A0A077Z3U2_TRITR Loading...

Armadillo segment polarity protein

AlphaFold DB , UniProt , Accession A0A077Z3U2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 784 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	34.3	Very low	33.8	Very low	223 Å²	223	154.7 Å²	154.7	100%	1.099	83%	0.829	S	S	*	*				0	108.4	0	-74.5	176.5	174.8	0	0	108.4
2	T	32.1	Very low	33.9	Very low	141 Å²	141	153.8 Å²	153.8	87%	0.865	82%	0.824	S	S	*	*			trans	-135.9	100.4	154.8	29.5	0	0	0	0	106
3	H	33.3	Very low	33.7	Very low	183 Å²	183	156.3 Å²	156.3	85%	0.847	83%	0.827	S	S	*	*			trans	-53.2	129.7	174.6	-79	-92.4	0	0	0	110.4
4	M	32.8	Very low	33.6	Very low	178 Å²	178	155.1 Å²	155.1	88%	0.877	83%	0.829	S	S	*	*			trans	-120.3	150.6	169.2	-90.4	-104.8	165.7	0	0	108.7
5	P	38.3	Very low	33.5	Very low	115 Å²	115	150.5 Å²	150.5	75%	0.747	82%	0.821	S	S	*	*			trans	-104.2	156.3	-130.2	16.7	1.1	0	0	0	113.9	S7	P5-S7 PolarHBondContact O-N 3.43Å
6	Q	33.1	Very low	33.3	Very low	202 Å²	202	152.9 Å²	152.9	94%	0.944	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-67.8	121.3	175.1	-70.4	177.8	-18.5	0	0	111
7	S	32.2	Very low	33.3	Very low	113 Å²	113	152.9 Å²	152.9	79%	0.79	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-80.3	146.6	174.3	-168.7	0	0	0	0	110.8	P5	P5-S7 PolarHBondContact O-N 3.43Å
8	P	37.2	Very low	33.5	Very low	112 Å²	112	153.7 Å²	153.7	73%	0.727	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-86.9	148.2	-162.4	30.2	-25.1	0	0	0	114.4
9	Y	30	Very low	33.7	Very low	211 Å²	211	151.8 Å²	151.8	83%	0.827	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-59.5	123.6	179	-161.8	-97.1	0	0	0	112.7
10	V	34.8	Very low	34.1	Very low	127 Å²	127	150.6 Å²	150.6	77%	0.77	82%	0.817	S	S	*	*			trans	-104.9	118.5	171.7	179.9	0	0	0	0	107.7
11	P	34.1	Very low	34.9	Very low	97 Å²	97	147.5 Å²	147.5	63%	0.63	81%	0.806	S	S	*	*			trans	-78.6	132.8	-174	-3.4	19.3	0	0	0	112.7	H13	P11-H13 PolarHBondContact O-N 3.49Å
12	D	35.1	Very low	35.4	Very low	143 Å²	143	144.3 Å²	144.3	77%	0.765	79%	0.786	S	S	*	*			trans	-61.4	117.2	175.9	-67.8	-50.9	0	0	0	113.7
13	H	31.4	Very low	36.3	Very low	187 Å²	187	142.4 Å²	142.4	87%	0.866	77%	0.771	S	S	*	*			trans	-144.7	74.3	154.6	-77.6	-56.9	0	0	0	109.7	P11	P11-H13 PolarHBondContact O-N 3.49Å
14	V	32.3	Very low	37.1	Very low	140 Å²	140	140.8 Å²	140.8	85%	0.848	76%	0.764	S	S	*	*			trans	-109.2	109.8	163.5	-177.3	0	0	0	0	107.9
15	A	31.7	Very low	37.8	Very low	86 Å²	86	138.9 Å²	138.9	71%	0.711	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-56.5	132.4	178	0	0	0	0	0	111.2	N17	A15-N17 PolarHBondContact O-N 3.21Å
16	M	30.7	Very low	38.2	Very low	189 Å²	189	138.1 Å²	138.1	93%	0.931	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-59.9	117.6	174.6	-72.5	-174.7	-158.3	0	0	110	L18	M16-L18 PolarHBondContact O-N 2.64Å
