å; L460-A464 VanDerWaalsContact O-CB 3.3Å; L460-A464 WeakPolarHBondContact O-CB 3.35Å; L460-A464 PolarHBondContact O-N 2.93Å; L460-V492 HydrophobicContact CB-CG1 4.18Å; L460-V492 HydrophobicContact CD2-CG1 4.18Å; L460-V492 HydrophobicContact CD2-CG2 4.09Å; L460-V492 HydrophobicContact CG-CG1 4.11Å; L460-V492 HydrophobicContact CG-CG2 4Å
461	Q	97.2	Very high	96.4	Very high	9 Å²	9	41.8 Å²	41.8	4%	0.042	22%	0.223	C	C	.	.	H	α-helix	trans	-64.3	-47.8	176.6	-178.1	66	41.7	0	0	111.3	F457 A458 T459 E463 A464 E465 G489 V492 L493	F457-Q461 WeakPolarHBondContact O-CB 3.49Å; F457-Q461 PolarHBondContact O-N 2.92Å; A458-Q461 WeakPolarHBondContact O-CB 3.44Å; A458-Q461 PolarHBondContact O-N 2.94Å; T459-Q461 VanDerWaalsContact C-N 3.29Å; T459-Q461 PolarHBondContact O-N 3.32Å; Q461-E463 PolarHBondContact O-N 2.99Å; Q461-A464 PolarHBondContact O-N 3.5Å; Q461-E465 PolarHBondContact NE2-OE1 3.46Å; Q461-E465 WeakPolarHBondContact O-CG 3.48Å; Q461-E465 PolarHBondContact O-N 3.22Å; Q461-G489 PolarHBondContact NE2-O 3.48Å; Q461-G489 PolarHBondContact OE1-O 2.87Å; Q461-V492 HydrophobicContact CB-CG1 4.04Å; Q461-L493 VanDerWaalsContact OE1-CA 3.31Å
462	D	96.1	Very high	96.4	Very high	69 Å²	69	42.8 Å²	42.8	37%	0.369	23%	0.225	S	C	.	.	H	α-helix	trans	-62.3	-41.7	177	172.3	63.7	0	0	0	111.7	A458 T459 E465 K466	A458-D462 PolarHBondContact O-N 3.31Å; T459-D462 PolarHBondContact O-N 2.97Å; D462-E465 PolarHBondContact O-N 3.16Å; D462-K466 WeakPolarHBondContact O-CG 3.31Å; D462-K466 PolarHBondContact O-N 3.06Å; D462-K466 VanDerWaalsContact O-N 3.16Å; D462-K466 VanDerWaalsContact OD1-CE 3.25Å; D462-K466 WeakPolarHBondContact OD1-CE 3.25Å; D462-K466 IonicContact OD1-NZ 2.87Å; D462-K466 PolarHBondContact OD1-NZ 3.23Å; D462-K466 WeakPolarHBondContact OD2-CE 3.3Å; D462-K466 IonicContact OD2-NZ 2.79Å; D462-K466 PolarHBondContact OD2-NZ 3.22Å
463	E	97.2	Very high	96.3	Very high	42 Å²	42	39.9 Å²	39.9	20%	0.196	22%	0.219	C	C	.	.	H	α-helix	trans	-61.9	-45.9	173.8	-172.2	-179.8	164.2	0	0	111.8	F424 H427 T459 Q461 E465 K466 V467	F424-E463 HydrophobicContact CD2-CG 4.09Å; H427-E463 IonicContact CE1-OE1 2.7Å; H427-E463 IonicContact CG-OE1 3.24Å; H427-E463 IonicContact CG-OE2 2.8Å; H427-E463 VanDerWaalsContact ND1-CD 3.3Å; H427-E463 IonicContact ND1-OE1 3.37Å; H427-E463 PolarHBondContact ND1-OE1 3.05Å; H427-E463 IonicContact ND1-OE2 2.81Å; H427-E463 PolarHBondContact ND1-OE2 2.9Å; T459-E463 PolarHBondContact O-N 3.27Å; T459-E463 VanDerWaalsContact O-N 3.11Å; Q461-E463 PolarHBondContact O-N 2.99Å; E463-E465 VanDerWaalsContact C-N 3.3Å; E463-E465 PolarHBondContact O-N 2.98Å; E463-K466 PolarHBondContact O-N 3.27Å; E463-V467 HydrophobicContact CG-CG2 4.31Å; E463-V467 WeakPolarHBondContact O-CG2 3.3Å; E463-V467 PolarHBondContact O-N 3.17Å
464	A	97.2	Very high	96.1	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58.8	-42	179.9	0	0	0	0	0	112.1	F424 L460 Q461 V467 D468 L488 V492	F424-A464 HydrophobicContact CE2-CB 3.62Å; F424-A464 HydrophobicContact CZ-CB 3.81Å; L460-A464 VanDerWaalsContact O-CB 3.3Å; L460-A464 WeakPolarHBondContact O-CB 3.35Å; L460-A464 PolarHBondContact O-N 2.93Å; Q461-A464 PolarHBondContact O-N 3.5Å; A464-V467 PolarHBondContact O-N 2.93Å; A464-D468 WeakPolarHBondContact O-CB 3.4Å; A464-D468 PolarHBondContact O-N 3.46Å; A464-L488 HydrophobicContact CB-CB 3.95Å; A464-V492 HydrophobicContact CB-CB 4.49Å; A464-V492 HydrophobicContact CB-CG2 3.9Å
465	E	95.4	Very high	95.8	Very high	86 Å²	86	40.9 Å²	40.9	40%	0.402	22%	0.224	S	C	.	.	H	α-helix	trans	-65.6	-41.1	178.1	-72	174.8	-166.6	0	0	112.1	Q461 D462 E463 D468 A469	Q461-E465 PolarHBondContact NE2-OE1 3.46Å; Q461-E465 WeakPolarHBondContact O-CG 3.48Å; Q461-E465 PolarHBondContact O-N 3.22Å; D462-E465 PolarHBondContact O-N 3.16Å; E463-E465 VanDerWaalsContact C-N 3.3Å; E463-E465 PolarHBondContact O-N 2.98Å; E465-D468 PolarHBondContact O-N 3.49Å; E465-A469 WeakPolarHBondContact O-CB 3.41Å; E465-A469 PolarHBondContact O-N 3.36Å
466	K	95.8	Very high	95.6	Very high	127 Å²	127	38.7 Å²	38.7	55%	0.552	22%	0.216	S	C	*	.	H	α-helix	trans	-63.6	-44	174.9	-72.1	167.8	-179.2	166.5	0	111.9	D462 E463 A469 A470	D462-K466 WeakPolarHBondContact O-CG 3.31Å; D462-K466 PolarHBondContact O-N 3.06Å; D462-K466 VanDerWaalsContact O-N 3.16Å; D462-K466 VanDerWaalsContact OD1-CE 3.25Å; D462-K466 WeakPolarHBondContact OD1-CE 3.25Å; D462-K466 IonicContact OD1-NZ 2.87Å; D462-K466 PolarHBondContact OD1-NZ 3.23Å; D462-K466 WeakPolarHBondContact OD2-CE 3.3Å; D462-K466 IonicContact OD2-NZ 2.79Å; D462-K466 PolarHBondContact OD2-NZ 3.22Å; E463-K466 PolarHBondContact O-N 3.27Å; K466-A469 PolarHBondContact O-N 2.91Å; K466-A470 PolarHBondContact O-N 3.45Å
467	V	96.8	Very high	95.2	Very high	14 Å²	14	44.2 Å²	44.2	9%	0.085	24%	0.239	C	C	.	.	H	α-helix	trans	-66.6	-43.8	178.5	175.4	0	0	0	0	110.8	F424 E463 A464 A469 A470 L471 L488	F424-V467 HydrophobicContact CB-CG2 4.39Å; E463-V467 HydrophobicContact CG-CG2 4.31Å; E463-V467 WeakPolarHBondContact O-CG2 3.3Å; E463-V467 PolarHBondContact O-N 3.17Å; A464-V467 PolarHBondContact O-N 2.93Å; V467-A469 VanDerWaalsContact C-N 3.35Å; V467-A469 PolarHBondContact O-N 3.18Å; V467-A470 PolarHBondContact O-N 3.04Å; V467-L471 HydrophobicContact CG1-CD1 3.71Å; V467-L471 HydrophobicContact CG1-CG 4.17Å; V467-L471 WeakPolarHBondContact O-CB 3.39Å; V467-L471 VanDerWaalsContact O-CG 3.31Å; V467-L471 WeakPolarHBondContact O-CG 3.43Å; V467-L471 PolarHBondContact O-N 3.25Å; V467-L488 HydrophobicContact CB-CD1 4.01Å; V467-L488 HydrophobicContact CG1-CD1 3.49Å; V467-L488 VanDerWaalsContact CG1-CD1 3.49Å
468	D	96.1	Very high	94.7	Very high	3 Å²	3	49.3 Å²	49.3	2%	0.016	26%	0.262	C	S	.	.	H	α-helix	trans	-58.3	-45.4	174.3	-87.9	-30.3	0	0	0	111.5	A464 E465 A470 L471 H472 H484 A486 C487 L488 G489	A464-D468 WeakPolarHBondContact O-CB 3.4Å; A464-D468 PolarHBondContact O-N 3.46Å; E465-D468 PolarHBondContact O-N 3.49Å; D468-A470 PolarHBondContact O-N 3.47Å; D468-L471 PolarHBondContact O-N 2.93Å; D468-H472 WeakPolarHBondContact O-CB 3.49Å; D468-H472 PolarHBondContact O-N 3.26Å; D468-H484 IonicContact OD1-CE1 3.37Å; D468-H484 PolarHBondContact OD1-CE1 3.4Å; D468-H484 IonicContact OD1-ND1 2.85Å; D468-H484 PolarHBondContact OD1-ND1 3.24Å; D468-H484 VanDerWaalsContact OD1-ND1 3.15Å; D468-A486 WeakPolarHBondContact OD2-CA 3.42Å; D468-C487 PolarHBondContact OD1-N 2.99Å; D468-C487 PolarHBondContact OD2-N 2.91Å; D468-L488 WeakPolarHBondContact OD1-CG 3.22Å; D468-L488 PolarHBondContact OD1-N 3Å; D468-L488 VanDerWaalsContact OD1-N 3.11Å; D468-L488 PolarHBondContact OD2-N 2.86Å; D468-G489 PolarHBondContact OD2-N 2.71Å
469	A	95.8	Very high	94.2	Very high	51 Å²	51	50.7 Å²	50.7	42%	0.421	27%	0.266	S	S	.	.	H	α-helix	trans	-62.5	-42	178.9	0	0	0	0	0	112.5	E465 K466 V467 S473	E465-A469 WeakPolarHBondContact O-CB 3.41Å; E465-A469 PolarHBondContact O-N 3.36Å; K466-A469 PolarHBondContact O-N 2.91Å; V467-A469 VanDerWaalsContact C-N 3.35Å; V467-A469 PolarHBondContact O-N 3.18Å; A469-S473 WeakPolarHBondContact O-CB 3.44Å; A469-S473 PolarHBondContact O-N 3.44Å; A469-S473 PolarHBondContact O-OG 3.14Å
470	A	95.4	Very high	93.5	Very high	33 Å²	33	50.6 Å²	50.6	27%	0.273	27%	0.267	S	S	.	.	H	α-helix	trans	-64.6	-50.7	176.6	0	0	0	0	0	111.5	Y420 K466 V467 D468 H472 S473 M474	Y420-A470 HydrophobicContact CD2-CB 4.4Å; Y420-A470 HydrophobicContact CE2-CB 4.08Å; K466-A470 PolarHBondContact O-N 3.45Å; V467-A470 PolarHBondContact O-N 3.04Å; D468-A470 PolarHBondContact O-N 3.47Å; A470-H472 VanDerWaalsContact C-N 3.34Å; A470-H472 PolarHBondContact O-N 3.32Å; A470-S473 PolarHBondContact O-N 3.4Å; A470-M474 WeakPolarHBondContact O-CG 3.43Å; A470-M474 PolarHBondContact O-N 2.87Å
471	L	95.1	Very high	92.8	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-63.5	-39.3	179.3	-69.7	175.5	0	0	0	111.8	V404 A417 Y420 V467 D468 M474 L475	V404-L471 HydrophobicContact CB-CD1 4.19Å; V404-L471 HydrophobicContact CG1-CD1 4.01Å; V404-L471 HydrophobicContact CG2-CD1 4.35Å; V404-L471 HydrophobicContact CG2-CD2 4.01Å; A417-L471 HydrophobicContact CB-CD2 3.76Å; Y420-L471 HydrophobicContact CD2-CD2 4.27Å; V467-L471 HydrophobicContact CG1-CD1 3.71Å; V467-L471 HydrophobicContact CG1-CG 4.17Å; V467-L471 WeakPolarHBondContact O-CB 3.39Å; V467-L471 VanDerWaalsContact O-CG 3.31Å; V467-L471 WeakPolarHBondContact O-CG 3.43Å; V467-L471 PolarHBondContact O-N 3.25Å; D468-L471 PolarHBondContact O-N 2.93Å; L471-M474 PolarHBondContact O-N 3.43Å; L471-L475 WeakPolarHBondContact O-CB 3.36Å; L471-L475 PolarHBondContact O-N 3.44Å
472	H	94.4	Very high	92.1	Very high	30 Å²	30	59.6 Å²	59.6	14%	0.139	31%	0.309	C	S	.	.	H	α-helix	trans	-63.2	-44.4	176.2	-175.6	46	0	0	0	112	D468 A470 M474 L475 L476 H484	D468-H472 WeakPolarHBondContact O-CB 3.49Å; D468-H472 PolarHBondContact O-N 3.26Å; A470-H472 VanDerWaalsContact C-N 3.34Å; A470-H472 PolarHBondContact O-N 3.32Å; H472-M474 VanDerWaalsContact C-N 3.28Å; H472-M474 PolarHBondContact O-N 2.95Å; H472-L475 PolarHBondContact O-N 2.91Å; H472-L476 WeakPolarHBondContact NE2-CD1 3.4Å; H472-L476 WeakPolarHBondContact O-CG 3.45Å; H472-L476 PolarHBondContact O-N 3.42Å; H472-H484 HydrophobicContact CB-CB 4.27Å; H472-H484 PolarHBondContact ND1-N 3.25Å
473	S	93.6	Very high	91.6	Very high	67 Å²	67	62.9 Å²	62.9	47%	0.469	32%	0.322	S	S	.	.	H	α-helix	trans	-62.6	-35.6	176.9	-60.9	0	0	0	0	112.4	A469 A470 K477	A469-S473 WeakPolarHBondContact O-CB 3.44Å; A469-S473 PolarHBondContact O-N 3.44Å; A469-S473 PolarHBondContact O-OG 3.14Å; A470-S473 PolarHBondContact O-N 3.4Å; S473-K477 WeakPolarHBondContact O-CG 3.38Å
474	M	93.7	Very high	91	Very high	29 Å²	29	60.9 Å²	60.9	14%	0.143	31%	0.312	C	S	.	.	H	α-helix	trans	-70.4	-43.1	173.6	-67.4	173.9	73.6	0	0	111.7	L411 N414 Q416 A417 Y420 A470 L471 H472 K477	L411-M474 HydrophobicContact CD1-CB 4.29Å; L411-M474 HydrophobicContact CD2-CB 4.06Å; N414-M474 WeakPolarHBondContact OD1-CE 3.36Å; Q416-M474 HydrophobicContact CB-CE 4.07Å; Q416-M474 HydrophobicContact CG-CE 4.2Å; A417-M474 HydrophobicContact CB-CE 4.15Å; Y420-M474 HydrophobicContact CD2-SD 4.3Å; Y420-M474 HydrophobicContact CE2-SD 3.96Å; A470-M474 WeakPolarHBondContact O-CG 3.43Å; A470-M474 PolarHBondContact O-N 2.87Å; L471-M474 PolarHBondContact O-N 3.43Å; H472-M474 VanDerWaalsContact C-N 3.28Å; H472-M474 PolarHBondContact O-N 2.95Å; M474-K477 PolarHBondContact O-N 3.44Å
475	L	91.6	Very high	90.3	Very high	0 Å²	0	66 Å²	66	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-64.9	-45.8	-177.8	-173.2	61	0	0	0	111.6	P403 L411 L471 H472 K477 Q478 E479 R482 H484	P403-L475 HydrophobicContact CB-CD2 4.06Å; P403-L475 HydrophobicContact CG-CD2 4.22Å; L411-L475 HydrophobicContact CD1-CB 3.83Å; L411-L475 HydrophobicContact CD1-CD1 4.12Å; L411-L475 HydrophobicContact CG-CD1 4.09Å; L471-L475 WeakPolarHBondContact O-CB 3.36Å; L471-L475 PolarHBondContact O-N 3.44Å; H472-L475 PolarHBondContact O-N 2.91Å; L475-K477 PolarHBondContact O-N 3.05Å; L475-K477 VanDerWaalsContact O-N 3.15Å; L475-Q478 PolarHBondContact O-N 3.41Å; L475-E479 HydrophobicContact CD1-CB 3.96Å; L475-E479 HydrophobicContact CD1-CG 4.46Å; L475-E479 HydrophobicContact CG-CB 4.49Å; L475-E479 CarbonylContact O-C 3.19Å; L475-E479 PolarHBondContact O-N 2.91Å; L475-R482 HydrophobicContact CD2-CB 4.07Å; L475-R482 HydrophobicContact CD2-CG 4.02Å; L475-R482 WeakPolarHBondContact CD2-O 3.46Å; L475-R482 HydrophobicContact CG-CB 4.43Å; L475-H484 HydrophobicContact CD2-CB 3.9Å
476	L	91.1	Very high	89.9	Confident	71 Å²	71	63.5 Å²	63.5	37%	0.372	33%	0.334	S	S	.	.	H	α-helix	trans	-59.9	-28.4	-178.7	-77	-179.7	0	0	0	113.5	H472 Q478 P480	H472-L476 WeakPolarHBondContact NE2-CD1 3.4Å; H472-L476 WeakPolarHBondContact O-CG 3.45Å; H472-L476 PolarHBondContact O-N 3.42Å; L476-Q478 VanDerWaalsContact C-N 3.27Å; L476-Q478 PolarHBondContact O-N 3.42Å; L476-P480 WeakPolarHBondContact O-CG 3.24Å
477	K	89.4	Confident	89.7	Confident	180 Å²	180	57.8 Å²	57.8	78%	0.783	31%	0.309	S	S	*	.	H	α-helix	trans	-69.1	-25.4	176.5	-69.1	175.9	-176.3	-179.9	0	112.9	S473 M474 L475	S473-K477 WeakPolarHBondContact O-CG 3.38Å; M474-K477 PolarHBondContact O-N 3.44Å; L475-K477 PolarHBondContact O-N 3.05Å; L475-K477 VanDerWaalsContact O-N 3.15Å
478	Q	86.1	Confident	89.7	Confident	106 Å²	106	57.1 Å²	57.1	50%	0.495	31%	0.305	S	S	.	.	H	α-helix	trans	-114	-39.6	-172.9	-61.8	-173.1	6.8	0	0	112.9	C410 L475 L476	C410-Q478 HydrophobicContact CB-CB 4.41Å; C410-Q478 VanDerWaalsContact CB-OE1 3.31Å; C410-Q478 PolarHBondContact SG-OE1 3.14Å; L475-Q478 PolarHBondContact O-N 3.41Å; L476-Q478 VanDerWaalsContact C-N 3.27Å; L476-Q478 PolarHBondContact O-N 3.42Å
479	E	86.1	Confident	89.7	Confident	46 Å²	46	57.2 Å²	57.2	22%	0.215	31%	0.307	C	S	.	.			trans	-129.9	77.8	178.9	-68.8	-180	-163.2	0	0	109.9	C410 L475 Q481 R482	C410-E479 HydrophobicContact CB-CG 4.4Å; C410-E479 WeakPolarHBondContact CB-OE1 3.38Å; C410-E479 PolarHBondContact N-OE1 3.43Å; C410-E479 PolarHBondContact SG-OE1 3.29Å; L475-E479 HydrophobicContact CD1-CB 3.96Å; L475-E479 HydrophobicContact CD1-CG 4.46Å; L475-E479 HydrophobicContact CG-CB 4.49Å; L475-E479 CarbonylContact O-C 3.19Å; L475-E479 PolarHBondContact O-N 2.91Å; E479-Q481 PolarHBondContact O-N 3.04Å; E479-R482 HydrophobicContact CB-CB 4.12Å; E479-R482 PolarHBondContact O-N 3.14Å; E479-R482 WeakPolarHBondContact OE2-CD 3.33Å; E479-R482 IonicContact OE2-NH1 3.13Å; E479-R482 PolarHBondContact OE2-NH1 3.05Å
480	P	82.3	Confident	89.7	Confident	94 Å²	94	54.9 Å²	54.9	61%	0.61	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-21.7	-175.9	-22.9	31.6	0	0	0	114.7	L476 R482	L476-P480 WeakPolarHBondContact O-CG 3.24Å; P480-R482 VanDerWaalsContact C-N 3.3Å
481	Q	81.6	Confident	89.8	Confident	195 Å²	195	53.3 Å²	53.3	91%	0.911	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-4.6	-179.7	-55.8	-161.8	11.8	0	0	113.3	E479	E479-Q481 PolarHBondContact O-N 3.04Å
482	R	84.4	Confident	89.9	Confident	8 Å²	8	53.3 Å²	53.3	3%	0.03	28%	0.275	C	S	.	.			trans	-118.1	136.7	-177.6	-161.9	176.2	-175.3	-176	-7.3	110.8	P403 S406 L475 E479 P480 E547 I550	P403-R482 HydrophobicContact CG-CG 4.44Å; S406-R482 VanDerWaalsContact CB-NH2 3.26Å; S406-R482 PolarHBondContact OG-NH2 3.28Å; L475-R482 HydrophobicContact CD2-CB 4.07Å; L475-R482 HydrophobicContact CD2-CG 4.02Å; L475-R482 WeakPolarHBondContact CD2-O 3.46Å; L475-R482 HydrophobicContact CG-CB 4.43Å; E479-R482 HydrophobicContact CB-CB 4.12Å; E479-R482 PolarHBondContact O-N 3.14Å; E479-R482 WeakPolarHBondContact OE2-CD 3.33Å; E479-R482 IonicContact OE2-NH1 3.13Å; E479-R482 PolarHBondContact OE2-NH1 3.05Å; P480-R482 VanDerWaalsContact C-N 3.3Å; R482-E547 IonicContact CZ-OE1 2.83Å; R482-E547 IonicContact CZ-OE2 2.64Å; R482-E547 IonicContact NE-OE2 3.06Å; R482-E547 PolarHBondContact NE-OE2 3.25Å; R482-E547 VanDerWaalsContact NE-OE2 3.14Å; R482-E547 IonicContact NH2-OE1 2.85Å; R482-E547 PolarHBondContact NH2-OE1 3.02Å; R482-E547 IonicContact NH2-OE2 2.74Å; R482-E547 PolarHBondContact NH2-OE2 2.51Å; R482-I550 HydrophobicContact CG-CD1 4.08Å
483	Q	83.6	Confident	90.1	Very high	138 Å²	138	52 Å²	52	65%	0.645	27%	0.269	S	S	*	.			trans	-115.1	141.2	-175.3	-62.5	-178.7	-10.9	0	0	110.7	P403	P403-Q483 VanDerWaalsContact CG-O 3.29Å; P403-Q483 WeakPolarHBondContact CG-O 3.35Å
484	H	84.6	Confident	90.3	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.247	C	C	.	.			trans	-118.8	25.9	172.3	-160.9	-60.6	0	0	0	110	P403 V404 D468 H472 L475 A486	P403-H484 VanDerWaalsContact CD-CD2 3.47Å; P403-H484 WeakPolarHBondContact CD-CD2 3.43Å; P403-H484 HydrophobicContact CG-CB 4.28Å; V404-H484 VanDerWaalsContact CG1-NE2 3.33Å; V404-H484 WeakPolarHBondContact CG1-NE2 3.4Å; D468-H484 IonicContact OD1-CE1 3.37Å; D468-H484 PolarHBondContact OD1-CE1 3.4Å; D468-H484 IonicContact OD1-ND1 2.85Å; D468-H484 PolarHBondContact OD1-ND1 3.24Å; D468-H484 VanDerWaalsContact OD1-ND1 3.15Å; H472-H484 HydrophobicContact CB-CB 4.27Å; H472-H484 PolarHBondContact ND1-N 3.25Å; L475-H484 HydrophobicContact CD2-CB 3.9Å; H484-A486 PolarHBondContact O-N 3.44Å
485	L	82.4	Confident	90.5	Very high	107 Å²	107	47.7 Å²	47.7	56%	0.56	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.2	128.4	-174.8	-170.2	69.2	0	0	0	110	C487	L485-C487 PolarHBondContact O-N 3.24Å
486	A	87.4	Confident	90.8	Very high	35 Å²	35	47.7 Å²	47.7	29%	0.289	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	26.3	173.6	0	0	0	0	0	115.3	D468 H484 T490	D468-A486 WeakPolarHBondContact OD2-CA 3.42Å; H484-A486 PolarHBondContact O-N 3.44Å; A486-T490 WeakPolarHBondContact O-CB 3.35Å; A486-T490 PolarHBondContact O-N 3.03Å; A486-T490 VanDerWaalsContact O-N 3.07Å; A486-T490 PolarHBondContact O-OG1 2.73Å
487	C	92.4	Very high	91.1	Very high	6 Å²	6	44.3 Å²	44.3	4%	0.041	22%	0.223	C	C	.	.	H	α-helix	trans	-68.4	-57.3	176.2	-65.8	0	0	0	0	111.1	P402 D468 L485 W491	P402-C487 HydrophobicContact CB-CB 3.97Å; D468-C487 PolarHBondContact OD1-N 2.99Å; D468-C487 PolarHBondContact OD2-N 2.91Å; L485-C487 PolarHBondContact O-N 3.24Å; C487-W491 PolarHBondContact O-N 2.87Å
488	L	96.3	Very high	91.5	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-68.6	-42.4	179.9	-55.5	179.5	0	0	0	110.4	L396 I421 F424 A464 V467 D468 T490 W491 V492	L396-L488 HydrophobicContact CD1-CD2 4.14Å; L396-L488 HydrophobicContact CD2-CD2 3.79Å; I421-L488 HydrophobicContact CD1-CD1 4.02Å; I421-L488 HydrophobicContact CD1-CD2 3.92Å; F424-L488 HydrophobicContact CD1-CD1 3.89Å; F424-L488 HydrophobicContact CD1-CD2 4.33Å; F424-L488 HydrophobicContact CE1-CB 4.11Å; F424-L488 HydrophobicContact CE1-CD1 4.04Å; F424-L488 HydrophobicContact CE1-CD2 4Å; F424-L488 HydrophobicContact CE1-CG 4.27Å; F424-L488 HydrophobicContact CG-CD1 4.32Å; F424-L488 HydrophobicContact CZ-CB 4.2Å; A464-L488 HydrophobicContact CB-CB 3.95Å; V467-L488 HydrophobicContact CB-CD1 4.01Å; V467-L488 HydrophobicContact CG1-CD1 3.49Å; V467-L488 VanDerWaalsContact CG1-CD1 3.49Å; D468-L488 WeakPolarHBondContact OD1-CG 3.22Å; D468-L488 PolarHBondContact OD1-N 3Å; D468-L488 VanDerWaalsContact OD1-N 3.11Å; D468-L488 PolarHBondContact OD2-N 2.86Å; L488-T490 VanDerWaalsContact C-N 3.31Å; L488-T490 PolarHBondContact O-N 3.14Å; L488-W491 WeakPolarHBondContact O-CB 3.28Å; L488-W491 PolarHBondContact O-N 2.86Å; L488-W491 VanDerWaalsContact O-N 3.08Å; L488-V492 PolarHBondContact O-N 3.22Å
489	G	96.1	Very high	92.1	Very high	5 Å²	5	33.5 Å²	33.5	5%	0.052	17%	0.173	C	C	.	.	H	α-helix	trans	-60.9	-36.3	178.1	0	0	0	0	0	113.1	Q461 D468 L493	Q461-G489 PolarHBondContact NE2-O 3.48Å; Q461-G489 PolarHBondContact OE1-O 2.87Å; D468-G489 PolarHBondContact OD2-N 2.71Å; G489-L493 WeakPolarHBondContact O-CB 3.4Å; G489-L493 PolarHBondContact O-N 3.06Å
490	T	96.6	Very high	92.7	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.018	16%	0.163	C	C	.	.	H	α-helix	trans	-67	-37.4	174.4	-65	0	0	0	0	111.7	V400 A486 L488 Y494 T536 R539 A540	V400-T490 HydrophobicContact CG1-CG2 4.13Å; A486-T490 WeakPolarHBondContact O-CB 3.35Å; A486-T490 PolarHBondContact O-N 3.03Å; A486-T490 VanDerWaalsContact O-N 3.07Å; A486-T490 PolarHBondContact O-OG1 2.73Å; L488-T490 VanDerWaalsContact C-N 3.31Å; L488-T490 PolarHBondContact O-N 3.14Å; T490-Y494 WeakPolarHBondContact O-CB 3.07Å; T490-Y494 PolarHBondContact O-N 3.02Å; T490-Y494 VanDerWaalsContact O-N 3.08Å; T490-T536 HydrophobicContact CG2-CG2 3.73Å; T490-T536 VanDerWaalsContact O-CG2 3.31Å; T490-T536 WeakPolarHBondContact O-CG2 3.46Å; T490-R539 HydrophobicContact CG2-CB 4.18Å; T490-A540 HydrophobicContact CG2-CB 4.23Å
491	W	96.9	Very high	93.5	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-70.1	-43.8	179.3	-177.1	74.9	0	0	0	112.4	L348 H349 V392 A395 L396 F399 V400 F432 C487 L488 Y494 H495	L348-W491 HydrophobicContact CD2-CZ2 4.13Å; H349-W491 AromaticContact CE1-NE1 3.64Å; H349-W491 AromaticContact NE2-NE1 3.41Å; H349-W491 PolarHBondContact NE2-NE1 3.25Å; V392-W491 HydrophobicContact CG1-CH2 3.75Å; V392-W491 HydrophobicContact CG1-CZ2 4.49Å; V392-W491 HydrophobicContact CG1-CZ3 4.31Å; A395-W491 HydrophobicContact CB-CZ2 4.05Å; L396-W491 HydrophobicContact CD2-CB 3.85Å; L396-W491 HydrophobicContact CD2-CD2 3.41Å; L396-W491 VanDerWaalsContact CD2-CD2 3.41Å; L396-W491 HydrophobicContact CD2-CE3 3.55Å; L396-W491 HydrophobicContact CD2-CG 3.56Å; L396-W491 HydrophobicContact CD2-CZ3 4.25Å; L396-W491 HydrophobicContact CG-CD2 4.1Å; L396-W491 HydrophobicContact CG-CE3 4.22Å; L396-W491 HydrophobicContact CG-CZ3 4.47Å; F399-W491 HydrophobicContact CD1-CB 4.43Å; F399-W491 AromaticContact CD1-CD1 3.55Å; F399-W491 HydrophobicContact CD1-CG 4.39Å; F399-W491 AromaticContact CG-CD1 3.87Å; V400-W491 HydrophobicContact CG1-CB 4.45Å; V400-W491 HydrophobicContact CG2-CB 3.96Å; V400-W491 HydrophobicContact CG2-CG 4.46Å; F432-W491 HydrophobicContact CD2-CH2 4.14Å; F432-W491 AromaticContact CE1-CH2 3.99Å; F432-W491 HydrophobicContact CE1-CH2 3.99Å; F432-W491 HydrophobicContact CE1-CZ2 4.16Å; F432-W491 AromaticContact CE2-CH2 3.24Å; F432-W491 HydrophobicContact CE2-CH2 3.24Å; F432-W491 HydrophobicContact CE2-CZ2 4.19Å; F432-W491 AromaticContact CE2-CZ3 3.51Å; F432-W491 HydrophobicContact CE2-CZ3 3.51Å; F432-W491 HydrophobicContact CZ-CE3 4.44Å; F432-W491 AromaticContact CZ-CH2 3.13Å; F432-W491 HydrophobicContact CZ-CH2 3.13Å; F432-W491 AromaticContact CZ-CZ2 3.63Å; F432-W491 HydrophobicContact CZ-CZ2 3.63Å; F432-W491 AromaticContact CZ-CZ3 3.61Å; F432-W491 HydrophobicContact CZ-CZ3 3.61Å; C487-W491 PolarHBondContact O-N 2.87Å; L488-W491 WeakPolarHBondContact O-CB 3.28Å; L488-W491 PolarHBondContact O-N 2.86Å; L488-W491 VanDerWaalsContact O-N 3.08Å; W491-Y494 WeakPolarHBondContact O-CB 3.22Å; W491-Y494 PolarHBondContact O-N 3.48Å; W491-H495 AromaticContact CE2-CD2 3.94Å; W491-H495 AromaticContact CE2-NE2 3.59Å; W491-H495 AromaticContact CZ2-NE2 3.76Å; W491-H495 AromaticContact NE1-NE2 3.58Å; W491-H495 PolarHBondContact O-CD2 3.38Å; W491-H495 PolarHBondContact O-N 2.91Å
492	V	97.9	Very high	94.2	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-66.4	-41.8	175.9	-179.1	0	0	0	0	111	F424 F457 L460 Q461 A464 L488 Y494 H495 N496	F424-V492 HydrophobicContact CE2-CG2 4.41Å; F424-V492 HydrophobicContact CZ-CG2 3.79Å; F457-V492 HydrophobicContact CD1-CG1 4.43Å; L460-V492 HydrophobicContact CB-CG1 4.18Å; L460-V492 HydrophobicContact CD2-CG1 4.18Å; L460-V492 HydrophobicContact CD2-CG2 4.09Å; L460-V492 HydrophobicContact CG-CG1 4.11Å; L460-V492 HydrophobicContact CG-CG2 4Å; Q461-V492 HydrophobicContact CB-CG1 4.04Å; A464-V492 HydrophobicContact CB-CB 4.49Å; A464-V492 HydrophobicContact CB-CG2 3.9Å; L488-V492 PolarHBondContact O-N 3.22Å; V492-Y494 VanDerWaalsContact C-N 3.28Å; V492-Y494 PolarHBondContact O-N 2.94Å; V492-H495 PolarHBondContact O-N 3.03Å; V492-N496 PolarHBondContact O-N 3.34Å
493	L	97.6	Very high	94.9	Very high	2 Å²	2	19.8 Å²	19.8	1%	0.01	10%	0.101	C	C	.	.	H	α-helix	trans	-60.5	-38.4	178.3	177	60.4	0	0	0	112.2	Q461 G489 H495 N496 L497 W532 T536 T628	Q461-L493 VanDerWaalsContact OE1-CA 3.31Å; G489-L493 WeakPolarHBondContact O-CB 3.4Å; G489-L493 PolarHBondContact O-N 3.06Å; L493-H495 VanDerWaalsContact C-N 3.29Å; L493-H495 PolarHBondContact O-N 3.43Å; L493-N496 PolarHBondContact O-N 2.95Å; L493-L497 HydrophobicContact CD1-CD1 4.02Å; L493-L497 HydrophobicContact CD1-CG 4.02Å; L493-L497 HydrophobicContact CG-CD1 3.88Å; L493-L497 HydrophobicContact CG-CG 4.36Å; L493-L497 WeakPolarHBondContact O-CB 3.41Å; L493-L497 VanDerWaalsContact O-CG 3.27Å; L493-L497 WeakPolarHBondContact O-CG 3.38Å; L493-L497 PolarHBondContact O-N 2.89Å; L493-W532 HydrophobicContact CD2-CE3 4.46Å; L493-T536 HydrophobicContact CB-CG2 4.45Å; L493-T536 HydrophobicContact CD2-CG2 4.37Å; L493-T536 WeakPolarHBondContact CD2-OG1 3.24Å; L493-T536 HydrophobicContact CG-CG2 4.3Å; L493-T628 HydrophobicContact CD1-CG2 4.07Å; L493-T628 WeakPolarHBondContact CD1-O 3.37Å; L493-T628 HydrophobicContact CD2-CG2 4.18Å
494	Y	97.6	Very high	95.6	Very high	2 Å²	2	13.2 Å²	13.2	1%	0.008	7%	0.07	C	C	.	.	H	α-helix	trans	-55.6	-45.2	173.5	162.5	-100.8	0	0	0	111.7	H349 F399 T490 W491 V492 L497 R498 L533 L537 E575	H349-Y494 AromaticContact NE2-CE1 3.91Å; F399-Y494 HydrophobicContact CE1-CD1 4.45Å; F399-Y494 HydrophobicContact CE1-CG 4.16Å; F399-Y494 HydrophobicContact CE2-CD1 4.19Å; F399-Y494 HydrophobicContact CE2-CD2 4.25Å; F399-Y494 HydrophobicContact CE2-CE1 4.24Å; F399-Y494 HydrophobicContact CE2-CE2 4.3Å; F399-Y494 HydrophobicContact CE2-CG 4.2Å; F399-Y494 AromaticContact CZ-CD1 3.9Å; F399-Y494 HydrophobicContact CZ-CD1 3.9Å; F399-Y494 AromaticContact CZ-CD2 3.74Å; F399-Y494 HydrophobicContact CZ-CD2 3.74Å; F399-Y494 HydrophobicContact CZ-CE1 4.39Å; F399-Y494 HydrophobicContact CZ-CE2 4.24Å; F399-Y494 AromaticContact CZ-CG 3.55Å; F399-Y494 HydrophobicContact CZ-CG 3.55Å; T490-Y494 WeakPolarHBondContact O-CB 3.07Å; T490-Y494 PolarHBondContact O-N 3.02Å; T490-Y494 VanDerWaalsContact O-N 3.08Å; W491-Y494 WeakPolarHBondContact O-CB 3.22Å; W491-Y494 PolarHBondContact O-N 3.48Å; V492-Y494 VanDerWaalsContact C-N 3.28Å; V492-Y494 PolarHBondContact O-N 2.94Å; Y494-L497 PolarHBondContact O-N 2.71Å; Y494-R498 HydrophobicContact CD2-CG 4.37Å; Y494-R498 HydrophobicContact CE1-CG 4.28Å; Y494-R498 HydrophobicContact CE2-CG 3.88Å; Y494-R498 VanDerWaalsContact O-CG 3.29Å; Y494-R498 WeakPolarHBondContact O-CG 3.27Å; Y494-R498 PolarHBondContact O-N 2.93Å; Y494-R498 PolarHBondContact OH-NH1 3.43Å; Y494-L533 HydrophobicContact CD2-CD1 3.68Å; Y494-L533 HydrophobicContact CE2-CD1 4.04Å; Y494-L537 HydrophobicContact CD2-CD2 4Å; Y494-L537 HydrophobicContact CE2-CD2 3.98Å; Y494-E575 WeakPolarHBondContact CE2-OE1 3.41Å; Y494-E575 VanDerWaalsContact OH-CD 3.27Å; Y494-E575 PolarHBondContact OH-OE1 3.38Å; Y494-E575 PolarHBondContact OH-OE2 2.74Å
495	H	97.9	Very high	96.2	Very high	4 Å²	4	13.7 Å²	13.7	2%	0.019	7%	0.072	C	C	.	.	H	α-helix	trans	-69.8	-40.5	177.7	-70.8	-66.3	0	0	0	112.8	H349 F432 F457 W491 V492 L493 L497 R498 I499	H349-H495 AromaticContact CD2-CE1 3.46Å; H349-H495 PolarHBondContact CD2-CE1 3.24Å; H349-H495 VanDerWaalsContact CD2-CE1 3.46Å; H349-H495 AromaticContact CD2-NE2 3.72Å; H349-H495 AromaticContact NE2-CE1 3.25Å; H349-H495 PolarHBondContact NE2-CE1 3.14Å; H349-H495 VanDerWaalsContact NE2-CE1 3.25Å; H349-H495 AromaticContact NE2-NE2 3.05Å; H349-H495 PolarHBondContact NE2-NE2 2.89Å; F432-H495 AromaticContact CE1-CD2 3.73Å; F432-H495 AromaticContact CE1-CE1 3.72Å; F432-H495 AromaticContact CE1-CG 3.89Å; F432-H495 AromaticContact CE1-ND1 3.88Å; F432-H495 AromaticContact CE1-NE2 3.63Å; F432-H495 AromaticContact CZ-CD2 3.45Å; F432-H495 VanDerWaalsContact CZ-CD2 3.45Å; F432-H495 WeakPolarHBondContact CZ-CD2 3.49Å; F432-H495 AromaticContact CZ-CG 3.86Å; F432-H495 AromaticContact CZ-NE2 3.72Å; F457-H495 HydrophobicContact CD1-CB 4.03Å; F457-H495 HydrophobicContact CE1-CB 3.65Å; W491-H495 AromaticContact CE2-CD2 3.94Å; W491-H495 AromaticContact CE2-NE2 3.59Å; W491-H495 AromaticContact CZ2-NE2 3.76Å; W491-H495 AromaticContact NE1-NE2 3.58Å; W491-H495 PolarHBondContact O-CD2 3.38Å; W491-H495 PolarHBondContact O-N 2.91Å; V492-H495 PolarHBondContact O-N 3.03Å; L493-H495 VanDerWaalsContact C-N 3.29Å; L493-H495 PolarHBondContact O-N 3.43Å; H495-L497 PolarHBondContact O-N 3.49Å; H495-R498 WeakPolarHBondContact O-CB 3.19Å; H495-R498 PolarHBondContact O-N 3.45Å; H495-I499 WeakPolarHBondContact O-CD1 3.38Å; H495-I499 VanDerWaalsContact O-CG1 3.26Å; H495-I499 WeakPolarHBondContact O-CG1 3.45Å; H495-I499 PolarHBondContact O-N 3.3Å
496	N	97.9	Very high	96.9	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-54.6	-50.8	172.2	-89.5	-45.1	0	0	0	111.4	F457 V492 L493 R498 I499 M500	F457-N496 WeakPolarHBondContact CB-OD1 3.3Å; F457-N496 PolarHBondContact O-ND2 2.92Å; V492-N496 PolarHBondContact O-N 3.34Å; L493-N496 PolarHBondContact O-N 2.95Å; N496-R498 PolarHBondContact O-N 3.46Å; N496-I499 PolarHBondContact O-N 2.88Å; N496-M500 VanDerWaalsContact O-CG 3.26Å; N496-M500 WeakPolarHBondContact O-CG 3.36Å; N496-M500 PolarHBondContact O-N 3.46Å
497	L	98.3	Very high	97.4	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-62.5	-42.1	179.9	-69.1	166.1	0	0	0	112.2	L493 Y494 H495 I499 M500 I501 L529 W532 L533 P629	L493-L497 HydrophobicContact CD1-CD1 4.02Å; L493-L497 HydrophobicContact CD1-CG 4.02Å; L493-L497 HydrophobicContact CG-CD1 3.88Å; L493-L497 HydrophobicContact CG-CG 4.36Å; L493-L497 WeakPolarHBondContact O-CB 3.41Å; L493-L497 VanDerWaalsContact O-CG 3.27Å; L493-L497 WeakPolarHBondContact O-CG 3.38Å; L493-L497 PolarHBondContact O-N 2.89Å; Y494-L497 PolarHBondContact O-N 2.71Å; H495-L497 PolarHBondContact O-N 3.49Å; L497-I499 PolarHBondContact O-N 3.17Å; L497-M500 PolarHBondContact O-N 3.43Å; L497-I501 WeakPolarHBondContact O-CB 3.11Å; L497-I501 WeakPolarHBondContact O-CD1 3.4Å; L497-I501 WeakPolarHBondContact O-CG1 3.28Å; L497-I501 PolarHBondContact O-N 3.08Å; L497-L529 HydrophobicContact CD2-CD2 3.98Å; L497-W532 HydrophobicContact CD1-CB 3.95Å; L497-W532 HydrophobicContact CD2-CB 3.71Å; L497-L533 HydrophobicContact CB-CD1 4.26Å; L497-L533 HydrophobicContact CD1-CB 4.31Å; L497-L533 HydrophobicContact CD1-CD1 4.46Å; L497-P629 HydrophobicContact CD2-CG 3.92Å
498	R	97.7	Very high	97.6	Very high	55 Å²	55	7.4 Å²	7.4	21%	0.208	3%	0.034	C	C	.	.	H	α-helix	trans	-57.4	-46.8	174.1	-77.5	-90.6	-51.2	-124.5	4	111.5	D353 Y494 H495 N496 I501 Q502 E575	D353-R498 IonicContact OD1-CZ 3.69Å; D353-R498 VanDerWaalsContact OD1-CZ 3.31Å; D353-R498 IonicContact OD1-NH1 3.78Å; D353-R498 PolarHBondContact OD1-NH1 3.43Å; D353-R498 IonicContact OD1-NH2 2.79Å; D353-R498 PolarHBondContact OD1-NH2 3.04Å; Y494-R498 HydrophobicContact CD2-CG 4.37Å; Y494-R498 HydrophobicContact CE1-CG 4.28Å; Y494-R498 HydrophobicContact CE2-CG 3.88Å; Y494-R498 VanDerWaalsContact O-CG 3.29Å; Y494-R498 WeakPolarHBondContact O-CG 3.27Å; Y494-R498 PolarHBondContact O-N 2.93Å; Y494-R498 PolarHBondContact OH-NH1 3.43Å; H495-R498 WeakPolarHBondContact O-CB 3.19Å; H495-R498 PolarHBondContact O-N 3.45Å; N496-R498 PolarHBondContact O-N 3.46Å; R498-I501 PolarHBondContact O-N 2.49Å; R498-Q502 WeakPolarHBondContact O-CB 3.36Å; R498-Q502 PolarHBondContact O-N 3.35Å; R498-E575 IonicContact NH1-OE1 3.28Å
499	I	98.4	Very high	97.6	Very high	3 Å²	3	9.7 Å²	9.7	2%	0.015	5%	0.045	C	C	.	.	H	α-helix	trans	-64.3	-46.8	179.5	-66	162.7	0	0	0	110.5	L435 L450 I453 L454 F457 H495 N496 L497 I501 Q502 Y503	L435-I499 HydrophobicContact CD1-CD1 4.03Å; L435-I499 HydrophobicContact CD1-CG1 3.94Å; L435-I499 HydrophobicContact CD2-CD1 4.23Å; L435-I499 HydrophobicContact CD2-CG1 4.47Å; L450-I499 HydrophobicContact CB-CG2 4.38Å; L450-I499 HydrophobicContact CD2-CG2 3.98Å; I453-I499 HydrophobicContact CG2-CD1 4.32Å; I453-I499 HydrophobicContact CG2-CG2 4.07Å; L454-I499 HydrophobicContact CD2-CB 3.94Å; L454-I499 HydrophobicContact CD2-CG2 3.51Å; L454-I499 HydrophobicContact CG-CG2 3.8Å; F457-I499 HydrophobicContact CD1-CD1 4.15Å; F457-I499 HydrophobicContact CD2-CD1 3.86Å; F457-I499 HydrophobicContact CE1-CD1 4.23Å; F457-I499 HydrophobicContact CE2-CD1 3.92Å; F457-I499 HydrophobicContact CG-CD1 3.97Å; F457-I499 HydrophobicContact CZ-CD1 4.11Å; H495-I499 WeakPolarHBondContact O-CD1 3.38Å; H495-I499 VanDerWaalsContact O-CG1 3.26Å; H495-I499 WeakPolarHBondContact O-CG1 3.45Å; H495-I499 PolarHBondContact O-N 3.3Å; N496-I499 PolarHBondContact O-N 2.88Å; L497-I499 PolarHBondContact O-N 3.17Å; I499-I501 PolarHBondContact O-N 3.01Å; I499-Q502 PolarHBondContact O-N 3.4Å; I499-Y503 WeakPolarHBondContact O-CB 3.2Å; I499-Y503 PolarHBondContact O-N 2.91Å
500	M	98.4	Very high	97.6	Very high	1 Å²	1	12 Å²	12	1%	0.005	6%	0.056	C	C	.	.	H	α-helix	trans	-60.3	-43.7	177.8	-66.4	171.6	86.4	0	0	112.1	L454 N496 L497 Y503 L504 L529 F623	L454-M500 HydrophobicContact CD1-CG 4.25Å; L454-M500 HydrophobicContact CD2-CG 3.82Å; N496-M500 VanDerWaalsContact O-CG 3.26Å; N496-M500 WeakPolarHBondContact O-CG 3.36Å; N496-M500 PolarHBondContact O-N 3.46Å; L497-M500 PolarHBondContact O-N 3.43Å; M500-Y503 PolarHBondContact O-N 3.22Å; M500-L504 PolarHBondContact O-N 3Å; M500-L504 VanDerWaalsContact O-N 3.14Å; M500-L529 HydrophobicContact CB-CD1 3.99Å; M500-L529 HydrophobicContact CB-CD2 4.09Å; M500-L529 HydrophobicContact CE-CD2 3.77Å; M500-L529 HydrophobicContact SD-CD2 3.92Å; M500-F623 HydrophobicContact CB-CD1 4.47Å; M500-F623 HydrophobicContact CB-CE1 3.87Å; M500-F623 HydrophobicContact CB-CE2 4.48Å; M500-F623 HydrophobicContact CB-CZ 3.86Å; M500-F623 HydrophobicContact CE-CB 3.77Å; M500-F623 HydrophobicContact CE-CD1 3.82Å; M500-F623 HydrophobicContact CE-CD2 3.55Å; M500-F623 HydrophobicContact CE-CE1 4.28Å; M500-F623 HydrophobicContact CE-CE2 3.99Å; M500-F623 HydrophobicContact CE-CG 3.43Å; M500-F623 VanDerWaalsContact CE-CG 3.43Å; M500-F623 HydrophobicContact CE-CZ 4.34Å; M500-F623 HydrophobicContact CG-CD1 3.99Å; M500-F623 HydrophobicContact CG-CE1 3.85Å; M500-F623 HydrophobicContact CG-CZ 4.26Å
501	I	98.4	Very high	97.5	Very high	11 Å²	11	20.2 Å²	20.2	6%	0.056	9%	0.094	C	C	.	.	H	α-helix	trans	-62.4	-48.2	176.7	-72.4	165.4	0	0	0	110	L497 R498 I499 Y503 L504 L505 L525 L529 Y530 L533	L497-I501 WeakPolarHBondContact O-CB 3.11Å; L497-I501 WeakPolarHBondContact O-CD1 3.4Å; L497-I501 WeakPolarHBondContact O-CG1 3.28Å; L497-I501 PolarHBondContact O-N 3.08Å; R498-I501 PolarHBondContact O-N 2.49Å; I499-I501 PolarHBondContact O-N 3.01Å; I501-Y503 VanDerWaalsContact C-N 3.33Å; I501-Y503 PolarHBondContact O-N 3.44Å; I501-L504 PolarHBondContact O-N 3.08Å; I501-L505 HydrophobicContact CG2-CD1 3.58Å; I501-L505 HydrophobicContact CG2-CG 4.15Å; I501-L505 WeakPolarHBondContact O-CB 3.18Å; I501-L505 VanDerWaalsContact O-CG 3.28Å; I501-L505 WeakPolarHBondContact O-CG 3.37Å; I501-L505 PolarHBondContact O-N 3.35Å; I501-L525 HydrophobicContact CB-CD2 4.48Å; I501-L525 HydrophobicContact CG1-CD2 4.31Å; I501-L525 HydrophobicContact CG2-CD2 4.23Å; I501-L529 HydrophobicContact CD1-CB 4.2Å; I501-L529 HydrophobicContact CG1-CB 3.76Å; I501-L529 HydrophobicContact CG1-CD1 3.94Å; I501-L529 HydrophobicContact CG1-CG 4.45Å; I501-Y530 HydrophobicContact CD1-CD1 4.05Å; I501-Y530 HydrophobicContact CD1-CE1 3.89Å; I501-Y530 HydrophobicContact CD1-CG 4.48Å; I501-Y530 HydrophobicContact CG2-CE1 4.41Å; I501-Y530 HydrophobicContact CG2-CE2 4.34Å; I501-Y530 WeakPolarHBondContact CG2-OH 3.46Å; I501-L533 HydrophobicContact CD1-CB 4.45Å; I501-L533 HydrophobicContact CD1-CD2 3.76Å
502	Q	97.5	Very high	97.5	Very high	28 Å²	28	23.3 Å²	23.3	13%	0.131	11%	0.11	C	C	.	.	H	α-helix	trans	-62.2	-39.6	179.3	-172.9	177.8	-5.9	0	0	112.3	H439 L450 R498 I499 L505 S506	H439-Q502 PolarHBondContact CD2-NE2 3.06Å; H439-Q502 PolarHBondContact NE2-NE2 2.79Å; H439-Q502 PolarHBondContact NE2-OE1 2.87Å; L450-Q502 HydrophobicContact CD1-CB 4.27Å; L450-Q502 HydrophobicContact CD1-CG 3.7Å; R498-Q502 WeakPolarHBondContact O-CB 3.36Å; R498-Q502 PolarHBondContact O-N 3.35Å; I499-Q502 PolarHBondContact O-N 3.4Å; Q502-L505 PolarHBondContact O-N 3.07Å; Q502-S506 VanDerWaalsContact O-CB 3.32Å; Q502-S506 WeakPolarHBondContact O-CB 3.49Å; Q502-S506 PolarHBondContact O-N 3.41Å; Q502-S506 PolarHBondContact O-OG 3.19Å
503	Y	98.1	Very high	97.5	Very high	16 Å²	16	23.8 Å²	23.8	6%	0.063	11%	0.112	C	C	.	.	H	α-helix	trans	-57	-50.1	174.1	178.6	-92.2	0	0	0	111.2	R447 L450 I499 M500 I501 S506 P622 F623	R447-Y503 HydrophobicContact CG-CD2 4.11Å; R447-Y503 HydrophobicContact CG-CE2 3.93Å; R447-Y503 PolarHBondContact NH2-OH 3.43Å; R447-Y503 WeakPolarHBondContact O-CD2 3.27Å; R447-Y503 WeakPolarHBondContact O-CE2 3.42Å; L450-Y503 HydrophobicContact CB-CD2 4.36Å; I499-Y503 WeakPolarHBondContact O-CB 3.2Å; I499-Y503 PolarHBondContact O-N 2.91Å; M500-Y503 PolarHBondContact O-N 3.22Å; I501-Y503 VanDerWaalsContact C-N 3.33Å; I501-Y503 PolarHBondContact O-N 3.44Å; Y503-S506 PolarHBondContact O-OG 2.93Å; Y503-P622 HydrophobicContact CE1-CG 4.02Å; Y503-P622 HydrophobicContact CE2-CG 4.08Å; Y503-P622 WeakPolarHBondContact OH-CG 3.42Å; Y503-F623 AromaticContact CD1-CE1 3.87Å; Y503-F623 HydrophobicContact CD1-CE1 3.87Å; Y503-F623 AromaticContact CD1-CZ 3.98Å; Y503-F623 HydrophobicContact CD1-CZ 3.98Å; Y503-F623 HydrophobicContact CG-CE1 4.34Å
504	L	98.3	Very high	97.3	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-66.2	-45.6	178.8	-67	-179.3	0	0	0	112.3	M500 I501 S506 G507 Y513 I521 Y524 L525 L529 F620 F623	M500-L504 PolarHBondContact O-N 3Å; M500-L504 VanDerWaalsContact O-N 3.14Å; I501-L504 PolarHBondContact O-N 3.08Å; L504-S506 VanDerWaalsContact C-N 3.29Å; L504-S506 PolarHBondContact O-N 3.37Å; L504-G507 PolarHBondContact O-N 3.28Å; L504-G507 VanDerWaalsContact O-N 3.09Å; L504-Y513 WeakPolarHBondContact CA-OH 3.43Å; L504-Y513 WeakPolarHBondContact O-CE2 3.29Å; L504-Y513 PolarHBondContact O-OH 3.15Å; L504-I521 HydrophobicContact CB-CG2 4.48Å; L504-I521 HydrophobicContact CD2-CD1 4.48Å; L504-Y524 HydrophobicContact CD1-CD1 3.89Å; L504-L525 HydrophobicContact CB-CD1 4.45Å; L504-L525 HydrophobicContact CB-CD2 4.06Å; L504-L525 HydrophobicContact CB-CG 4.36Å; L504-L525 HydrophobicContact CD1-CD2 3.93Å; L504-L525 HydrophobicContact CD1-CG 3.95Å; L504-L529 HydrophobicContact CD1-CD1 3.69Å; L504-F620 HydrophobicContact CD1-CE1 3.87Å; L504-F620 HydrophobicContact CD2-CD1 4.1Å; L504-F620 HydrophobicContact CD2-CE1 3.76Å; L504-F620 HydrophobicContact CG-CE1 4.48Å; L504-F623 HydrophobicContact CD1-CE2 4.07Å; L504-F623 HydrophobicContact CD1-CZ 4.22Å; L504-F623 HydrophobicContact CD2-CE2 4.11Å; L504-F623 HydrophobicContact CD2-CZ 3.96Å; L504-F623 HydrophobicContact CG-CE2 4.1Å; L504-F623 HydrophobicContact CG-CZ 3.81Å
505	L	97.7	Very high	97.1	Very high	9 Å²	9	28.3 Å²	28.3	5%	0.047	14%	0.141	C	C	.	.	H	α-helix	trans	-63.1	-36.1	-178.9	-68	177.1	0	0	0	112.1	I501 Q502 G507 F508 E509 L525 Y582 Y718	I501-L505 HydrophobicContact CG2-CD1 3.58Å; I501-L505 HydrophobicContact CG2-CG 4.15Å; I501-L505 WeakPolarHBondContact O-CB 3.18Å; I501-L505 VanDerWaalsContact O-CG 3.28Å; I501-L505 WeakPolarHBondContact O-CG 3.37Å; I501-L505 PolarHBondContact O-N 3.35Å; Q502-L505 PolarHBondContact O-N 3.07Å; L505-G507 PolarHBondContact O-N 2.85Å; L505-F508 PolarHBondContact O-N 3.05Å; L505-E509 PolarHBondContact O-N 2.87Å; L505-L525 HydrophobicContact CD2-CD1 3.82Å; L505-L525 HydrophobicContact CD2-CD2 4.45Å; L505-L525 HydrophobicContact CG-CD2 4.46Å; L505-Y582 HydrophobicContact CD1-CE1 4.28Å; L505-Y718 HydrophobicContact CB-CD1 3.83Å; L505-Y718 HydrophobicContact CB-CD2 4.23Å; L505-Y718 HydrophobicContact CB-CE1 3.81Å; L505-Y718 HydrophobicContact CB-CE2 4.21Å; L505-Y718 HydrophobicContact CB-CG 4.05Å; L505-Y718 HydrophobicContact CD1-CD2 3.91Å; L505-Y718 HydrophobicContact CD1-CE2 3.89Å; L505-Y718 HydrophobicContact CD1-CG 4.46Å; L505-Y718 HydrophobicContact CD2-CD1 4.43Å; L505-Y718 HydrophobicContact CD2-CD2 4.03Å; L505-Y718 HydrophobicContact CD2-CG 3.87Å; L505-Y718 HydrophobicContact CG-CD2 4.29Å; L505-Y718 HydrophobicContact CG-CG 4.35Å; L505-Y718 WeakPolarHBondContact O-CD1 3.48Å
506	S	97.1	Very high	96.8	Very high	6 Å²	6	29.1 Å²	29.1	4%	0.042	14%	0.144	C	C	.	.	H	α-helix	trans	-60.5	-26.6	175.5	74	0	0	0	0	112.9	R447 Q502 Y503 L504 F508 E509 L510	R447-S506 WeakPolarHBondContact CB-OG 3.45Å; R447-S506 VanDerWaalsContact CD-OG 3.31Å; R447-S506 WeakPolarHBondContact CD-OG 3.21Å; R447-S506 VanDerWaalsContact CG-OG 3.22Å; R447-S506 WeakPolarHBondContact CG-OG 3.46Å; Q502-S506 VanDerWaalsContact O-CB 3.32Å; Q502-S506 WeakPolarHBondContact O-CB 3.49Å; Q502-S506 PolarHBondContact O-N 3.41Å; Q502-S506 PolarHBondContact O-OG 3.19Å; Y503-S506 PolarHBondContact O-OG 2.93Å; L504-S506 VanDerWaalsContact C-N 3.29Å; L504-S506 PolarHBondContact O-N 3.37Å; S506-F508 VanDerWaalsContact C-N 3.32Å; S506-F508 PolarHBondContact O-N 2.81Å; S506-E509 PolarHBondContact O-N 3.05Å; S506-L510 VanDerWaalsContact O-CB 3.31Å; S506-L510 WeakPolarHBondContact O-CB 3.12Å; S506-L510 VanDerWaalsContact O-CG 3.27Å; S506-L510 WeakPolarHBondContact O-CG 3.49Å; S506-L510 PolarHBondContact O-N 3.36Å
507	G	97.5	Very high	96.7	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-70.9	-24.4	175	0	0	0	0	0	114.1	L504 L505 E511 L512 Y513	L504-G507 PolarHBondContact O-N 3.28Å; L504-G507 VanDerWaalsContact O-N 3.09Å; L505-G507 PolarHBondContact O-N 2.85Å; G507-E511 PolarHBondContact O-N 3.42Å; G507-L512 PolarHBondContact O-N 2.88Å; G507-Y513 VanDerWaalsContact CA-CE2 3.49Å
508	F	97.6	Very high	96.7	Very high	10 Å²	10	30.6 Å²	30.6	4%	0.044	15%	0.15	C	C	.	.	H	α-helix	trans	-74	-45.1	168.6	-73	-73.5	0	0	0	111.1	L505 S506 L510 E511 Y513 Y518 I521 Y522 L525 F713	L505-F508 PolarHBondContact O-N 3.05Å; S506-F508 VanDerWaalsContact C-N 3.32Å; S506-F508 PolarHBondContact O-N 2.81Å; F508-L510 VanDerWaalsContact C-N 3.28Å; F508-L510 PolarHBondContact O-N 3.2Å; F508-E511 PolarHBondContact O-N 3.5Å; F508-E511 VanDerWaalsContact O-N 3.13Å; F508-Y513 AromaticContact CD1-CD2 3.89Å; F508-Y513 HydrophobicContact CD1-CD2 3.89Å; F508-Y513 HydrophobicContact CD2-CD2 4.05Å; F508-Y513 AromaticContact CD2-CE2 3.89Å; F508-Y513 HydrophobicContact CD2-CE2 3.89Å; F508-Y513 AromaticContact CE1-CD2 3.92Å; F508-Y513 HydrophobicContact CE1-CD2 3.92Å; F508-Y513 HydrophobicContact CE2-CD2 4.09Å; F508-Y513 HydrophobicContact CE2-CE2 4.02Å; F508-Y513 AromaticContact CG-CD2 3.95Å; F508-Y513 HydrophobicContact CG-CD2 3.95Å; F508-Y513 HydrophobicContact CG-CE2 4.16Å; F508-Y513 HydrophobicContact CZ-CD2 4.02Å; F508-Y513 HydrophobicContact CZ-CE2 4.39Å; F508-Y518 HydrophobicContact CD1-CD1 4.47Å; F508-Y518 HydrophobicContact CD1-CE1 4.16Å; F508-Y518 AromaticContact CE1-CD1 3.61Å; F508-Y518 HydrophobicContact CE1-CD1 3.61Å; F508-Y518 HydrophobicContact CE1-CD2 4.5Å; F508-Y518 AromaticContact CE1-CE1 3.74Å; F508-Y518 HydrophobicContact CE1-CE1 3.74Å; F508-Y518 HydrophobicContact CE1-CG 4.02Å; F508-Y518 HydrophobicContact CZ-CD1 4.4Å; F508-I521 HydrophobicContact CE2-CB 4.43Å; F508-I521 HydrophobicContact CE2-CG2 3.54Å; F508-I521 HydrophobicContact CZ-CB 4.2Å; F508-I521 HydrophobicContact CZ-CG2 3.8Å; F508-Y522 HydrophobicContact CE1-CE1 4.36Å; F508-Y522 AromaticContact CE1-CE2 3.76Å; F508-Y522 HydrophobicContact CE1-CE2 3.76Å; F508-Y522 AromaticContact CE1-CZ 3.62Å; F508-Y522 WeakPolarHBondContact CE1-OH 3.34Å; F508-Y522 HydrophobicContact CE2-CD1 4.22Å; F508-Y522 AromaticContact CE2-CE1 3.72Å; F508-Y522 HydrophobicContact CE2-CE1 3.72Å; F508-Y522 HydrophobicContact CE2-CE2 4.42Å; F508-Y522 AromaticContact CE2-CZ 3.84Å; F508-Y522 HydrophobicContact CZ-CD1 4.1Å; F508-Y522 AromaticContact CZ-CD2 3.98Å; F508-Y522 HydrophobicContact CZ-CD2 3.98Å; F508-Y522 AromaticContact CZ-CE1 3.62Å; F508-Y522 HydrophobicContact CZ-CE1 3.62Å; F508-Y522 AromaticContact CZ-CE2 3.5Å; F508-Y522 HydrophobicContact CZ-CE2 3.5Å; F508-Y522 VanDerWaalsContact CZ-CE2 3.5Å; F508-Y522 HydrophobicContact CZ-CG 4.27Å; F508-Y522 AromaticContact CZ-CZ 3.29Å; F508-L525 HydrophobicContact CE2-CD1 4.36Å; F508-F713 HydrophobicContact CD1-CE1 4.08Å; F508-F713 HydrophobicContact CD1-CZ 4.07Å
509	E	95.4	Very high	96.6	Very high	49 Å²	49	29.7 Å²	29.7	23%	0.229	15%	0.147	C	C	.	.	H	α-helix	trans	-61	-37.4	179.4	-179.6	-178.9	161.4	0	0	112.9	R443 L505 S506 E511 K717 Y718	R443-E509 IonicContact CZ-OE1 4Å; R443-E509 IonicContact CZ-OE2 2.68Å; R443-E509 IonicContact NE-OE1 3.73Å; R443-E509 PolarHBondContact NE-OE1 2.82Å; R443-E509 IonicContact NE-OE2 3.14Å; R443-E509 IonicContact NH2-OE1 3.78Å; R443-E509 PolarHBondContact NH2-OE1 3.45Å; R443-E509 IonicContact NH2-OE2 3.19Å; R443-E509 PolarHBondContact NH2-OE2 2.97Å; L505-E509 PolarHBondContact O-N 2.87Å; S506-E509 PolarHBondContact O-N 3.05Å; E509-E511 VanDerWaalsContact C-N 3.33Å; E509-K717 HydrophobicContact CB-CB 4.41Å; E509-K717 HydrophobicContact CG-CB 4.43Å; E509-Y718 HydrophobicContact CB-CE1 4.24Å
510	L	95.9	Very high	96.6	Very high	52 Å²	52	29.6 Å²	29.6	27%	0.272	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	8.3	179.4	-61.9	171.6	0	0	0	113	R443 A444 R447 S506 F508 L512	R443-L510 HydrophobicContact CB-CD2 4.24Å; A444-L510 HydrophobicContact CB-CD2 4.46Å; R447-L510 HydrophobicContact CB-CD1 3.89Å; R447-L510 HydrophobicContact CG-CD1 4.5Å; S506-L510 VanDerWaalsContact O-CB 3.31Å; S506-L510 WeakPolarHBondContact O-CB 3.12Å; S506-L510 VanDerWaalsContact O-CG 3.27Å; S506-L510 WeakPolarHBondContact O-CG 3.49Å; S506-L510 PolarHBondContact O-N 3.36Å; F508-L510 VanDerWaalsContact C-N 3.28Å; F508-L510 PolarHBondContact O-N 3.2Å; L510-L512 VanDerWaalsContact C-N 3.26Å; L510-L512 HydrophobicContact CB-CD1 3.91Å; L510-L512 HydrophobicContact CB-CD2 4.33Å; L510-L512 HydrophobicContact CB-CG 3.74Å; L510-L512 HydrophobicContact CD1-CD1 4.18Å; L510-L512 PolarHBondContact O-N 3.34Å
511	E	96.3	Very high	96.6	Very high	177 Å²	177	29.6 Å²	29.6	83%	0.827	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.7	37	178.3	-56.8	-175.9	176.7	0	0	114.2	G507 F508 E509	G507-E511 PolarHBondContact O-N 3.42Å; F508-E511 PolarHBondContact O-N 3.5Å; F508-E511 VanDerWaalsContact O-N 3.13Å; E509-E511 VanDerWaalsContact C-N 3.33Å
512	L	96.8	Very high	96.6	Very high	65 Å²	65	29 Å²	29	34%	0.34	14%	0.144	S	C	.	.			trans	-86.8	-8.2	-175.5	-58.8	178.8	0	0	0	114	R447 G507 L510 R619	R447-L512 VanDerWaalsContact CZ-CD1 3.46Å; G507-L512 PolarHBondContact O-N 2.88Å; L510-L512 VanDerWaalsContact C-N 3.26Å; L510-L512 HydrophobicContact CB-CD1 3.91Å; L510-L512 HydrophobicContact CB-CD2 4.33Å; L510-L512 HydrophobicContact CB-CG 3.74Å; L510-L512 HydrophobicContact CD1-CD1 4.18Å; L510-L512 PolarHBondContact O-N 3.34Å; L512-R619 PolarHBondContact O-NH2 3.25Å
513	Y	96.4	Very high	96.6	Very high	10 Å²	10	28 Å²	28	4%	0.039	14%	0.138	C	C	.	.	S	Bend	trans	-109.9	132.1	179.8	-51.5	-43.5	0	0	0	111	L504 G507 F508 Y518 I521	L504-Y513 WeakPolarHBondContact CA-OH 3.43Å; L504-Y513 WeakPolarHBondContact O-CE2 3.29Å; L504-Y513 PolarHBondContact O-OH 3.15Å; G507-Y513 VanDerWaalsContact CA-CE2 3.49Å; F508-Y513 AromaticContact CD1-CD2 3.89Å; F508-Y513 HydrophobicContact CD1-CD2 3.89Å; F508-Y513 HydrophobicContact CD2-CD2 4.05Å; F508-Y513 AromaticContact CD2-CE2 3.89Å; F508-Y513 HydrophobicContact CD2-CE2 3.89Å; F508-Y513 AromaticContact CE1-CD2 3.92Å; F508-Y513 HydrophobicContact CE1-CD2 3.92Å; F508-Y513 HydrophobicContact CE2-CD2 4.09Å; F508-Y513 HydrophobicContact CE2-CE2 4.02Å; F508-Y513 AromaticContact CG-CD2 3.95Å; F508-Y513 HydrophobicContact CG-CD2 3.95Å; F508-Y513 HydrophobicContact CG-CE2 4.16Å; F508-Y513 HydrophobicContact CZ-CD2 4.02Å; F508-Y513 HydrophobicContact CZ-CE2 4.39Å; Y513-Y518 WeakPolarHBondContact O-CE1 3.14Å; Y513-I521 HydrophobicContact CD1-CD1 4.34Å; Y513-I521 HydrophobicContact CD1-CG1 4.33Å; Y513-I521 HydrophobicContact CD2-CG1 4.31Å; Y513-I521 HydrophobicContact CD2-CG2 4.35Å; Y513-I521 HydrophobicContact CE1-CD1 4Å; Y513-I521 HydrophobicContact CE1-CG1 4.38Å; Y513-I521 HydrophobicContact CE2-CG1 4.35Å; Y513-I521 HydrophobicContact CE2-CG2 3.89Å; Y513-I521 HydrophobicContact CG-CG1 4.31Å
514	S	93.5	Very high	96.6	Very high	61 Å²	61	27.3 Å²	27.3	43%	0.427	14%	0.136	S	C	.	.			trans	-77.1	154.6	167.8	-65.6	0	0	0	0	111.3	H516 E517 Y518	S514-H516 WeakPolarHBondContact CB-CE1 3.41Å; S514-H516 PolarHBondContact O-N 3.11Å; S514-H516 VanDerWaalsContact O-N 3.1Å; S514-E517 PolarHBondContact N-OE2 3.41Å; S514-E517 WeakPolarHBondContact O-CA 3.14Å; S514-E517 VanDerWaalsContact O-CB 3.27Å; S514-E517 WeakPolarHBondContact O-CB 3.5Å; S514-E517 PolarHBondContact O-N 3Å; S514-Y518 VanDerWaalsContact O-CD1 3.3Å; S514-Y518 WeakPolarHBondContact O-CD1 3.48Å
515	M	93.3	Very high	96.6	Very high	38 Å²	38	27.3 Å²	27.3	19%	0.187	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-50	-40.8	-179.2	176.5	-174.4	166.8	0	0	113.8	E517 Y518 M593 V602 P708 P709 F711	M515-E517 PolarHBondContact O-N 3.08Å; M515-Y518 WeakPolarHBondContact O-CB 3.45Å; M515-Y518 PolarHBondContact O-N 2.88Å; M515-M593 HydrophobicContact CE-CE 4.29Å; M515-M593 HydrophobicContact CG-CE 3.93Å; M515-M593 VanDerWaalsContact O-CE 3.25Å; M515-M593 WeakPolarHBondContact O-CE 3.32Å; M515-V602 HydrophobicContact CE-CB 4.21Å; M515-V602 HydrophobicContact CE-CG1 4.3Å; M515-V602 HydrophobicContact CE-CG2 3.96Å; M515-P708 HydrophobicContact CE-CB 4.44Å; M515-P709 HydrophobicContact CE-CG 3.82Å; M515-F711 HydrophobicContact CE-CE2 3.78Å; M515-F711 HydrophobicContact CE-CZ 4.43Å; M515-F711 HydrophobicContact CG-CD2 4.36Å; M515-F711 HydrophobicContact CG-CE2 3.79Å; M515-F711 HydrophobicContact SD-CD2 4.48Å; M515-F711 HydrophobicContact SD-CE2 3.91Å
516	H	93.5	Very high	96.7	Very high	21 Å²	21	27 Å²	27	10%	0.097	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-71.6	-10.3	-179.3	63.9	-93.4	0	0	0	113.7	S514 Y519 V602 K604 F607	S514-H516 WeakPolarHBondContact CB-CE1 3.41Å; S514-H516 PolarHBondContact O-N 3.11Å; S514-H516 VanDerWaalsContact O-N 3.1Å; H516-Y519 VanDerWaalsContact O-CD1 3.3Å; H516-Y519 WeakPolarHBondContact O-CD1 3.34Å; H516-Y519 VanDerWaalsContact O-CE1 3.3Å; H516-Y519 WeakPolarHBondContact O-CE1 3.46Å; H516-V602 HydrophobicContact CB-CG1 3.79Å; H516-K604 HydrophobicContact CB-CG 4.17Å; H516-F607 AromaticContact NE2-CZ 3.68Å
517	E	95.6	Very high	96.6	Very high	3 Å²	3	30.9 Å²	30.9	1%	0.014	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-91.7	-19.6	177	-55.5	-172.7	75.2	0	0	112.3	S514 M515 Y519 Y520 I521 R619	S514-E517 PolarHBondContact N-OE2 3.41Å; S514-E517 WeakPolarHBondContact O-CA 3.14Å; S514-E517 VanDerWaalsContact O-CB 3.27Å; S514-E517 WeakPolarHBondContact O-CB 3.5Å; S514-E517 PolarHBondContact O-N 3Å; M515-E517 PolarHBondContact O-N 3.08Å; E517-Y519 PolarHBondContact O-N 3.21Å; E517-Y519 VanDerWaalsContact O-N 3.1Å; E517-Y520 HydrophobicContact CB-CE1 4.04Å; E517-Y520 HydrophobicContact CB-CE2 3.98Å; E517-Y520 VanDerWaalsContact CB-CZ 3.48Å; E517-Y520 VanDerWaalsContact CB-OH 3.22Å; E517-Y520 WeakPolarHBondContact CB-OH 3.35Å; E517-Y520 VanDerWaalsContact CD-OH 3.31Å; E517-Y520 HydrophobicContact CG-CE1 4.39Å; E517-Y520 WeakPolarHBondContact CG-OH 3.47Å; E517-Y520 WeakPolarHBondContact O-CD2 3.39Å; E517-Y520 WeakPolarHBondContact O-CE2 3.35Å; E517-Y520 PolarHBondContact O-N 3.38Å; E517-Y520 PolarHBondContact OE1-OH 2.97Å; E517-I521 PolarHBondContact O-N 3.4Å; E517-R619 IonicContact OE1-CZ 2.77Å; E517-R619 IonicContact OE1-NE 3.92Å; E517-R619 PolarHBondContact OE1-NE 3.31Å; E517-R619 IonicContact OE1-NH2 2.7Å; E517-R619 PolarHBondContact OE1-NH2 2.91Å; E517-R619 IonicContact OE2-CZ 3.17Å; E517-R619 IonicContact OE2-NH2 3.65Å; E517-R619 PolarHBondContact OE2-NH2 3.18Å