17	N	32.9	Very low	38.8	Very low	152 Å²	152	133.8 Å²	133.8	81%	0.813	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-63.4	120.8	170.4	-81	-35.4	0	0	0	109.8	A15 V19	A15-N17 PolarHBondContact O-N 3.21Å; N17-V19 PolarHBondContact O-N 2.82Å; N17-V19 VanDerWaalsContact O-N 3.13Å
18	L	36.6	Very low	39.5	Very low	167 Å²	167	131 Å²	131	87%	0.874	71%	0.712	S	S	*	*			trans	-53.2	112.1	168.6	-79.2	134.4	0	0	0	109.5	M16 N20	M16-L18 PolarHBondContact O-N 2.64Å; L18-N20 PolarHBondContact O-N 2.89Å
19	V	37.2	Very low	39.6	Very low	118 Å²	118	136.1 Å²	136.1	72%	0.715	72%	0.717	S	S	*	*			trans	-59.9	126	175.1	174.9	0	0	0	0	109.1	N17	N17-V19 PolarHBondContact O-N 2.82Å; N17-V19 VanDerWaalsContact O-N 3.13Å
20	N	41.6	Very low	40.2	Very low	128 Å²	128	129.9 Å²	129.9	68%	0.684	71%	0.709	S	S	*	*			trans	-57.1	133.5	-176.2	-83.8	-38.9	0	0	0	112.3	L18 K22 D23	L18-N20 PolarHBondContact O-N 2.89Å; N20-K22 PolarHBondContact O-N 3.32Å; N20-D23 PolarHBondContact O-N 3.42Å
21	S	51.9	Low	40.6	Very low	85 Å²	85	131.7 Å²	131.7	59%	0.594	71%	0.709	S	S	*	*	H	α-helix	trans	-60.6	-10.4	-176.3	61.7	0	0	0	0	115.9	Q25	S21-Q25 PolarHBondContact O-N 3.4Å
22	K	45.1	Very low	40.7	Very low	156 Å²	156	134.2 Å²	134.2	68%	0.678	71%	0.712	S	S	*	*	H	α-helix	trans	-73.8	-30.4	177.5	-75.7	-170.7	173.6	-176.2	0	113.4	N20 Q25 T26	N20-K22 PolarHBondContact O-N 3.32Å; K22-Q25 PolarHBondContact O-N 3.1Å; K22-T26 PolarHBondContact O-N 2.92Å; K22-T26 VanDerWaalsContact O-N 3.08Å; K22-T26 PolarHBondContact O-OG1 3.02Å
23	D	50.7	Low	40.6	Very low	102 Å²	102	134.3 Å²	134.3	55%	0.545	71%	0.713	S	S	.	*	H	α-helix	trans	-73.4	-33.9	178.4	-67.1	-21.2	0	0	0	111	N20 T26 L27	N20-D23 PolarHBondContact O-N 3.42Å; D23-T26 PolarHBondContact O-N 3.31Å; D23-L27 PolarHBondContact O-N 3.49Å; D23-L27 VanDerWaalsContact O-N 3.09Å
24	Q	49.4	Very low	40.5	Very low	149 Å²	149	135.2 Å²	135.2	70%	0.696	71%	0.71	S	S	*	*	H	α-helix	trans	-70.4	-33.5	172.1	-79.7	-176.1	-18.7	0	0	112.9	T26 L27 A28	Q24-T26 VanDerWaalsContact C-N 3.34Å; Q24-L27 PolarHBondContact O-N 3.21Å; Q24-A28 VanDerWaalsContact O-CB 3.31Å; Q24-A28 WeakPolarHBondContact O-CB 3.22Å; Q24-A28 PolarHBondContact O-N 2.9Å
25	Q	47.5	Very low	40.5	Very low	137 Å²	137	135.2 Å²	135.2	64%	0.64	71%	0.71	S	S	*	*	H	α-helix	trans	-67.7	-34.8	172.4	-93.9	-178.6	-7.2	0	0	112.5	S21 K22 A28 W29	S21-Q25 PolarHBondContact O-N 3.4Å; K22-Q25 PolarHBondContact O-N 3.1Å; Q25-A28 PolarHBondContact O-N 3.15Å; Q25-W29 PolarHBondContact O-N 3.44Å
26	T	45.7	Very low	40.5	Very low	100 Å²	100	137.7 Å²	137.7	61%	0.613	71%	0.71	S	S	*	*	H	α-helix	trans	-69.8	-37	177.4	-51	0	0	0	0	111.4	K22 D23 Q24 A30	K22-T26 PolarHBondContact O-N 2.92Å; K22-T26 VanDerWaalsContact O-N 3.08Å; K22-T26 PolarHBondContact O-OG1 3.02Å; D23-T26 PolarHBondContact O-N 3.31Å; Q24-T26 VanDerWaalsContact C-N 3.34Å; T26-A30 PolarHBondContact O-N 2.95Å; T26-A30 VanDerWaalsContact O-N 3.12Å