518	Y	96.9	Very high	96.6	Very high	28 Å²	28	31.8 Å²	31.8	11%	0.11	16%	0.155	C	C	.	.	H	α-helix	trans	-55.9	-36.3	-170.9	-71.9	0.2	0	0	0	113.3	F508 Y513 S514 M515 I521 Y522 M593 F711 F713	F508-Y518 HydrophobicContact CD1-CD1 4.47Å; F508-Y518 HydrophobicContact CD1-CE1 4.16Å; F508-Y518 AromaticContact CE1-CD1 3.61Å; F508-Y518 HydrophobicContact CE1-CD1 3.61Å; F508-Y518 HydrophobicContact CE1-CD2 4.5Å; F508-Y518 AromaticContact CE1-CE1 3.74Å; F508-Y518 HydrophobicContact CE1-CE1 3.74Å; F508-Y518 HydrophobicContact CE1-CG 4.02Å; F508-Y518 HydrophobicContact CZ-CD1 4.4Å; Y513-Y518 WeakPolarHBondContact O-CE1 3.14Å; S514-Y518 VanDerWaalsContact O-CD1 3.3Å; S514-Y518 WeakPolarHBondContact O-CD1 3.48Å; M515-Y518 WeakPolarHBondContact O-CB 3.45Å; M515-Y518 PolarHBondContact O-N 2.88Å; Y518-I521 PolarHBondContact O-N 3.17Å; Y518-Y522 HydrophobicContact CD2-CE2 4.46Å; Y518-Y522 HydrophobicContact CG-CE2 4.37Å; Y518-Y522 WeakPolarHBondContact O-CB 3.4Å; Y518-Y522 WeakPolarHBondContact O-CD2 3Å; Y518-Y522 PolarHBondContact O-N 3.45Å; Y518-M593 HydrophobicContact CD2-CE 4.38Å; Y518-M593 HydrophobicContact CD2-SD 4.17Å; Y518-F711 HydrophobicContact CE2-CD2 4.2Å; Y518-F711 HydrophobicContact CE2-CG 4.37Å; Y518-F713 HydrophobicContact CE2-CE2 4.27Å; Y518-F713 HydrophobicContact CE2-CZ 4.05Å
519	Y	96.4	Very high	96.6	Very high	36 Å²	36	31.3 Å²	31.3	14%	0.141	15%	0.153	C	C	.	.	H	α-helix	trans	-64.5	-43.9	-173.8	80.5	-76.3	0	0	0	112.5	H516 E517 W523 Y590 E612 F637	H516-Y519 VanDerWaalsContact O-CD1 3.3Å; H516-Y519 WeakPolarHBondContact O-CD1 3.34Å; H516-Y519 VanDerWaalsContact O-CE1 3.3Å; H516-Y519 WeakPolarHBondContact O-CE1 3.46Å; E517-Y519 PolarHBondContact O-N 3.21Å; E517-Y519 VanDerWaalsContact O-N 3.1Å; Y519-W523 WeakPolarHBondContact O-CB 3.35Å; Y519-W523 PolarHBondContact O-N 3.32Å; Y519-Y590 HydrophobicContact CD2-CE2 4.46Å; Y519-Y590 VanDerWaalsContact O-CD2 3.3Å; Y519-Y590 WeakPolarHBondContact O-CD2 3.39Å; Y519-E612 PolarHBondContact OH-OE1 3.28Å; Y519-E612 PolarHBondContact OH-OE2 3.48Å; Y519-F637 HydrophobicContact CD2-CZ 4.09Å; Y519-F637 AromaticContact CE2-CE1 3.93Å; Y519-F637 HydrophobicContact CE2-CE1 3.93Å; Y519-F637 AromaticContact CE2-CZ 3.5Å; Y519-F637 HydrophobicContact CE2-CZ 3.5Å
520	Y	97.5	Very high	96.7	Very high	1 Å²	1	29.5 Å²	29.5	0%	0.004	15%	0.145	C	C	.	.	H	α-helix	trans	-75.6	-28.7	179	57.1	-115.4	0	0	0	112.5	E517 Y524 E612 Y616 R619 F620 F637	E517-Y520 HydrophobicContact CB-CE1 4.04Å; E517-Y520 HydrophobicContact CB-CE2 3.98Å; E517-Y520 VanDerWaalsContact CB-CZ 3.48Å; E517-Y520 VanDerWaalsContact CB-OH 3.22Å; E517-Y520 WeakPolarHBondContact CB-OH 3.35Å; E517-Y520 VanDerWaalsContact CD-OH 3.31Å; E517-Y520 HydrophobicContact CG-CE1 4.39Å; E517-Y520 WeakPolarHBondContact CG-OH 3.47Å; E517-Y520 WeakPolarHBondContact O-CD2 3.39Å; E517-Y520 WeakPolarHBondContact O-CE2 3.35Å; E517-Y520 PolarHBondContact O-N 3.38Å; E517-Y520 PolarHBondContact OE1-OH 2.97Å; Y520-Y524 VanDerWaalsContact O-CB 3.31Å; Y520-Y524 WeakPolarHBondContact O-CB 3.49Å; Y520-Y524 PolarHBondContact O-N 3.45Å; Y520-E612 HydrophobicContact CE1-CG 4.43Å; Y520-Y616 HydrophobicContact CD2-CD2 4.13Å; Y520-Y616 HydrophobicContact CG-CD2 4.03Å; Y520-R619 HydrophobicContact CE2-CG 4.1Å; Y520-F620 AromaticContact CD2-CE2 3.93Å; Y520-F620 HydrophobicContact CD2-CE2 3.93Å; Y520-F620 HydrophobicContact CD2-CZ 4.25Å; Y520-F620 HydrophobicContact CE2-CE2 4.47Å; Y520-F637 VanDerWaalsContact CB-CZ 3.42Å
521	I	98.4	Very high	96.8	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-67	-51.6	173.5	-57.2	-63.1	0	0	0	110.1	L504 F508 Y513 E517 Y518 W523 Y524 L525 R619 F620	L504-I521 HydrophobicContact CB-CG2 4.48Å; L504-I521 HydrophobicContact CD2-CD1 4.48Å; F508-I521 HydrophobicContact CE2-CB 4.43Å; F508-I521 HydrophobicContact CE2-CG2 3.54Å; F508-I521 HydrophobicContact CZ-CB 4.2Å; F508-I521 HydrophobicContact CZ-CG2 3.8Å; Y513-I521 HydrophobicContact CD1-CD1 4.34Å; Y513-I521 HydrophobicContact CD1-CG1 4.33Å; Y513-I521 HydrophobicContact CD2-CG1 4.31Å; Y513-I521 HydrophobicContact CD2-CG2 4.35Å; Y513-I521 HydrophobicContact CE1-CD1 4Å; Y513-I521 HydrophobicContact CE1-CG1 4.38Å; Y513-I521 HydrophobicContact CE2-CG1 4.35Å; Y513-I521 HydrophobicContact CE2-CG2 3.89Å; Y513-I521 HydrophobicContact CG-CG1 4.31Å; E517-I521 PolarHBondContact O-N 3.4Å; Y518-I521 PolarHBondContact O-N 3.17Å; I521-W523 VanDerWaalsContact C-N 3.33Å; I521-W523 PolarHBondContact O-N 2.94Å; I521-Y524 PolarHBondContact O-N 3.2Å; I521-L525 HydrophobicContact CG2-CD1 4.17Å; I521-L525 WeakPolarHBondContact O-CG 3.29Å; I521-L525 PolarHBondContact O-N 3.12Å; I521-R619 HydrophobicContact CD1-CB 4.13Å; I521-R619 HydrophobicContact CD1-CG 4.22Å; I521-F620 HydrophobicContact CD1-CE1 4.48Å; I521-F620 HydrophobicContact CD1-CE2 4.41Å; I521-F620 HydrophobicContact CD1-CZ 3.89Å
522	Y	98.6	Very high	96.8	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-66	-34.9	178.2	-75.7	-56	0	0	0	112.7	F508 Y518 L525 S526 C586 M589 Y718 F719 P720	F508-Y522 HydrophobicContact CE1-CE1 4.36Å; F508-Y522 AromaticContact CE1-CE2 3.76Å; F508-Y522 HydrophobicContact CE1-CE2 3.76Å; F508-Y522 AromaticContact CE1-CZ 3.62Å; F508-Y522 WeakPolarHBondContact CE1-OH 3.34Å; F508-Y522 HydrophobicContact CE2-CD1 4.22Å; F508-Y522 AromaticContact CE2-CE1 3.72Å; F508-Y522 HydrophobicContact CE2-CE1 3.72Å; F508-Y522 HydrophobicContact CE2-CE2 4.42Å; F508-Y522 AromaticContact CE2-CZ 3.84Å; F508-Y522 HydrophobicContact CZ-CD1 4.1Å; F508-Y522 AromaticContact CZ-CD2 3.98Å; F508-Y522 HydrophobicContact CZ-CD2 3.98Å; F508-Y522 AromaticContact CZ-CE1 3.62Å; F508-Y522 HydrophobicContact CZ-CE1 3.62Å; F508-Y522 AromaticContact CZ-CE2 3.5Å; F508-Y522 HydrophobicContact CZ-CE2 3.5Å; F508-Y522 VanDerWaalsContact CZ-CE2 3.5Å; F508-Y522 HydrophobicContact CZ-CG 4.27Å; F508-Y522 AromaticContact CZ-CZ 3.29Å; Y518-Y522 HydrophobicContact CD2-CE2 4.46Å; Y518-Y522 HydrophobicContact CG-CE2 4.37Å; Y518-Y522 WeakPolarHBondContact O-CB 3.4Å; Y518-Y522 WeakPolarHBondContact O-CD2 3Å; Y518-Y522 PolarHBondContact O-N 3.45Å; Y522-L525 HydrophobicContact CD1-CD1 4.33Å; Y522-L525 PolarHBondContact O-N 3.33Å; Y522-S526 WeakPolarHBondContact O-CB 2.89Å; Y522-S526 PolarHBondContact O-N 3.42Å; Y522-S526 PolarHBondContact O-OG 2.95Å; Y522-S526 VanDerWaalsContact O-OG 3.09Å; Y522-C586 HydrophobicContact CD1-CB 4.22Å; Y522-M589 HydrophobicContact CD1-CB 4.02Å; Y522-M589 HydrophobicContact CD2-CB 3.52Å; Y522-M589 HydrophobicContact CD2-CG 4.43Å; Y522-M589 HydrophobicContact CE1-CB 4.16Å; Y522-M589 HydrophobicContact CE1-CG 4.3Å; Y522-M589 HydrophobicContact CE2-CB 3.65Å; Y522-M589 HydrophobicContact CE2-CE 4.08Å; Y522-M589 HydrophobicContact CE2-CG 4.09Å; Y522-M589 HydrophobicContact CG-CB 3.71Å; Y522-Y718 PolarHBondContact OH-O 3.39Å; Y522-F719 HydrophobicContact CD1-CE1 4.34Å; Y522-F719 AromaticContact CE1-CD1 3.85Å; Y522-F719 HydrophobicContact CE1-CD1 3.85Å; Y522-F719 AromaticContact CE1-CE1 3.77Å; Y522-F719 HydrophobicContact CE1-CE1 3.77Å; Y522-P720 WeakPolarHBondContact OH-CD 3.25Å
523	W	98.4	Very high	96.9	Very high	6 Å²	6	21.3 Å²	21.3	2%	0.023	11%	0.106	C	C	.	.	H	α-helix	trans	-60	-49.6	172.4	177.4	79.4	0	0	0	111.6	Y519 I521 L525 S526 E527 Y590 V632 F637 M640	Y519-W523 WeakPolarHBondContact O-CB 3.35Å; Y519-W523 PolarHBondContact O-N 3.32Å; I521-W523 VanDerWaalsContact C-N 3.33Å; I521-W523 PolarHBondContact O-N 2.94Å; W523-L525 VanDerWaalsContact C-N 3.28Å; W523-L525 PolarHBondContact O-N 2.89Å; W523-S526 PolarHBondContact O-N 3.45Å; W523-S526 PolarHBondContact O-OG 3.14Å; W523-E527 VanDerWaalsContact CD1-CG 3.48Å; W523-E527 HydrophobicContact CG-CG 4.28Å; W523-E527 HydrophobicContact CZ2-CB 4.44Å; W523-E527 WeakPolarHBondContact O-CB 3.3Å; W523-E527 PolarHBondContact O-N 3.28Å; W523-Y590 HydrophobicContact CB-CD1 4.49Å; W523-Y590 HydrophobicContact CB-CD2 3.65Å; W523-Y590 HydrophobicContact CB-CE2 3.71Å; W523-Y590 HydrophobicContact CB-CG 4.05Å; W523-Y590 AromaticContact CD1-CE1 3.45Å; W523-Y590 VanDerWaalsContact CD1-CE1 3.45Å; W523-Y590 AromaticContact CD1-CE2 3.68Å; W523-Y590 AromaticContact CD1-CZ 3.25Å; W523-Y590 HydrophobicContact CG-CD2 4.36Å; W523-Y590 HydrophobicContact CG-CE1 4.4Å; W523-Y590 AromaticContact CG-CE2 3.98Å; W523-Y590 HydrophobicContact CG-CE2 3.98Å; W523-V632 HydrophobicContact CH2-CG1 3.95Å; W523-V632 HydrophobicContact CZ3-CG1 4.16Å; W523-F637 HydrophobicContact CB-CE2 4.11Å; W523-F637 AromaticContact CD2-CD2 3.45Å; W523-F637 HydrophobicContact CD2-CD2 3.45Å; W523-F637 VanDerWaalsContact CD2-CD2 3.45Å; W523-F637 AromaticContact CD2-CE2 3.39Å; W523-F637 HydrophobicContact CD2-CE2 3.39Å; W523-F637 AromaticContact CE2-CD2 3.81Å; W523-F637 AromaticContact CE2-CE2 3.99Å; W523-F637 AromaticContact CE3-CD2 3.22Å; W523-F637 HydrophobicContact CE3-CD2 3.22Å; W523-F637 AromaticContact CE3-CE2 3.51Å; W523-F637 HydrophobicContact CE3-CE2 3.51Å; W523-F637 HydrophobicContact CE3-CG 4.3Å; W523-F637 HydrophobicContact CG-CD2 4.23Å; W523-F637 AromaticContact CG-CE2 3.67Å; W523-F637 HydrophobicContact CG-CE2 3.67Å; W523-F637 HydrophobicContact CH2-CB 4.42Å; W523-F637 AromaticContact CH2-CD2 3.81Å; W523-F637 HydrophobicContact CH2-CD2 3.81Å; W523-F637 AromaticContact CZ2-CD2 4Å; W523-F637 HydrophobicContact CZ2-CD2 4Å; W523-F637 HydrophobicContact CZ3-CB 4.23Å; W523-F637 AromaticContact CZ3-CD2 3.42Å; W523-F637 HydrophobicContact CZ3-CD2 3.42Å; W523-F637 VanDerWaalsContact CZ3-CD2 3.42Å; W523-F637 HydrophobicContact CZ3-CE2 4.2Å; W523-F637 HydrophobicContact CZ3-CG 4.23Å; W523-M640 HydrophobicContact CH2-CB 4.3Å; W523-M640 HydrophobicContact CH2-SD 4.11Å; W523-M640 HydrophobicContact CZ2-CB 3.67Å; W523-M640 HydrophobicContact CZ2-CE 4.28Å; W523-M640 HydrophobicContact CZ2-SD 4.19Å
524	Y	98.5	Very high	96.8	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.008	11%	0.113	C	C	.	.	I	π-helix	trans	-63.6	-38.3	-179	-160.3	-81.9	0	0	0	110.9	L504 Y520 I521 F528 L529 F620 F623 V632	L504-Y524 HydrophobicContact CD1-CD1 3.89Å; Y520-Y524 VanDerWaalsContact O-CB 3.31Å; Y520-Y524 WeakPolarHBondContact O-CB 3.49Å; Y520-Y524 PolarHBondContact O-N 3.45Å; I521-Y524 PolarHBondContact O-N 3.2Å; Y524-F528 HydrophobicContact CD1-CD1 4.2Å; Y524-F528 AromaticContact CE1-CD1 3.59Å; Y524-F528 HydrophobicContact CE1-CD1 3.59Å; Y524-F528 HydrophobicContact CE1-CE1 4.18Å; Y524-F528 HydrophobicContact CE2-CD1 4.13Å; Y524-F528 AromaticContact CZ-CD1 3.53Å; Y524-F528 AromaticContact CZ-CE1 3.83Å; Y524-F528 VanDerWaalsContact O-CB 3.29Å; Y524-F528 WeakPolarHBondContact O-CB 3.35Å; Y524-F528 PolarHBondContact O-N 2.86Å; Y524-F528 WeakPolarHBondContact OH-CE1 3.22Å; Y524-L529 HydrophobicContact CD1-CD1 3.74Å; Y524-L529 HydrophobicContact CD1-CD2 4.38Å; Y524-L529 HydrophobicContact CD1-CG 3.66Å; Y524-L529 HydrophobicContact CE1-CD1 3.84Å; Y524-L529 HydrophobicContact CE1-CD2 3.82Å; Y524-L529 HydrophobicContact CE1-CG 3.62Å; Y524-L529 PolarHBondContact O-N 3.01Å; Y524-F620 HydrophobicContact CD1-CD1 4.13Å; Y524-F620 AromaticContact CD1-CE1 3.64Å; Y524-F620 HydrophobicContact CD1-CE1 3.64Å; Y524-F620 HydrophobicContact CD1-CZ 4.47Å; Y524-F620 AromaticContact CD2-CD1 3.99Å; Y524-F620 HydrophobicContact CD2-CD1 3.99Å; Y524-F620 AromaticContact CD2-CE1 3.6Å; Y524-F620 HydrophobicContact CD2-CE1 3.6Å; Y524-F620 HydrophobicContact CD2-CE2 4.38Å; Y524-F620 AromaticContact CD2-CZ 3.83Å; Y524-F620 HydrophobicContact CD2-CZ 3.83Å; Y524-F620 HydrophobicContact CE1-CD1 4.18Å; Y524-F620 HydrophobicContact CE1-CE1 4.16Å; Y524-F620 HydrophobicContact CE2-CD1 4.03Å; Y524-F620 HydrophobicContact CE2-CE1 4.12Å; Y524-F620 HydrophobicContact CE2-CG 4.43Å; Y524-F620 HydrophobicContact CG-CD1 4.05Å; Y524-F620 AromaticContact CG-CE1 3.34Å; Y524-F620 HydrophobicContact CG-CE1 3.34Å; Y524-F620 AromaticContact CG-CZ 3.75Å; Y524-F620 HydrophobicContact CG-CZ 3.75Å; Y524-F623 HydrophobicContact CD1-CE2 4.28Å; Y524-F623 AromaticContact CE1-CD2 3.81Å; Y524-F623 HydrophobicContact CE1-CD2 3.81Å; Y524-F623 AromaticContact CE1-CE2 3.68Å; Y524-F623 HydrophobicContact CE1-CE2 3.68Å; Y524-F623 AromaticContact CZ-CD2 3.94Å; Y524-V632 HydrophobicContact CE2-CB 3.91Å; Y524-V632 HydrophobicContact CE2-CG2 4.11Å
525	L	98.5	Very high	96.9	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.113	C	C	.	.	I	π-helix	trans	-62.3	-52	171.6	-73.8	165.6	0	0	0	111.7	I501 L504 L505 F508 I521 Y522 W523 L529 Y530 C586	I501-L525 HydrophobicContact CB-CD2 4.48Å; I501-L525 HydrophobicContact CG1-CD2 4.31Å; I501-L525 HydrophobicContact CG2-CD2 4.23Å; L504-L525 HydrophobicContact CB-CD1 4.45Å; L504-L525 HydrophobicContact CB-CD2 4.06Å; L504-L525 HydrophobicContact CB-CG 4.36Å; L504-L525 HydrophobicContact CD1-CD2 3.93Å; L504-L525 HydrophobicContact CD1-CG 3.95Å; L505-L525 HydrophobicContact CD2-CD1 3.82Å; L505-L525 HydrophobicContact CD2-CD2 4.45Å; L505-L525 HydrophobicContact CG-CD2 4.46Å; F508-L525 HydrophobicContact CE2-CD1 4.36Å; I521-L525 HydrophobicContact CG2-CD1 4.17Å; I521-L525 WeakPolarHBondContact O-CG 3.29Å; I521-L525 PolarHBondContact O-N 3.12Å; Y522-L525 HydrophobicContact CD1-CD1 4.33Å; Y522-L525 PolarHBondContact O-N 3.33Å; W523-L525 VanDerWaalsContact C-N 3.28Å; W523-L525 PolarHBondContact O-N 2.89Å; L525-L529 HydrophobicContact CD2-CD1 4.29Å; L525-Y530 HydrophobicContact CB-CD2 4.29Å; L525-Y530 HydrophobicContact CB-CE2 4.34Å; L525-Y530 HydrophobicContact CD2-CE2 4.24Å; L525-Y530 WeakPolarHBondContact O-CB 3.49Å; L525-Y530 WeakPolarHBondContact O-CD2 3.41Å; L525-Y530 PolarHBondContact O-N 3.17Å; L525-C586 HydrophobicContact CB-CB 4.13Å
526	S	97.9	Very high	97	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.007	10%	0.104	C	C	.	.	I	π-helix	trans	-76.4	-51.9	-170.9	64.5	0	0	0	0	114.8	Y522 W523 Q583	Y522-S526 WeakPolarHBondContact O-CB 2.89Å; Y522-S526 PolarHBondContact O-N 3.42Å; Y522-S526 PolarHBondContact O-OG 2.95Å; Y522-S526 VanDerWaalsContact O-OG 3.09Å; W523-S526 PolarHBondContact O-N 3.45Å; W523-S526 PolarHBondContact O-OG 3.14Å; S526-Q583 WeakPolarHBondContact O-CG 3.42Å; S526-Q583 PolarHBondContact O-NE2 2.64Å
527	E	95.9	Very high	97.1	Very high	89 Å²	89	19.8 Å²	19.8	42%	0.416	10%	0.1	S	C	.	.	I	π-helix	trans	-84.6	-21.9	-171.4	-59.4	-59.1	154.6	0	0	111.9	W523 A531	W523-E527 VanDerWaalsContact CD1-CG 3.48Å; W523-E527 HydrophobicContact CG-CG 4.28Å; W523-E527 HydrophobicContact CZ2-CB 4.44Å; W523-E527 WeakPolarHBondContact O-CB 3.3Å; W523-E527 PolarHBondContact O-N 3.28Å; E527-A531 WeakPolarHBondContact O-CB 3.49Å
528	F	96.8	Very high	96.9	Very high	18 Å²	18	22.9 Å²	22.9	8%	0.079	12%	0.122	C	C	.	.	I	π-helix	trans	-114.4	-73.8	-175.7	-165.4	-107.3	0	0	0	112.4	Y524 A531 W532 P629 P630 V632	Y524-F528 HydrophobicContact CD1-CD1 4.2Å; Y524-F528 AromaticContact CE1-CD1 3.59Å; Y524-F528 HydrophobicContact CE1-CD1 3.59Å; Y524-F528 HydrophobicContact CE1-CE1 4.18Å; Y524-F528 HydrophobicContact CE2-CD1 4.13Å; Y524-F528 AromaticContact CZ-CD1 3.53Å; Y524-F528 AromaticContact CZ-CE1 3.83Å; Y524-F528 VanDerWaalsContact O-CB 3.29Å; Y524-F528 WeakPolarHBondContact O-CB 3.35Å; Y524-F528 PolarHBondContact O-N 2.86Å; Y524-F528 WeakPolarHBondContact OH-CE1 3.22Å; F528-A531 PolarHBondContact O-N 3.43Å; F528-W532 AromaticContact CD2-CD1 3.93Å; F528-W532 AromaticContact CD2-NE1 3.88Å; F528-W532 AromaticContact CE2-CD1 3.8Å; F528-W532 AromaticContact CE2-NE1 3.37Å; F528-W532 AromaticContact CZ-CD1 3.97Å; F528-W532 AromaticContact CZ-NE1 3.67Å; F528-W532 VanDerWaalsContact O-CD1 3.26Å; F528-W532 PolarHBondContact O-N 3.45Å; F528-P629 HydrophobicContact CE1-CB 3.92Å; F528-P629 HydrophobicContact CE1-CG 3.68Å; F528-P629 HydrophobicContact CE2-CB 4.49Å; F528-P629 HydrophobicContact CZ-CB 3.6Å; F528-P629 HydrophobicContact CZ-CG 3.92Å; F528-P630 WeakPolarHBondContact CZ-O 3.49Å; F528-V632 HydrophobicContact CD1-CG2 4.22Å; F528-V632 HydrophobicContact CD2-CG2 3.65Å; F528-V632 HydrophobicContact CE1-CG2 4.12Å; F528-V632 HydrophobicContact CE2-CG2 3.53Å; F528-V632 HydrophobicContact CG-CG2 4Å; F528-V632 HydrophobicContact CZ-CG2 3.78Å
529	L	98.2	Very high	96.7	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.132	C	C	.	.	I	π-helix	trans	-65.4	-49.1	-169.6	-67.7	179.9	0	0	0	113.8	L497 M500 I501 L504 Y524 L525 A531 W532 L533 F623	L497-L529 HydrophobicContact CD2-CD2 3.98Å; M500-L529 HydrophobicContact CB-CD1 3.99Å; M500-L529 HydrophobicContact CB-CD2 4.09Å; M500-L529 HydrophobicContact CE-CD2 3.77Å; M500-L529 HydrophobicContact SD-CD2 3.92Å; I501-L529 HydrophobicContact CD1-CB 4.2Å; I501-L529 HydrophobicContact CG1-CB 3.76Å; I501-L529 HydrophobicContact CG1-CD1 3.94Å; I501-L529 HydrophobicContact CG1-CG 4.45Å; L504-L529 HydrophobicContact CD1-CD1 3.69Å; Y524-L529 HydrophobicContact CD1-CD1 3.74Å; Y524-L529 HydrophobicContact CD1-CD2 4.38Å; Y524-L529 HydrophobicContact CD1-CG 3.66Å; Y524-L529 HydrophobicContact CE1-CD1 3.84Å; Y524-L529 HydrophobicContact CE1-CD2 3.82Å; Y524-L529 HydrophobicContact CE1-CG 3.62Å; Y524-L529 PolarHBondContact O-N 3.01Å; L525-L529 HydrophobicContact CD2-CD1 4.29Å; L529-A531 VanDerWaalsContact C-N 3.32Å; L529-A531 PolarHBondContact O-N 3Å; L529-W532 PolarHBondContact O-N 3.01Å; L529-L533 WeakPolarHBondContact O-CB 3.4Å; L529-L533 PolarHBondContact O-N 2.8Å; L529-F623 HydrophobicContact CD1-CE2 4.46Å
530	Y	98.3	Very high	96.5	Very high	12 Å²	12	23.9 Å²	23.9	5%	0.047	13%	0.125	C	C	.	.	H	α-helix	trans	-67.3	-34.1	177.1	-80.3	-66.1	0	0	0	111.8	I501 L525 W532 L533 M534 Y582 Q583	I501-Y530 HydrophobicContact CD1-CD1 4.05Å; I501-Y530 HydrophobicContact CD1-CE1 3.89Å; I501-Y530 HydrophobicContact CD1-CG 4.48Å; I501-Y530 HydrophobicContact CG2-CE1 4.41Å; I501-Y530 HydrophobicContact CG2-CE2 4.34Å; I501-Y530 WeakPolarHBondContact CG2-OH 3.46Å; L525-Y530 HydrophobicContact CB-CD2 4.29Å; L525-Y530 HydrophobicContact CB-CE2 4.34Å; L525-Y530 HydrophobicContact CD2-CE2 4.24Å; L525-Y530 WeakPolarHBondContact O-CB 3.49Å; L525-Y530 WeakPolarHBondContact O-CD2 3.41Å; L525-Y530 PolarHBondContact O-N 3.17Å; Y530-W532 PolarHBondContact O-N 3.49Å; Y530-L533 HydrophobicContact CD1-CD2 4.07Å; Y530-L533 HydrophobicContact CE1-CD2 4.22Å; Y530-L533 PolarHBondContact O-N 3.1Å; Y530-M534 WeakPolarHBondContact O-CB 3.25Å; Y530-M534 VanDerWaalsContact O-CG 3.24Å; Y530-M534 WeakPolarHBondContact O-CG 3.42Å; Y530-M534 PolarHBondContact O-N 2.55Å; Y530-Y582 HydrophobicContact CE1-CG 4.48Å; Y530-Y582 HydrophobicContact CE2-CD1 4.39Å; Y530-Y582 AromaticContact CZ-CD1 3.87Å; Y530-Y582 WeakPolarHBondContact OH-CD1 3.3Å; Y530-Q583 HydrophobicContact CG-CB 4.12Å
531	A	96.6	Very high	96.1	Very high	38 Å²	38	24.8 Å²	24.8	31%	0.314	13%	0.13	S	C	.	.	H	α-helix	trans	-61.4	-44.9	174.5	0	0	0	0	0	111.6	E527 F528 L529 M534 S535	E527-A531 WeakPolarHBondContact O-CB 3.49Å; F528-A531 PolarHBondContact O-N 3.43Å; L529-A531 VanDerWaalsContact C-N 3.32Å; L529-A531 PolarHBondContact O-N 3Å; A531-M534 PolarHBondContact O-N 2.92Å; A531-S535 PolarHBondContact O-N 2.94Å; A531-S535 VanDerWaalsContact O-N 3.08Å
532	W	97.6	Very high	95.6	Very high	80 Å²	80	28 Å²	28	30%	0.303	15%	0.153	S	C	.	.	H	α-helix	trans	-63.8	-40.1	173	-86.9	103.6	0	0	0	112.9	L493 L497 F528 L529 Y530 S535 T536 T628 P629	L493-W532 HydrophobicContact CD2-CE3 4.46Å; L497-W532 HydrophobicContact CD1-CB 3.95Å; L497-W532 HydrophobicContact CD2-CB 3.71Å; F528-W532 AromaticContact CD2-CD1 3.93Å; F528-W532 AromaticContact CD2-NE1 3.88Å; F528-W532 AromaticContact CE2-CD1 3.8Å; F528-W532 AromaticContact CE2-NE1 3.37Å; F528-W532 AromaticContact CZ-CD1 3.97Å; F528-W532 AromaticContact CZ-NE1 3.67Å; F528-W532 VanDerWaalsContact O-CD1 3.26Å; F528-W532 PolarHBondContact O-N 3.45Å; L529-W532 PolarHBondContact O-N 3.01Å; Y530-W532 PolarHBondContact O-N 3.49Å; W532-S535 PolarHBondContact O-N 2.94Å; W532-T536 WeakPolarHBondContact O-CB 3.48Å; W532-T536 PolarHBondContact O-N 2.91Å; W532-T536 PolarHBondContact O-OG1 2.81Å; W532-T628 HydrophobicContact CZ3-CG2 4.49Å; W532-P629 HydrophobicContact CD2-CB 3.62Å; W532-P629 HydrophobicContact CD2-CG 4.49Å; W532-P629 HydrophobicContact CE3-CB 4.27Å; W532-P629 HydrophobicContact CG-CB 3.81Å; W532-P629 HydrophobicContact CG-CG 4.27Å; W532-P629 HydrophobicContact CH2-CB 4.47Å; W532-P629 HydrophobicContact CZ2-CB 3.86Å
533	L	97.8	Very high	95.1	Very high	3 Å²	3	29.8 Å²	29.8	2%	0.016	17%	0.165	C	C	.	.	H	α-helix	trans	-63.5	-45.6	177.6	-177.7	61	0	0	0	110.8	Y494 L497 I501 L529 Y530 S535 T536 L537	Y494-L533 HydrophobicContact CD2-CD1 3.68Å; Y494-L533 HydrophobicContact CE2-CD1 4.04Å; L497-L533 HydrophobicContact CB-CD1 4.26Å; L497-L533 HydrophobicContact CD1-CB 4.31Å; L497-L533 HydrophobicContact CD1-CD1 4.46Å; I501-L533 HydrophobicContact CD1-CB 4.45Å; I501-L533 HydrophobicContact CD1-CD2 3.76Å; L529-L533 WeakPolarHBondContact O-CB 3.4Å; L529-L533 PolarHBondContact O-N 2.8Å; Y530-L533 HydrophobicContact CD1-CD2 4.07Å; Y530-L533 HydrophobicContact CE1-CD2 4.22Å; Y530-L533 PolarHBondContact O-N 3.1Å; L533-S535 PolarHBondContact O-N 3.1Å; L533-T536 PolarHBondContact O-N 3.34Å; L533-L537 HydrophobicContact CD1-CD1 4.28Å; L533-L537 HydrophobicContact CD1-CG 4.27Å; L533-L537 HydrophobicContact CG-CD1 4.01Å; L533-L537 HydrophobicContact CG-CG 4.44Å; L533-L537 WeakPolarHBondContact O-CB 3.38Å; L533-L537 WeakPolarHBondContact O-CG 3.31Å; L533-L537 PolarHBondContact O-N 3.46Å
534	M	95.2	Very high	94.5	Very high	36 Å²	36	30.4 Å²	30.4	18%	0.177	17%	0.168	C	C	.	.	H	α-helix	trans	-60.6	-43.8	176.6	-68.4	-45.5	-64.3	0	0	112.1	Y530 A531 T536 L537 S538 I576 S579 Q580	Y530-M534 WeakPolarHBondContact O-CB 3.25Å; Y530-M534 VanDerWaalsContact O-CG 3.24Å; Y530-M534 WeakPolarHBondContact O-CG 3.42Å; Y530-M534 PolarHBondContact O-N 2.55Å; A531-M534 PolarHBondContact O-N 2.92Å; M534-T536 VanDerWaalsContact C-N 3.33Å; M534-T536 PolarHBondContact O-N 2.97Å; M534-L537 PolarHBondContact O-N 3.2Å; M534-S538 WeakPolarHBondContact O-CB 3.3Å; M534-S538 PolarHBondContact O-N 2.85Å; M534-I576 HydrophobicContact CE-CB 4.17Å; M534-I576 HydrophobicContact CE-CG2 3.55Å; M534-I576 WeakPolarHBondContact CE-O 3.48Å; M534-S579 WeakPolarHBondContact SD-CB 3.47Å; M534-Q580 HydrophobicContact CE-CB 4.19Å; M534-Q580 HydrophobicContact SD-CB 4.42Å
535	S	95.1	Very high	93.8	Very high	62 Å²	62	32.6 Å²	32.6	43%	0.434	18%	0.179	S	C	.	.	H	α-helix	trans	-62.7	-40.9	176	-175.1	0	0	0	0	111.7	A531 W532 L533 S538 R539	A531-S535 PolarHBondContact O-N 2.94Å; A531-S535 VanDerWaalsContact O-N 3.08Å; W532-S535 PolarHBondContact O-N 2.94Å; L533-S535 PolarHBondContact O-N 3.1Å; S535-S538 PolarHBondContact O-N 3.31Å; S535-R539 WeakPolarHBondContact O-CG 3.25Å; S535-R539 PolarHBondContact O-N 3.45Å
536	T	96.1	Very high	93.1	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-66.2	-45.3	178.1	-59.8	0	0	0	0	112.1	T490 L493 W532 L533 M534 S538 R539 A540	T490-T536 HydrophobicContact CG2-CG2 3.73Å; T490-T536 VanDerWaalsContact O-CG2 3.31Å; T490-T536 WeakPolarHBondContact O-CG2 3.46Å; L493-T536 HydrophobicContact CB-CG2 4.45Å; L493-T536 HydrophobicContact CD2-CG2 4.37Å; L493-T536 WeakPolarHBondContact CD2-OG1 3.24Å; L493-T536 HydrophobicContact CG-CG2 4.3Å; W532-T536 WeakPolarHBondContact O-CB 3.48Å; W532-T536 PolarHBondContact O-N 2.91Å; W532-T536 PolarHBondContact O-OG1 2.81Å; L533-T536 PolarHBondContact O-N 3.34Å; M534-T536 VanDerWaalsContact C-N 3.33Å; M534-T536 PolarHBondContact O-N 2.97Å; T536-S538 PolarHBondContact O-N 3.26Å; T536-R539 PolarHBondContact O-N 3.22Å; T536-R539 PolarHBondContact OG1-NH2 3.45Å; T536-R539 VanDerWaalsContact OG1-NH2 3.14Å; T536-A540 PolarHBondContact O-N 2.96Å
537	L	94.9	Very high	92.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-63.2	-40.4	174.5	-69.8	169.7	0	0	0	112	F399 Y494 L533 M534 R539 A540 D541 E575 I576	F399-L537 HydrophobicContact CE2-CD2 4.2Å; F399-L537 HydrophobicContact CZ-CD2 4.02Å; Y494-L537 HydrophobicContact CD2-CD2 4Å; Y494-L537 HydrophobicContact CE2-CD2 3.98Å; L533-L537 HydrophobicContact CD1-CD1 4.28Å; L533-L537 HydrophobicContact CD1-CG 4.27Å; L533-L537 HydrophobicContact CG-CD1 4.01Å; L533-L537 HydrophobicContact CG-CG 4.44Å; L533-L537 WeakPolarHBondContact O-CB 3.38Å; L533-L537 WeakPolarHBondContact O-CG 3.31Å; L533-L537 PolarHBondContact O-N 3.46Å; M534-L537 PolarHBondContact O-N 3.2Å; L537-R539 VanDerWaalsContact C-N 3.34Å; L537-R539 PolarHBondContact O-N 2.95Å; L537-A540 PolarHBondContact O-N 3.37Å; L537-D541 PolarHBondContact O-N 2.85Å; L537-E575 HydrophobicContact CD1-CG 4Å; L537-E575 HydrophobicContact CD2-CG 4.2Å; L537-I576 HydrophobicContact CB-CD1 4.28Å; L537-I576 HydrophobicContact CB-CG1 3.75Å; L537-I576 HydrophobicContact CD1-CG1 3.98Å; L537-I576 HydrophobicContact CG-CG1 4.39Å
538	S	92.3	Very high	91.8	Very high	68 Å²	68	35.4 Å²	35.4	48%	0.476	20%	0.201	S	C	.	.	H	α-helix	trans	-65	-37	176.3	-173.9	0	0	0	0	112.4	M534 S535 T536 S542	M534-S538 WeakPolarHBondContact O-CB 3.3Å; M534-S538 PolarHBondContact O-N 2.85Å; S535-S538 PolarHBondContact O-N 3.31Å; T536-S538 PolarHBondContact O-N 3.26Å; S538-S542 WeakPolarHBondContact O-CB 3.16Å; S538-S542 PolarHBondContact O-N 3.34Å; S538-S542 PolarHBondContact O-OG 3.44Å
539	R	91.8	Very high	91.1	Very high	86 Å²	86	42.3 Å²	42.3	33%	0.325	23%	0.226	S	C	.	.	H	α-helix	trans	-64.5	-47	173.2	-76.2	-174.2	-65.1	164.8	-0.1	110.9	T490 S535 T536 L537 S542 S543	T490-R539 HydrophobicContact CG2-CB 4.18Å; S535-R539 WeakPolarHBondContact O-CG 3.25Å; S535-R539 PolarHBondContact O-N 3.45Å; T536-R539 PolarHBondContact O-N 3.22Å; T536-R539 PolarHBondContact OG1-NH2 3.45Å; T536-R539 VanDerWaalsContact OG1-NH2 3.14Å; L537-R539 VanDerWaalsContact C-N 3.34Å; L537-R539 PolarHBondContact O-N 2.95Å; R539-S542 WeakPolarHBondContact O-CB 3.45Å; R539-S542 PolarHBondContact O-N 2.9Å; R539-S543 PolarHBondContact O-N 3.07Å; R539-S543 PolarHBondContact O-OG 2.86Å
540	A	92.6	Very high	90.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-58.2	-49.7	177	0	0	0	0	0	112.1	F399 V400 T490 T536 L537 S542 S543 Q544 L572	F399-A540 HydrophobicContact CD1-CB 4.01Å; F399-A540 HydrophobicContact CE1-CB 3.61Å; F399-A540 HydrophobicContact CZ-CB 4.06Å; V400-A540 HydrophobicContact CG1-CB 3.99Å; T490-A540 HydrophobicContact CG2-CB 4.23Å; T536-A540 PolarHBondContact O-N 2.96Å; L537-A540 PolarHBondContact O-N 3.37Å; A540-S542 VanDerWaalsContact C-N 3.27Å; A540-S542 PolarHBondContact O-N 2.9Å; A540-S543 PolarHBondContact O-N 2.6Å; A540-Q544 WeakPolarHBondContact O-CG 3.37Å; A540-Q544 PolarHBondContact O-N 3.45Å; A540-L572 HydrophobicContact CB-CD1 3.67Å
541	D	89.4	Confident	89.3	Confident	20 Å²	20	47 Å²	47	11%	0.107	25%	0.25	C	C	.	.	H	α-helix	trans	-58.4	-39.7	176.7	-166.5	48.7	0	0	0	111.2	L537 Q544 M545 R570 L572	L537-D541 PolarHBondContact O-N 2.85Å; D541-Q544 PolarHBondContact O-N 2.99Å; D541-M545 WeakPolarHBondContact O-CG 3.19Å; D541-M545 PolarHBondContact O-N 2.99Å; D541-M545 WeakPolarHBondContact OD2-CE 3.29Å; D541-R570 IonicContact OD2-NH1 2.63Å; D541-L572 HydrophobicContact CB-CD1 4.47Å
542	S	88.2	Confident	88.6	Confident	68 Å²	68	47.8 Å²	47.8	48%	0.476	25%	0.247	S	C	.	.	H	α-helix	trans	-66.4	-42.7	177.4	-58.8	0	0	0	0	112.7	S538 R539 A540 M545 A546	S538-S542 WeakPolarHBondContact O-CB 3.16Å; S538-S542 PolarHBondContact O-N 3.34Å; S538-S542 PolarHBondContact O-OG 3.44Å; R539-S542 WeakPolarHBondContact O-CB 3.45Å; R539-S542 PolarHBondContact O-N 2.9Å; A540-S542 VanDerWaalsContact C-N 3.27Å; A540-S542 PolarHBondContact O-N 2.9Å; S542-M545 PolarHBondContact O-N 2.65Å; S542-A546 WeakPolarHBondContact O-CB 3.5Å; S542-A546 PolarHBondContact O-N 2.94Å
543	S	86.1	Confident	87.6	Confident	37 Å²	37	50.2 Å²	50.2	26%	0.259	26%	0.262	S	S	.	.	H	α-helix	trans	-60.9	-43.6	176	-65.4	0	0	0	0	111.6	R539 A540 A546 E547	R539-S543 PolarHBondContact O-N 3.07Å; R539-S543 PolarHBondContact O-OG 2.86Å; A540-S543 PolarHBondContact O-N 2.6Å; S543-A546 PolarHBondContact O-N 3.41Å; S543-E547 PolarHBondContact O-N 3.08Å; S543-E547 VanDerWaalsContact O-N 3.08Å
544	Q	85.9	Confident	86.3	Confident	19 Å²	19	54.5 Å²	54.5	9%	0.089	28%	0.282	C	S	.	.	H	α-helix	trans	-60.7	-47	175.3	-66.6	-167.6	-46.7	0	0	111.9	S398 F399 A540 D541 A546 E547 E548	S398-Q544 VanDerWaalsContact C-NE2 3.31Å; S398-Q544 PolarHBondContact O-NE2 3.44Å; F399-Q544 VanDerWaalsContact O-CD 3.27Å; F399-Q544 WeakPolarHBondContact O-CG 3.3Å; F399-Q544 PolarHBondContact O-NE2 3.18Å; A540-Q544 WeakPolarHBondContact O-CG 3.37Å; A540-Q544 PolarHBondContact O-N 3.45Å; D541-Q544 PolarHBondContact O-N 2.99Å; Q544-A546 VanDerWaalsContact C-N 3.32Å; Q544-A546 PolarHBondContact O-N 3.29Å; Q544-E547 PolarHBondContact O-N 3.15Å; Q544-E548 WeakPolarHBondContact O-CG 3.49Å; Q544-E548 PolarHBondContact O-N 3.39Å
545	M	84.7	Confident	85	Confident	48 Å²	48	58.3 Å²	58.3	24%	0.236	30%	0.299	C	S	.	.	H	α-helix	trans	-64.1	-36.9	179	-71.3	-169.8	-164.7	0	0	112.8	D541 S542 R549 R570	D541-M545 WeakPolarHBondContact O-CG 3.19Å; D541-M545 PolarHBondContact O-N 2.99Å; D541-M545 WeakPolarHBondContact OD2-CE 3.29Å; S542-M545 PolarHBondContact O-N 2.65Å; M545-R549 VanDerWaalsContact O-CG 3.27Å; M545-R549 WeakPolarHBondContact O-CG 3.17Å; M545-R549 PolarHBondContact O-N 2.9Å; M545-R549 VanDerWaalsContact O-N 3.08Å; M545-R570 VanDerWaalsContact CE-CZ 3.41Å
546	A	84.3	Confident	83.3	Confident	50 Å²	50	62.8 Å²	62.8	41%	0.413	31%	0.311	S	S	.	.	H	α-helix	trans	-64.4	-47.8	177.5	0	0	0	0	0	111	S542 S543 Q544 R549 I550	S542-A546 WeakPolarHBondContact O-CB 3.5Å; S542-A546 PolarHBondContact O-N 2.94Å; S543-A546 PolarHBondContact O-N 3.41Å; Q544-A546 VanDerWaalsContact C-N 3.32Å; Q544-A546 PolarHBondContact O-N 3.29Å; A546-R549 PolarHBondContact O-N 3.16Å; A546-I550 WeakPolarHBondContact O-CG1 3.19Å; A546-I550 PolarHBondContact O-N 3.32Å; A546-I550 VanDerWaalsContact O-N 3.12Å
547	E	82.4	Confident	81.4	Confident	15 Å²	15	66.1 Å²	66.1	7%	0.07	35%	0.345	C	S	.	.	H	α-helix	trans	-64.2	-42	177.9	-177.4	63.8	-162.7	0	0	111.4	S406 R482 S543 Q544 R549 I550 M551	S406-E547 WeakPolarHBondContact CB-OE1 3.43Å; S406-E547 PolarHBondContact OG-OE1 2.88Å; R482-E547 IonicContact CZ-OE1 2.83Å; R482-E547 IonicContact CZ-OE2 2.64Å; R482-E547 IonicContact NE-OE2 3.06Å; R482-E547 PolarHBondContact NE-OE2 3.25Å; R482-E547 VanDerWaalsContact NE-OE2 3.14Å; R482-E547 IonicContact NH2-OE1 2.85Å; R482-E547 PolarHBondContact NH2-OE1 3.02Å; R482-E547 IonicContact NH2-OE2 2.74Å; R482-E547 PolarHBondContact NH2-OE2 2.51Å; S543-E547 PolarHBondContact O-N 3.08Å; S543-E547 VanDerWaalsContact O-N 3.08Å; Q544-E547 PolarHBondContact O-N 3.15Å; E547-R549 VanDerWaalsContact C-N 3.33Å; E547-R549 PolarHBondContact O-N 2.95Å; E547-I550 PolarHBondContact O-N 3.28Å; E547-M551 HydrophobicContact CG-SD 4.47Å; E547-M551 VanDerWaalsContact O-CG 3.3Å; E547-M551 WeakPolarHBondContact O-CG 3.29Å; E547-M551 PolarHBondContact O-N 2.68Å
548	E	82.8	Confident	79.5	Confident	84 Å²	84	76.7 Å²	76.7	39%	0.393	39%	0.385	S	S	.	.	H	α-helix	trans	-58.7	-42.6	174.6	-78.1	-160.1	135.7	0	0	112.2	Q544 M551 E552 K568	Q544-E548 WeakPolarHBondContact O-CG 3.49Å; Q544-E548 PolarHBondContact O-N 3.39Å; E548-M551 PolarHBondContact O-N 2.61Å; E548-E552 WeakPolarHBondContact O-CG 3.46Å; E548-E552 PolarHBondContact O-N 2.91Å; E548-K568 IonicContact OE1-NZ 3.62Å; E548-K568 PolarHBondContact OE1-NZ 2.8Å
549	R	83.4	Confident	77.2	Confident	163 Å²	163	79 Å²	79	62%	0.615	40%	0.401	S	S	*	.	H	α-helix	trans	-62.5	-45.7	178	-73.9	175.3	-162.8	-160.3	7.8	111.7	M545 A546 E547 M551 E552 E553	M545-R549 VanDerWaalsContact O-CG 3.27Å; M545-R549 WeakPolarHBondContact O-CG 3.17Å; M545-R549 PolarHBondContact O-N 2.9Å; M545-R549 VanDerWaalsContact O-N 3.08Å; A546-R549 PolarHBondContact O-N 3.16Å; E547-R549 VanDerWaalsContact C-N 3.33Å; E547-R549 PolarHBondContact O-N 2.95Å; R549-M551 VanDerWaalsContact C-N 3.3Å; R549-M551 PolarHBondContact O-N 2.99Å; R549-E552 PolarHBondContact O-N 3.39Å; R549-E553 WeakPolarHBondContact O-CG 3.36Å; R549-E553 PolarHBondContact O-N 2.87Å
550	I	81.3	Confident	75	Confident	43 Å²	43	80.7 Å²	80.7	22%	0.221	43%	0.427	C	S	.	.	H	α-helix	trans	-60.2	-43.6	176.9	-66.1	168.6	0	0	0	110	R482 A546 E547 E552 E553 Q554	R482-I550 HydrophobicContact CG-CD1 4.08Å; A546-I550 WeakPolarHBondContact O-CG1 3.19Å; A546-I550 PolarHBondContact O-N 3.32Å; A546-I550 VanDerWaalsContact O-N 3.12Å; E547-I550 PolarHBondContact O-N 3.28Å; I550-E552 PolarHBondContact O-N 3.25Å; I550-E553 PolarHBondContact O-N 3.34Å; I550-Q554 VanDerWaalsContact O-CG 3.32Å; I550-Q554 WeakPolarHBondContact O-CG 3.46Å; I550-Q554 PolarHBondContact O-N 3.14Å
551	M	76.9	Confident	72.8	Confident	66 Å²	66	90 Å²	90	33%	0.325	47%	0.467	S	S	.	.	H	α-helix	trans	-64	-38.5	178.1	-71.5	-174.5	80.6	0	0	113.1	K408 E547 E548 R549 Q555	K408-M551 PolarHBondContact NZ-O 3.48Å; E547-M551 HydrophobicContact CG-SD 4.47Å; E547-M551 VanDerWaalsContact O-CG 3.3Å; E547-M551 WeakPolarHBondContact O-CG 3.29Å; E547-M551 PolarHBondContact O-N 2.68Å; E548-M551 PolarHBondContact O-N 2.61Å; R549-M551 VanDerWaalsContact C-N 3.3Å; R549-M551 PolarHBondContact O-N 2.99Å; M551-Q555 WeakPolarHBondContact O-CG 3.06Å; M551-Q555 PolarHBondContact O-N 3.27Å
552	E	80.8	Confident	70.8	Confident	56 Å²	56	99.6 Å²	99.6	26%	0.262	51%	0.508	S	S	.	.	H	α-helix	trans	-69.4	-41	176.7	-75	-172.8	171.2	0	0	112.5	E548 R549 I550 Q555 K556 K565	E548-E552 WeakPolarHBondContact O-CG 3.46Å; E548-E552 PolarHBondContact O-N 2.91Å; R549-E552 PolarHBondContact O-N 3.39Å; I550-E552 PolarHBondContact O-N 3.25Å; E552-Q555 PolarHBondContact O-N 3.21Å; E552-Q555 VanDerWaalsContact O-N 3.17Å; E552-K556 WeakPolarHBondContact O-CG 3.19Å; E552-K556 PolarHBondContact O-N 3.26Å; E552-K565 IonicContact OE1-NZ 3.11Å; E552-K565 PolarHBondContact OE1-NZ 2.68Å; E552-K565 IonicContact OE2-NZ 2.7Å; E552-K565 PolarHBondContact OE2-NZ 3.42Å
553	E	78.5	Confident	68.7	Low	130 Å²	130	102.2 Å²	102.2	61%	0.607	52%	0.521	S	S	*	.	H	α-helix	trans	-63.6	-42	176.9	-74.9	176.6	177.7	0	0	111.6	R549 I550 Q555 K556	R549-E553 WeakPolarHBondContact O-CG 3.36Å; R549-E553 PolarHBondContact O-N 2.87Å; I550-E553 PolarHBondContact O-N 3.34Å; E553-Q555 VanDerWaalsContact C-N 3.27Å; E553-Q555 PolarHBondContact O-N 2.82Å; E553-K556 PolarHBondContact O-N 3.35Å
554	Q	70.4	Confident	66.7	Low	93 Å²	93	110.2 Å²	110.2	44%	0.435	55%	0.551	S	S	.	*	H	α-helix	trans	-67.4	-24.2	174	-69	176.9	-3.6	0	0	113.2	I550	I550-Q554 VanDerWaalsContact O-CG 3.32Å; I550-Q554 WeakPolarHBondContact O-CG 3.46Å; I550-Q554 PolarHBondContact O-N 3.14Å
555	Q	67.6	Low	65	Low	117 Å²	117	116.8 Å²	116.8	55%	0.547	58%	0.579	S	S	.	*	H	α-helix	trans	-81.2	-31.1	175.1	-81	177.7	-3	0	0	113.2	M551 E552 E553 G557 R558	M551-Q555 WeakPolarHBondContact O-CG 3.06Å; M551-Q555 PolarHBondContact O-N 3.27Å; E552-Q555 PolarHBondContact O-N 3.21Å; E552-Q555 VanDerWaalsContact O-N 3.17Å; E553-Q555 VanDerWaalsContact C-N 3.27Å; E553-Q555 PolarHBondContact O-N 2.82Å; Q555-G557 PolarHBondContact O-N 3.01Å; Q555-G557 VanDerWaalsContact O-N 3.09Å; Q555-R558 PolarHBondContact O-N 3.15Å
556	K	59.7	Low	63.3	Low	155 Å²	155	123.7 Å²	123.7	67%	0.674	61%	0.608	S	S	*	*	H	α-helix	trans	-61.3	-17.7	177.9	-76.3	174.1	-174.2	166.1	0	113.9	E552 E553 R558	E552-K556 WeakPolarHBondContact O-CG 3.19Å; E552-K556 PolarHBondContact O-N 3.26Å; E553-K556 PolarHBondContact O-N 3.35Å; K556-R558 PolarHBondContact O-N 3.45Å
557	G	55.1	Low	61.6	Low	70 Å²	70	131.4 Å²	131.4	72%	0.722	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-10.8	171.8	0	0	0	0	0	114.9	Q555	Q555-G557 PolarHBondContact O-N 3.01Å; Q555-G557 VanDerWaalsContact O-N 3.09Å
558	R	54.3	Low	60.5	Low	222 Å²	222	137.4 Å²	137.4	84%	0.838	66%	0.658	S	S	*	*	S	Bend	trans	-133	98	178.9	-76.9	178	164	165.2	-5.2	110.7	Q555 K556	Q555-R558 PolarHBondContact O-N 3.15Å; K556-R558 PolarHBondContact O-N 3.45Å
559	S	45.7	Very low	59.4	Low	116 Å²	116	139.9 Å²	139.9	81%	0.811	68%	0.679	S	S	*	*			trans	80.6	121.6	172.2	79.9	0	0	0	0	118.1
560	S	45	Very low	58.7	Low	123 Å²	123	139 Å²	139	86%	0.86	68%	0.675	S	S	*	*			trans	-89.9	101.4	174.2	55.4	0	0	0	0	111
561	K	45.9	Very low	58.1	Low	195 Å²	195	141 Å²	141	85%	0.848	69%	0.691	S	S	*	*			trans	-147.5	106.5	154.3	-111.2	171.6	-174.5	174.2	0	109.2	T563	K561-T563 PolarHBondContact O-N 3.03Å
562	K	48	Very low	58.5	Low	222 Å²	222	138.3 Å²	138.3	97%	0.965	68%	0.678	S	S	*	*			trans	-70.8	89	175.3	-79.5	-179.3	176.8	174.8	0	109.5
563	T	43.2	Very low	58.8	Low	123 Å²	123	138.4 Å²	138.4	76%	0.755	69%	0.685	S	S	*	*			trans	-76.6	132.7	163.1	-19.1	0	0	0	0	108.5	K561 K565	K561-T563 PolarHBondContact O-N 3.03Å; T563-K565 PolarHBondContact O-N 2.77Å
564	K	44.9	Very low	59.2	Low	204 Å²	204	139 Å²	139	89%	0.887	68%	0.681	S	S	*	*			trans	-50.7	113.2	177.3	-86	178	173.9	175.7	0	109.7	K566	K564-K566 PolarHBondContact O-N 2.96Å; K564-K566 VanDerWaalsContact O-N 3.14Å
565	K	51.1	Low	60.1	Low	157 Å²	157	136.4 Å²	136.4	68%	0.683	67%	0.67	S	S	*	*			trans	-61	114.1	177.7	-73.5	-171.2	178.2	-167.7	0	109.2	E552 T563 K567	E552-K565 IonicContact OE1-NZ 3.11Å; E552-K565 PolarHBondContact OE1-NZ 2.68Å; E552-K565 IonicContact OE2-NZ 2.7Å; E552-K565 PolarHBondContact OE2-NZ 3.42Å; T563-K565 PolarHBondContact O-N 2.77Å; K565-K567 PolarHBondContact O-N 3.19Å
566	K	47	Very low	61.3	Low	193 Å²	193	132.7 Å²	132.7	84%	0.839	65%	0.653	S	S	*	*			trans	-58.4	133.7	161.8	-79.3	-177.2	174.6	-179.5	0	107.5	K564 K568	K564-K566 PolarHBondContact O-N 2.96Å; K564-K566 VanDerWaalsContact O-N 3.14Å; K566-K568 PolarHBondContact O-N 3.14Å
567	K	49.8	Very low	62.9	Low	213 Å²	213	126.9 Å²	126.9	93%	0.926	63%	0.63	S	S	*	*			trans	-60.8	104	173.9	-148.9	-179.7	-172.9	-175.9	0	106.8	K565	K565-K567 PolarHBondContact O-N 3.19Å
568	K	58.8	Low	64.7	Low	141 Å²	141	124.9 Å²	124.9	61%	0.613	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-65.2	140.9	-179.9	-78	-179.4	173.9	177.2	0	109.3	E548 K566 R570	E548-K568 IonicContact OE1-NZ 3.62Å; E548-K568 PolarHBondContact OE1-NZ 2.8Å; K566-K568 PolarHBondContact O-N 3.14Å; K568-R570 PolarHBondContact O-N 2.85Å
569	V	59	Low	66.7	Low	136 Å²	136	114.8 Å²	114.8	82%	0.824	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-67.3	128.3	174.4	179.8	0	0	0	0	107.9
570	R	69.4	Low	69.2	Low	144 Å²	144	113.2 Å²	113.2	54%	0.543	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-79.4	117.4	174.7	-71.1	-171.3	-172.2	-171.4	2.4	109	D541 M545 K568 L572 S573	D541-R570 IonicContact OD2-NH1 2.63Å; M545-R570 VanDerWaalsContact CE-CZ 3.41Å; K568-R570 PolarHBondContact O-N 2.85Å; R570-L572 VanDerWaalsContact C-N 3.33Å; R570-L572 PolarHBondContact O-N 2.64Å; R570-S573 WeakPolarHBondContact O-CB 3.31Å; R570-S573 PolarHBondContact O-N 3.2Å
571	P	69.9	Low	71.7	Confident	85 Å²	85	107.3 Å²	107.3	55%	0.552	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-36.4	-170.3	22.8	-32.2	0	0	0	113.1
572	L	84.5	Confident	74.1	Confident	10 Å²	10	99.3 Å²	99.3	5%	0.052	47%	0.47	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-1.7	-177.6	-56.5	-179.1	0	0	0	114.3	F399 A540 D541 R570 R574 E575 I576	F399-L572 HydrophobicContact CD2-CD1 4.41Å; F399-L572 HydrophobicContact CD2-CD2 3.54Å; F399-L572 HydrophobicContact CE2-CD1 4.18Å; F399-L572 HydrophobicContact CE2-CD2 3.47Å; F399-L572 VanDerWaalsContact CE2-CD2 3.47Å; F399-L572 HydrophobicContact CE2-CG 4.49Å; F399-L572 HydrophobicContact CZ-CD1 4.48Å; F399-L572 HydrophobicContact CZ-CD2 4.48Å; A540-L572 HydrophobicContact CB-CD1 3.67Å; D541-L572 HydrophobicContact CB-CD1 4.47Å; R570-L572 VanDerWaalsContact C-N 3.33Å; R570-L572 PolarHBondContact O-N 2.64Å; L572-R574 VanDerWaalsContact C-N 3.34Å; L572-R574 PolarHBondContact O-N 2.84Å; L572-E575 PolarHBondContact O-N 3.46Å; L572-I576 HydrophobicContact CB-CD1 4.16Å; L572-I576 WeakPolarHBondContact O-CB 3.4Å; L572-I576 WeakPolarHBondContact O-CG1 3.34Å; L572-I576 PolarHBondContact O-N 2.96Å
573	S	86	Confident	76.5	Confident	57 Å²	57	91 Å²	91	40%	0.399	43%	0.434	S	S	.	.	H	α-helix	trans	-61.7	-39.8	-171.3	-171.5	0	0	0	0	113.1	R570 T577	R570-S573 WeakPolarHBondContact O-CB 3.31Å; R570-S573 PolarHBondContact O-N 3.2Å; S573-T577 WeakPolarHBondContact O-CB 3.31Å; S573-T577 PolarHBondContact O-N 3.08Å; S573-T577 VanDerWaalsContact O-N 3.09Å; S573-T577 PolarHBondContact O-OG1 2.95Å
574	R	87.3	Confident	79.2	Confident	142 Å²	142	85.7 Å²	85.7	54%	0.536	40%	0.401	S	S	.	.	H	α-helix	trans	-65.8	-45.9	178.7	-179.1	174.9	174.4	-129.2	2.9	110.6	L572 T577 M578 D677	L572-R574 VanDerWaalsContact C-N 3.34Å; L572-R574 PolarHBondContact O-N 2.84Å; R574-T577 WeakPolarHBondContact O-CB 3.33Å; R574-T577 PolarHBondContact O-N 2.92Å; R574-M578 HydrophobicContact CG-CG 4.42Å; R574-M578 WeakPolarHBondContact O-CG 3.12Å; R574-M578 PolarHBondContact O-N 3.1Å; R574-D677 IonicContact CZ-OD2 3.35Å; R574-D677 IonicContact NH2-OD2 2.53Å; R574-D677 PolarHBondContact NH2-OD2 3.36Å
575	E	89.8	Confident	81.7	Confident	40 Å²	40	76 Å²	76	19%	0.187	36%	0.359	C	S	.	.	H	α-helix	trans	-65.1	-42.2	-178.8	-175.5	165.6	-148.1	0	0	112.8	Y494 R498 L537 L572 T577 M578 S579	Y494-E575 WeakPolarHBondContact CE2-OE1 3.41Å; Y494-E575 VanDerWaalsContact OH-CD 3.27Å; Y494-E575 PolarHBondContact OH-OE1 3.38Å; Y494-E575 PolarHBondContact OH-OE2 2.74Å; R498-E575 IonicContact NH1-OE1 3.28Å; L537-E575 HydrophobicContact CD1-CG 4Å; L537-E575 HydrophobicContact CD2-CG 4.2Å; L572-E575 PolarHBondContact O-N 3.46Å; E575-T577 VanDerWaalsContact C-N 3.31Å; E575-T577 PolarHBondContact O-N 2.84Å; E575-M578 PolarHBondContact O-N 3.23Å; E575-S579 VanDerWaalsContact O-CB 3.23Å; E575-S579 WeakPolarHBondContact O-CB 3.36Å; E575-S579 PolarHBondContact O-N 3.48Å; E575-S579 PolarHBondContact O-OG 3.21Å
576	I	92.8	Very high	84	Confident	38 Å²	38	68.5 Å²	68.5	20%	0.195	33%	0.326	C	S	.	.	H	α-helix	trans	-56.3	-47.6	171.3	-73.1	171.1	0	0	0	110.1	M534 L537 L572 S579 Q580	M534-I576 HydrophobicContact CE-CB 4.17Å; M534-I576 HydrophobicContact CE-CG2 3.55Å; M534-I576 WeakPolarHBondContact CE-O 3.48Å; L537-I576 HydrophobicContact CB-CD1 4.28Å; L537-I576 HydrophobicContact CB-CG1 3.75Å; L537-I576 HydrophobicContact CD1-CG1 3.98Å; L537-I576 HydrophobicContact CG-CG1 4.39Å; L572-I576 HydrophobicContact CB-CD1 4.16Å; L572-I576 WeakPolarHBondContact O-CB 3.4Å; L572-I576 WeakPolarHBondContact O-CG1 3.34Å; L572-I576 PolarHBondContact O-N 2.96Å; I576-S579 PolarHBondContact O-N 2.67Å; I576-Q580 WeakPolarHBondContact O-CB 3.4Å; I576-Q580 PolarHBondContact O-N 3.49Å
577	T	93.2	Very high	86.5	Confident	33 Å²	33	59.5 Å²	59.5	20%	0.202	29%	0.288	C	S	.	.	H	α-helix	trans	-63.7	-46	-178.4	-55.4	0	0	0	0	111.4	S573 R574 E575 Q580 A581 I669 I673	S573-T577 WeakPolarHBondContact O-CB 3.31Å; S573-T577 PolarHBondContact O-N 3.08Å; S573-T577 VanDerWaalsContact O-N 3.09Å; S573-T577 PolarHBondContact O-OG1 2.95Å; R574-T577 WeakPolarHBondContact O-CB 3.33Å; R574-T577 PolarHBondContact O-N 2.92Å; E575-T577 VanDerWaalsContact C-N 3.31Å; E575-T577 PolarHBondContact O-N 2.84Å; T577-Q580 PolarHBondContact O-N 3.1Å; T577-A581 PolarHBondContact O-N 2.88Å; T577-I669 HydrophobicContact CG2-CG2 3.46Å; T577-I669 VanDerWaalsContact CG2-CG2 3.46Å; T577-I669 WeakPolarHBondContact O-CG2 3.22Å; T577-I673 HydrophobicContact CG2-CD1 3.87Å; T577-I673 HydrophobicContact CG2-CG1 3.83Å
578	M	94.1	Very high	88.8	Confident	29 Å²	29	49.4 Å²	49.4	14%	0.143	24%	0.244	C	C	.	.	H	α-helix	trans	-66	-45	178.4	-71.5	-56.7	-65.5	0	0	111.9	R574 E575 Q580 A581 Y582 L670 I673 E679 V680 I683	R574-M578 HydrophobicContact CG-CG 4.42Å; R574-M578 WeakPolarHBondContact O-CG 3.12Å; R574-M578 PolarHBondContact O-N 3.1Å; E575-M578 PolarHBondContact O-N 3.23Å; M578-Q580 VanDerWaalsContact C-N 3.29Å; M578-Q580 PolarHBondContact O-N 3.25Å; M578-A581 WeakPolarHBondContact O-CB 3.06Å; M578-A581 PolarHBondContact O-N 3.3Å; M578-A581 VanDerWaalsContact O-N 3.16Å; M578-Y582 HydrophobicContact CE-CE2 4.23Å; M578-Y582 WeakPolarHBondContact O-CD2 3.29Å; M578-Y582 PolarHBondContact O-N 2.86Å; M578-L670 HydrophobicContact CE-CD2 4.4Å; M578-L670 HydrophobicContact SD-CD2 3.94Å; M578-I673 HydrophobicContact SD-CD1 3.63Å; M578-E679 HydrophobicContact CE-CG 4.24Å; M578-V680 HydrophobicContact CE-CG2 4.11Å; M578-V680 HydrophobicContact SD-CG2 3.77Å; M578-I683 HydrophobicContact CE-CD1 4.15Å
579	S	96.1	Very high	90.7	Very high	10 Å²	10	42.7 Å²	42.7	7%	0.07	22%	0.215	C	C	.	.	H	α-helix	trans	-60.7	-39.2	177.2	-61.8	0	0	0	0	111.6	M534 E575 I576 Y582 Q583	M534-S579 WeakPolarHBondContact SD-CB 3.47Å; E575-S579 VanDerWaalsContact O-CB 3.23Å; E575-S579 WeakPolarHBondContact O-CB 3.36Å; E575-S579 PolarHBondContact O-N 3.48Å; E575-S579 PolarHBondContact O-OG 3.21Å; I576-S579 PolarHBondContact O-N 2.67Å; S579-Y582 PolarHBondContact O-N 2.9Å; S579-Q583 WeakPolarHBondContact O-CB 3.38Å; S579-Q583 PolarHBondContact O-N 2.91Å
580	Q	96.5	Very high	92.5	Very high	82 Å²	82	36.4 Å²	36.4	38%	0.383	18%	0.176	S	C	.	.	H	α-helix	trans	-67.6	-37.9	175.6	-165.9	-177.9	3.3	0	0	112.6	M534 I576 T577 M578 N584 I669	M534-Q580 HydrophobicContact CE-CB 4.19Å; M534-Q580 HydrophobicContact SD-CB 4.42Å; I576-Q580 WeakPolarHBondContact O-CB 3.4Å; I576-Q580 PolarHBondContact O-N 3.49Å; T577-Q580 PolarHBondContact O-N 3.1Å; M578-Q580 VanDerWaalsContact C-N 3.29Å; M578-Q580 PolarHBondContact O-N 3.25Å; Q580-N584 PolarHBondContact O-N 3.43Å; Q580-N584 VanDerWaalsContact O-N 3.15Å; Q580-N584 PolarHBondContact O-ND2 3.39Å; Q580-I669 HydrophobicContact CB-CD1 4.29Å; Q580-I669 HydrophobicContact CG-CD1 3.71Å
581	A	97.4	Very high	93.9	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-64.5	-46.6	174.4	0	0	0	0	0	111.2	T577 M578 Q583 N584 M585 I669 L670	T577-A581 PolarHBondContact O-N 2.88Å; M578-A581 WeakPolarHBondContact O-CB 3.06Å; M578-A581 PolarHBondContact O-N 3.3Å; M578-A581 VanDerWaalsContact O-N 3.16Å; A581-Q583 PolarHBondContact O-N 3.25Å; A581-N584 PolarHBondContact O-N 3.44Å; A581-M585 WeakPolarHBondContact O-CG 3.48Å; A581-M585 PolarHBondContact O-N 3.22Å; A581-I669 HydrophobicContact CB-CG2 4.12Å; A581-L670 HydrophobicContact CB-CD1 4.16Å; A581-L670 HydrophobicContact CB-CD2 3.6Å; A581-L670 HydrophobicContact CB-CG 3.72Å
582	Y	98.1	Very high	95.2	Very high	27 Å²	27	27.2 Å²	27.2	11%	0.106	13%	0.132	C	C	.	.	H	α-helix	trans	-60.6	-42.7	175.8	-98.2	-98.2	0	0	0	112.9	L505 Y530 M578 S579 N584 M585 C586 E679 I683 Y718 F719	L505-Y582 HydrophobicContact CD1-CE1 4.28Å; Y530-Y582 HydrophobicContact CE1-CG 4.48Å; Y530-Y582 HydrophobicContact CE2-CD1 4.39Å; Y530-Y582 AromaticContact CZ-CD1 3.87Å; Y530-Y582 WeakPolarHBondContact OH-CD1 3.3Å; M578-Y582 HydrophobicContact CE-CE2 4.23Å; M578-Y582 WeakPolarHBondContact O-CD2 3.29Å; M578-Y582 PolarHBondContact O-N 2.86Å; S579-Y582 PolarHBondContact O-N 2.9Å; Y582-N584 VanDerWaalsContact C-N 3.3Å; Y582-N584 PolarHBondContact O-N 2.74Å; Y582-M585 PolarHBondContact O-N 3.29Å; Y582-C586 PolarHBondContact O-N 3.49Å; Y582-C586 PolarHBondContact O-SG 2.92Å; Y582-E679 PolarHBondContact OH-OE1 3.2Å; Y582-I683 HydrophobicContact CD2-CD1 3.96Å; Y582-I683 HydrophobicContact CE2-CD1 3.42Å; Y582-I683 VanDerWaalsContact CE2-CD1 3.42Å; Y582-Y718 HydrophobicContact CE1-CD2 4.01Å; Y582-Y718 HydrophobicContact CE1-CE2 4.47Å; Y582-F719 AromaticContact CD1-CE2 3.65Å; Y582-F719 HydrophobicContact CD1-CE2 3.65Å; Y582-F719 AromaticContact CD1-CZ 3.74Å; Y582-F719 HydrophobicContact CD1-CZ 3.74Å; Y582-F719 AromaticContact CE1-CE2 3.63Å; Y582-F719 HydrophobicContact CE1-CE2 3.63Å; Y582-F719 HydrophobicContact CE1-CZ 4.09Å; Y582-F719 HydrophobicContact CG-CE2 4.37Å
583	Q	98.4	Very high	95.8	Very high	46 Å²	46	26.9 Å²	26.9	22%	0.215	13%	0.13	C	C	.	.	H	α-helix	trans	-56.5	-46	174.6	-170.9	179.1	28.6	0	0	111.3	S526 Y530 S579 A581 C586 A587	S526-Q583 WeakPolarHBondContact O-CG 3.42Å; S526-Q583 PolarHBondContact O-NE2 2.64Å; Y530-Q583 HydrophobicContact CG-CB 4.12Å; S579-Q583 WeakPolarHBondContact O-CB 3.38Å; S579-Q583 PolarHBondContact O-N 2.91Å; A581-Q583 PolarHBondContact O-N 3.25Å; Q583-C586 PolarHBondContact O-N 3.22Å; Q583-A587 WeakPolarHBondContact O-CB 3.09Å; Q583-A587 PolarHBondContact O-N 2.85Å
584	N	98.5	Very high	96.3	Very high	13 Å²	13	25.2 Å²	25.2	7%	0.07	12%	0.116	C	C	.	.	H	α-helix	trans	-69.1	-36.5	178.7	-83.1	-72.2	0	0	0	112.8	Q580 A581 Y582 A587 G588 H662 Q665 A666	Q580-N584 PolarHBondContact O-N 3.43Å; Q580-N584 VanDerWaalsContact O-N 3.15Å; Q580-N584 PolarHBondContact O-ND2 3.39Å; A581-N584 PolarHBondContact O-N 3.44Å; Y582-N584 VanDerWaalsContact C-N 3.3Å; Y582-N584 PolarHBondContact O-N 2.74Å; N584-A587 PolarHBondContact O-N 3.38Å; N584-G588 PolarHBondContact O-N 3.09Å; N584-H662 WeakPolarHBondContact O-CB 3.16Å; N584-H662 PolarHBondContact OD1-ND1 3.32Å; N584-Q665 PolarHBondContact OD1-OE1 2.81Å; N584-A666 HydrophobicContact CB-CB 3.85Å
585	M	98.6	Very high	96.8	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-61.8	-46.1	172.4	-70.8	-62.1	-63.7	0	0	111.3	A581 Y582 G588 M589 F663 A666 I683 V686 A687 F719	A581-M585 WeakPolarHBondContact O-CG 3.48Å; A581-M585 PolarHBondContact O-N 3.22Å; Y582-M585 PolarHBondContact O-N 3.29Å; M585-G588 PolarHBondContact O-N 3.45Å; M585-M589 WeakPolarHBondContact O-CG 3.4Å; M585-M589 PolarHBondContact O-N 2.87Å; M585-F663 HydrophobicContact CE-CD1 4.1Å; M585-F663 HydrophobicContact CE-CE1 4.09Å; M585-F663 HydrophobicContact SD-CD1 3.76Å; M585-F663 HydrophobicContact SD-CE1 4.24Å; M585-A666 HydrophobicContact CG-CB 3.96Å; M585-A666 HydrophobicContact SD-CB 3.83Å; M585-I683 HydrophobicContact CE-CG2 4.09Å; M585-I683 HydrophobicContact CG-CG2 3.65Å; M585-I683 HydrophobicContact SD-CG2 3.81Å; M585-V686 HydrophobicContact CE-CB 4.19Å; M585-V686 HydrophobicContact CE-CG1 3.88Å; M585-A687 HydrophobicContact CE-CB 4.34Å; M585-A687 HydrophobicContact SD-CB 3.81Å; M585-F719 HydrophobicContact CB-CD1 4.05Å; M585-F719 HydrophobicContact CB-CD2 4.17Å; M585-F719 HydrophobicContact CB-CE1 3.65Å; M585-F719 HydrophobicContact CB-CE2 3.79Å; M585-F719 HydrophobicContact CB-CG 4.32Å; M585-F719 HydrophobicContact CB-CZ 3.52Å; M585-F719 HydrophobicContact CE-CB 4.09Å; M585-F719 HydrophobicContact CE-CD2 4.24Å; M585-F719 HydrophobicContact CE-CG 4.04Å; M585-F719 HydrophobicContact CG-CD2 4.48Å; M585-F719 HydrophobicContact CG-CE2 4.3Å; M585-F719 HydrophobicContact CG-CZ 4.48Å
586	C	98.8	Very high	97.1	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-62.2	-45.7	175.9	-64.2	0	0	0	0	111.5	Y522 L525 Y582 Q583 G588 M589 Y590	Y522-C586 HydrophobicContact CD1-CB 4.22Å; L525-C586 HydrophobicContact CB-CB 4.13Å; Y582-C586 PolarHBondContact O-N 3.49Å; Y582-C586 PolarHBondContact O-SG 2.92Å; Q583-C586 PolarHBondContact O-N 3.22Å; C586-G588 VanDerWaalsContact C-N 3.33Å; C586-G588 PolarHBondContact O-N 2.98Å; C586-M589 PolarHBondContact O-N 3.45Å; C586-Y590 WeakPolarHBondContact O-CB 3.48Å; C586-Y590 PolarHBondContact O-N 3.39Å