27	L	47.1	Very low	40.3	Very low	111 Å²	111	134.5 Å²	134.5	58%	0.581	70%	0.696	S	S	*	*	H	α-helix	trans	-69.9	-37.1	171.1	-80.3	159.3	0	0	0	112.6	D23 Q24 W29 A30 H31	D23-L27 PolarHBondContact O-N 3.49Å; D23-L27 VanDerWaalsContact O-N 3.09Å; Q24-L27 PolarHBondContact O-N 3.21Å; L27-W29 VanDerWaalsContact C-N 3.34Å; L27-W29 PolarHBondContact O-N 3.43Å; L27-A30 PolarHBondContact O-N 3.17Å; L27-H31 PolarHBondContact O-CD2 3.3Å; L27-H31 VanDerWaalsContact O-CD2 3.31Å; L27-H31 PolarHBondContact O-N 3.03Å
28	A	46.6	Very low	40.2	Very low	53 Å²	53	132.3 Å²	132.3	44%	0.438	69%	0.693	S	S	.	*	H	α-helix	trans	-66.7	-35.5	176.4	0	0	0	0	0	112.2	Q24 Q25 H31	Q24-A28 VanDerWaalsContact O-CB 3.31Å; Q24-A28 WeakPolarHBondContact O-CB 3.22Å; Q24-A28 PolarHBondContact O-N 2.9Å; Q25-A28 PolarHBondContact O-N 3.15Å; A28-H31 PolarHBondContact O-N 3.02Å
29	W	38.8	Very low	39.7	Very low	221 Å²	221	126.8 Å²	126.8	84%	0.837	68%	0.676	S	S	*	*	H	α-helix	trans	-72.7	-35.5	175	-102.4	39	0	0	0	113.5	Q25 L27 H31 Q32	Q25-W29 PolarHBondContact O-N 3.44Å; L27-W29 VanDerWaalsContact C-N 3.34Å; L27-W29 PolarHBondContact O-N 3.43Å; W29-H31 PolarHBondContact O-N 3.35Å; W29-Q32 PolarHBondContact O-N 3.46Å
30	A	43.7	Very low	39.2	Very low	79 Å²	79	128.2 Å²	128.2	65%	0.653	68%	0.679	S	S	*	*	H	α-helix	trans	-63.2	-22.9	175.1	0	0	0	0	0	112.8	T26 L27	T26-A30 PolarHBondContact O-N 2.95Å; T26-A30 VanDerWaalsContact O-N 3.12Å; L27-A30 PolarHBondContact O-N 3.17Å
31	H	42.9	Very low	38.5	Very low	165 Å²	165	129.9 Å²	129.9	76%	0.764	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-7.5	179.5	-84.2	-68.7	0	0	0	115.2	L27 A28 W29	L27-H31 PolarHBondContact O-CD2 3.3Å; L27-H31 VanDerWaalsContact O-CD2 3.31Å; L27-H31 PolarHBondContact O-N 3.03Å; A28-H31 PolarHBondContact O-N 3.02Å; W29-H31 PolarHBondContact O-N 3.35Å
32	Q	36.3	Very low	37.4	Very low	150 Å²	150	131.1 Å²	131.1	70%	0.701	69%	0.691	S	S	*	*	S	Bend	trans	-110.4	1.8	-163.9	-118	-179.8	5.5	0	0	118.2	W29	W29-Q32 PolarHBondContact O-N 3.46Å
33	N	31.5	Very low	36.6	Very low	146 Å²	146	127.6 Å²	127.6	78%	0.781	69%	0.691	S	S	*	*	S	Bend	trans	-153.2	134	169.9	-90.5	-35.8	0	0	0	111.5
34	Y	30.3	Very low	35.5	Very low	206 Å²	206	126.6 Å²	126.6	81%	0.808	70%	0.704	S	S	*	*			trans	91	55.6	-172.5	-65.9	-87	0	0	0	117.1
35	V	32.5	Very low	34.5	Very low	140 Å²	140	125 Å²	125	85%	0.848	70%	0.704	S	S	*	*			trans	-122.9	88.4	130.6	-178.1	0	0	0	0	106.5	D37	V35-D37 VanDerWaalsContact C-N 3.28Å; V35-D37 PolarHBondContact O-N 3.02Å
36	I	32.2	Very low	33.6	Very low	137 Å²	137	121.4 Å²	121.4	70%	0.703	70%	0.704	S	S	*	*			trans	-71.7	99.4	161.6	-69.6	172.7	0	0	0	105.1	S38	I36-S38 PolarHBondContact O-N 3.39Å
37	D	26.4	Very low	32.6	Very low	122 Å²	122	122 Å²	122	65%	0.652	71%	0.708	S	S	*	*			trans	-43.9	95	167.9	-174.2	10.8	0	0	0	110.4	V35 G39	V35-D37 VanDerWaalsContact C-N 3.28Å; V35-D37 PolarHBondContact O-N 3.02Å; D37-G39 PolarHBondContact O-N 3.02Å; D37-G39 VanDerWaalsContact O-N 3.12Å