587	A	98.6	Very high	97.1	Very high	4 Å²	4	17.7 Å²	17.7	3%	0.033	9%	0.088	C	C	.	.	H	α-helix	trans	-61.5	-42.2	177.4	0	0	0	0	0	111.6	Q583 N584 M589 Y590 K591 H662	Q583-A587 WeakPolarHBondContact O-CB 3.09Å; Q583-A587 PolarHBondContact O-N 2.85Å; N584-A587 PolarHBondContact O-N 3.38Å; A587-M589 PolarHBondContact O-N 2.86Å; A587-Y590 PolarHBondContact O-N 2.91Å; A587-K591 VanDerWaalsContact O-CG 3.29Å; A587-K591 WeakPolarHBondContact O-CG 3.36Å; A587-K591 PolarHBondContact O-N 2.99Å; A587-H662 HydrophobicContact CB-CB 4.41Å
588	G	98.5	Very high	97.2	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-59	-46.4	174.5	0	0	0	0	0	112.2	N584 M585 C586 T592 A659	N584-G588 PolarHBondContact O-N 3.09Å; M585-G588 PolarHBondContact O-N 3.45Å; C586-G588 VanDerWaalsContact C-N 3.33Å; C586-G588 PolarHBondContact O-N 2.98Å; G588-T592 WeakPolarHBondContact O-CB 3.36Å; G588-T592 PolarHBondContact O-N 3.47Å; G588-T592 PolarHBondContact O-OG1 3.2Å; G588-A659 WeakPolarHBondContact O-CB 3.34Å
589	M	98.4	Very high	97.1	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-66.8	-42.6	176.9	-71.4	-54.7	-56.5	0	0	112.7	Y522 M585 C586 A587 K591 T592 M593 F663 F711 F719 P720 V722	Y522-M589 HydrophobicContact CD1-CB 4.02Å; Y522-M589 HydrophobicContact CD2-CB 3.52Å; Y522-M589 HydrophobicContact CD2-CG 4.43Å; Y522-M589 HydrophobicContact CE1-CB 4.16Å; Y522-M589 HydrophobicContact CE1-CG 4.3Å; Y522-M589 HydrophobicContact CE2-CB 3.65Å; Y522-M589 HydrophobicContact CE2-CE 4.08Å; Y522-M589 HydrophobicContact CE2-CG 4.09Å; Y522-M589 HydrophobicContact CG-CB 3.71Å; M585-M589 WeakPolarHBondContact O-CG 3.4Å; M585-M589 PolarHBondContact O-N 2.87Å; C586-M589 PolarHBondContact O-N 3.45Å; A587-M589 PolarHBondContact O-N 2.86Å; M589-K591 PolarHBondContact O-N 3.23Å; M589-T592 WeakPolarHBondContact O-CB 3.42Å; M589-T592 PolarHBondContact O-N 3.42Å; M589-M593 WeakPolarHBondContact O-CG 3.48Å; M589-M593 PolarHBondContact O-N 2.87Å; M589-F663 HydrophobicContact CG-CE1 4.22Å; M589-F663 HydrophobicContact CG-CZ 4.13Å; M589-F663 HydrophobicContact SD-CE1 4.22Å; M589-F663 HydrophobicContact SD-CZ 3.71Å; M589-F711 HydrophobicContact CE-CD1 4.28Å; M589-F711 HydrophobicContact CE-CE1 3.9Å; M589-F719 HydrophobicContact CG-CD1 4.23Å; M589-P720 HydrophobicContact CE-CG 3.63Å; M589-P720 HydrophobicContact SD-CG 4.38Å; M589-V722 HydrophobicContact CE-CG2 4.46Å; M589-V722 HydrophobicContact SD-CG2 4.5Å
590	Y	98.4	Very high	97	Very high	5 Å²	5	21.2 Å²	21.2	2%	0.02	11%	0.113	C	C	.	.	H	α-helix	trans	-55	-52.1	175.1	164.7	-127.2	0	0	0	111.7	Y519 W523 C586 A587 T592 M593 I594 S641	Y519-Y590 HydrophobicContact CD2-CE2 4.46Å; Y519-Y590 VanDerWaalsContact O-CD2 3.3Å; Y519-Y590 WeakPolarHBondContact O-CD2 3.39Å; W523-Y590 HydrophobicContact CB-CD1 4.49Å; W523-Y590 HydrophobicContact CB-CD2 3.65Å; W523-Y590 HydrophobicContact CB-CE2 3.71Å; W523-Y590 HydrophobicContact CB-CG 4.05Å; W523-Y590 AromaticContact CD1-CE1 3.45Å; W523-Y590 VanDerWaalsContact CD1-CE1 3.45Å; W523-Y590 AromaticContact CD1-CE2 3.68Å; W523-Y590 AromaticContact CD1-CZ 3.25Å; W523-Y590 HydrophobicContact CG-CD2 4.36Å; W523-Y590 HydrophobicContact CG-CE1 4.4Å; W523-Y590 AromaticContact CG-CE2 3.98Å; W523-Y590 HydrophobicContact CG-CE2 3.98Å; C586-Y590 WeakPolarHBondContact O-CB 3.48Å; C586-Y590 PolarHBondContact O-N 3.39Å; A587-Y590 PolarHBondContact O-N 2.91Å; Y590-T592 VanDerWaalsContact C-N 3.33Å; Y590-T592 PolarHBondContact O-N 3.36Å; Y590-M593 PolarHBondContact O-N 3.49Å; Y590-I594 HydrophobicContact CD2-CD1 3.78Å; Y590-I594 HydrophobicContact CD2-CG1 4.13Å; Y590-I594 HydrophobicContact CE1-CD1 3.95Å; Y590-I594 HydrophobicContact CE2-CD1 3.08Å; Y590-I594 HydrophobicContact CE2-CG1 3.74Å; Y590-I594 HydrophobicContact CG-CD1 4.47Å; Y590-I594 PolarHBondContact O-N 3.4Å; Y590-I594 VanDerWaalsContact O-N 3.1Å; Y590-I594 WeakPolarHBondContact OH-CD1 3.41Å; Y590-S641 WeakPolarHBondContact OH-CB 3.45Å
591	K	98.2	Very high	96.8	Very high	35 Å²	35	17.6 Å²	17.6	15%	0.152	10%	0.097	C	C	.	.	H	α-helix	trans	-63.9	-38.4	178.2	-62.6	-64.3	175.7	-174.4	0	112	A587 M589 I594 A595 L655 A659	A587-K591 VanDerWaalsContact O-CG 3.29Å; A587-K591 WeakPolarHBondContact O-CG 3.36Å; A587-K591 PolarHBondContact O-N 2.99Å; M589-K591 PolarHBondContact O-N 3.23Å; K591-I594 PolarHBondContact O-N 3.24Å; K591-A595 WeakPolarHBondContact O-CB 3.47Å; K591-A595 PolarHBondContact O-N 3.44Å; K591-L655 HydrophobicContact CD-CD2 3.95Å; K591-A659 HydrophobicContact CB-CB 3.89Å
592	T	97.9	Very high	96.5	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-57.8	-48.2	173.9	-60.6	0	0	0	0	111.3	G588 M589 Y590 A595 F596 A659 M694 V722	G588-T592 WeakPolarHBondContact O-CB 3.36Å; G588-T592 PolarHBondContact O-N 3.47Å; G588-T592 PolarHBondContact O-OG1 3.2Å; M589-T592 WeakPolarHBondContact O-CB 3.42Å; M589-T592 PolarHBondContact O-N 3.42Å; Y590-T592 VanDerWaalsContact C-N 3.33Å; Y590-T592 PolarHBondContact O-N 3.36Å; T592-A595 PolarHBondContact O-N 3.46Å; T592-F596 HydrophobicContact CG2-CD2 3.65Å; T592-F596 HydrophobicContact CG2-CE2 3.27Å; T592-F596 HydrophobicContact CG2-CZ 4.09Å; T592-F596 WeakPolarHBondContact O-CD2 3.4Å; T592-F596 WeakPolarHBondContact O-CG 3.33Å; T592-F596 PolarHBondContact O-N 3Å; T592-A659 WeakPolarHBondContact OG1-CB 3.35Å; T592-M694 HydrophobicContact CG2-CE 3.56Å; T592-M694 HydrophobicContact CG2-SD 3.68Å; T592-M694 PolarHBondContact OG1-SD 3.36Å; T592-M694 VanDerWaalsContact OG1-SD 3.34Å; T592-V722 HydrophobicContact CG2-CG2 4.43Å
593	M	97.3	Very high	96	Very high	4 Å²	4	25.9 Å²	25.9	2%	0.02	13%	0.129	C	C	.	.	H	α-helix	trans	-66.8	-40.5	-177.9	-67.9	-51.5	-56.4	0	0	112.6	M515 Y518 M589 Y590 F596 D597 V602 F711	M515-M593 HydrophobicContact CE-CE 4.29Å; M515-M593 HydrophobicContact CG-CE 3.93Å; M515-M593 VanDerWaalsContact O-CE 3.25Å; M515-M593 WeakPolarHBondContact O-CE 3.32Å; Y518-M593 HydrophobicContact CD2-CE 4.38Å; Y518-M593 HydrophobicContact CD2-SD 4.17Å; M589-M593 WeakPolarHBondContact O-CG 3.48Å; M589-M593 PolarHBondContact O-N 2.87Å; Y590-M593 PolarHBondContact O-N 3.49Å; M593-F596 PolarHBondContact O-N 3.43Å; M593-D597 PolarHBondContact O-N 3.05Å; M593-V602 HydrophobicContact CE-CG2 4.12Å; M593-F711 HydrophobicContact CE-CE2 4.45Å; M593-F711 HydrophobicContact CE-CZ 4.19Å; M593-F711 HydrophobicContact SD-CE1 4.02Å; M593-F711 HydrophobicContact SD-CE2 4.16Å; M593-F711 HydrophobicContact SD-CZ 3.4Å; M593-F711 WeakPolarHBondContact SD-CZ 3.25Å
594	I	96.5	Very high	95.5	Very high	21 Å²	21	28.9 Å²	28.9	11%	0.108	14%	0.142	C	C	.	.	H	α-helix	trans	-63.9	-44.6	174.9	-61.3	168.3	0	0	0	110.9	Y590 K591 F596 D597 M598 L643 L655	Y590-I594 HydrophobicContact CD2-CD1 3.78Å; Y590-I594 HydrophobicContact CD2-CG1 4.13Å; Y590-I594 HydrophobicContact CE1-CD1 3.95Å; Y590-I594 HydrophobicContact CE2-CD1 3.08Å; Y590-I594 HydrophobicContact CE2-CG1 3.74Å; Y590-I594 HydrophobicContact CG-CD1 4.47Å; Y590-I594 PolarHBondContact O-N 3.4Å; Y590-I594 VanDerWaalsContact O-N 3.1Å; Y590-I594 WeakPolarHBondContact OH-CD1 3.41Å; K591-I594 PolarHBondContact O-N 3.24Å; I594-F596 VanDerWaalsContact C-N 3.29Å; I594-F596 PolarHBondContact O-N 2.93Å; I594-D597 WeakPolarHBondContact O-CB 3.34Å; I594-D597 PolarHBondContact O-N 3.01Å; I594-D597 VanDerWaalsContact O-N 3.08Å; I594-M598 HydrophobicContact CG2-CG 4.2Å; I594-M598 HydrophobicContact CG2-SD 4.07Å; I594-M598 WeakPolarHBondContact O-CG 3.08Å; I594-M598 PolarHBondContact O-N 3.25Å; I594-L643 HydrophobicContact CG2-CD1 3.85Å; I594-L655 HydrophobicContact CB-CD1 4.18Å; I594-L655 HydrophobicContact CG2-CD1 3.71Å
595	A	96.3	Very high	94.9	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60.8	-40.2	179.5	0	0	0	0	0	111.8	K591 T592 M598 D599 L655 Y656	K591-A595 WeakPolarHBondContact O-CB 3.47Å; K591-A595 PolarHBondContact O-N 3.44Å; T592-A595 PolarHBondContact O-N 3.46Å; A595-M598 PolarHBondContact O-N 3.5Å; A595-D599 PolarHBondContact O-N 3.47Å; A595-L655 HydrophobicContact CB-CB 3.81Å; A595-L655 HydrophobicContact CB-CD1 4.49Å; A595-Y656 HydrophobicContact CB-CD1 3.51Å; A595-Y656 HydrophobicContact CB-CD2 4.16Å; A595-Y656 HydrophobicContact CB-CE1 3.31Å; A595-Y656 HydrophobicContact CB-CE2 3.99Å; A595-Y656 HydrophobicContact CB-CG 3.93Å; A595-Y656 PolarHBondContact O-OH 3.33Å
596	F	96.1	Very high	94.2	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-64.9	-38.3	172.7	-74.6	-40.4	0	0	0	113	T592 M593 I594 D599 G600 K601 V602 Y656 M694 L697 P709 F711 V722 L724	T592-F596 HydrophobicContact CG2-CD2 3.65Å; T592-F596 HydrophobicContact CG2-CE2 3.27Å; T592-F596 HydrophobicContact CG2-CZ 4.09Å; T592-F596 WeakPolarHBondContact O-CD2 3.4Å; T592-F596 WeakPolarHBondContact O-CG 3.33Å; T592-F596 PolarHBondContact O-N 3Å; M593-F596 PolarHBondContact O-N 3.43Å; I594-F596 VanDerWaalsContact C-N 3.29Å; I594-F596 PolarHBondContact O-N 2.93Å; F596-D599 PolarHBondContact O-N 2.86Å; F596-G600 PolarHBondContact O-N 3.43Å; F596-K601 HydrophobicContact CB-CB 4.2Å; F596-K601 HydrophobicContact CD1-CB 4.17Å; F596-K601 HydrophobicContact CD1-CD 3.71Å; F596-K601 HydrophobicContact CE1-CD 4.19Å; F596-K601 PolarHBondContact O-N 3.38Å; F596-V602 HydrophobicContact CB-CG2 3.82Å; F596-Y656 AromaticContact CD1-CE1 3.87Å; F596-Y656 HydrophobicContact CD1-CE1 3.87Å; F596-Y656 AromaticContact CD1-CZ 3.95Å; F596-Y656 WeakPolarHBondContact CD1-OH 3.49Å; F596-Y656 AromaticContact CE1-CE1 3.84Å; F596-Y656 HydrophobicContact CE1-CE1 3.84Å; F596-Y656 HydrophobicContact CG-CE1 4.45Å; F596-Y656 HydrophobicContact CZ-CE1 4.4Å; F596-M694 HydrophobicContact CZ-CE 4.27Å; F596-L697 HydrophobicContact CE1-CD1 3.58Å; F596-L697 HydrophobicContact CE1-CD2 4.42Å; F596-L697 HydrophobicContact CZ-CD1 3.76Å; F596-P709 HydrophobicContact CD1-CG 4.46Å; F596-P709 HydrophobicContact CD2-CG 3.83Å; F596-P709 HydrophobicContact CE1-CB 4.5Å; F596-P709 HydrophobicContact CE1-CG 4.32Å; F596-P709 HydrophobicContact CE2-CB 4.02Å; F596-P709 HydrophobicContact CE2-CG 3.64Å; F596-P709 HydrophobicContact CG-CG 4.25Å; F596-P709 HydrophobicContact CZ-CB 3.94Å; F596-P709 HydrophobicContact CZ-CG 3.92Å; F596-F711 HydrophobicContact CD2-CZ 4.32Å; F596-F711 HydrophobicContact CE2-CZ 4.23Å; F596-V722 HydrophobicContact CE2-CG1 3.8Å; F596-V722 HydrophobicContact CZ-CG1 3.71Å; F596-L724 HydrophobicContact CE1-CD2 4.38Å; F596-L724 HydrophobicContact CZ-CD2 4.37Å
597	D	94.1	Very high	93.6	Very high	62 Å²	62	41.7 Å²	41.7	33%	0.332	21%	0.211	S	C	.	.	H	α-helix	trans	-65.3	-44.3	177.3	-163.3	48.2	0	0	0	111.3	M593 I594 D599 G600 V602 K604	M593-D597 PolarHBondContact O-N 3.05Å; I594-D597 WeakPolarHBondContact O-CB 3.34Å; I594-D597 PolarHBondContact O-N 3.01Å; I594-D597 VanDerWaalsContact O-N 3.08Å; D597-D599 VanDerWaalsContact C-N 3.29Å; D597-D599 PolarHBondContact O-N 3.5Å; D597-G600 WeakPolarHBondContact O-CA 3.21Å; D597-G600 PolarHBondContact O-N 3.01Å; D597-V602 HydrophobicContact CB-CB 4.47Å; D597-V602 HydrophobicContact CB-CG2 3.97Å; D597-K604 WeakPolarHBondContact OD1-CE 3.4Å; D597-K604 IonicContact OD1-NZ 3.05Å; D597-K604 PolarHBondContact OD1-NZ 3.44Å; D597-K604 IonicContact OD2-NZ 3.15Å; D597-K604 PolarHBondContact OD2-NZ 3.19Å
598	M	93.6	Very high	93	Very high	88 Å²	88	49.7 Å²	49.7	43%	0.433	25%	0.247	S	C	.	.	H	α-helix	trans	-59.8	-38.2	175	-69.9	177.2	71.6	0	0	112.5	I594 A595 G600 L643 L655	I594-M598 HydrophobicContact CG2-CG 4.2Å; I594-M598 HydrophobicContact CG2-SD 4.07Å; I594-M598 WeakPolarHBondContact O-CG 3.08Å; I594-M598 PolarHBondContact O-N 3.25Å; A595-M598 PolarHBondContact O-N 3.5Å; M598-G600 PolarHBondContact O-N 3.08Å; M598-L643 HydrophobicContact SD-CD1 3.94Å; M598-L655 HydrophobicContact SD-CD1 3.39Å; M598-L655 WeakPolarHBondContact SD-CD1 3.34Å
599	D	93.8	Very high	92.5	Very high	18 Å²	18	58.2 Å²	58.2	10%	0.096	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-1.6	175.2	-78.5	-3.5	0	0	0	113	A595 F596 D597 K601 S652 Y656 K706	A595-D599 PolarHBondContact O-N 3.47Å; F596-D599 PolarHBondContact O-N 2.86Å; D597-D599 VanDerWaalsContact C-N 3.29Å; D597-D599 PolarHBondContact O-N 3.5Å; D599-K601 VanDerWaalsContact C-N 3.3Å; D599-K601 HydrophobicContact CB-CD 3.82Å; D599-K601 HydrophobicContact CB-CG 4.11Å; D599-K601 PolarHBondContact O-N 2.83Å; D599-K601 IonicContact OD2-NZ 3.6Å; D599-K601 PolarHBondContact OD2-NZ 3.49Å; D599-S652 WeakPolarHBondContact OD1-CB 3.38Å; D599-S652 PolarHBondContact OD1-OG 2.95Å; D599-Y656 VanDerWaalsContact OD2-CE2 3.31Å; D599-Y656 WeakPolarHBondContact OD2-CE2 3.15Å; D599-Y656 PolarHBondContact OD2-OH 3.01Å; D599-K706 WeakPolarHBondContact O-CD 3.41Å; D599-K706 PolarHBondContact O-NZ 3.41Å
600	G	92.5	Very high	92	Very high	40 Å²	40	61.1 Å²	61.1	41%	0.412	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.8	28.2	-177.6	0	0	0	0	0	114	F596 D597 M598	F596-G600 PolarHBondContact O-N 3.43Å; D597-G600 WeakPolarHBondContact O-CA 3.21Å; D597-G600 PolarHBondContact O-N 3.01Å; M598-G600 PolarHBondContact O-N 3.08Å
601	K	92.7	Very high	91.7	Very high	7 Å²	7	63.2 Å²	63.2	3%	0.03	32%	0.323	C	S	.	.			trans	-93.3	-9.3	179	-68.6	165.3	179.3	155.7	0	112.8	F596 D599 K702 S705 P708	F596-K601 HydrophobicContact CB-CB 4.2Å; F596-K601 HydrophobicContact CD1-CB 4.17Å; F596-K601 HydrophobicContact CD1-CD 3.71Å; F596-K601 HydrophobicContact CE1-CD 4.19Å; F596-K601 PolarHBondContact O-N 3.38Å; D599-K601 VanDerWaalsContact C-N 3.3Å; D599-K601 HydrophobicContact CB-CD 3.82Å; D599-K601 HydrophobicContact CB-CG 4.11Å; D599-K601 PolarHBondContact O-N 2.83Å; D599-K601 IonicContact OD2-NZ 3.6Å; D599-K601 PolarHBondContact OD2-NZ 3.49Å; K601-K702 PolarHBondContact NZ-O 2.85Å; K601-S705 WeakPolarHBondContact CE-O 3.47Å; K601-P708 WeakPolarHBondContact O-CA 3.36Å; K601-P708 WeakPolarHBondContact O-CB 3.22Å
602	V	92.1	Very high	91.5	Very high	17 Å²	17	63.4 Å²	63.4	10%	0.103	32%	0.324	C	S	.	.	S	Bend	trans	-89.8	120.5	175.2	-178	0	0	0	0	109.6	M515 H516 M593 F596 D597 K604	M515-V602 HydrophobicContact CE-CB 4.21Å; M515-V602 HydrophobicContact CE-CG1 4.3Å; M515-V602 HydrophobicContact CE-CG2 3.96Å; H516-V602 HydrophobicContact CB-CG1 3.79Å; M593-V602 HydrophobicContact CE-CG2 4.12Å; F596-V602 HydrophobicContact CB-CG2 3.82Å; D597-V602 HydrophobicContact CB-CB 4.47Å; D597-V602 HydrophobicContact CB-CG2 3.97Å; V602-K604 PolarHBondContact O-N 3.16Å
603	R	87.1	Confident	91.4	Very high	184 Å²	184	67.1 Å²	67.1	69%	0.694	34%	0.342	S	S	*	.			trans	-77	123.6	173.2	-70.2	-176.6	179.9	167	8.2	110	P708	R603-P708 HydrophobicContact CG-CG 3.7Å; R603-P708 VanDerWaalsContact NE-CG 3.28Å
604	K	87.5	Confident	91.2	Very high	109 Å²	109	69.8 Å²	69.8	47%	0.474	36%	0.358	S	S	.	.			trans	-111.9	126.3	173.3	-63.6	-179	-175.9	171.8	0	108.8	H516 D597 V602	H516-K604 HydrophobicContact CB-CG 4.17Å; D597-K604 WeakPolarHBondContact OD1-CE 3.4Å; D597-K604 IonicContact OD1-NZ 3.05Å; D597-K604 PolarHBondContact OD1-NZ 3.44Å; D597-K604 IonicContact OD2-NZ 3.15Å; D597-K604 PolarHBondContact OD2-NZ 3.19Å; V602-K604 PolarHBondContact O-N 3.16Å
605	P	85.3	Confident	91.1	Very high	69 Å²	69	70.1 Å²	70.1	45%	0.448	36%	0.358	S	S	.	.			trans	-56.4	155.5	168.6	-21.5	30.4	0	0	0	111.7	F607	P605-F607 HydrophobicContact CB-CD1 4.22Å; P605-F607 HydrophobicContact CB-CE1 3.74Å; P605-F607 HydrophobicContact CB-CE2 4.36Å; P605-F607 HydrophobicContact CB-CZ 3.83Å; P605-F607 HydrophobicContact CG-CE1 3.87Å; P605-F607 HydrophobicContact CG-CZ 3.73Å; P605-F607 VanDerWaalsContact O-CD2 3.22Å; P605-F607 WeakPolarHBondContact O-CD2 3.46Å; P605-F607 VanDerWaalsContact O-CE2 3.28Å; P605-F607 WeakPolarHBondContact O-CE2 3.28Å; P605-F607 PolarHBondContact O-N 2.86Å
606	N	85.8	Confident	91.1	Very high	144 Å²	144	70.3 Å²	70.3	77%	0.77	36%	0.359	S	S	*	.			trans	-79.1	115.4	166.6	-170.6	30.2	0	0	0	108.4
607	F	84.1	Confident	91.1	Very high	68 Å²	68	74.6 Å²	74.6	30%	0.298	38%	0.379	S	S	.	.			trans	-100.8	111.8	-175.5	-56.3	-74.7	0	0	0	110	H516 P605 D610 R615	H516-F607 AromaticContact NE2-CZ 3.68Å; P605-F607 HydrophobicContact CB-CD1 4.22Å; P605-F607 HydrophobicContact CB-CE1 3.74Å; P605-F607 HydrophobicContact CB-CE2 4.36Å; P605-F607 HydrophobicContact CB-CZ 3.83Å; P605-F607 HydrophobicContact CG-CE1 3.87Å; P605-F607 HydrophobicContact CG-CZ 3.73Å; P605-F607 VanDerWaalsContact O-CD2 3.22Å; P605-F607 WeakPolarHBondContact O-CD2 3.46Å; P605-F607 VanDerWaalsContact O-CE2 3.28Å; P605-F607 WeakPolarHBondContact O-CE2 3.28Å; P605-F607 PolarHBondContact O-N 2.86Å; F607-D610 HydrophobicContact CB-CB 4.23Å; F607-D610 VanDerWaalsContact CB-O 3.3Å; F607-D610 WeakPolarHBondContact CB-O 3.47Å; F607-D610 HydrophobicContact CD1-CB 4.05Å; F607-D610 HydrophobicContact CG-CB 4.49Å; F607-R615 VanDerWaalsContact CD1-NH1 3.3Å; F607-R615 VanDerWaalsContact CZ-CZ 3.48Å; F607-R615 VanDerWaalsContact CZ-NH1 3.27Å
608	E	87.5	Confident	91.2	Very high	172 Å²	172	78 Å²	78	80%	0.804	39%	0.392	S	S	*	.	S	Bend	trans	-91.7	-36.1	175.8	-67.6	-176.5	178.1	0	0	112.8
609	L	88.3	Confident	91.3	Very high	180 Å²	180	76.8 Å²	76.8	94%	0.942	38%	0.383	S	S	*	.	S	Bend	trans	-118.6	10.1	-175.9	-60.4	177.5	0	0	0	113.3
610	D	88.1	Confident	91.5	Very high	60 Å²	60	76.4 Å²	76.4	32%	0.321	38%	0.38	S	S	.	.			trans	-135.2	154.9	-172.3	-175.2	20.8	0	0	0	110.7	F607 R615	F607-D610 HydrophobicContact CB-CB 4.23Å; F607-D610 VanDerWaalsContact CB-O 3.3Å; F607-D610 WeakPolarHBondContact CB-O 3.47Å; F607-D610 HydrophobicContact CD1-CB 4.05Å; F607-D610 HydrophobicContact CG-CB 4.49Å; D610-R615 IonicContact OD1-NH1 3.83Å; D610-R615 WeakPolarHBondContact OD2-CD 3.37Å; D610-R615 WeakPolarHBondContact OD2-CG 3.42Å; D610-R615 IonicContact OD2-CZ 3.9Å; D610-R615 IonicContact OD2-NE 3.02Å; D610-R615 IonicContact OD2-NH1 3.85Å; D610-R615 PolarHBondContact OD2-NH1 2.97Å
611	S	91.1	Very high	91.6	Very high	49 Å²	49	76.4 Å²	76.4	34%	0.343	38%	0.377	S	S	.	.			trans	-141.2	158.9	175.4	72.3	0	0	0	0	111.3	Q613 V614 R615	S611-Q613 PolarHBondContact O-N 3.47Å; S611-V614 PolarHBondContact O-N 3Å; S611-V614 WeakPolarHBondContact OG-CG2 3.41Å; S611-V614 PolarHBondContact OG-N 2.8Å; S611-R615 PolarHBondContact O-N 3.28Å; S611-R615 VanDerWaalsContact O-N 3.17Å
612	E	93.8	Very high	91.7	Very high	39 Å²	39	77.4 Å²	77.4	18%	0.182	38%	0.384	C	S	.	.	H	α-helix	trans	-56.5	-34.8	175.1	-175.1	-178.6	103.1	0	0	112.1	Y519 Y520 Y616 Y634 K638	Y519-E612 PolarHBondContact OH-OE1 3.28Å; Y519-E612 PolarHBondContact OH-OE2 3.48Å; Y520-E612 HydrophobicContact CE1-CG 4.43Å; E612-Y616 VanDerWaalsContact O-CB 3.24Å; E612-Y616 WeakPolarHBondContact O-CB 3.39Å; E612-Y616 PolarHBondContact O-N 3.45Å; E612-Y634 HydrophobicContact CB-CE2 4.37Å; E612-Y634 VanDerWaalsContact CD-OH 3.26Å; E612-Y634 HydrophobicContact CG-CE2 3.8Å; E612-Y634 WeakPolarHBondContact OE1-CE2 3.48Å; E612-Y634 PolarHBondContact OE1-OH 2.93Å; E612-K638 IonicContact OE1-NZ 3.27Å; E612-K638 PolarHBondContact OE1-NZ 3.45Å
613	Q	95.4	Very high	91.9	Very high	78 Å²	78	76.7 Å²	76.7	36%	0.364	38%	0.38	S	S	.	.	H	α-helix	trans	-61.3	-50.5	176.5	-180	170.5	-2.6	0	0	111.9	S611 R615 Y616 E617 Y634	S611-Q613 PolarHBondContact O-N 3.47Å; Q613-R615 PolarHBondContact O-N 3.48Å; Q613-Y616 WeakPolarHBondContact O-CB 3.41Å; Q613-Y616 PolarHBondContact O-N 3.4Å; Q613-E617 HydrophobicContact CG-CG 4.39Å; Q613-E617 VanDerWaalsContact CG-OE1 3.24Å; Q613-E617 WeakPolarHBondContact CG-OE1 3.46Å; Q613-E617 PolarHBondContact NE2-OE1 3.07Å; Q613-E617 WeakPolarHBondContact O-CB 3.28Å; Q613-E617 WeakPolarHBondContact O-CG 3.49Å; Q613-E617 PolarHBondContact O-N 3.19Å; Q613-Y634 HydrophobicContact CB-CD1 3.48Å; Q613-Y634 VanDerWaalsContact CB-CD1 3.48Å; Q613-Y634 HydrophobicContact CB-CD2 4.5Å; Q613-Y634 HydrophobicContact CB-CE1 3.63Å; Q613-Y634 HydrophobicContact CB-CG 3.94Å; Q613-Y634 HydrophobicContact CG-CD1 3.53Å; Q613-Y634 HydrophobicContact CG-CE1 4.2Å; Q613-Y634 HydrophobicContact CG-CG 3.84Å
614	V	94.1	Very high	92.2	Very high	60 Å²	60	73 Å²	73	36%	0.364	37%	0.373	S	S	.	.	H	α-helix	trans	-60.8	-47.1	-178.8	171.6	0	0	0	0	110.1	S611 Y616 E617 H618	S611-V614 PolarHBondContact O-N 3Å; S611-V614 WeakPolarHBondContact OG-CG2 3.41Å; S611-V614 PolarHBondContact OG-N 2.8Å; V614-Y616 PolarHBondContact O-N 2.88Å; V614-E617 PolarHBondContact O-N 2.95Å; V614-H618 PolarHBondContact O-CD2 2.94Å; V614-H618 PolarHBondContact O-N 3.41Å
615	R	94.5	Very high	92.4	Very high	29 Å²	29	69.7 Å²	69.7	11%	0.109	36%	0.364	C	S	.	.	H	α-helix	trans	-59.6	-47.8	176.4	-65.9	-172.6	-64.1	-90.1	3.7	111.9	F607 D610 S611 Q613 E617 H618 R619	F607-R615 VanDerWaalsContact CD1-NH1 3.3Å; F607-R615 VanDerWaalsContact CZ-CZ 3.48Å; F607-R615 VanDerWaalsContact CZ-NH1 3.27Å; D610-R615 IonicContact OD1-NH1 3.83Å; D610-R615 WeakPolarHBondContact OD2-CD 3.37Å; D610-R615 WeakPolarHBondContact OD2-CG 3.42Å; D610-R615 IonicContact OD2-CZ 3.9Å; D610-R615 IonicContact OD2-NE 3.02Å; D610-R615 IonicContact OD2-NH1 3.85Å; D610-R615 PolarHBondContact OD2-NH1 2.97Å; S611-R615 PolarHBondContact O-N 3.28Å; S611-R615 VanDerWaalsContact O-N 3.17Å; Q613-R615 PolarHBondContact O-N 3.48Å; R615-E617 PolarHBondContact O-N 2.85Å; R615-H618 PolarHBondContact O-N 3.44Å; R615-R619 VanDerWaalsContact O-CG 3.29Å; R615-R619 WeakPolarHBondContact O-CG 3.43Å; R615-R619 PolarHBondContact O-N 2.92Å
616	Y	96.8	Very high	92.8	Very high	3 Å²	3	66.5 Å²	66.5	1%	0.012	34%	0.344	C	S	.	.	H	α-helix	trans	-55.6	-52.7	177.5	-178.5	-83.2	0	0	0	110.8	Y520 E612 Q613 V614 H618 R619 F620 V632 Y634 F637	Y520-Y616 HydrophobicContact CD2-CD2 4.13Å; Y520-Y616 HydrophobicContact CG-CD2 4.03Å; E612-Y616 VanDerWaalsContact O-CB 3.24Å; E612-Y616 WeakPolarHBondContact O-CB 3.39Å; E612-Y616 PolarHBondContact O-N 3.45Å; Q613-Y616 WeakPolarHBondContact O-CB 3.41Å; Q613-Y616 PolarHBondContact O-N 3.4Å; V614-Y616 PolarHBondContact O-N 2.88Å; Y616-H618 VanDerWaalsContact C-N 3.3Å; Y616-H618 PolarHBondContact O-N 3.32Å; Y616-R619 PolarHBondContact O-N 3.24Å; Y616-R619 VanDerWaalsContact O-N 3.1Å; Y616-F620 AromaticContact CD1-CD2 3.81Å; Y616-F620 HydrophobicContact CD1-CD2 3.81Å; Y616-F620 HydrophobicContact CD1-CE2 4.35Å; Y616-F620 AromaticContact CD2-CD2 3.8Å; Y616-F620 HydrophobicContact CD2-CD2 3.8Å; Y616-F620 AromaticContact CD2-CE2 3.48Å; Y616-F620 HydrophobicContact CD2-CE2 3.48Å; Y616-F620 VanDerWaalsContact CD2-CE2 3.48Å; Y616-F620 AromaticContact CE1-CD2 3.66Å; Y616-F620 HydrophobicContact CE1-CD2 3.66Å; Y616-F620 HydrophobicContact CE1-CE2 4.19Å; Y616-F620 AromaticContact CE2-CD2 3.67Å; Y616-F620 HydrophobicContact CE2-CD2 3.67Å; Y616-F620 AromaticContact CE2-CE2 3.29Å; Y616-F620 HydrophobicContact CE2-CE2 3.29Å; Y616-F620 HydrophobicContact CE2-CZ 4.23Å; Y616-F620 AromaticContact CG-CD2 3.86Å; Y616-F620 HydrophobicContact CG-CD2 3.86Å; Y616-F620 HydrophobicContact CG-CE2 4.01Å; Y616-F620 AromaticContact CZ-CD2 3.58Å; Y616-F620 AromaticContact CZ-CE2 3.66Å; Y616-F620 WeakPolarHBondContact O-CD2 3.48Å; Y616-F620 PolarHBondContact O-N 3.18Å; Y616-F620 VanDerWaalsContact O-N 3.11Å; Y616-V632 WeakPolarHBondContact CE1-O 3.45Å; Y616-V632 PolarHBondContact OH-O 3.29Å; Y616-V632 VanDerWaalsContact OH-O 3.06Å; Y616-Y634 HydrophobicContact CD1-CD2 4.02Å; Y616-Y634 HydrophobicContact CD1-CG 4.41Å; Y616-Y634 HydrophobicContact CD2-CD2 4.05Å; Y616-Y634 AromaticContact CG-CD2 3.67Å; Y616-Y634 HydrophobicContact CG-CD2 3.67Å; Y616-Y634 HydrophobicContact CG-CG 4.47Å; Y616-F637 AromaticContact CD2-CD1 4Å; Y616-F637 HydrophobicContact CD2-CD1 4Å; Y616-F637 HydrophobicContact CD2-CE1 4.37Å; Y616-F637 HydrophobicContact CE2-CB 3.98Å; Y616-F637 AromaticContact CE2-CD1 3.67Å; Y616-F637 HydrophobicContact CE2-CD1 3.67Å; Y616-F637 HydrophobicContact CE2-CD2 4.4Å; Y616-F637 HydrophobicContact CE2-CE1 4.26Å; Y616-F637 AromaticContact CE2-CG 3.73Å; Y616-F637 HydrophobicContact CE2-CG 3.73Å
617	E	96.1	Very high	93	Very high	90 Å²	90	66 Å²	66	42%	0.421	34%	0.339	S	S	.	.	H	α-helix	trans	-58.4	-40.9	179.9	-72.3	170.7	-178.9	0	0	111.6	Q613 V614 R615 F620 A621	Q613-E617 HydrophobicContact CG-CG 4.39Å; Q613-E617 VanDerWaalsContact CG-OE1 3.24Å; Q613-E617 WeakPolarHBondContact CG-OE1 3.46Å; Q613-E617 PolarHBondContact NE2-OE1 3.07Å; Q613-E617 WeakPolarHBondContact O-CB 3.28Å; Q613-E617 WeakPolarHBondContact O-CG 3.49Å; Q613-E617 PolarHBondContact O-N 3.19Å; V614-E617 PolarHBondContact O-N 2.95Å; R615-E617 PolarHBondContact O-N 2.85Å; E617-F620 PolarHBondContact O-N 3.49Å; E617-A621 WeakPolarHBondContact O-CA 3.31Å; E617-A621 VanDerWaalsContact O-CB 3.32Å; E617-A621 WeakPolarHBondContact O-CB 3.49Å; E617-A621 PolarHBondContact O-N 2.74Å
618	H	94.7	Very high	93.4	Very high	134 Å²	134	64.4 Å²	64.4	62%	0.62	34%	0.335	S	S	*	.	H	α-helix	trans	-66.9	-38.4	174.6	-84	-73.7	0	0	0	113.9	V614 R615 Y616 F620	V614-H618 PolarHBondContact O-CD2 2.94Å; V614-H618 PolarHBondContact O-N 3.41Å; R615-H618 PolarHBondContact O-N 3.44Å; Y616-H618 VanDerWaalsContact C-N 3.3Å; Y616-H618 PolarHBondContact O-N 3.32Å; H618-F620 VanDerWaalsContact C-N 3.29Å; H618-F620 PolarHBondContact O-N 2.94Å
619	R	96.2	Very high	93.6	Very high	62 Å²	62	56.2 Å²	56.2	23%	0.234	30%	0.297	C	S	.	.	H	α-helix	trans	-66.7	-33.1	179.2	-64.6	-36.9	-177.5	-178.9	7	112.3	L512 E517 Y520 I521 R615 Y616	L512-R619 PolarHBondContact O-NH2 3.25Å; E517-R619 IonicContact OE1-CZ 2.77Å; E517-R619 IonicContact OE1-NE 3.92Å; E517-R619 PolarHBondContact OE1-NE 3.31Å; E517-R619 IonicContact OE1-NH2 2.7Å; E517-R619 PolarHBondContact OE1-NH2 2.91Å; E517-R619 IonicContact OE2-CZ 3.17Å; E517-R619 IonicContact OE2-NH2 3.65Å; E517-R619 PolarHBondContact OE2-NH2 3.18Å; Y520-R619 HydrophobicContact CE2-CG 4.1Å; I521-R619 HydrophobicContact CD1-CB 4.13Å; I521-R619 HydrophobicContact CD1-CG 4.22Å; R615-R619 VanDerWaalsContact O-CG 3.29Å; R615-R619 WeakPolarHBondContact O-CG 3.43Å; R615-R619 PolarHBondContact O-N 2.92Å; Y616-R619 PolarHBondContact O-N 3.24Å; Y616-R619 VanDerWaalsContact O-N 3.1Å
620	F	97.3	Very high	93.8	Very high	10 Å²	10	51.1 Å²	51.1	4%	0.044	28%	0.275	C	S	.	.	H	α-helix	trans	-104.1	0.5	-177.1	-60.2	-69.9	0	0	0	113.7	L504 Y520 I521 Y524 Y616 E617 H618 P622 F623	L504-F620 HydrophobicContact CD1-CE1 3.87Å; L504-F620 HydrophobicContact CD2-CD1 4.1Å; L504-F620 HydrophobicContact CD2-CE1 3.76Å; L504-F620 HydrophobicContact CG-CE1 4.48Å; Y520-F620 AromaticContact CD2-CE2 3.93Å; Y520-F620 HydrophobicContact CD2-CE2 3.93Å; Y520-F620 HydrophobicContact CD2-CZ 4.25Å; Y520-F620 HydrophobicContact CE2-CE2 4.47Å; I521-F620 HydrophobicContact CD1-CE1 4.48Å; I521-F620 HydrophobicContact CD1-CE2 4.41Å; I521-F620 HydrophobicContact CD1-CZ 3.89Å; Y524-F620 HydrophobicContact CD1-CD1 4.13Å; Y524-F620 AromaticContact CD1-CE1 3.64Å; Y524-F620 HydrophobicContact CD1-CE1 3.64Å; Y524-F620 HydrophobicContact CD1-CZ 4.47Å; Y524-F620 AromaticContact CD2-CD1 3.99Å; Y524-F620 HydrophobicContact CD2-CD1 3.99Å; Y524-F620 AromaticContact CD2-CE1 3.6Å; Y524-F620 HydrophobicContact CD2-CE1 3.6Å; Y524-F620 HydrophobicContact CD2-CE2 4.38Å; Y524-F620 AromaticContact CD2-CZ 3.83Å; Y524-F620 HydrophobicContact CD2-CZ 3.83Å; Y524-F620 HydrophobicContact CE1-CD1 4.18Å; Y524-F620 HydrophobicContact CE1-CE1 4.16Å; Y524-F620 HydrophobicContact CE2-CD1 4.03Å; Y524-F620 HydrophobicContact CE2-CE1 4.12Å; Y524-F620 HydrophobicContact CE2-CG 4.43Å; Y524-F620 HydrophobicContact CG-CD1 4.05Å; Y524-F620 AromaticContact CG-CE1 3.34Å; Y524-F620 HydrophobicContact CG-CE1 3.34Å; Y524-F620 AromaticContact CG-CZ 3.75Å; Y524-F620 HydrophobicContact CG-CZ 3.75Å; Y616-F620 AromaticContact CD1-CD2 3.81Å; Y616-F620 HydrophobicContact CD1-CD2 3.81Å; Y616-F620 HydrophobicContact CD1-CE2 4.35Å; Y616-F620 AromaticContact CD2-CD2 3.8Å; Y616-F620 HydrophobicContact CD2-CD2 3.8Å; Y616-F620 AromaticContact CD2-CE2 3.48Å; Y616-F620 HydrophobicContact CD2-CE2 3.48Å; Y616-F620 VanDerWaalsContact CD2-CE2 3.48Å; Y616-F620 AromaticContact CE1-CD2 3.66Å; Y616-F620 HydrophobicContact CE1-CD2 3.66Å; Y616-F620 HydrophobicContact CE1-CE2 4.19Å; Y616-F620 AromaticContact CE2-CD2 3.67Å; Y616-F620 HydrophobicContact CE2-CD2 3.67Å; Y616-F620 AromaticContact CE2-CE2 3.29Å; Y616-F620 HydrophobicContact CE2-CE2 3.29Å; Y616-F620 HydrophobicContact CE2-CZ 4.23Å; Y616-F620 AromaticContact CG-CD2 3.86Å; Y616-F620 HydrophobicContact CG-CD2 3.86Å; Y616-F620 HydrophobicContact CG-CE2 4.01Å; Y616-F620 AromaticContact CZ-CD2 3.58Å; Y616-F620 AromaticContact CZ-CE2 3.66Å; Y616-F620 WeakPolarHBondContact O-CD2 3.48Å; Y616-F620 PolarHBondContact O-N 3.18Å; Y616-F620 VanDerWaalsContact O-N 3.11Å; E617-F620 PolarHBondContact O-N 3.49Å; H618-F620 VanDerWaalsContact C-N 3.29Å; H618-F620 PolarHBondContact O-N 2.94Å; F620-P622 VanDerWaalsContact C-CD 3.4Å; F620-P622 VanDerWaalsContact C-N 3.33Å; F620-F623 HydrophobicContact CB-CD2 4.23Å; F620-F623 AromaticContact CD1-CD2 3.79Å; F620-F623 HydrophobicContact CD1-CD2 3.79Å; F620-F623 AromaticContact CD1-CE2 3.62Å; F620-F623 HydrophobicContact CD1-CE2 3.62Å; F620-F623 HydrophobicContact CE1-CE2 4.26Å; F620-F623 VanDerWaalsContact O-CB 3.29Å; F620-F623 WeakPolarHBondContact O-CB 3.24Å; F620-F623 PolarHBondContact O-N 3.32Å
621	A	95.8	Very high	94	Very high	40 Å²	40	49.8 Å²	49.8	33%	0.331	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-50.6	-40.3	-178.2	0	0	0	0	0	114.8	E617 F623 N624	E617-A621 WeakPolarHBondContact O-CA 3.31Å; E617-A621 VanDerWaalsContact O-CB 3.32Å; E617-A621 WeakPolarHBondContact O-CB 3.49Å; E617-A621 PolarHBondContact O-N 2.74Å; A621-F623 PolarHBondContact O-N 3.2Å; A621-N624 WeakPolarHBondContact O-CB 3.23Å; A621-N624 PolarHBondContact O-N 3.46Å; A621-N624 VanDerWaalsContact O-N 3.15Å; A621-N624 PolarHBondContact O-ND2 3.04Å
622	P	95.1	Very high	94.2	Very high	29 Å²	29	47.7 Å²	47.7	19%	0.188	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-63.1	-14.9	177.9	-25.5	37.7	0	0	0	114.5	L454 Y503 F620 N624 S625	L454-P622 HydrophobicContact CD1-CB 4.32Å; Y503-P622 HydrophobicContact CE1-CG 4.02Å; Y503-P622 HydrophobicContact CE2-CG 4.08Å; Y503-P622 WeakPolarHBondContact OH-CG 3.42Å; F620-P622 VanDerWaalsContact C-CD 3.4Å; F620-P622 VanDerWaalsContact C-N 3.33Å; P622-N624 VanDerWaalsContact C-N 3.34Å; P622-S625 PolarHBondContact O-OG 3.04Å
623	F	96.2	Very high	94.2	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.009	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-85.2	-10.4	-179.3	-57.7	-13.2	0	0	0	112.7	L454 M500 Y503 L504 Y524 L529 F620 A621 S625 V626	L454-F623 HydrophobicContact CD1-CD1 3.67Å; L454-F623 HydrophobicContact CD1-CE1 3.91Å; M500-F623 HydrophobicContact CB-CD1 4.47Å; M500-F623 HydrophobicContact CB-CE1 3.87Å; M500-F623 HydrophobicContact CB-CE2 4.48Å; M500-F623 HydrophobicContact CB-CZ 3.86Å; M500-F623 HydrophobicContact CE-CB 3.77Å; M500-F623 HydrophobicContact CE-CD1 3.82Å; M500-F623 HydrophobicContact CE-CD2 3.55Å; M500-F623 HydrophobicContact CE-CE1 4.28Å; M500-F623 HydrophobicContact CE-CE2 3.99Å; M500-F623 HydrophobicContact CE-CG 3.43Å; M500-F623 VanDerWaalsContact CE-CG 3.43Å; M500-F623 HydrophobicContact CE-CZ 4.34Å; M500-F623 HydrophobicContact CG-CD1 3.99Å; M500-F623 HydrophobicContact CG-CE1 3.85Å; M500-F623 HydrophobicContact CG-CZ 4.26Å; Y503-F623 AromaticContact CD1-CE1 3.87Å; Y503-F623 HydrophobicContact CD1-CE1 3.87Å; Y503-F623 AromaticContact CD1-CZ 3.98Å; Y503-F623 HydrophobicContact CD1-CZ 3.98Å; Y503-F623 HydrophobicContact CG-CE1 4.34Å; L504-F623 HydrophobicContact CD1-CE2 4.07Å; L504-F623 HydrophobicContact CD1-CZ 4.22Å; L504-F623 HydrophobicContact CD2-CE2 4.11Å; L504-F623 HydrophobicContact CD2-CZ 3.96Å; L504-F623 HydrophobicContact CG-CE2 4.1Å; L504-F623 HydrophobicContact CG-CZ 3.81Å; Y524-F623 HydrophobicContact CD1-CE2 4.28Å; Y524-F623 AromaticContact CE1-CD2 3.81Å; Y524-F623 HydrophobicContact CE1-CD2 3.81Å; Y524-F623 AromaticContact CE1-CE2 3.68Å; Y524-F623 HydrophobicContact CE1-CE2 3.68Å; Y524-F623 AromaticContact CZ-CD2 3.94Å; L529-F623 HydrophobicContact CD1-CE2 4.46Å; F620-F623 HydrophobicContact CB-CD2 4.23Å; F620-F623 AromaticContact CD1-CD2 3.79Å; F620-F623 HydrophobicContact CD1-CD2 3.79Å; F620-F623 AromaticContact CD1-CE2 3.62Å; F620-F623 HydrophobicContact CD1-CE2 3.62Å; F620-F623 HydrophobicContact CE1-CE2 4.26Å; F620-F623 VanDerWaalsContact O-CB 3.29Å; F620-F623 WeakPolarHBondContact O-CB 3.24Å; F620-F623 PolarHBondContact O-N 3.32Å; A621-F623 PolarHBondContact O-N 3.2Å; F623-S625 PolarHBondContact O-N 3.3Å; F623-V626 PolarHBondContact O-N 3.33Å
624	N	93.6	Very high	94.3	Very high	105 Å²	105	49 Å²	49	56%	0.561	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-64.6	-21.9	-178	-69.5	-23.4	0	0	0	113.5	A621 P622 V626	A621-N624 WeakPolarHBondContact O-CB 3.23Å; A621-N624 PolarHBondContact O-N 3.46Å; A621-N624 VanDerWaalsContact O-N 3.15Å; A621-N624 PolarHBondContact O-ND2 3.04Å; P622-N624 VanDerWaalsContact C-N 3.34Å; N624-V626 VanDerWaalsContact C-N 3.31Å
625	S	91	Very high	94.4	Very high	41 Å²	41	51.9 Å²	51.9	29%	0.287	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-75.8	-19.8	174.7	57.6	0	0	0	0	113	A458 P622 F623	A458-S625 WeakPolarHBondContact CB-O 3.5Å; P622-S625 PolarHBondContact O-OG 3.04Å; F623-S625 PolarHBondContact O-N 3.3Å
626	V	93.2	Very high	94.5	Very high	2 Å²	2	54.6 Å²	54.6	1%	0.012	29%	0.286	C	S	.	.			trans	-93.1	121.5	-176.4	-177.9	0	0	0	0	110.1	L454 A458 F623 N624 T628	L454-V626 HydrophobicContact CB-CG2 4.12Å; L454-V626 HydrophobicContact CD2-CG2 4.13Å; A458-V626 HydrophobicContact CB-CG2 4.38Å; F623-V626 PolarHBondContact O-N 3.33Å; N624-V626 VanDerWaalsContact C-N 3.31Å; V626-T628 VanDerWaalsContact CG1-O 3.23Å; V626-T628 WeakPolarHBondContact CG1-O 3.38Å
627	I	90.6	Very high	94.5	Very high	133 Å²	133	54.5 Å²	54.5	68%	0.682	29%	0.286	S	S	*	.			trans	-85.4	-34.9	179.3	-60.3	171.5	0	0	0	111.7	P629 P630	I627-P629 CarbonylContact O-C 3.58Å; I627-P629 VanDerWaalsContact O-C 3.24Å; I627-P630 WeakPolarHBondContact O-CA 3.35Å; I627-P630 VanDerWaalsContact O-N 3.1Å
628	T	91.2	Very high	94.5	Very high	34 Å²	34	54.3 Å²	54.3	21%	0.209	28%	0.284	C	S	.	.	S	Bend	trans	-123.9	114.4	-179.2	-57.3	0	0	0	0	109.4	L493 W532 V626	L493-T628 HydrophobicContact CD1-CG2 4.07Å; L493-T628 WeakPolarHBondContact CD1-O 3.37Å; L493-T628 HydrophobicContact CD2-CG2 4.18Å; W532-T628 HydrophobicContact CZ3-CG2 4.49Å; V626-T628 VanDerWaalsContact CG1-O 3.23Å; V626-T628 WeakPolarHBondContact CG1-O 3.38Å
629	P	92.8	Very high	94.6	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.006	28%	0.281	C	S	.	.	S	Bend	cis	-73.9	152.9	-0.4	37.1	-39	0	0	0	112	L497 F528 W532 I627	L497-P629 HydrophobicContact CD2-CG 3.92Å; F528-P629 HydrophobicContact CE1-CB 3.92Å; F528-P629 HydrophobicContact CE1-CG 3.68Å; F528-P629 HydrophobicContact CE2-CB 4.49Å; F528-P629 HydrophobicContact CZ-CB 3.6Å; F528-P629 HydrophobicContact CZ-CG 3.92Å; W532-P629 HydrophobicContact CD2-CB 3.62Å; W532-P629 HydrophobicContact CD2-CG 4.49Å; W532-P629 HydrophobicContact CE3-CB 4.27Å; W532-P629 HydrophobicContact CG-CB 3.81Å; W532-P629 HydrophobicContact CG-CG 4.27Å; W532-P629 HydrophobicContact CH2-CB 4.47Å; W532-P629 HydrophobicContact CZ2-CB 3.86Å; I627-P629 CarbonylContact O-C 3.58Å; I627-P629 VanDerWaalsContact O-C 3.24Å
630	P	92.1	Very high	94.4	Very high	73 Å²	73	55.7 Å²	55.7	47%	0.474	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-66.1	135.1	-176.9	25.9	-34.2	0	0	0	111.1	F528 I627 V632	F528-P630 WeakPolarHBondContact CZ-O 3.49Å; I627-P630 WeakPolarHBondContact O-CA 3.35Å; I627-P630 VanDerWaalsContact O-N 3.1Å; P630-V632 PolarHBondContact O-N 3.08Å
631	P	91.6	Very high	94.2	Very high	31 Å²	31	56.2 Å²	56.2	20%	0.201	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-60.1	134.9	-177.8	25.2	-33.9	0	0	0	110.7	H633	P631-H633 PolarHBondContact O-N 3.39Å
632	V	95.6	Very high	94.1	Very high	6 Å²	6	57.1 Å²	57.1	4%	0.036	30%	0.298	C	S	.	.			trans	-84.4	111.9	174.8	-175.2	0	0	0	0	108.2	W523 Y524 F528 Y616 P630 Q636 F637	W523-V632 HydrophobicContact CH2-CG1 3.95Å; W523-V632 HydrophobicContact CZ3-CG1 4.16Å; Y524-V632 HydrophobicContact CE2-CB 3.91Å; Y524-V632 HydrophobicContact CE2-CG2 4.11Å; F528-V632 HydrophobicContact CD1-CG2 4.22Å; F528-V632 HydrophobicContact CD2-CG2 3.65Å; F528-V632 HydrophobicContact CE1-CG2 4.12Å; F528-V632 HydrophobicContact CE2-CG2 3.53Å; F528-V632 HydrophobicContact CG-CG2 4Å; F528-V632 HydrophobicContact CZ-CG2 3.78Å; Y616-V632 WeakPolarHBondContact CE1-O 3.45Å; Y616-V632 PolarHBondContact OH-O 3.29Å; Y616-V632 VanDerWaalsContact OH-O 3.06Å; P630-V632 PolarHBondContact O-N 3.08Å; V632-Q636 HydrophobicContact CG1-CB 3.98Å; V632-Q636 HydrophobicContact CG1-CG 3.99Å; V632-F637 HydrophobicContact CG1-CB 4.11Å
633	H	95.3	Very high	93.9	Very high	117 Å²	117	57.1 Å²	57.1	54%	0.542	30%	0.296	S	S	.	.			trans	-74.2	158.1	174.8	-63.2	-64.9	0	0	0	111.6	P631 L635 Q636 F637	P631-H633 PolarHBondContact O-N 3.39Å; H633-L635 VanDerWaalsContact C-N 3.33Å; H633-L635 PolarHBondContact O-N 2.94Å; H633-Q636 WeakPolarHBondContact O-CB 3.32Å; H633-Q636 PolarHBondContact O-N 3.34Å; H633-F637 PolarHBondContact O-N 3.42Å
634	Y	96.9	Very high	93.7	Very high	27 Å²	27	62.7 Å²	62.7	11%	0.106	33%	0.327	C	S	.	.	H	α-helix	trans	-54.7	-43.6	-173.3	178.7	-109.6	0	0	0	113.8	E612 Q613 Y616 Q636 F637 K638	E612-Y634 HydrophobicContact CB-CE2 4.37Å; E612-Y634 VanDerWaalsContact CD-OH 3.26Å; E612-Y634 HydrophobicContact CG-CE2 3.8Å; E612-Y634 WeakPolarHBondContact OE1-CE2 3.48Å; E612-Y634 PolarHBondContact OE1-OH 2.93Å; Q613-Y634 HydrophobicContact CB-CD1 3.48Å; Q613-Y634 VanDerWaalsContact CB-CD1 3.48Å; Q613-Y634 HydrophobicContact CB-CD2 4.5Å; Q613-Y634 HydrophobicContact CB-CE1 3.63Å; Q613-Y634 HydrophobicContact CB-CG 3.94Å; Q613-Y634 HydrophobicContact CG-CD1 3.53Å; Q613-Y634 HydrophobicContact CG-CE1 4.2Å; Q613-Y634 HydrophobicContact CG-CG 3.84Å; Y616-Y634 HydrophobicContact CD1-CD2 4.02Å; Y616-Y634 HydrophobicContact CD1-CG 4.41Å; Y616-Y634 HydrophobicContact CD2-CD2 4.05Å; Y616-Y634 AromaticContact CG-CD2 3.67Å; Y616-Y634 HydrophobicContact CG-CD2 3.67Å; Y616-Y634 HydrophobicContact CG-CG 4.47Å; Y634-Q636 PolarHBondContact O-N 3.3Å; Y634-F637 HydrophobicContact CD2-CD1 4.12Å; Y634-F637 HydrophobicContact CE2-CD1 4.19Å; Y634-F637 WeakPolarHBondContact O-CB 3.43Å; Y634-F637 PolarHBondContact O-N 3.12Å; Y634-K638 HydrophobicContact CD1-CG 4.39Å; Y634-K638 HydrophobicContact CD2-CG 4.46Å; Y634-K638 HydrophobicContact CE1-CD 4.4Å; Y634-K638 HydrophobicContact CE1-CG 3.92Å; Y634-K638 HydrophobicContact CE2-CD 3.9Å; Y634-K638 HydrophobicContact CE2-CG 4Å; Y634-K638 WeakPolarHBondContact O-CG 3.41Å; Y634-K638 PolarHBondContact O-N 2.83Å
635	L	96.8	Very high	93.5	Very high	121 Å²	121	63.9 Å²	63.9	63%	0.634	33%	0.327	S	S	*	.	H	α-helix	trans	-60.9	-43.8	177.4	-67.4	175.3	0	0	0	112.1	H633 F637 K638 E639	H633-L635 VanDerWaalsContact C-N 3.33Å; H633-L635 PolarHBondContact O-N 2.94Å; L635-F637 VanDerWaalsContact C-N 3.33Å; L635-F637 PolarHBondContact O-N 3.27Å; L635-K638 PolarHBondContact O-N 3.07Å; L635-E639 WeakPolarHBondContact O-CG 3.43Å; L635-E639 PolarHBondContact O-N 3.43Å
636	Q	96	Very high	93.4	Very high	86 Å²	86	68.7 Å²	68.7	40%	0.402	34%	0.34	S	S	.	.	H	α-helix	trans	-64	-39.8	176.6	-173.3	-176.7	3.9	0	0	111.1	V632 H633 Y634 E639 M640	V632-Q636 HydrophobicContact CG1-CB 3.98Å; V632-Q636 HydrophobicContact CG1-CG 3.99Å; H633-Q636 WeakPolarHBondContact O-CB 3.32Å; H633-Q636 PolarHBondContact O-N 3.34Å; Y634-Q636 PolarHBondContact O-N 3.3Å; Q636-E639 PolarHBondContact O-N 3.3Å; Q636-M640 HydrophobicContact CG-CG 4.35Å; Q636-M640 HydrophobicContact CG-SD 3.97Å; Q636-M640 WeakPolarHBondContact O-CB 3.45Å; Q636-M640 VanDerWaalsContact O-CG 3.25Å; Q636-M640 WeakPolarHBondContact O-CG 3.38Å; Q636-M640 PolarHBondContact O-N 3.38Å
637	F	96.6	Very high	93.1	Very high	0 Å²	0	74.6 Å²	74.6	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-58.6	-47.6	172.6	161.7	-115.4	0	0	0	111.8	Y519 Y520 W523 Y616 V632 H633 Y634 L635 E639 M640 S641	Y519-F637 HydrophobicContact CD2-CZ 4.09Å; Y519-F637 AromaticContact CE2-CE1 3.93Å; Y519-F637 HydrophobicContact CE2-CE1 3.93Å; Y519-F637 AromaticContact CE2-CZ 3.5Å; Y519-F637 HydrophobicContact CE2-CZ 3.5Å; Y520-F637 VanDerWaalsContact CB-CZ 3.42Å; W523-F637 HydrophobicContact CB-CE2 4.11Å; W523-F637 AromaticContact CD2-CD2 3.45Å; W523-F637 HydrophobicContact CD2-CD2 3.45Å; W523-F637 VanDerWaalsContact CD2-CD2 3.45Å; W523-F637 AromaticContact CD2-CE2 3.39Å; W523-F637 HydrophobicContact CD2-CE2 3.39Å; W523-F637 AromaticContact CE2-CD2 3.81Å; W523-F637 AromaticContact CE2-CE2 3.99Å; W523-F637 AromaticContact CE3-CD2 3.22Å; W523-F637 HydrophobicContact CE3-CD2 3.22Å; W523-F637 AromaticContact CE3-CE2 3.51Å; W523-F637 HydrophobicContact CE3-CE2 3.51Å; W523-F637 HydrophobicContact CE3-CG 4.3Å; W523-F637 HydrophobicContact CG-CD2 4.23Å; W523-F637 AromaticContact CG-CE2 3.67Å; W523-F637 HydrophobicContact CG-CE2 3.67Å; W523-F637 HydrophobicContact CH2-CB 4.42Å; W523-F637 AromaticContact CH2-CD2 3.81Å; W523-F637 HydrophobicContact CH2-CD2 3.81Å; W523-F637 AromaticContact CZ2-CD2 4Å; W523-F637 HydrophobicContact CZ2-CD2 4Å; W523-F637 HydrophobicContact CZ3-CB 4.23Å; W523-F637 AromaticContact CZ3-CD2 3.42Å; W523-F637 HydrophobicContact CZ3-CD2 3.42Å; W523-F637 VanDerWaalsContact CZ3-CD2 3.42Å; W523-F637 HydrophobicContact CZ3-CE2 4.2Å; W523-F637 HydrophobicContact CZ3-CG 4.23Å; Y616-F637 AromaticContact CD2-CD1 4Å; Y616-F637 HydrophobicContact CD2-CD1 4Å; Y616-F637 HydrophobicContact CD2-CE1 4.37Å; Y616-F637 HydrophobicContact CE2-CB 3.98Å; Y616-F637 AromaticContact CE2-CD1 3.67Å; Y616-F637 HydrophobicContact CE2-CD1 3.67Å; Y616-F637 HydrophobicContact CE2-CD2 4.4Å; Y616-F637 HydrophobicContact CE2-CE1 4.26Å; Y616-F637 AromaticContact CE2-CG 3.73Å; Y616-F637 HydrophobicContact CE2-CG 3.73Å; V632-F637 HydrophobicContact CG1-CB 4.11Å; H633-F637 PolarHBondContact O-N 3.42Å; Y634-F637 HydrophobicContact CD2-CD1 4.12Å; Y634-F637 HydrophobicContact CE2-CD1 4.19Å; Y634-F637 WeakPolarHBondContact O-CB 3.43Å; Y634-F637 PolarHBondContact O-N 3.12Å; L635-F637 VanDerWaalsContact C-N 3.33Å; L635-F637 PolarHBondContact O-N 3.27Å; F637-E639 VanDerWaalsContact C-N 3.32Å; F637-E639 PolarHBondContact O-N 3.41Å; F637-M640 PolarHBondContact O-N 2.68Å; F637-S641 WeakPolarHBondContact O-CB 3.46Å; F637-S641 PolarHBondContact O-N 3.49Å; F637-S641 PolarHBondContact O-OG 3.38Å
638	K	96.7	Very high	92.9	Very high	87 Å²	87	73.6 Å²	73.6	38%	0.378	38%	0.383	S	S	.	.	H	α-helix	trans	-61.4	-41.1	178	-64.9	-63.5	-77.5	-164.6	0	111.8	E612 Y634 L635 S641 D642	E612-K638 IonicContact OE1-NZ 3.27Å; E612-K638 PolarHBondContact OE1-NZ 3.45Å; Y634-K638 HydrophobicContact CD1-CG 4.39Å; Y634-K638 HydrophobicContact CD2-CG 4.46Å; Y634-K638 HydrophobicContact CE1-CD 4.4Å; Y634-K638 HydrophobicContact CE1-CG 3.92Å; Y634-K638 HydrophobicContact CE2-CD 3.9Å; Y634-K638 HydrophobicContact CE2-CG 4Å; Y634-K638 WeakPolarHBondContact O-CG 3.41Å; Y634-K638 PolarHBondContact O-N 2.83Å; L635-K638 PolarHBondContact O-N 3.07Å; K638-S641 PolarHBondContact O-OG 3.41Å; K638-D642 WeakPolarHBondContact O-CB 3.46Å; K638-D642 PolarHBondContact O-N 3.06Å; K638-D642 VanDerWaalsContact O-N 3.1Å
639	E	95.3	Very high	93	Very high	122 Å²	122	75.1 Å²	75.1	57%	0.57	39%	0.394	S	S	*	.	H	α-helix	trans	-62.2	-50.7	173.5	-71.4	177.4	-174.9	0	0	111.2	L635 Q636 F637 S641 D642 K645	L635-E639 WeakPolarHBondContact O-CG 3.43Å; L635-E639 PolarHBondContact O-N 3.43Å; Q636-E639 PolarHBondContact O-N 3.3Å; F637-E639 VanDerWaalsContact C-N 3.32Å; F637-E639 PolarHBondContact O-N 3.41Å; E639-S641 PolarHBondContact O-N 3.37Å; E639-D642 PolarHBondContact O-N 3.37Å; E639-K645 VanDerWaalsContact C-NZ 3.32Å; E639-K645 WeakPolarHBondContact O-CE 3.33Å; E639-K645 PolarHBondContact O-NZ 3.19Å
640	M	93.7	Very high	93	Very high	102 Å²	102	76.4 Å²	76.4	50%	0.502	40%	0.402	S	S	.	.	H	α-helix	trans	-67.2	-24.5	-176.7	-68.8	-179.7	76.3	0	0	113.4	W523 Q636 F637	W523-M640 HydrophobicContact CH2-CB 4.3Å; W523-M640 HydrophobicContact CH2-SD 4.11Å; W523-M640 HydrophobicContact CZ2-CB 3.67Å; W523-M640 HydrophobicContact CZ2-CE 4.28Å; W523-M640 HydrophobicContact CZ2-SD 4.19Å; Q636-M640 HydrophobicContact CG-CG 4.35Å; Q636-M640 HydrophobicContact CG-SD 3.97Å; Q636-M640 WeakPolarHBondContact O-CB 3.45Å; Q636-M640 VanDerWaalsContact O-CG 3.25Å; Q636-M640 WeakPolarHBondContact O-CG 3.38Å; Q636-M640 PolarHBondContact O-N 3.38Å; F637-M640 PolarHBondContact O-N 2.68Å
641	S	93.2	Very high	93.1	Very high	21 Å²	21	78.9 Å²	78.9	15%	0.147	41%	0.407	C	S	.	.	H	α-helix	trans	-97.7	-0.1	179	59.2	0	0	0	0	114.3	Y590 F637 K638 E639 L643	Y590-S641 WeakPolarHBondContact OH-CB 3.45Å; F637-S641 WeakPolarHBondContact O-CB 3.46Å; F637-S641 PolarHBondContact O-N 3.49Å; F637-S641 PolarHBondContact O-OG 3.38Å; K638-S641 PolarHBondContact O-OG 3.41Å; E639-S641 PolarHBondContact O-N 3.37Å; S641-L643 PolarHBondContact O-N 3.18Å
642	D	92.9	Very high	93.3	Very high	59 Å²	59	78.3 Å²	78.3	32%	0.316	40%	0.404	S	S	.	.			trans	-67.9	114.7	-177.7	-177.6	17.2	0	0	0	112.3	K638 E639 N644 K645	K638-D642 WeakPolarHBondContact O-CB 3.46Å; K638-D642 PolarHBondContact O-N 3.06Å; K638-D642 VanDerWaalsContact O-N 3.1Å; E639-D642 PolarHBondContact O-N 3.37Å; D642-N644 VanDerWaalsContact C-N 3.27Å; D642-N644 PolarHBondContact O-N 2.85Å; D642-N644 WeakPolarHBondContact OD1-CB 3.32Å; D642-N644 PolarHBondContact OD1-N 2.72Å; D642-N644 PolarHBondContact OD1-ND2 2.76Å; D642-K645 HydrophobicContact CB-CD 4.27Å; D642-K645 HydrophobicContact CB-CG 4.23Å
643	L	91.5	Very high	93.3	Very high	29 Å²	29	79.9 Å²	79.9	15%	0.152	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-73.3	-18.2	179	-61.6	-178.2	0	0	0	113.1	I594 M598 S641 K645 Y646 P650 L655	I594-L643 HydrophobicContact CG2-CD1 3.85Å; M598-L643 HydrophobicContact SD-CD1 3.94Å; S641-L643 PolarHBondContact O-N 3.18Å; L643-K645 PolarHBondContact O-N 2.98Å; L643-Y646 WeakPolarHBondContact O-CD2 3.38Å; L643-Y646 PolarHBondContact O-N 2.91Å; L643-P650 HydrophobicContact CB-CG 4.11Å; L643-P650 HydrophobicContact CD1-CG 4.32Å; L643-P650 HydrophobicContact CD2-CG 3.97Å; L643-P650 HydrophobicContact CG-CG 4.36Å; L643-P650 WeakPolarHBondContact O-CD 3.3Å; L643-L655 HydrophobicContact CD1-CD1 3.9Å
644	N	90.9	Very high	93.4	Very high	120 Å²	120	78.4 Å²	78.4	64%	0.642	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-72.6	-9.2	179.7	-59.9	-59.3	0	0	0	113.1	D642 Y646	D642-N644 VanDerWaalsContact C-N 3.27Å; D642-N644 PolarHBondContact O-N 2.85Å; D642-N644 WeakPolarHBondContact OD1-CB 3.32Å; D642-N644 PolarHBondContact OD1-N 2.72Å; D642-N644 PolarHBondContact OD1-ND2 2.76Å; N644-Y646 PolarHBondContact O-N 2.9Å
645	K	90.5	Very high	93.4	Very high	129 Å²	129	77.4 Å²	77.4	56%	0.561	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-67.9	-16.4	173.5	-65.7	-178.8	171.6	-173.6	0	113.2	E639 D642 L643	E639-K645 VanDerWaalsContact C-NZ 3.32Å; E639-K645 WeakPolarHBondContact O-CE 3.33Å; E639-K645 PolarHBondContact O-NZ 3.19Å; D642-K645 HydrophobicContact CB-CD 4.27Å; D642-K645 HydrophobicContact CB-CG 4.23Å; L643-K645 PolarHBondContact O-N 2.98Å
646	Y	88.4	Confident	93.4	Very high	143 Å²	143	71.7 Å²	71.7	56%	0.561	38%	0.378	S	S	*	.	S	Bend	trans	-95.4	143.2	177	-58.3	-78.9	0	0	0	110.9	L643 N644 P648 P649 P650	L643-Y646 WeakPolarHBondContact O-CD2 3.38Å; L643-Y646 PolarHBondContact O-N 2.91Å; N644-Y646 PolarHBondContact O-N 2.9Å; Y646-P648 CarbonylContact C-O 3.48Å; Y646-P648 CarbonylContact O-C 3.42Å; Y646-P649 WeakPolarHBondContact O-CA 3.4Å; Y646-P649 WeakPolarHBondContact O-CD 3.44Å; Y646-P649 VanDerWaalsContact O-N 3.09Å; Y646-P650 HydrophobicContact CD2-CG 4.44Å
647	S	86.5	Confident	93.5	Very high	125 Å²	125	71.2 Å²	71.2	87%	0.874	38%	0.376	S	S	*	.	S	Bend	trans	-124.1	109.1	179.4	-179.7	0	0	0	0	111.3
648	P	87.3	Confident	93.6	Very high	113 Å²	113	72.6 Å²	72.6	73%	0.734	39%	0.388	S	S	*	.	S	Bend	cis	-71.3	159.3	-4.8	31.4	-35.4	0	0	0	112.6	Y646	Y646-P648 CarbonylContact C-O 3.48Å; Y646-P648 CarbonylContact O-C 3.42Å
649	P	91.8	Very high	93.7	Very high	66 Å²	66	68.4 Å²	68.4	43%	0.429	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-59.7	139.9	173.1	-24.3	34.3	0	0	0	111.2	Y646	Y646-P649 WeakPolarHBondContact O-CA 3.4Å; Y646-P649 WeakPolarHBondContact O-CD 3.44Å; Y646-P649 VanDerWaalsContact O-N 3.09Å
650	P	93.8	Very high	93.8	Very high	28 Å²	28	62.7 Å²	62.7	18%	0.182	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-64.4	140.2	-179.9	26.9	-34.5	0	0	0	111	L643 Y646 D654 L655	L643-P650 HydrophobicContact CB-CG 4.11Å; L643-P650 HydrophobicContact CD1-CG 4.32Å; L643-P650 HydrophobicContact CD2-CG 3.97Å; L643-P650 HydrophobicContact CG-CG 4.36Å; L643-P650 WeakPolarHBondContact O-CD 3.3Å; Y646-P650 HydrophobicContact CD2-CG 4.44Å; P650-D654 HydrophobicContact CB-CB 4.25Å; P650-L655 HydrophobicContact CB-CD2 4.41Å; P650-L655 HydrophobicContact CG-CD2 4.45Å
651	Q	94.6	Very high	94.1	Very high	125 Å²	125	63.8 Å²	63.8	58%	0.584	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-85.9	166.6	173.2	-61.8	-168.9	-13	0	0	111.3	S653 D654 L655	Q651-S653 PolarHBondContact O-N 2.68Å; Q651-D654 PolarHBondContact N-OD2 3.48Å; Q651-D654 WeakPolarHBondContact O-CB 3.06Å; Q651-D654 PolarHBondContact O-N 3.38Å; Q651-L655 PolarHBondContact O-N 3.41Å; Q651-L655 VanDerWaalsContact O-N 3.17Å
652	S	94.9	Very high	94.3	Very high	19 Å²	19	65 Å²	65	13%	0.133	35%	0.348	C	S	.	.	H	α-helix	trans	-58	-35.4	177.8	57.8	0	0	0	0	112.4	D599 D654 L655 Y656	D599-S652 WeakPolarHBondContact OD1-CB 3.38Å; D599-S652 PolarHBondContact OD1-OG 2.95Å; S652-D654 VanDerWaalsContact C-N 3.35Å; S652-D654 PolarHBondContact O-N 3.4Å; S652-L655 PolarHBondContact O-N 3.23Å; S652-Y656 WeakPolarHBondContact O-CD2 3.36Å; S652-Y656 PolarHBondContact O-N 2.95Å
653	S	95.5	Very high	94.6	Very high	39 Å²	39	62.2 Å²	62.2	27%	0.273	33%	0.333	S	S	.	.	H	α-helix	trans	-61	-39	173.5	51.5	0	0	0	0	113.5	Q651 L655 M657	Q651-S653 PolarHBondContact O-N 2.68Å; S653-L655 VanDerWaalsContact C-N 3.34Å; S653-M657 PolarHBondContact O-N 3.34Å
654	D	96.7	Very high	94.9	Very high	85 Å²	85	64.6 Å²	64.6	46%	0.455	34%	0.343	S	S	.	.	H	α-helix	trans	-67.6	-39.6	178.3	-57.8	-44.1	0	0	0	110.6	P650 Q651 S652 M657 A658	P650-D654 HydrophobicContact CB-CB 4.25Å; Q651-D654 PolarHBondContact N-OD2 3.48Å; Q651-D654 WeakPolarHBondContact O-CB 3.06Å; Q651-D654 PolarHBondContact O-N 3.38Å; S652-D654 VanDerWaalsContact C-N 3.35Å; S652-D654 PolarHBondContact O-N 3.4Å; D654-M657 PolarHBondContact O-N 2.97Å; D654-A658 WeakPolarHBondContact O-CB 3.36Å; D654-A658 PolarHBondContact O-N 2.98Å