38	S	30.3	Very low	31.7	Very low	106 Å²	106	126.5 Å²	126.5	74%	0.741	72%	0.719	S	S	*	*			trans	-83	80.3	165.3	-59.9	0	0	0	0	107.2	I36 I40	I36-S38 PolarHBondContact O-N 3.39Å; S38-I40 PolarHBondContact O-N 3.15Å
39	G	25.7	Very low	30.7	Very low	51 Å²	51	128.5 Å²	128.5	53%	0.526	74%	0.735	S	S	.	*			trans	0.3	89.3	159.6	0	0	0	0	0	115.8	D37	D37-G39 PolarHBondContact O-N 3.02Å; D37-G39 VanDerWaalsContact O-N 3.12Å
40	I	26.8	Very low	30.1	Very low	149 Å²	149	122.3 Å²	122.3	76%	0.764	73%	0.725	S	S	*	*			trans	-124.2	87.5	139	-49.1	178.1	0	0	0	104.6	S38 S42	S38-I40 PolarHBondContact O-N 3.15Å; I40-S42 PolarHBondContact O-N 2.99Å
41	H	26.7	Very low	29.5	Very low	162 Å²	162	124.9 Å²	124.9	75%	0.75	74%	0.738	S	S	*	*			trans	-56	91.7	161.7	-79.6	35.5	0	0	0	106.9	A43	H41-A43 PolarHBondContact O-N 2.71Å
42	S	30.2	Very low	28.8	Very low	112 Å²	112	120.1 Å²	120.1	78%	0.783	73%	0.728	S	S	*	*			trans	-60.8	91.6	155.4	-70.9	0	0	0	0	105	I40 G44	I40-S42 PolarHBondContact O-N 2.99Å; S42-G44 PolarHBondContact O-N 3.3Å
43	A	27.1	Very low	28.4	Very low	82 Å²	82	120.6 Å²	120.6	68%	0.678	73%	0.732	S	S	*	*			trans	-43.2	114.4	173	0	0	0	0	0	106.9	H41 V45	H41-A43 PolarHBondContact O-N 2.71Å; A43-V45 PolarHBondContact O-N 2.95Å
44	G	27.4	Very low	28.5	Very low	80 Å²	80	119.5 Å²	119.5	83%	0.825	74%	0.736	S	S	*	*			trans	-60.1	89.7	170.4	0	0	0	0	0	107.8	S42 G46	S42-G44 PolarHBondContact O-N 3.3Å; G44-G46 PolarHBondContact O-N 3.24Å
45	V	28.8	Very low	28.6	Very low	115 Å²	115	111.1 Å²	111.1	70%	0.697	71%	0.712	S	S	*	*			trans	-87.5	82.2	153.3	-167.3	0	0	0	0	104.2	A43 T47	A43-V45 PolarHBondContact O-N 2.95Å; V45-T47 HydrophobicContact CG1-CG2 4.01Å; V45-T47 PolarHBondContact O-N 3.29Å
46	G	28	Very low	28.6	Very low	63 Å²	63	110.4 Å²	110.4	65%	0.649	71%	0.708	S	S	*	*			trans	-63.6	76.9	162.3	0	0	0	0	0	108.4	G44 Y48	G44-G46 PolarHBondContact O-N 3.24Å; G46-Y48 VanDerWaalsContact C-N 3.32Å; G46-Y48 PolarHBondContact O-N 3.04Å
47	T	26.6	Very low	28.9	Very low	112 Å²	112	109.3 Å²	109.3	69%	0.687	71%	0.712	S	S	*	*			trans	-90.5	88.6	154.5	43.9	0	0	0	0	105.6	V45 A49	V45-T47 HydrophobicContact CG1-CG2 4.01Å; V45-T47 PolarHBondContact O-N 3.29Å; T47-A49 PolarHBondContact O-N 2.94Å
48	Y	26.6	Very low	29.3	Very low	206 Å²	206	107.5 Å²	107.5	81%	0.808	71%	0.709	S	S	*	*			trans	-36.4	104.6	138.6	-63.1	-90.3	0	0	0	106	G46 S50	G46-Y48 VanDerWaalsContact C-N 3.32Å; G46-Y48 PolarHBondContact O-N 3.04Å; Y48-S50 PolarHBondContact O-N 3.44Å
49	A	27.1	Very low	29.4	Very low	94 Å²	94	111.2 Å²	111.2	78%	0.777	71%	0.712	S	S	*	*			trans	-67.5	83.2	159.6	0	0	0	0	0	103.8	T47 S51	T47-A49 PolarHBondContact O-N 2.94Å; A49-S51 PolarHBondContact O-N 2.71Å
50	S	25.9	Very low	29.8	Very low	91 Å²	91	116 Å²	116	64%	0.636	72%	0.724	S	S	*	*			trans	-46	114.4	165.2	-73.7	0	0	0	0	105.6	Y48 A52	Y48-S50 PolarHBondContact O-N 3.44Å; S50-A52 PolarHBondContact O-N 2.81Å
51	S	30.3	Very low	30.3	Very low	133 Å²	133	117.6 Å²	117.6	93%	0.93	73%	0.728	S	S	*	*	S	Bend	trans	-62.3	65.9	162.2	-46.4	0	0	0	0	108.1	A49	A49-S51 PolarHBondContact O-N 2.71Å
52	A	28.4	Very low	30.9	Very low	66 Å²	66	118.3 Å²	118.3	55%	0.545	73%	0.732	S	S	.	*			trans	-163.9	88.6	-179.4	0	0	0	0	0	106.8	S50	S50-A52 PolarHBondContact O-N 2.81Å
53	M	28.9	Very low	31.1	Very low	160 Å²	160	123.6 Å²	123.6	79%	0.788	74%	0.736	S	S	*	*				-178.3	91	118.8	-85.2	-94.3	88.9	0	0	106	G55	M53-G55 PolarHBondContact O-N 3.15Å
54	S	33.7	Very low	31.4	Very low	123 Å²	123	122.7 Å²	122.7	86%	0.86	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.2	40.3	148.9	54.4	0	0	0	0	111.8
55	G	31.9	Very low	31.8	Very low	29 Å²	29	123.4 Å²	123.4	30%	0.299	72%	0.72	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.9	-11.9	-167	0	0	0	0	0	114.7	M53 S57	M53-G55 PolarHBondContact O-N 3.15Å; G55-S57 PolarHBondContact O-N 2.91Å; G55-S57 VanDerWaalsContact O-N 3.08Å
56	V	31.8	Very low	32.5	Very low	126 Å²	126	123.7 Å²	123.7	76%	0.764	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	29.9	176.8	-155.5	0	0	0	0	111.6
57	S	38.5	Very low	33.2	Very low	113 Å²	113	130.4 Å²	130.4	79%	0.79	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	-2.2	166.5	-149	0	0	0	0	112.6	G55	G55-S57 PolarHBondContact O-N 2.91Å; G55-S57 VanDerWaalsContact O-N 3.08Å
58	S	35.8	Very low	34	Very low	84 Å²	84	129.3 Å²	129.3	59%	0.587	73%	0.725	S	S	*	*	S	Bend	trans	-121.6	12.1	-175.4	72.5	0	0	0	0	116.3
59	F	31.4	Very low	34.9	Very low	184 Å²	184	123.9 Å²	123.9	81%	0.807	72%	0.715	S	S	*	*	S	Bend	trans	-114.2	11.9	178.3	-96.1	-77.6	0	0	0	115.1
60	I	34.1	Very low	35.9	Very low	151 Å²	151	122.9 Å²	122.9	77%	0.774	71%	0.713	S	S	*	*	S	Bend	trans	-100.7	-2.1	172.3	-69.9	175.2	0	0	0	112.3
61	E	38.3	Very low	37.6	Very low	184 Å²	184	124.9 Å²	124.9	86%	0.86	71%	0.708	S	S	*	*	S	Bend	trans	-86.6	-3.8	-175.3	-79.3	-170.9	160.8	0	0	117
62	E	38.5	Very low	39.5	Very low	177 Å²	177	121.5 Å²	121.5	83%	0.827	68%	0.682	S	S	*	*	S	Bend	trans	-116.3	3.2	-176.5	-146.4	173.6	-177.5	0	0	116.7
63	Y	34.3	Very low	41.4	Very low	222 Å²	222	127.3 Å²	127.3	87%	0.871	69%	0.689	S	S	*	*			trans	-129.1	60.5	162.3	-77.6	-89.2	0	0	0	109.4	D65	Y63-D65 PolarHBondContact O-N 2.74Å
64	G	32.8	Very low	43.3	Very low	63 Å²	63	126.7 Å²	126.7	65%	0.649	69%	0.685	S	S	*	*			trans	-67.2	80.2	154.9	0	0	0	0	0	108.4	P66	G64-P66 WeakPolarHBondContact O-CD 3.38Å
65	D	35.9	Very low	45.1	Very low	95 Å²	95	125.2 Å²	125.2	51%	0.508	66%	0.664	S	S	.	*			trans	-54.8	124.6	158.9	-174.1	-11.3	0	0	0	106.5	Y63 Y67 T68	Y63-D65 PolarHBondContact O-N 2.74Å; D65-Y67 PolarHBondContact O-N 3.07Å; D65-Y67 WeakPolarHBondContact OD1-CD2 3.24Å; D65-Y67 PolarHBondContact OD1-N 3.36Å; D65-T68 PolarHBondContact O-N 3.48Å; D65-T68 PolarHBondContact O-OG1 2.67Å
66	P	43.7	Very low	46.8	Very low	122 Å²	122	127.3 Å²	127.3	79%	0.792	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.8	-0.5	179.5	-24.1	34.4	0	0	0	114.8	G64	G64-P66 WeakPolarHBondContact O-CD 3.38Å