655	L	97.3	Very high	95.3	Very high	7 Å²	7	63.3 Å²	63.3	4%	0.037	33%	0.334	C	S	.	.	H	α-helix	trans	-69.6	-40.2	177.7	-66	177.8	0	0	0	112.5	K591 I594 A595 M598 L643 P650 Q651 S652 S653 M657 A658 A659	K591-L655 HydrophobicContact CD-CD2 3.95Å; I594-L655 HydrophobicContact CB-CD1 4.18Å; I594-L655 HydrophobicContact CG2-CD1 3.71Å; A595-L655 HydrophobicContact CB-CB 3.81Å; A595-L655 HydrophobicContact CB-CD1 4.49Å; M598-L655 HydrophobicContact SD-CD1 3.39Å; M598-L655 WeakPolarHBondContact SD-CD1 3.34Å; L643-L655 HydrophobicContact CD1-CD1 3.9Å; P650-L655 HydrophobicContact CB-CD2 4.41Å; P650-L655 HydrophobicContact CG-CD2 4.45Å; Q651-L655 PolarHBondContact O-N 3.41Å; Q651-L655 VanDerWaalsContact O-N 3.17Å; S652-L655 PolarHBondContact O-N 3.23Å; S653-L655 VanDerWaalsContact C-N 3.34Å; L655-M657 VanDerWaalsContact C-N 3.32Å; L655-M657 PolarHBondContact O-N 3.01Å; L655-A658 PolarHBondContact O-N 3.33Å; L655-A659 WeakPolarHBondContact O-CB 3.29Å; L655-A659 PolarHBondContact O-N 3.06Å
656	Y	98.3	Very high	95.7	Very high	1 Å²	1	57.1 Å²	57.1	0%	0.004	31%	0.307	C	S	.	.	H	α-helix	trans	-61.2	-41.9	171.3	-68.8	-53.4	0	0	0	111.3	A595 F596 D599 S652 A658 A659 S660 M694 L697	A595-Y656 HydrophobicContact CB-CD1 3.51Å; A595-Y656 HydrophobicContact CB-CD2 4.16Å; A595-Y656 HydrophobicContact CB-CE1 3.31Å; A595-Y656 HydrophobicContact CB-CE2 3.99Å; A595-Y656 HydrophobicContact CB-CG 3.93Å; A595-Y656 PolarHBondContact O-OH 3.33Å; F596-Y656 AromaticContact CD1-CE1 3.87Å; F596-Y656 HydrophobicContact CD1-CE1 3.87Å; F596-Y656 AromaticContact CD1-CZ 3.95Å; F596-Y656 WeakPolarHBondContact CD1-OH 3.49Å; F596-Y656 AromaticContact CE1-CE1 3.84Å; F596-Y656 HydrophobicContact CE1-CE1 3.84Å; F596-Y656 HydrophobicContact CG-CE1 4.45Å; F596-Y656 HydrophobicContact CZ-CE1 4.4Å; D599-Y656 VanDerWaalsContact OD2-CE2 3.31Å; D599-Y656 WeakPolarHBondContact OD2-CE2 3.15Å; D599-Y656 PolarHBondContact OD2-OH 3.01Å; S652-Y656 WeakPolarHBondContact O-CD2 3.36Å; S652-Y656 PolarHBondContact O-N 2.95Å; Y656-A658 PolarHBondContact O-N 3.24Å; Y656-A659 PolarHBondContact O-N 3.39Å; Y656-S660 PolarHBondContact O-N 3.43Å; Y656-M694 HydrophobicContact CD1-SD 3.71Å; Y656-M694 HydrophobicContact CE1-SD 4.38Å; Y656-M694 WeakPolarHBondContact O-CB 3.39Å; Y656-L697 HydrophobicContact CD1-CB 3.93Å; Y656-L697 HydrophobicContact CD1-CD1 3.86Å; Y656-L697 HydrophobicContact CD2-CB 3.71Å; Y656-L697 HydrophobicContact CE1-CB 4.09Å; Y656-L697 HydrophobicContact CE1-CD1 3.58Å; Y656-L697 HydrophobicContact CE1-CG 4.38Å; Y656-L697 HydrophobicContact CE2-CB 3.89Å; Y656-L697 HydrophobicContact CG-CB 3.74Å
657	M	98.2	Very high	96.1	Very high	75 Å²	75	53.3 Å²	53.3	37%	0.369	29%	0.293	S	S	.	.	H	α-helix	trans	-64.6	-40.8	175.8	-173.3	57	66.7	0	0	111.8	S653 D654 L655 S660 K661 A698	S653-M657 PolarHBondContact O-N 3.34Å; D654-M657 PolarHBondContact O-N 2.97Å; L655-M657 VanDerWaalsContact C-N 3.32Å; L655-M657 PolarHBondContact O-N 3.01Å; M657-S660 PolarHBondContact O-N 3.05Å; M657-K661 WeakPolarHBondContact O-CG 3.35Å; M657-K661 PolarHBondContact O-N 2.67Å; M657-A698 HydrophobicContact CB-CB 4.32Å; M657-A698 HydrophobicContact CE-CB 4Å
658	A	97.9	Very high	96.7	Very high	29 Å²	29	52.5 Å²	52.5	24%	0.24	28%	0.277	C	S	.	.	H	α-helix	trans	-62.6	-43.8	174.3	0	0	0	0	0	111.9	D654 L655 Y656 S660 K661 H662	D654-A658 WeakPolarHBondContact O-CB 3.36Å; D654-A658 PolarHBondContact O-N 2.98Å; L655-A658 PolarHBondContact O-N 3.33Å; Y656-A658 PolarHBondContact O-N 3.24Å; A658-S660 VanDerWaalsContact C-N 3.34Å; A658-S660 PolarHBondContact O-N 2.86Å; A658-K661 WeakPolarHBondContact O-CB 3.37Å; A658-K661 PolarHBondContact O-N 3.37Å; A658-H662 PolarHBondContact O-CD2 2.86Å; A658-H662 VanDerWaalsContact O-CD2 3.25Å; A658-H662 PolarHBondContact O-N 3.21Å
659	A	98.4	Very high	97.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-57.8	-46.3	174.5	0	0	0	0	0	111.5	G588 K591 T592 L655 Y656 K661 H662 F663 M694	G588-A659 WeakPolarHBondContact O-CB 3.34Å; K591-A659 HydrophobicContact CB-CB 3.89Å; T592-A659 WeakPolarHBondContact OG1-CB 3.35Å; L655-A659 WeakPolarHBondContact O-CB 3.29Å; L655-A659 PolarHBondContact O-N 3.06Å; Y656-A659 PolarHBondContact O-N 3.39Å; A659-K661 VanDerWaalsContact C-N 3.32Å; A659-K661 PolarHBondContact O-N 3.37Å; A659-H662 PolarHBondContact O-N 3.3Å; A659-F663 HydrophobicContact CB-CE2 4.31Å; A659-F663 WeakPolarHBondContact O-CD2 3.47Å; A659-F663 PolarHBondContact O-N 3.18Å; A659-M694 HydrophobicContact CB-CG 3.97Å; A659-M694 HydrophobicContact CB-SD 4.23Å
660	S	98.6	Very high	97.3	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.007	23%	0.228	C	C	.	.	H	α-helix	trans	-58.9	-41.4	176.1	-168.6	0	0	0	0	112.5	Y656 M657 A658 F663 Q664 I691 K695	Y656-S660 PolarHBondContact O-N 3.43Å; M657-S660 PolarHBondContact O-N 3.05Å; A658-S660 VanDerWaalsContact C-N 3.34Å; A658-S660 PolarHBondContact O-N 2.86Å; S660-F663 PolarHBondContact O-N 3.45Å; S660-Q664 VanDerWaalsContact O-CB 3.3Å; S660-Q664 WeakPolarHBondContact O-CB 3.3Å; S660-Q664 PolarHBondContact O-N 3.04Å; S660-I691 PolarHBondContact OG-O 2.95Å; S660-I691 VanDerWaalsContact OG-O 3.1Å; S660-K695 VanDerWaalsContact OG-CE 3.3Å; S660-K695 WeakPolarHBondContact OG-CE 3.4Å; S660-K695 WeakPolarHBondContact OG-CG 3.39Å
661	K	98.6	Very high	97.3	Very high	126 Å²	126	48.5 Å²	48.5	55%	0.548	24%	0.241	S	C	.	.	H	α-helix	trans	-62.1	-43.1	176.1	-72.8	173.9	-178.7	175.6	0	111.9	M657 A658 A659 Q664 Q665	M657-K661 WeakPolarHBondContact O-CG 3.35Å; M657-K661 PolarHBondContact O-N 2.67Å; A658-K661 WeakPolarHBondContact O-CB 3.37Å; A658-K661 PolarHBondContact O-N 3.37Å; A659-K661 VanDerWaalsContact C-N 3.32Å; A659-K661 PolarHBondContact O-N 3.37Å; K661-Q664 PolarHBondContact O-N 3.26Å; K661-Q665 WeakPolarHBondContact O-CG 3.48Å; K661-Q665 PolarHBondContact O-N 2.87Å
662	H	98.6	Very high	97.3	Very high	46 Å²	46	48.9 Å²	48.9	21%	0.213	25%	0.247	C	C	.	.	H	α-helix	trans	-64	-46.3	176.4	-77	-63.7	0	0	0	112.3	N584 A587 A658 A659 Q664 Q665 A666	N584-H662 WeakPolarHBondContact O-CB 3.16Å; N584-H662 PolarHBondContact OD1-ND1 3.32Å; A587-H662 HydrophobicContact CB-CB 4.41Å; A658-H662 PolarHBondContact O-CD2 2.86Å; A658-H662 VanDerWaalsContact O-CD2 3.25Å; A658-H662 PolarHBondContact O-N 3.21Å; A659-H662 PolarHBondContact O-N 3.3Å; H662-Q664 VanDerWaalsContact C-N 3.25Å; H662-Q664 PolarHBondContact O-N 3.14Å; H662-Q665 PolarHBondContact O-N 3.15Å; H662-Q665 VanDerWaalsContact O-N 3.15Å; H662-A666 PolarHBondContact O-N 3.23Å
663	F	98.7	Very high	97.1	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.5	-35.6	174.3	-64.2	-51.2	0	0	0	112.3	M585 M589 A659 S660 A666 K667 N690 I691 M694	M585-F663 HydrophobicContact CE-CD1 4.1Å; M585-F663 HydrophobicContact CE-CE1 4.09Å; M585-F663 HydrophobicContact SD-CD1 3.76Å; M585-F663 HydrophobicContact SD-CE1 4.24Å; M589-F663 HydrophobicContact CG-CE1 4.22Å; M589-F663 HydrophobicContact CG-CZ 4.13Å; M589-F663 HydrophobicContact SD-CE1 4.22Å; M589-F663 HydrophobicContact SD-CZ 3.71Å; A659-F663 HydrophobicContact CB-CE2 4.31Å; A659-F663 WeakPolarHBondContact O-CD2 3.47Å; A659-F663 PolarHBondContact O-N 3.18Å; S660-F663 PolarHBondContact O-N 3.45Å; F663-A666 PolarHBondContact O-N 2.99Å; F663-K667 WeakPolarHBondContact O-CB 3.49Å; F663-K667 PolarHBondContact O-N 2.92Å; F663-N690 HydrophobicContact CD1-CB 4.49Å; F663-N690 HydrophobicContact CD2-CB 3.8Å; F663-N690 HydrophobicContact CE1-CB 4.46Å; F663-N690 HydrophobicContact CE2-CB 3.77Å; F663-N690 HydrophobicContact CG-CB 4.18Å; F663-N690 HydrophobicContact CZ-CB 4.11Å; F663-I691 HydrophobicContact CB-CD1 4.36Å; F663-I691 HydrophobicContact CB-CG1 3.54Å; F663-M694 HydrophobicContact CD2-CG 4.14Å; F663-M694 HydrophobicContact CE2-CG 3.89Å
664	Q	98.5	Very high	96.5	Very high	79 Å²	79	52.5 Å²	52.5	37%	0.369	27%	0.267	S	S	.	.	H	α-helix	trans	-67.1	-39.8	174.8	-176.6	167.5	-11.7	0	0	112.1	S660 K661 H662 K667 M668 I691	S660-Q664 VanDerWaalsContact O-CB 3.3Å; S660-Q664 WeakPolarHBondContact O-CB 3.3Å; S660-Q664 PolarHBondContact O-N 3.04Å; K661-Q664 PolarHBondContact O-N 3.26Å; H662-Q664 VanDerWaalsContact C-N 3.25Å; H662-Q664 PolarHBondContact O-N 3.14Å; Q664-K667 PolarHBondContact O-N 3.29Å; Q664-M668 HydrophobicContact CG-SD 4.38Å; Q664-M668 VanDerWaalsContact O-CG 3.31Å; Q664-M668 WeakPolarHBondContact O-CG 3.46Å; Q664-M668 PolarHBondContact O-N 2.67Å; Q664-I691 HydrophobicContact CB-CD1 4.17Å; Q664-I691 HydrophobicContact CB-CG1 4.39Å
665	Q	98.3	Very high	96	Very high	93 Å²	93	55.8 Å²	55.8	44%	0.435	29%	0.285	S	S	.	.	H	α-helix	trans	-63.4	-46.6	173.5	-74.3	173.9	-4.8	0	0	111.3	N584 K661 H662 K667 M668 I669	N584-Q665 PolarHBondContact OD1-OE1 2.81Å; K661-Q665 WeakPolarHBondContact O-CG 3.48Å; K661-Q665 PolarHBondContact O-N 2.87Å; H662-Q665 PolarHBondContact O-N 3.15Å; H662-Q665 VanDerWaalsContact O-N 3.15Å; Q665-K667 VanDerWaalsContact C-N 3.33Å; Q665-K667 PolarHBondContact O-N 3.09Å; Q665-M668 PolarHBondContact O-N 3.49Å; Q665-I669 WeakPolarHBondContact O-CD1 3.48Å; Q665-I669 VanDerWaalsContact O-CG1 3.25Å; Q665-I669 WeakPolarHBondContact O-CG1 3.38Å; Q665-I669 PolarHBondContact O-N 3.48Å
666	A	98.1	Very high	95.5	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-56.2	-47.6	174.5	0	0	0	0	0	111.3	N584 M585 H662 F663 M668 I669 L670	N584-A666 HydrophobicContact CB-CB 3.85Å; M585-A666 HydrophobicContact CG-CB 3.96Å; M585-A666 HydrophobicContact SD-CB 3.83Å; H662-A666 PolarHBondContact O-N 3.23Å; F663-A666 PolarHBondContact O-N 2.99Å; A666-M668 PolarHBondContact O-N 3.08Å; A666-I669 PolarHBondContact O-N 2.95Å; A666-L670 WeakPolarHBondContact O-CB 3.39Å; A666-L670 VanDerWaalsContact O-CG 3.22Å; A666-L670 WeakPolarHBondContact O-CG 3.05Å; A666-L670 PolarHBondContact O-N 2.94Å
667	K	98.1	Very high	95	Very high	63 Å²	63	60.4 Å²	60.4	27%	0.274	31%	0.313	S	S	.	.	H	α-helix	trans	-56.1	-50.1	175.1	177.8	-166.7	166.6	-171.3	0	111.9	F663 Q664 Q665 I669 L670 E671 L684 K688 I691	F663-K667 WeakPolarHBondContact O-CB 3.49Å; F663-K667 PolarHBondContact O-N 2.92Å; Q664-K667 PolarHBondContact O-N 3.29Å; Q665-K667 VanDerWaalsContact C-N 3.33Å; Q665-K667 PolarHBondContact O-N 3.09Å; K667-I669 VanDerWaalsContact C-N 3.32Å; K667-I669 PolarHBondContact O-N 2.63Å; K667-L670 PolarHBondContact O-N 2.7Å; K667-E671 WeakPolarHBondContact CE-OE1 3.49Å; K667-E671 WeakPolarHBondContact CE-OE2 3.36Å; K667-E671 HydrophobicContact CG-CG 4.28Å; K667-E671 IonicContact NZ-OE1 3.95Å; K667-E671 IonicContact NZ-OE2 3.97Å; K667-E671 WeakPolarHBondContact O-CB 3.32Å; K667-E671 WeakPolarHBondContact O-CG 3.37Å; K667-E671 PolarHBondContact O-N 3.17Å; K667-L684 HydrophobicContact CB-CD2 4.32Å; K667-L684 HydrophobicContact CG-CD2 3.96Å; K667-K688 HydrophobicContact CD-CG 4.18Å; K667-I691 HydrophobicContact CB-CD1 4.2Å; K667-I691 HydrophobicContact CD-CD1 3.91Å
668	M	97.8	Very high	94.6	Very high	107 Å²	107	64 Å²	64	53%	0.527	33%	0.329	S	S	.	.	H	α-helix	trans	-62	-40	-179	-74	176.5	65.3	0	0	112.2	Q664 Q665 A666 N672	Q664-M668 HydrophobicContact CG-SD 4.38Å; Q664-M668 VanDerWaalsContact O-CG 3.31Å; Q664-M668 WeakPolarHBondContact O-CG 3.46Å; Q664-M668 PolarHBondContact O-N 2.67Å; Q665-M668 PolarHBondContact O-N 3.49Å; A666-M668 PolarHBondContact O-N 3.08Å; M668-N672 VanDerWaalsContact O-CG 3.29Å; M668-N672 PolarHBondContact O-N 3.09Å; M668-N672 PolarHBondContact O-ND2 3.24Å
669	I	96.3	Very high	94.4	Very high	28 Å²	28	64.4 Å²	64.4	14%	0.144	33%	0.325	C	S	.	.	H	α-helix	trans	-62.1	-49	176.5	-69.2	164.3	0	0	0	110	T577 Q580 A581 Q665 A666 K667 N672	T577-I669 HydrophobicContact CG2-CG2 3.46Å; T577-I669 VanDerWaalsContact CG2-CG2 3.46Å; T577-I669 WeakPolarHBondContact O-CG2 3.22Å; Q580-I669 HydrophobicContact CB-CD1 4.29Å; Q580-I669 HydrophobicContact CG-CD1 3.71Å; A581-I669 HydrophobicContact CB-CG2 4.12Å; Q665-I669 WeakPolarHBondContact O-CD1 3.48Å; Q665-I669 VanDerWaalsContact O-CG1 3.25Å; Q665-I669 WeakPolarHBondContact O-CG1 3.38Å; Q665-I669 PolarHBondContact O-N 3.48Å; A666-I669 PolarHBondContact O-N 2.95Å; K667-I669 VanDerWaalsContact C-N 3.32Å; K667-I669 PolarHBondContact O-N 2.63Å; I669-N672 PolarHBondContact O-N 3.35Å
670	L	95.8	Very high	94.2	Very high	1 Å²	1	64.4 Å²	64.4	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-70.1	-38	-175.4	-69.7	172.2	0	0	0	113.4	M578 A581 A666 K667 N672 I673 V680 I683 L684	M578-L670 HydrophobicContact CE-CD2 4.4Å; M578-L670 HydrophobicContact SD-CD2 3.94Å; A581-L670 HydrophobicContact CB-CD1 4.16Å; A581-L670 HydrophobicContact CB-CD2 3.6Å; A581-L670 HydrophobicContact CB-CG 3.72Å; A666-L670 WeakPolarHBondContact O-CB 3.39Å; A666-L670 VanDerWaalsContact O-CG 3.22Å; A666-L670 WeakPolarHBondContact O-CG 3.05Å; A666-L670 PolarHBondContact O-N 2.94Å; K667-L670 PolarHBondContact O-N 2.7Å; L670-N672 PolarHBondContact O-N 2.94Å; L670-I673 HydrophobicContact CD2-CD1 3.9Å; L670-I673 WeakPolarHBondContact O-CB 3.41Å; L670-I673 PolarHBondContact O-N 3.04Å; L670-I673 VanDerWaalsContact O-N 3.14Å; L670-V680 HydrophobicContact CB-CG1 4.09Å; L670-V680 HydrophobicContact CD2-CG1 4.13Å; L670-V680 HydrophobicContact CD2-CG2 4.17Å; L670-I683 HydrophobicContact CD1-CB 3.8Å; L670-I683 HydrophobicContact CD1-CG2 3.42Å; L670-I683 VanDerWaalsContact CD1-CG2 3.42Å; L670-L684 HydrophobicContact CB-CD1 4.38Å; L670-L684 HydrophobicContact CB-CD2 3.85Å; L670-L684 HydrophobicContact CB-CG 4.04Å; L670-L684 HydrophobicContact CD1-CD2 4.26Å; L670-L684 HydrophobicContact CD1-CG 4.25Å
671	E	95.1	Very high	94	Very high	94 Å²	94	67.6 Å²	67.6	44%	0.439	34%	0.342	S	S	.	.	H	α-helix	trans	-67.3	-18.5	177.1	-74.3	179.9	164	0	0	112.8	K667 L684 K688	K667-E671 WeakPolarHBondContact CE-OE1 3.49Å; K667-E671 WeakPolarHBondContact CE-OE2 3.36Å; K667-E671 HydrophobicContact CG-CG 4.28Å; K667-E671 IonicContact NZ-OE1 3.95Å; K667-E671 IonicContact NZ-OE2 3.97Å; K667-E671 WeakPolarHBondContact O-CB 3.32Å; K667-E671 WeakPolarHBondContact O-CG 3.37Å; K667-E671 PolarHBondContact O-N 3.17Å; E671-L684 HydrophobicContact CG-CD1 4.31Å; E671-L684 HydrophobicContact CG-CD2 3.97Å; E671-K688 WeakPolarHBondContact OE1-CE 3.43Å; E671-K688 IonicContact OE1-NZ 2.63Å; E671-K688 PolarHBondContact OE1-NZ 2.96Å; E671-K688 VanDerWaalsContact OE1-NZ 3.11Å
672	N	93.4	Very high	93.9	Very high	133 Å²	133	67 Å²	67	71%	0.711	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-5.6	175.5	-71.4	-31.5	0	0	0	113.7	M668 I669 L670 P674	M668-N672 VanDerWaalsContact O-CG 3.29Å; M668-N672 PolarHBondContact O-N 3.09Å; M668-N672 PolarHBondContact O-ND2 3.24Å; I669-N672 PolarHBondContact O-N 3.35Å; L670-N672 PolarHBondContact O-N 2.94Å; N672-P674 WeakPolarHBondContact O-CD 3.48Å
673	I	90.6	Very high	93.8	Very high	24 Å²	24	64.8 Å²	64.8	12%	0.123	33%	0.327	C	S	.	.	S	Bend	trans	-75	121.9	177.8	-63.2	177.3	0	0	0	109.1	T577 M578 L670 N675 V680	T577-I673 HydrophobicContact CG2-CD1 3.87Å; T577-I673 HydrophobicContact CG2-CG1 3.83Å; M578-I673 HydrophobicContact SD-CD1 3.63Å; L670-I673 HydrophobicContact CD2-CD1 3.9Å; L670-I673 WeakPolarHBondContact O-CB 3.41Å; L670-I673 PolarHBondContact O-N 3.04Å; L670-I673 VanDerWaalsContact O-N 3.14Å; I673-N675 PolarHBondContact O-N 3.36Å; I673-V680 HydrophobicContact CD1-CG2 3.92Å
674	P	84.1	Confident	93.8	Very high	110 Å²	110	65.4 Å²	65.4	71%	0.714	33%	0.33	S	S	*	.	S	Bend	trans	-69.2	133.9	175.5	29.3	-33	0	0	0	109.8	N672	N672-P674 WeakPolarHBondContact O-CD 3.48Å
675	N	85.1	Confident	93.7	Very high	154 Å²	154	68.4 Å²	68.4	82%	0.824	34%	0.342	S	S	*	.	S	Bend	trans	55.3	70.3	-177.5	-57.1	-26.4	0	0	0	112.7	I673 D677	I673-N675 PolarHBondContact O-N 3.36Å; N675-D677 PolarHBondContact O-N 2.99Å
676	P	86.4	Confident	93.7	Very high	60 Å²	60	64 Å²	64	39%	0.39	32%	0.321	S	S	.	.			trans	-62.7	125.4	-177.4	27.2	-35.1	0	0	0	111.2	V680 N681	P676-V680 HydrophobicContact CB-CB 3.92Å; P676-V680 HydrophobicContact CB-CG1 3.5Å; P676-N681 PolarHBondContact O-ND2 3.32Å
677	D	89.3	Confident	93.7	Very high	45 Å²	45	64 Å²	64	24%	0.241	32%	0.321	C	S	.	.			trans	-73.6	179.1	175.4	59.3	41	0	0	0	112.1	R574 N675 E679 V680 N681	R574-D677 IonicContact CZ-OD2 3.35Å; R574-D677 IonicContact NH2-OD2 2.53Å; R574-D677 PolarHBondContact NH2-OD2 3.36Å; N675-D677 PolarHBondContact O-N 2.99Å; D677-E679 PolarHBondContact O-N 3.41Å; D677-E679 WeakPolarHBondContact OD1-CA 3.47Å; D677-E679 WeakPolarHBondContact OD1-CB 3.4Å; D677-E679 PolarHBondContact OD1-N 2.68Å; D677-V680 PolarHBondContact O-N 3.32Å; D677-V680 WeakPolarHBondContact OD1-CG2 3.27Å; D677-V680 PolarHBondContact OD1-N 2.88Å; D677-N681 PolarHBondContact O-N 3.49Å; D677-N681 PolarHBondContact O-ND2 3.28Å
678	H	90.1	Very high	93.7	Very high	152 Å²	152	65.4 Å²	65.4	70%	0.704	33%	0.327	S	S	*	.	H	α-helix	trans	-58.9	-34.5	179.6	-76	-69.5	0	0	0	112.9	N681 R682	H678-N681 PolarHBondContact O-N 3.03Å; H678-R682 VanDerWaalsContact O-CG 3.31Å; H678-R682 WeakPolarHBondContact O-CG 3.4Å; H678-R682 PolarHBondContact O-N 3.17Å
679	E	92	Very high	93.8	Very high	36 Å²	36	62.7 Å²	62.7	17%	0.168	32%	0.318	C	S	.	.	H	α-helix	trans	-72.4	-46.3	-176.7	177.5	57.9	-169.6	0	0	111.3	M578 Y582 D677 N681 R682 I683 H716	M578-E679 HydrophobicContact CE-CG 4.24Å; Y582-E679 PolarHBondContact OH-OE1 3.2Å; D677-E679 PolarHBondContact O-N 3.41Å; D677-E679 WeakPolarHBondContact OD1-CA 3.47Å; D677-E679 WeakPolarHBondContact OD1-CB 3.4Å; D677-E679 PolarHBondContact OD1-N 2.68Å; E679-N681 PolarHBondContact O-N 3.23Å; E679-R682 PolarHBondContact O-N 3.28Å; E679-I683 HydrophobicContact CG-CD1 4.29Å; E679-I683 WeakPolarHBondContact O-CG1 3.37Å; E679-I683 PolarHBondContact O-N 3.35Å; E679-H716 IonicContact OE1-CD2 2.73Å; E679-H716 IonicContact OE1-NE2 2.62Å; E679-H716 PolarHBondContact OE1-NE2 3.46Å; E679-H716 IonicContact OE2-CD2 3.33Å; E679-H716 IonicContact OE2-NE2 3.62Å
680	V	94.9	Very high	93.9	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-52.8	-44.9	171.7	172.4	0	0	0	0	110.9	M578 L670 I673 P676 D677 I683 L684	M578-V680 HydrophobicContact CE-CG2 4.11Å; M578-V680 HydrophobicContact SD-CG2 3.77Å; L670-V680 HydrophobicContact CB-CG1 4.09Å; L670-V680 HydrophobicContact CD2-CG1 4.13Å; L670-V680 HydrophobicContact CD2-CG2 4.17Å; I673-V680 HydrophobicContact CD1-CG2 3.92Å; P676-V680 HydrophobicContact CB-CB 3.92Å; P676-V680 HydrophobicContact CB-CG1 3.5Å; D677-V680 PolarHBondContact O-N 3.32Å; D677-V680 WeakPolarHBondContact OD1-CG2 3.27Å; D677-V680 PolarHBondContact OD1-N 2.88Å; V680-I683 PolarHBondContact O-N 3.04Å; V680-L684 HydrophobicContact CG1-CD1 4Å; V680-L684 WeakPolarHBondContact O-CB 3.38Å; V680-L684 VanDerWaalsContact O-CG 3.31Å; V680-L684 WeakPolarHBondContact O-CG 3.18Å; V680-L684 PolarHBondContact O-N 3.24Å
681	N	95.5	Very high	94	Very high	68 Å²	68	62.1 Å²	62.1	36%	0.364	31%	0.314	S	S	.	.	H	α-helix	trans	-66.4	-37.2	178.9	-74.3	-59.2	0	0	0	113	P676 D677 H678 E679 L684 K685	P676-N681 PolarHBondContact O-ND2 3.32Å; D677-N681 PolarHBondContact O-N 3.49Å; D677-N681 PolarHBondContact O-ND2 3.28Å; H678-N681 PolarHBondContact O-N 3.03Å; E679-N681 PolarHBondContact O-N 3.23Å; N681-L684 PolarHBondContact O-N 3.31Å; N681-K685 WeakPolarHBondContact O-CG 3.47Å; N681-K685 PolarHBondContact O-N 2.85Å
682	R	95.9	Very high	94.1	Very high	113 Å²	113	61.7 Å²	61.7	43%	0.426	32%	0.318	S	S	.	.	H	α-helix	trans	-64.8	-45.9	175.5	-72.6	174.6	-162.6	-167.6	4.7	111.4	H678 E679 L684 K685 V686	H678-R682 VanDerWaalsContact O-CG 3.31Å; H678-R682 WeakPolarHBondContact O-CG 3.4Å; H678-R682 PolarHBondContact O-N 3.17Å; E679-R682 PolarHBondContact O-N 3.28Å; R682-L684 VanDerWaalsContact C-N 3.34Å; R682-L684 PolarHBondContact O-N 3.01Å; R682-K685 WeakPolarHBondContact O-CB 3.39Å; R682-K685 PolarHBondContact O-N 3.44Å; R682-V686 PolarHBondContact O-N 3.16Å
683	I	97.1	Very high	94.3	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-63.5	-41.4	178.1	-58.9	167.3	0	0	0	110.7	M578 Y582 M585 L670 E679 V680 K685 V686 A687	M578-I683 HydrophobicContact CE-CD1 4.15Å; Y582-I683 HydrophobicContact CD2-CD1 3.96Å; Y582-I683 HydrophobicContact CE2-CD1 3.42Å; Y582-I683 VanDerWaalsContact CE2-CD1 3.42Å; M585-I683 HydrophobicContact CE-CG2 4.09Å; M585-I683 HydrophobicContact CG-CG2 3.65Å; M585-I683 HydrophobicContact SD-CG2 3.81Å; L670-I683 HydrophobicContact CD1-CB 3.8Å; L670-I683 HydrophobicContact CD1-CG2 3.42Å; L670-I683 VanDerWaalsContact CD1-CG2 3.42Å; E679-I683 HydrophobicContact CG-CD1 4.29Å; E679-I683 WeakPolarHBondContact O-CG1 3.37Å; E679-I683 PolarHBondContact O-N 3.35Å; V680-I683 PolarHBondContact O-N 3.04Å; I683-K685 VanDerWaalsContact C-N 3.31Å; I683-K685 PolarHBondContact O-N 3.48Å; I683-V686 PolarHBondContact O-N 2.94Å; I683-A687 WeakPolarHBondContact O-CB 3.05Å; I683-A687 PolarHBondContact O-N 3.15Å
684	L	97.6	Very high	94.7	Very high	13 Å²	13	55.2 Å²	55.2	7%	0.068	29%	0.285	C	S	.	.	H	α-helix	trans	-62.1	-35.9	175.8	-75.7	172.5	0	0	0	113	K667 L670 E671 V680 N681 R682 V686 K688	K667-L684 HydrophobicContact CB-CD2 4.32Å; K667-L684 HydrophobicContact CG-CD2 3.96Å; L670-L684 HydrophobicContact CB-CD1 4.38Å; L670-L684 HydrophobicContact CB-CD2 3.85Å; L670-L684 HydrophobicContact CB-CG 4.04Å; L670-L684 HydrophobicContact CD1-CD2 4.26Å; L670-L684 HydrophobicContact CD1-CG 4.25Å; E671-L684 HydrophobicContact CG-CD1 4.31Å; E671-L684 HydrophobicContact CG-CD2 3.97Å; V680-L684 HydrophobicContact CG1-CD1 4Å; V680-L684 WeakPolarHBondContact O-CB 3.38Å; V680-L684 VanDerWaalsContact O-CG 3.31Å; V680-L684 WeakPolarHBondContact O-CG 3.18Å; V680-L684 PolarHBondContact O-N 3.24Å; N681-L684 PolarHBondContact O-N 3.31Å; R682-L684 VanDerWaalsContact C-N 3.34Å; R682-L684 PolarHBondContact O-N 3.01Å; L684-V686 PolarHBondContact O-N 3.42Å; L684-K688 WeakPolarHBondContact O-CB 3.48Å; L684-K688 WeakPolarHBondContact O-CG 3.18Å; L684-K688 PolarHBondContact O-N 2.95Å
685	K	97.4	Very high	95.3	Very high	143 Å²	143	54.5 Å²	54.5	62%	0.622	27%	0.27	S	S	*	.	H	α-helix	trans	-63.6	-26.6	174	-77.4	177.7	179.5	-176.2	0	112.7	N681 R682 I683 P689	N681-K685 WeakPolarHBondContact O-CG 3.47Å; N681-K685 PolarHBondContact O-N 2.85Å; R682-K685 WeakPolarHBondContact O-CB 3.39Å; R682-K685 PolarHBondContact O-N 3.44Å; I683-K685 VanDerWaalsContact C-N 3.31Å; I683-K685 PolarHBondContact O-N 3.48Å; K685-P689 WeakPolarHBondContact O-CD 3.5Å; K685-P689 VanDerWaalsContact O-CG 3.3Å; K685-P689 WeakPolarHBondContact O-CG 3.45Å
686	V	98.2	Very high	95.8	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-88.2	-46.8	176.2	-179.5	0	0	0	0	112	M585 R682 I683 L684 K688 P689 N690 P715 H716 F719 P720 V721	M585-V686 HydrophobicContact CE-CB 4.19Å; M585-V686 HydrophobicContact CE-CG1 3.88Å; R682-V686 PolarHBondContact O-N 3.16Å; I683-V686 PolarHBondContact O-N 2.94Å; L684-V686 PolarHBondContact O-N 3.42Å; V686-K688 PolarHBondContact O-N 3.41Å; V686-P689 WeakPolarHBondContact O-CD 3.31Å; V686-N690 WeakPolarHBondContact CG1-ND2 3.41Å; V686-N690 WeakPolarHBondContact O-CB 3.42Å; V686-N690 PolarHBondContact O-N 3.24Å; V686-P715 HydrophobicContact CG2-CB 4.06Å; V686-H716 HydrophobicContact CG2-CB 3.71Å; V686-F719 HydrophobicContact CG1-CB 4.01Å; V686-F719 WeakPolarHBondContact CG2-O 3.45Å; V686-P720 VanDerWaalsContact CG1-O 3.28Å; V686-P720 WeakPolarHBondContact CG1-O 3.48Å; V686-V721 HydrophobicContact CB-CG2 4.39Å; V686-V721 HydrophobicContact CG1-CG2 4.32Å; V686-V721 HydrophobicContact CG2-CG2 4.21Å
687	A	98.3	Very high	96.3	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60.6	-42.9	-175.9	0	0	0	0	0	112.2	M585 I683 N690 I691	M585-A687 HydrophobicContact CE-CB 4.34Å; M585-A687 HydrophobicContact SD-CB 3.81Å; I683-A687 WeakPolarHBondContact O-CB 3.05Å; I683-A687 PolarHBondContact O-N 3.15Å; A687-N690 PolarHBondContact O-N 3.47Å; A687-I691 WeakPolarHBondContact O-CG1 3.44Å; A687-I691 PolarHBondContact O-N 2.98Å
688	K	98	Very high	96.5	Very high	93 Å²	93	47.6 Å²	47.6	40%	0.404	23%	0.233	S	C	.	.	H	α-helix	trans	-61.7	-52.9	-175.4	-73.3	173.5	-177.1	-176.7	0	112.9	K667 E671 L684 V686 I691	K667-K688 HydrophobicContact CD-CG 4.18Å; E671-K688 WeakPolarHBondContact OE1-CE 3.43Å; E671-K688 IonicContact OE1-NZ 2.63Å; E671-K688 PolarHBondContact OE1-NZ 2.96Å; E671-K688 VanDerWaalsContact OE1-NZ 3.11Å; L684-K688 WeakPolarHBondContact O-CB 3.48Å; L684-K688 WeakPolarHBondContact O-CG 3.18Å; L684-K688 PolarHBondContact O-N 2.95Å; V686-K688 PolarHBondContact O-N 3.41Å; K688-I691 PolarHBondContact O-N 2.98Å
689	P	97.9	Very high	96.7	Very high	50 Å²	50	43.7 Å²	43.7	33%	0.325	23%	0.234	S	C	.	.	H	α-helix	trans	-58.7	-45.2	172.6	-26	34.6	0	0	0	113	K685 V686 I691 V692 V693 V721	K685-P689 WeakPolarHBondContact O-CD 3.5Å; K685-P689 VanDerWaalsContact O-CG 3.3Å; K685-P689 WeakPolarHBondContact O-CG 3.45Å; V686-P689 WeakPolarHBondContact O-CD 3.31Å; P689-I691 VanDerWaalsContact C-N 3.29Å; P689-I691 PolarHBondContact O-N 3.34Å; P689-V692 WeakPolarHBondContact O-CB 3.47Å; P689-V692 PolarHBondContact O-N 2.82Å; P689-V693 WeakPolarHBondContact O-CG2 3.45Å; P689-V693 PolarHBondContact O-N 3.18Å; P689-V721 HydrophobicContact CB-CG1 3.95Å; P689-V721 HydrophobicContact CG-CG1 4.44Å; P689-V721 HydrophobicContact CG-CG2 4.49Å
690	N	98.4	Very high	96.6	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-63.6	-33.9	-176.4	-71	-2.4	0	0	0	112.1	F663 V686 A687 V692 V693 M694 P720 V722	F663-N690 HydrophobicContact CD1-CB 4.49Å; F663-N690 HydrophobicContact CD2-CB 3.8Å; F663-N690 HydrophobicContact CE1-CB 4.46Å; F663-N690 HydrophobicContact CE2-CB 3.77Å; F663-N690 HydrophobicContact CG-CB 4.18Å; F663-N690 HydrophobicContact CZ-CB 4.11Å; V686-N690 WeakPolarHBondContact CG1-ND2 3.41Å; V686-N690 WeakPolarHBondContact O-CB 3.42Å; V686-N690 PolarHBondContact O-N 3.24Å; A687-N690 PolarHBondContact O-N 3.47Å; N690-V692 VanDerWaalsContact C-N 3.31Å; N690-V692 PolarHBondContact O-N 3.25Å; N690-V693 PolarHBondContact O-N 3.44Å; N690-M694 WeakPolarHBondContact O-CB 3.49Å; N690-M694 WeakPolarHBondContact O-CG 3.33Å; N690-M694 PolarHBondContact O-N 3.28Å; N690-P720 PolarHBondContact ND2-O 2.98Å; N690-V722 PolarHBondContact OD1-N 3.32Å
691	I	98.6	Very high	96.3	Very high	16 Å²	16	47.9 Å²	47.9	8%	0.082	26%	0.262	C	S	.	.	H	α-helix	trans	-55.5	-47	171.3	-69.7	161.3	0	0	0	111.2	S660 F663 Q664 K667 A687 K688 P689 K695	S660-I691 PolarHBondContact OG-O 2.95Å; S660-I691 VanDerWaalsContact OG-O 3.1Å; F663-I691 HydrophobicContact CB-CD1 4.36Å; F663-I691 HydrophobicContact CB-CG1 3.54Å; Q664-I691 HydrophobicContact CB-CD1 4.17Å; Q664-I691 HydrophobicContact CB-CG1 4.39Å; K667-I691 HydrophobicContact CB-CD1 4.2Å; K667-I691 HydrophobicContact CD-CD1 3.91Å; A687-I691 WeakPolarHBondContact O-CG1 3.44Å; A687-I691 PolarHBondContact O-N 2.98Å; K688-I691 PolarHBondContact O-N 2.98Å; P689-I691 VanDerWaalsContact C-N 3.29Å; P689-I691 PolarHBondContact O-N 3.34Å; I691-K695 HydrophobicContact CG2-CD 4.33Å; I691-K695 WeakPolarHBondContact O-CG 3.36Å; I691-K695 PolarHBondContact O-N 3Å; I691-K695 VanDerWaalsContact O-N 3.16Å
692	V	97.9	Very high	95.9	Very high	85 Å²	85	48 Å²	48	52%	0.515	26%	0.259	S	S	.	.	H	α-helix	trans	-68.1	-49.2	-177	178.6	0	0	0	0	110.2	P689 N690 M694 K695 L696	P689-V692 WeakPolarHBondContact O-CB 3.47Å; P689-V692 PolarHBondContact O-N 2.82Å; N690-V692 VanDerWaalsContact C-N 3.31Å; N690-V692 PolarHBondContact O-N 3.25Å; V692-M694 VanDerWaalsContact C-N 3.34Å; V692-M694 PolarHBondContact O-N 2.95Å; V692-K695 PolarHBondContact O-N 3.38Å; V692-K695 VanDerWaalsContact O-N 3.15Å; V692-L696 HydrophobicContact CG1-CD1 4.17Å; V692-L696 WeakPolarHBondContact O-CG 3.44Å; V692-L696 PolarHBondContact O-N 3.05Å
693	V	97.3	Very high	95.4	Very high	22 Å²	22	48.5 Å²	48.5	13%	0.133	27%	0.265	C	S	.	.	H	α-helix	trans	-59.9	-45.5	-178.9	176.8	0	0	0	0	110.9	P689 N690 K695 L696 L697 V722 L724	P689-V693 WeakPolarHBondContact O-CG2 3.45Å; P689-V693 PolarHBondContact O-N 3.18Å; N690-V693 PolarHBondContact O-N 3.44Å; V693-K695 VanDerWaalsContact C-N 3.34Å; V693-K695 PolarHBondContact O-N 3.2Å; V693-L696 PolarHBondContact O-N 3.5Å; V693-L697 HydrophobicContact CG1-CD1 4.09Å; V693-L697 WeakPolarHBondContact O-CG 3.36Å; V693-L697 PolarHBondContact O-N 3.39Å; V693-V722 HydrophobicContact CG1-CB 4.43Å; V693-V722 HydrophobicContact CG1-CG1 4.22Å; V693-L724 HydrophobicContact CG1-CD1 3.97Å; V693-L724 HydrophobicContact CG1-CD2 4.22Å; V693-L724 HydrophobicContact CG1-CG 3.84Å
694	M	98.1	Very high	94.9	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-63.8	-36.9	177.6	-67.6	-49.5	114.2	0	0	112.6	T592 F596 Y656 A659 F663 N690 V692 L697 A698 V722	T592-M694 HydrophobicContact CG2-CE 3.56Å; T592-M694 HydrophobicContact CG2-SD 3.68Å; T592-M694 PolarHBondContact OG1-SD 3.36Å; T592-M694 VanDerWaalsContact OG1-SD 3.34Å; F596-M694 HydrophobicContact CZ-CE 4.27Å; Y656-M694 HydrophobicContact CD1-SD 3.71Å; Y656-M694 HydrophobicContact CE1-SD 4.38Å; Y656-M694 WeakPolarHBondContact O-CB 3.39Å; A659-M694 HydrophobicContact CB-CG 3.97Å; A659-M694 HydrophobicContact CB-SD 4.23Å; F663-M694 HydrophobicContact CD2-CG 4.14Å; F663-M694 HydrophobicContact CE2-CG 3.89Å; N690-M694 WeakPolarHBondContact O-CB 3.49Å; N690-M694 WeakPolarHBondContact O-CG 3.33Å; N690-M694 PolarHBondContact O-N 3.28Å; V692-M694 VanDerWaalsContact C-N 3.34Å; V692-M694 PolarHBondContact O-N 2.95Å; M694-L697 HydrophobicContact CE-CD1 3.92Å; M694-L697 PolarHBondContact O-N 3.01Å; M694-L697 HydrophobicContact SD-CD1 4.2Å; M694-A698 WeakPolarHBondContact O-CB 3.19Å; M694-A698 PolarHBondContact O-N 3.1Å; M694-V722 HydrophobicContact CE-CB 4.17Å; M694-V722 HydrophobicContact CE-CG1 4.02Å; M694-V722 HydrophobicContact CE-CG2 4.21Å
695	K	97.5	Very high	94.4	Very high	95 Å²	95	56.7 Å²	56.7	41%	0.413	31%	0.311	S	S	.	.	H	α-helix	trans	-66.5	-39.2	174.7	-76.5	178	-177.6	-179.5	0	112.6	S660 I691 V692 V693 A698 G699	S660-K695 VanDerWaalsContact OG-CE 3.3Å; S660-K695 WeakPolarHBondContact OG-CE 3.4Å; S660-K695 WeakPolarHBondContact OG-CG 3.39Å; I691-K695 HydrophobicContact CG2-CD 4.33Å; I691-K695 WeakPolarHBondContact O-CG 3.36Å; I691-K695 PolarHBondContact O-N 3Å; I691-K695 VanDerWaalsContact O-N 3.16Å; V692-K695 PolarHBondContact O-N 3.38Å; V692-K695 VanDerWaalsContact O-N 3.15Å; V693-K695 VanDerWaalsContact C-N 3.34Å; V693-K695 PolarHBondContact O-N 3.2Å; K695-A698 PolarHBondContact O-N 3.29Å; K695-G699 PolarHBondContact O-N 2.95Å
696	L	96.1	Very high	93.8	Very high	84 Å²	84	56 Å²	56	44%	0.44	31%	0.308	S	S	.	.	H	α-helix	trans	-63	-46	176.4	-70.9	172.7	0	0	0	111.2	V692 V693 G699 G700 H701	V692-L696 HydrophobicContact CG1-CD1 4.17Å; V692-L696 WeakPolarHBondContact O-CG 3.44Å; V692-L696 PolarHBondContact O-N 3.05Å; V693-L696 PolarHBondContact O-N 3.5Å; L696-G699 CarbonylContact O-C 3.54Å; L696-G699 PolarHBondContact O-N 3.47Å; L696-G699 VanDerWaalsContact O-N 3.16Å; L696-G700 PolarHBondContact O-N 3.32Å; L696-H701 HydrophobicContact CB-CB 3.98Å; L696-H701 WeakPolarHBondContact O-CB 3.3Å; L696-H701 PolarHBondContact O-N 3.48Å
697	L	95.5	Very high	93.3	Very high	8 Å²	8	59.5 Å²	59.5	4%	0.042	33%	0.329	C	S	.	.	H	α-helix	trans	-63.3	-42.9	176.8	-70.3	166.5	0	0	0	112	F596 Y656 V693 M694 G699 G700 L724	F596-L697 HydrophobicContact CE1-CD1 3.58Å; F596-L697 HydrophobicContact CE1-CD2 4.42Å; F596-L697 HydrophobicContact CZ-CD1 3.76Å; Y656-L697 HydrophobicContact CD1-CB 3.93Å; Y656-L697 HydrophobicContact CD1-CD1 3.86Å; Y656-L697 HydrophobicContact CD2-CB 3.71Å; Y656-L697 HydrophobicContact CE1-CB 4.09Å; Y656-L697 HydrophobicContact CE1-CD1 3.58Å; Y656-L697 HydrophobicContact CE1-CG 4.38Å; Y656-L697 HydrophobicContact CE2-CB 3.89Å; Y656-L697 HydrophobicContact CG-CB 3.74Å; V693-L697 HydrophobicContact CG1-CD1 4.09Å; V693-L697 WeakPolarHBondContact O-CG 3.36Å; V693-L697 PolarHBondContact O-N 3.39Å; M694-L697 HydrophobicContact CE-CD1 3.92Å; M694-L697 PolarHBondContact O-N 3.01Å; M694-L697 HydrophobicContact SD-CD1 4.2Å; L697-G699 PolarHBondContact O-N 3.05Å; L697-G700 PolarHBondContact O-N 3.28Å; L697-L724 HydrophobicContact CD1-CD1 4.48Å; L697-L724 HydrophobicContact CD1-CD2 4.12Å; L697-L724 HydrophobicContact CD2-CD1 3.8Å; L697-L724 HydrophobicContact CD2-CD2 3.95Å; L697-L724 HydrophobicContact CG-CD1 3.98Å; L697-L724 HydrophobicContact CG-CD2 4.36Å
698	A	95.3	Very high	92.8	Very high	22 Å²	22	60.4 Å²	60.4	18%	0.182	34%	0.335	C	S	.	.	H	α-helix	trans	-59.7	-34.3	174.1	0	0	0	0	0	112.3	M657 M694 K695 G700	M657-A698 HydrophobicContact CB-CB 4.32Å; M657-A698 HydrophobicContact CE-CB 4Å; M694-A698 WeakPolarHBondContact O-CB 3.19Å; M694-A698 PolarHBondContact O-N 3.1Å; K695-A698 PolarHBondContact O-N 3.29Å; A698-G700 PolarHBondContact O-N 2.89Å
699	G	92.6	Very high	92.6	Very high	70 Å²	70	56.4 Å²	56.4	72%	0.722	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	2.1	174.2	0	0	0	0	0	115.2	K695 L696 L697	K695-G699 PolarHBondContact O-N 2.95Å; L696-G699 CarbonylContact O-C 3.54Å; L696-G699 PolarHBondContact O-N 3.47Å; L696-G699 VanDerWaalsContact O-N 3.16Å; L697-G699 PolarHBondContact O-N 3.05Å
700	G	89.9	Confident	92.4	Very high	35 Å²	35	58.5 Å²	58.5	36%	0.361	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.8	8.4	177.8	0	0	0	0	0	115.3	L696 L697 A698 K702 K703	L696-G700 PolarHBondContact O-N 3.32Å; L697-G700 PolarHBondContact O-N 3.28Å; A698-G700 PolarHBondContact O-N 2.89Å; G700-K702 PolarHBondContact O-N 2.94Å; G700-K703 WeakPolarHBondContact O-CB 3.38Å; G700-K703 PolarHBondContact O-N 2.91Å
701	H	90.4	Very high	92.2	Very high	89 Å²	89	60 Å²	60	41%	0.412	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	128.1	175	-173.7	73.3	0	0	0	110.7	L696 K703	L696-H701 HydrophobicContact CB-CB 3.98Å; L696-H701 WeakPolarHBondContact O-CB 3.3Å; L696-H701 PolarHBondContact O-N 3.48Å; H701-K703 PolarHBondContact O-N 3.15Å
702	K	86	Confident	92.1	Very high	69 Å²	69	61 Å²	61	30%	0.3	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	35.2	-176.6	-66.9	-177.6	175.5	-170	0	113.4	K601 G700 D704 S705 L724 V725	K601-K702 PolarHBondContact NZ-O 2.85Å; G700-K702 PolarHBondContact O-N 2.94Å; K702-D704 VanDerWaalsContact C-N 3.31Å; K702-D704 PolarHBondContact O-N 2.86Å; K702-S705 PolarHBondContact O-N 2.94Å; K702-L724 HydrophobicContact CD-CB 4.11Å; K702-L724 PolarHBondContact NZ-O 3.43Å; K702-V725 PolarHBondContact NZ-O 3.45Å; K702-V725 PolarHBondContact NZ-OXT 3.03Å
703	K	84.9	Confident	92	Very high	125 Å²	125	59.4 Å²	59.4	54%	0.543	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-42.1	178	-172.3	175.3	-178.6	178.6	0	112.3	G700 H701 S705	G700-K703 WeakPolarHBondContact O-CB 3.38Å; G700-K703 PolarHBondContact O-N 2.91Å; H701-K703 PolarHBondContact O-N 3.15Å; K703-S705 VanDerWaalsContact C-N 3.34Å
704	D	86.3	Confident	91.9	Very high	151 Å²	151	63.1 Å²	63.1	81%	0.807	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-9.9	-177.4	-53.1	-47.5	0	0	0	113.5	K702 K706	K702-D704 VanDerWaalsContact C-N 3.31Å; K702-D704 PolarHBondContact O-N 2.86Å; D704-K706 PolarHBondContact O-N 3.2Å
705	S	87.7	Confident	91.8	Very high	33 Å²	33	64.9 Å²	64.9	23%	0.231	36%	0.361	C	S	.	.			trans	-73.1	129.2	177.1	-176.1	0	0	0	0	110.8	K601 K702 K703 V707	K601-S705 WeakPolarHBondContact CE-O 3.47Å; K702-S705 PolarHBondContact O-N 2.94Å; K703-S705 VanDerWaalsContact C-N 3.34Å; S705-V707 PolarHBondContact OG-N 2.93Å
706	K	85.4	Confident	91.8	Very high	129 Å²	129	60.5 Å²	60.5	56%	0.561	34%	0.342	S	S	*	.			trans	-98.9	6.9	170.4	-57.6	-62.2	178.9	177.7	0	112.7	D599 D704 P708	D599-K706 WeakPolarHBondContact O-CD 3.41Å; D599-K706 PolarHBondContact O-NZ 3.41Å; D704-K706 PolarHBondContact O-N 3.2Å; K706-P708 WeakPolarHBondContact O-CD 3.3Å
707	V	88.3	Confident	91.6	Very high	73 Å²	73	58.2 Å²	58.2	44%	0.442	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-66.4	125.5	175.2	-175.8	0	0	0	0	108.1	S705 V725	S705-V707 PolarHBondContact OG-N 2.93Å; V707-V725 HydrophobicContact CG1-CB 3.79Å; V707-V725 HydrophobicContact CG1-CG1 3.95Å
708	P	87.9	Confident	91.7	Very high	19 Å²	19	58.4 Å²	58.4	12%	0.123	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-63.1	147.9	178	-21.7	32.8	0	0	0	111.9	M515 K601 R603 K706	M515-P708 HydrophobicContact CE-CB 4.44Å; K601-P708 WeakPolarHBondContact O-CA 3.36Å; K601-P708 WeakPolarHBondContact O-CB 3.22Å; R603-P708 HydrophobicContact CG-CG 3.7Å; R603-P708 VanDerWaalsContact NE-CG 3.28Å; K706-P708 WeakPolarHBondContact O-CD 3.3Å
709	P	91.8	Very high	91.8	Very high	10 Å²	10	57.3 Å²	57.3	7%	0.065	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-65.9	152	169.9	31.4	-37.4	0	0	0	111.2	M515 F596 F711 V722 K723	M515-P709 HydrophobicContact CE-CG 3.82Å; F596-P709 HydrophobicContact CD1-CG 4.46Å; F596-P709 HydrophobicContact CD2-CG 3.83Å; F596-P709 HydrophobicContact CE1-CB 4.5Å; F596-P709 HydrophobicContact CE1-CG 4.32Å; F596-P709 HydrophobicContact CE2-CB 4.02Å; F596-P709 HydrophobicContact CE2-CG 3.64Å; F596-P709 HydrophobicContact CG-CG 4.25Å; F596-P709 HydrophobicContact CZ-CB 3.94Å; F596-P709 HydrophobicContact CZ-CG 3.92Å; P709-F711 HydrophobicContact CB-CZ 4.48Å; P709-F711 HydrophobicContact CG-CE2 3.84Å; P709-F711 HydrophobicContact CG-CZ 3.83Å; P709-V722 HydrophobicContact CB-CG1 4.05Å; P709-K723 WeakPolarHBondContact CA-O 3.16Å
710	E	94.3	Very high	92	Very high	94 Å²	94	54 Å²	54	44%	0.439	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	135.8	166.3	-178.8	-163.4	139.3	0	0	108.9	K723 V725	E710-K723 HydrophobicContact CB-CB 4.22Å; E710-K723 PolarHBondContact N-O 3.16Å; E710-K723 PolarHBondContact O-N 3.31Å; E710-K723 IonicContact OE1-NZ 3.67Å; E710-K723 PolarHBondContact OE1-NZ 3.41Å; E710-V725 HydrophobicContact CB-CG2 4.18Å
711	F	95.4	Very high	92.4	Very high	32 Å²	32	53.2 Å²	53.2	14%	0.14	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	107.8	177.3	-69.2	-73.1	0	0	0	109.9	M515 Y518 M589 M593 F596 P709 F713 P720 V722	M515-F711 HydrophobicContact CE-CE2 3.78Å; M515-F711 HydrophobicContact CE-CZ 4.43Å; M515-F711 HydrophobicContact CG-CD2 4.36Å; M515-F711 HydrophobicContact CG-CE2 3.79Å; M515-F711 HydrophobicContact SD-CD2 4.48Å; M515-F711 HydrophobicContact SD-CE2 3.91Å; Y518-F711 HydrophobicContact CE2-CD2 4.2Å; Y518-F711 HydrophobicContact CE2-CG 4.37Å; M589-F711 HydrophobicContact CE-CD1 4.28Å; M589-F711 HydrophobicContact CE-CE1 3.9Å; M593-F711 HydrophobicContact CE-CE2 4.45Å; M593-F711 HydrophobicContact CE-CZ 4.19Å; M593-F711 HydrophobicContact SD-CE1 4.02Å; M593-F711 HydrophobicContact SD-CE2 4.16Å; M593-F711 HydrophobicContact SD-CZ 3.4Å; M593-F711 WeakPolarHBondContact SD-CZ 3.25Å; F596-F711 HydrophobicContact CD2-CZ 4.32Å; F596-F711 HydrophobicContact CE2-CZ 4.23Å; P709-F711 HydrophobicContact CB-CZ 4.48Å; P709-F711 HydrophobicContact CG-CE2 3.84Å; P709-F711 HydrophobicContact CG-CZ 3.83Å; F711-F713 HydrophobicContact CB-CD2 4.39Å; F711-F713 HydrophobicContact CB-CE2 3.89Å; F711-P720 HydrophobicContact CB-CB 3.59Å; F711-P720 HydrophobicContact CB-CG 3.93Å; F711-P720 HydrophobicContact CD1-CB 3.85Å; F711-P720 HydrophobicContact CD1-CG 3.38Å; F711-P720 HydrophobicContact CE1-CG 4.26Å; F711-P720 HydrophobicContact CG-CB 4.19Å; F711-P720 HydrophobicContact CG-CG 4.01Å; F711-V722 HydrophobicContact CD1-CG2 4.06Å; F711-V722 HydrophobicContact CE1-CG1 4.39Å; F711-V722 HydrophobicContact CE1-CG2 3.83Å
712	D	96.4	Very high	92.7	Very high	35 Å²	35	49 Å²	49	19%	0.187	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	102.8	-179.2	-179.1	1.4	0	0	0	110.9	S714 P715 P720 V721 K723	D712-S714 VanDerWaalsContact C-N 3.34Å; D712-S714 WeakPolarHBondContact OD1-CB 3.31Å; D712-S714 PolarHBondContact OD1-N 2.9Å; D712-S714 PolarHBondContact OD1-OG 3.33Å; D712-S714 PolarHBondContact OD2-OG 2.95Å; D712-P715 WeakPolarHBondContact O-CD 3.09Å; D712-P720 CarbonylContact O-C 3.5Å; D712-P720 VanDerWaalsContact O-CA 3.29Å; D712-P720 WeakPolarHBondContact O-CA 3.49Å; D712-V721 HydrophobicContact CB-CB 4.38Å; D712-V721 PolarHBondContact N-O 3.11Å; D712-V721 PolarHBondContact O-N 3.43Å; D712-K723 HydrophobicContact CB-CD 4.42Å; D712-K723 WeakPolarHBondContact OD2-CE 3.41Å; D712-K723 IonicContact OD2-NZ 3.7Å; D712-K723 PolarHBondContact OD2-NZ 3.01Å
713	F	96.2	Very high	93.1	Very high	52 Å²	52	49.4 Å²	49.4	23%	0.228	26%	0.256	C	S	.	.			trans	-84.6	-1	177.3	-71.8	-89.5	0	0	0	113.7	F508 Y518 F711 P715 H716 P720	F508-F713 HydrophobicContact CD1-CE1 4.08Å; F508-F713 HydrophobicContact CD1-CZ 4.07Å; Y518-F713 HydrophobicContact CE2-CE2 4.27Å; Y518-F713 HydrophobicContact CE2-CZ 4.05Å; F711-F713 HydrophobicContact CB-CD2 4.39Å; F711-F713 HydrophobicContact CB-CE2 3.89Å; F713-P715 VanDerWaalsContact C-CD 3.42Å; F713-P715 VanDerWaalsContact C-N 3.32Å; F713-H716 CarbonylContact O-C 3.57Å; F713-H716 PolarHBondContact O-N 3.5Å; F713-H716 VanDerWaalsContact O-N 3.07Å; F713-P720 HydrophobicContact CD1-CB 4.06Å; F713-P720 HydrophobicContact CD2-CB 3.93Å; F713-P720 HydrophobicContact CE1-CB 3.95Å; F713-P720 VanDerWaalsContact CE1-CD 3.47Å; F713-P720 HydrophobicContact CE1-CG 3.92Å; F713-P720 HydrophobicContact CE2-CB 3.8Å; F713-P720 HydrophobicContact CE2-CG 4.08Å; F713-P720 HydrophobicContact CG-CB 4.06Å; F713-P720 HydrophobicContact CZ-CB 3.81Å; F713-P720 HydrophobicContact CZ-CG 3.67Å
714	S	94.9	Very high	93.3	Very high	101 Å²	101	45.6 Å²	45.6	71%	0.706	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-33.2	-179.3	68.9	0	0	0	0	114.6	D712	D712-S714 VanDerWaalsContact C-N 3.34Å; D712-S714 WeakPolarHBondContact OD1-CB 3.31Å; D712-S714 PolarHBondContact OD1-N 2.9Å; D712-S714 PolarHBondContact OD1-OG 3.33Å; D712-S714 PolarHBondContact OD2-OG 2.95Å
715	P	95.6	Very high	93	Very high	36 Å²	36	43.8 Å²	43.8	23%	0.234	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-25.3	176.3	-17.1	35	0	0	0	113.4	V686 D712 F713 V721	V686-P715 HydrophobicContact CG2-CB 4.06Å; D712-P715 WeakPolarHBondContact O-CD 3.09Å; F713-P715 VanDerWaalsContact C-CD 3.42Å; F713-P715 VanDerWaalsContact C-N 3.32Å; P715-V721 HydrophobicContact CG-CG2 3.92Å
716	H	96.3	Very high	93.2	Very high	3 Å²	3	44.3 Å²	44.3	1%	0.014	24%	0.236	C	C	.	.			trans	-160.6	126	-176.9	-171.8	-84.7	0	0	0	112.3	E679 V686 F713 Y718 F719	E679-H716 IonicContact OE1-CD2 2.73Å; E679-H716 IonicContact OE1-NE2 2.62Å; E679-H716 PolarHBondContact OE1-NE2 3.46Å; E679-H716 IonicContact OE2-CD2 3.33Å; E679-H716 IonicContact OE2-NE2 3.62Å; V686-H716 HydrophobicContact CG2-CB 3.71Å; F713-H716 CarbonylContact O-C 3.57Å; F713-H716 PolarHBondContact O-N 3.5Å; F713-H716 VanDerWaalsContact O-N 3.07Å; H716-Y718 VanDerWaalsContact C-N 3.29Å; H716-Y718 AromaticContact CE1-CD2 3.46Å; H716-Y718 VanDerWaalsContact CE1-CD2 3.46Å; H716-Y718 WeakPolarHBondContact CE1-CD2 3.18Å; H716-Y718 AromaticContact CE1-CG 3.8Å; H716-Y718 PolarHBondContact ND1-N 3.01Å; H716-Y718 PolarHBondContact O-N 3.39Å; H716-Y718 VanDerWaalsContact O-N 3.15Å; H716-F719 AromaticContact CE1-CD2 3.28Å; H716-F719 WeakPolarHBondContact CE1-CD2 3.41Å; H716-F719 AromaticContact CE1-CE2 3.83Å; H716-F719 AromaticContact ND1-CD2 3.46Å; H716-F719 WeakPolarHBondContact ND1-CD2 2.95Å; H716-F719 AromaticContact ND1-CG 3.92Å; H716-F719 PolarHBondContact ND1-N 3.39Å; H716-F719 VanDerWaalsContact ND1-N 3.16Å; H716-F719 PolarHBondContact O-N 2.99Å; H716-F719 VanDerWaalsContact O-O 3.12Å
717	K	93.6	Very high	93.6	Very high	36 Å²	36	39.8 Å²	39.8	16%	0.157	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-26.7	-176	50	179.1	169.9	173.5	0	116.6	E360 E509	E360-K717 IonicContact OE1-NZ 3.59Å; E360-K717 PolarHBondContact OE1-NZ 3.14Å; E360-K717 IonicContact OE2-NZ 2.64Å; E360-K717 PolarHBondContact OE2-NZ 3.03Å; E509-K717 HydrophobicContact CB-CB 4.41Å; E509-K717 HydrophobicContact CG-CB 4.43Å
718	Y	95.9	Very high	93.9	Very high	12 Å²	12	38 Å²	38	5%	0.047	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109	-13.5	-178.5	-40.4	-44.5	0	0	0	114.3	L505 E509 Y522 Y582 H716	L505-Y718 HydrophobicContact CB-CD1 3.83Å; L505-Y718 HydrophobicContact CB-CD2 4.23Å; L505-Y718 HydrophobicContact CB-CE1 3.81Å; L505-Y718 HydrophobicContact CB-CE2 4.21Å; L505-Y718 HydrophobicContact CB-CG 4.05Å; L505-Y718 HydrophobicContact CD1-CD2 3.91Å; L505-Y718 HydrophobicContact CD1-CE2 3.89Å; L505-Y718 HydrophobicContact CD1-CG 4.46Å; L505-Y718 HydrophobicContact CD2-CD1 4.43Å; L505-Y718 HydrophobicContact CD2-CD2 4.03Å; L505-Y718 HydrophobicContact CD2-CG 3.87Å; L505-Y718 HydrophobicContact CG-CD2 4.29Å; L505-Y718 HydrophobicContact CG-CG 4.35Å; L505-Y718 WeakPolarHBondContact O-CD1 3.48Å; E509-Y718 HydrophobicContact CB-CE1 4.24Å; Y522-Y718 PolarHBondContact OH-O 3.39Å; Y582-Y718 HydrophobicContact CE1-CD2 4.01Å; Y582-Y718 HydrophobicContact CE1-CE2 4.47Å; H716-Y718 VanDerWaalsContact C-N 3.29Å; H716-Y718 AromaticContact CE1-CD2 3.46Å; H716-Y718 VanDerWaalsContact CE1-CD2 3.46Å; H716-Y718 WeakPolarHBondContact CE1-CD2 3.18Å; H716-Y718 AromaticContact CE1-CG 3.8Å; H716-Y718 PolarHBondContact ND1-N 3.01Å; H716-Y718 PolarHBondContact O-N 3.39Å; H716-Y718 VanDerWaalsContact O-N 3.15Å
719	F	98	Very high	94.3	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.211	C	C	.	.	S	Bend	trans	-136.2	115.8	-171	-62.9	-58.6	0	0	0	109.2	Y522 Y582 M585 M589 V686 H716	Y522-F719 HydrophobicContact CD1-CE1 4.34Å; Y522-F719 AromaticContact CE1-CD1 3.85Å; Y522-F719 HydrophobicContact CE1-CD1 3.85Å; Y522-F719 AromaticContact CE1-CE1 3.77Å; Y522-F719 HydrophobicContact CE1-CE1 3.77Å; Y582-F719 AromaticContact CD1-CE2 3.65Å; Y582-F719 HydrophobicContact CD1-CE2 3.65Å; Y582-F719 AromaticContact CD1-CZ 3.74Å; Y582-F719 HydrophobicContact CD1-CZ 3.74Å; Y582-F719 AromaticContact CE1-CE2 3.63Å; Y582-F719 HydrophobicContact CE1-CE2 3.63Å; Y582-F719 HydrophobicContact CE1-CZ 4.09Å; Y582-F719 HydrophobicContact CG-CE2 4.37Å; M585-F719 HydrophobicContact CB-CD1 4.05Å; M585-F719 HydrophobicContact CB-CD2 4.17Å; M585-F719 HydrophobicContact CB-CE1 3.65Å; M585-F719 HydrophobicContact CB-CE2 3.79Å; M585-F719 HydrophobicContact CB-CG 4.32Å; M585-F719 HydrophobicContact CB-CZ 3.52Å; M585-F719 HydrophobicContact CE-CB 4.09Å; M585-F719 HydrophobicContact CE-CD2 4.24Å; M585-F719 HydrophobicContact CE-CG 4.04Å; M585-F719 HydrophobicContact CG-CD2 4.48Å; M585-F719 HydrophobicContact CG-CE2 4.3Å; M585-F719 HydrophobicContact CG-CZ 4.48Å; M589-F719 HydrophobicContact CG-CD1 4.23Å; V686-F719 HydrophobicContact CG1-CB 4.01Å; V686-F719 WeakPolarHBondContact CG2-O 3.45Å; H716-F719 AromaticContact CE1-CD2 3.28Å; H716-F719 WeakPolarHBondContact CE1-CD2 3.41Å; H716-F719 AromaticContact CE1-CE2 3.83Å; H716-F719 AromaticContact ND1-CD2 3.46Å; H716-F719 WeakPolarHBondContact ND1-CD2 2.95Å; H716-F719 AromaticContact ND1-CG 3.92Å; H716-F719 PolarHBondContact ND1-N 3.39Å; H716-F719 VanDerWaalsContact ND1-N 3.16Å; H716-F719 PolarHBondContact O-N 2.99Å; H716-F719 VanDerWaalsContact O-O 3.12Å
720	P	97.4	Very high	94.5	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-85.2	150.1	-178.2	32.5	-32.9	0	0	0	112.3	Y522 M589 V686 N690 F711 D712 F713	Y522-P720 WeakPolarHBondContact OH-CD 3.25Å; M589-P720 HydrophobicContact CE-CG 3.63Å; M589-P720 HydrophobicContact SD-CG 4.38Å; V686-P720 VanDerWaalsContact CG1-O 3.28Å; V686-P720 WeakPolarHBondContact CG1-O 3.48Å; N690-P720 PolarHBondContact ND2-O 2.98Å; F711-P720 HydrophobicContact CB-CB 3.59Å; F711-P720 HydrophobicContact CB-CG 3.93Å; F711-P720 HydrophobicContact CD1-CB 3.85Å; F711-P720 HydrophobicContact CD1-CG 3.38Å; F711-P720 HydrophobicContact CE1-CG 4.26Å; F711-P720 HydrophobicContact CG-CB 4.19Å; F711-P720 HydrophobicContact CG-CG 4.01Å; D712-P720 CarbonylContact O-C 3.5Å; D712-P720 VanDerWaalsContact O-CA 3.29Å; D712-P720 WeakPolarHBondContact O-CA 3.49Å; F713-P720 HydrophobicContact CD1-CB 4.06Å; F713-P720 HydrophobicContact CD2-CB 3.93Å; F713-P720 HydrophobicContact CE1-CB 3.95Å; F713-P720 VanDerWaalsContact CE1-CD 3.47Å; F713-P720 HydrophobicContact CE1-CG 3.92Å; F713-P720 HydrophobicContact CE2-CB 3.8Å; F713-P720 HydrophobicContact CE2-CG 4.08Å; F713-P720 HydrophobicContact CG-CB 4.06Å; F713-P720 HydrophobicContact CZ-CB 3.81Å; F713-P720 HydrophobicContact CZ-CG 3.67Å
721	V	98.1	Very high	94.5	Very high	19 Å²	19	37.4 Å²	37.4	12%	0.115	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	124	157.3	173.3	0	0	0	0	108	V686 P689 D712 P715 K723	V686-V721 HydrophobicContact CB-CG2 4.39Å; V686-V721 HydrophobicContact CG1-CG2 4.32Å; V686-V721 HydrophobicContact CG2-CG2 4.21Å; P689-V721 HydrophobicContact CB-CG1 3.95Å; P689-V721 HydrophobicContact CG-CG1 4.44Å; P689-V721 HydrophobicContact CG-CG2 4.49Å; D712-V721 HydrophobicContact CB-CB 4.38Å; D712-V721 PolarHBondContact N-O 3.11Å; D712-V721 PolarHBondContact O-N 3.43Å; P715-V721 HydrophobicContact CG-CG2 3.92Å; V721-K723 HydrophobicContact CG1-CG 4.42Å
722	V	97.1	Very high	94.4	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.006	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	119.4	179.3	-175.4	0	0	0	0	109.2	M589 T592 F596 N690 V693 M694 P709 F711	M589-V722 HydrophobicContact CE-CG2 4.46Å; M589-V722 HydrophobicContact SD-CG2 4.5Å; T592-V722 HydrophobicContact CG2-CG2 4.43Å; F596-V722 HydrophobicContact CE2-CG1 3.8Å; F596-V722 HydrophobicContact CZ-CG1 3.71Å; N690-V722 PolarHBondContact OD1-N 3.32Å; V693-V722 HydrophobicContact CG1-CB 4.43Å; V693-V722 HydrophobicContact CG1-CG1 4.22Å; M694-V722 HydrophobicContact CE-CB 4.17Å; M694-V722 HydrophobicContact CE-CG1 4.02Å; M694-V722 HydrophobicContact CE-CG2 4.21Å; P709-V722 HydrophobicContact CB-CG1 4.05Å; F711-V722 HydrophobicContact CD1-CG2 4.06Å; F711-V722 HydrophobicContact CE1-CG1 4.39Å; F711-V722 HydrophobicContact CE1-CG2 3.83Å
723	K	94.6	Very high	94.3	Very high	76 Å²	76	38 Å²	38	33%	0.33	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	133.8	176.3	-61.5	176.7	-169.6	161	0	110.4	P709 E710 D712 V721	P709-K723 WeakPolarHBondContact CA-O 3.16Å; E710-K723 HydrophobicContact CB-CB 4.22Å; E710-K723 PolarHBondContact N-O 3.16Å; E710-K723 PolarHBondContact O-N 3.31Å; E710-K723 IonicContact OE1-NZ 3.67Å; E710-K723 PolarHBondContact OE1-NZ 3.41Å; D712-K723 HydrophobicContact CB-CD 4.42Å; D712-K723 WeakPolarHBondContact OD2-CE 3.41Å; D712-K723 IonicContact OD2-NZ 3.7Å; D712-K723 PolarHBondContact OD2-NZ 3.01Å; V721-K723 HydrophobicContact CG1-CG 4.42Å
724	L	89	Confident	94.1	Very high	45 Å²	45	36.8 Å²	36.8	24%	0.236	21%	0.211	C	C	.	.			trans	-93.7	108.5	177	-60.2	179.2	0	0	0	110.1	F596 V693 L697 K702	F596-L724 HydrophobicContact CE1-CD2 4.38Å; F596-L724 HydrophobicContact CZ-CD2 4.37Å; V693-L724 HydrophobicContact CG1-CD1 3.97Å; V693-L724 HydrophobicContact CG1-CD2 4.22Å; V693-L724 HydrophobicContact CG1-CG 3.84Å; L697-L724 HydrophobicContact CD1-CD1 4.48Å; L697-L724 HydrophobicContact CD1-CD2 4.12Å; L697-L724 HydrophobicContact CD2-CD1 3.8Å; L697-L724 HydrophobicContact CD2-CD2 3.95Å; L697-L724 HydrophobicContact CG-CD1 3.98Å; L697-L724 HydrophobicContact CG-CD2 4.36Å; K702-L724 HydrophobicContact CD-CB 4.11Å; K702-L724 PolarHBondContact NZ-O 3.43Å
725	V	78.6	Confident	94	Very high	113 Å²	113	31 Å²	31	69%	0.685	17%	0.166	S	C	*	.			trans	-71.5	0	175.9	-176	0	0	0	0	111.4	K702 V707 E710	K702-V725 PolarHBondContact NZ-O 3.45Å; K702-V725 PolarHBondContact NZ-OXT 3.03Å; V707-V725 HydrophobicContact CG1-CB 3.79Å; V707-V725 HydrophobicContact CG1-CG1 3.95Å; E710-V725 HydrophobicContact CB-CG2 4.18Å

Retrieved 725 of 725 residues in 557.1 ms (Link to these results)

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