67	Y	42.9	Very low	48.5	Very low	203 Å²	203	124.7 Å²	124.7	80%	0.796	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.9	10.1	174.5	-69.5	-79.2	0	0	0	115.7	D65 P69	D65-Y67 PolarHBondContact O-N 3.07Å; D65-Y67 WeakPolarHBondContact OD1-CD2 3.24Å; D65-Y67 PolarHBondContact OD1-N 3.36Å; Y67-P69 VanDerWaalsContact O-CD 3.25Å; Y67-P69 WeakPolarHBondContact O-CD 3.38Å
68	T	43.9	Very low	50.1	Low	90 Å²	90	120.5 Å²	120.5	55%	0.552	62%	0.624	S	S	*	*			trans	-100	98.5	169.8	4.7	0	0	0	0	109.9	D65 G70	D65-T68 PolarHBondContact O-N 3.48Å; D65-T68 PolarHBondContact O-OG1 2.67Å; T68-G70 PolarHBondContact O-N 3.12Å; T68-G70 VanDerWaalsContact O-N 3.16Å
69	P	45.7	Very low	51.8	Low	92 Å²	92	120.2 Å²	120.2	60%	0.597	62%	0.615	S	S	*	*			trans	-58.9	123.5	171.5	-14	28.4	0	0	0	107.5	Y67 Y71	Y67-P69 VanDerWaalsContact O-CD 3.25Å; Y67-P69 WeakPolarHBondContact O-CD 3.38Å; P69-Y71 PolarHBondContact O-N 3.22Å
70	G	48.3	Very low	53.6	Low	72 Å²	72	115.1 Å²	115.1	74%	0.742	60%	0.597	S	S	*	*			trans	-54.8	110.3	171.2	0	0	0	0	0	108.2	T68 T72	T68-G70 PolarHBondContact O-N 3.12Å; T68-G70 VanDerWaalsContact O-N 3.16Å; G70-T72 PolarHBondContact O-N 3.48Å
71	Y	60.5	Low	55.2	Low	133 Å²	133	113.4 Å²	113.4	52%	0.522	59%	0.588	S	S	.	*			trans	-58.7	127.2	-179.1	-67.3	-75.3	0	0	0	108.7	P69 Q75 I79	P69-Y71 PolarHBondContact O-N 3.22Å; Y71-Q75 VanDerWaalsContact CA-OE1 3.28Å; Y71-Q75 HydrophobicContact CD1-CB 4.01Å; Y71-I79 HydrophobicContact CD1-CD1 3.57Å; Y71-I79 HydrophobicContact CD2-CD1 4.39Å; Y71-I79 HydrophobicContact CE1-CD1 3.52Å; Y71-I79 HydrophobicContact CE2-CD1 4.36Å; Y71-I79 HydrophobicContact CG-CD1 4.01Å
72	T	70.1	Confident	56.7	Low	62 Å²	62	110 Å²	110	38%	0.38	58%	0.576	S	S	.	*			trans	-61	158.4	172.2	73.2	0	0	0	0	109.4	G70 E74 Q75 I76	G70-T72 PolarHBondContact O-N 3.48Å; T72-E74 WeakPolarHBondContact CB-OE2 3.3Å; T72-E74 PolarHBondContact O-N 3.22Å; T72-E74 PolarHBondContact OG1-OE2 3.15Å; T72-Q75 CarbonylContact O-C 3.59Å; T72-Q75 WeakPolarHBondContact O-CA 3.45Å; T72-Q75 WeakPolarHBondContact O-CB 3.35Å; T72-Q75 PolarHBondContact O-N 3.32Å; T72-Q75 WeakPolarHBondContact OG1-CG 3.49Å; T72-Q75 PolarHBondContact OG1-N 3.36Å; T72-I76 PolarHBondContact O-N 3.46Å
73	R	68.3	Low	58.2	Low	188 Å²	188	107.5 Å²	107.5	71%	0.709	56%	0.56	S	S	*	*	H	α-helix	trans	-51.9	-40.5	175	-171.1	78.6	-179.8	-176.3	0.8	110.6	Q75 I76 D77	R73-Q75 PolarHBondContact O-N 2.84Å; R73-I76 PolarHBondContact O-N 3.33Å; R73-D77 WeakPolarHBondContact O-CB 3.33Å; R73-D77 PolarHBondContact O-N 2.6Å
74	E	68.5	Low	59.9	Low	147 Å²	147	102.5 Å²	102.5	69%	0.687	55%	0.545	S	S	*	.	H	α-helix	trans	-65.2	-36.7	175.2	-56.2	101.2	177.7	0	0	113.1	T72 G78	T72-E74 WeakPolarHBondContact CB-OE2 3.3Å; T72-E74 PolarHBondContact O-N 3.22Å; T72-E74 PolarHBondContact OG1-OE2 3.15Å; E74-G78 PolarHBondContact O-N 3.19Å
75	Q	71.1	Confident	61.6	Low	93 Å²	93	101.9 Å²	101.9	44%	0.435	53%	0.533	S	S	.	.	H	α-helix	trans	-70	-39.6	176	-71.6	173.5	-31.1	0	0	112	Y71 T72 R73 G78 I79	Y71-Q75 VanDerWaalsContact CA-OE1 3.28Å; Y71-Q75 HydrophobicContact CD1-CB 4.01Å; T72-Q75 CarbonylContact O-C 3.59Å; T72-Q75 WeakPolarHBondContact O-CA 3.45Å; T72-Q75 WeakPolarHBondContact O-CB 3.35Å; T72-Q75 PolarHBondContact O-N 3.32Å; T72-Q75 WeakPolarHBondContact OG1-CG 3.49Å; T72-Q75 PolarHBondContact OG1-N 3.36Å; R73-Q75 PolarHBondContact O-N 2.84Å; Q75-G78 PolarHBondContact O-N 3.12Å; Q75-I79 WeakPolarHBondContact O-CB 2.89Å; Q75-I79 VanDerWaalsContact O-CG1 3.24Å; Q75-I79 WeakPolarHBondContact O-CG1 3.28Å; Q75-I79 PolarHBondContact O-N 3.07Å
76	I	68	Low	63.5	Low	72 Å²	72	98.7 Å²	98.7	37%	0.369	52%	0.517	S	S	.	.	H	α-helix	trans	-63.8	-44.8	173.7	-63.7	175.4	0	0	0	109.8	T72 R73 G78 I79 N80	T72-I76 PolarHBondContact O-N 3.46Å; R73-I76 PolarHBondContact O-N 3.33Å; I76-G78 VanDerWaalsContact C-N 3.32Å; I76-G78 PolarHBondContact O-N 2.98Å; I76-I79 PolarHBondContact O-N 3.08Å; I76-N80 WeakPolarHBondContact O-CB 3.21Å; I76-N80 VanDerWaalsContact O-CG 3.26Å; I76-N80 PolarHBondContact O-N 2.94Å; I76-N80 PolarHBondContact O-ND2 2.95Å
77	D	68.4	Low	65	Low	71 Å²	71	99.6 Å²	99.6	38%	0.38	51%	0.505	S	S	.	.	H	α-helix	trans	-63.2	-39.6	176.8	-68.8	-18.7	0	0	0	110.8	R73 N80 L81	R73-D77 WeakPolarHBondContact O-CB 3.33Å; R73-D77 PolarHBondContact O-N 2.6Å; D77-N80 PolarHBondContact O-N 3.12Å; D77-L81 WeakPolarHBondContact O-CB 3.36Å; D77-L81 VanDerWaalsContact O-CG 3.3Å; D77-L81 WeakPolarHBondContact O-CG 3.49Å; D77-L81 PolarHBondContact O-N 3.29Å
78	G	72.1	Confident	66.7	Low	26 Å²	26	92.6 Å²	92.6	27%	0.268	49%	0.485	S	S	.	.	H	α-helix	trans	-63.7	-47.4	173.4	0	0	0	0	0	113.6	E74 Q75 I76 N80 L81 D82	E74-G78 PolarHBondContact O-N 3.19Å; Q75-G78 PolarHBondContact O-N 3.12Å; I76-G78 VanDerWaalsContact C-N 3.32Å; I76-G78 PolarHBondContact O-N 2.98Å; G78-N80 VanDerWaalsContact C-N 3.3Å; G78-N80 PolarHBondContact O-N 3.34Å; G78-L81 WeakPolarHBondContact O-CB 3.47Å; G78-L81 PolarHBondContact O-N 3.47Å; G78-D82 PolarHBondContact O-N 3.4Å
79	I	71	Confident	68.4	Low	77 Å²	77	92.2 Å²	92.2	40%	0.395	48%	0.478	S	S	.	.	H	α-helix	trans	-61.9	-40.2	175.8	-69.7	164.1	0	0	0	110.6	Y71 Q75 I76 D82 Y83	Y71-I79 HydrophobicContact CD1-CD1 3.57Å; Y71-I79 HydrophobicContact CD2-CD1 4.39Å; Y71-I79 HydrophobicContact CE1-CD1 3.52Å; Y71-I79 HydrophobicContact CE2-CD1 4.36Å; Y71-I79 HydrophobicContact CG-CD1 4.01Å; Q75-I79 WeakPolarHBondContact O-CB 2.89Å; Q75-I79 VanDerWaalsContact O-CG1 3.24Å; Q75-I79 WeakPolarHBondContact O-CG1 3.28Å; Q75-I79 PolarHBondContact O-N 3.07Å; I76-I79 PolarHBondContact O-N 3.08Å; I79-D82 PolarHBondContact O-N 3Å; I79-Y83 VanDerWaalsContact O-CB 3.23Å; I79-Y83 WeakPolarHBondContact O-CB 3.47Å; I79-Y83 PolarHBondContact O-N 2.74Å
80	N	68.8	Low	69.8	Low	78 Å²	78	90 Å²	90	42%	0.417	46%	0.457	S	S	.	.	H	α-helix	trans	-64.6	-42.4	176.2	-76.1	-27.5	0	0	0	111.4	I76 D77 G78 Y83 E84	I76-N80 WeakPolarHBondContact O-CB 3.21Å; I76-N80 VanDerWaalsContact O-CG 3.26Å; I76-N80 PolarHBondContact O-N 2.94Å; I76-N80 PolarHBondContact O-ND2 2.95Å; D77-N80 PolarHBondContact O-N 3.12Å; G78-N80 VanDerWaalsContact C-N 3.3Å; G78-N80 PolarHBondContact O-N 3.34Å; N80-Y83 PolarHBondContact O-N 3.43Å; N80-E84 WeakPolarHBondContact O-CB 3.34Å; N80-E84 VanDerWaalsContact O-CG 3.28Å; N80-E84 WeakPolarHBondContact O-CG 3.25Å; N80-E84 PolarHBondContact O-N 3Å
81	L	68.6	Low	71.4	Confident	114 Å²	114	89.2 Å²	89.2	60%	0.597	44%	0.435	S	S	*	.	H	α-helix	trans	-59.7	-46.3	174.2	-77.7	163.1	0	0	0	111.8	D77 G78 E84 A85	D77-L81 WeakPolarHBondContact O-CB 3.36Å; D77-L81 VanDerWaalsContact O-CG 3.3Å; D77-L81 WeakPolarHBondContact O-CG 3.49Å; D77-L81 PolarHBondContact O-N 3.29Å; G78-L81 WeakPolarHBondContact O-CB 3.47Å; G78-L81 PolarHBondContact O-N 3.47Å; L81-E84 PolarHBondContact O-N 3.28Å; L81-A85 WeakPolarHBondContact O-CB 3.43Å; L81-A85 PolarHBondContact O-N 2.75Å
82	D	69.3	Low	72.5	Confident	113 Å²	113	88.8 Å²	88.8	60%	0.604	43%	0.433	S	S	*	.	H	α-helix	trans	-65.4	-39.6	177	-74.4	-15.4	0	0	0	111.8	G78 I79 A85 T86	G78-D82 PolarHBondContact O-N 3.4Å; I79-D82 PolarHBondContact O-N 3Å; D82-A85 PolarHBondContact O-N 2.87Å; D82-T86 WeakPolarHBondContact O-CB 3.44Å; D82-T86 VanDerWaalsContact O-CG2 3.31Å; D82-T86 WeakPolarHBondContact O-CG2 3.43Å; D82-T86 PolarHBondContact O-N 3.36Å; D82-T86 PolarHBondContact O-OG1 2.87Å
83	Y	70.3	Confident	73	Confident	125 Å²	125	87.2 Å²	87.2	49%	0.49	43%	0.426	S	S	.	.	H	α-helix	trans	-67.1	-39.7	176.8	-169.9	-99.9	0	0	0	112	I79 N80 T86 R87	I79-Y83 VanDerWaalsContact O-CB 3.23Å; I79-Y83 WeakPolarHBondContact O-CB 3.47Å; I79-Y83 PolarHBondContact O-N 2.74Å; N80-Y83 PolarHBondContact O-N 3.43Å; Y83-T86 WeakPolarHBondContact CA-OG1 3.3Å; Y83-T86 PolarHBondContact O-OG1 3.48Å; Y83-T86 VanDerWaalsContact O-OG1 3.11Å; Y83-R87 WeakPolarHBondContact O-CB 3.18Å; Y83-R87 PolarHBondContact O-N 2.89Å
84	E	69.8	Low	73.6	Confident	117 Å²	117	79 Å²	79	55%	0.547	40%	0.399	S	S	.	.	H	α-helix	trans	-65.2	-42	173.9	-77.1	-179.4	175.8	0	0	111.7	N80 L81 R87 S88	N80-E84 WeakPolarHBondContact O-CB 3.34Å; N80-E84 VanDerWaalsContact O-CG 3.28Å; N80-E84 WeakPolarHBondContact O-CG 3.25Å; N80-E84 PolarHBondContact O-N 3Å; L81-E84 PolarHBondContact O-N 3.28Å; E84-R87 PolarHBondContact O-N 3.37Å; E84-S88 WeakPolarHBondContact O-CB 3.46Å; E84-S88 PolarHBondContact O-N 3.37Å; E84-S88 PolarHBondContact O-OG 2.97Å
85	A	69.4	Low	74.2	Confident	50 Å²	50	73.8 Å²	73.8	41%	0.413	38%	0.375	S	S	.	.	H	α-helix	trans	-62.5	-51.6	175.7	0	0	0	0	0	111.5	L81 D82 R87 S88 Q89	L81-A85 WeakPolarHBondContact O-CB 3.43Å; L81-A85 PolarHBondContact O-N 2.75Å; D82-A85 PolarHBondContact O-N 2.87Å; A85-R87 PolarHBondContact O-N 2.85Å; A85-S88 PolarHBondContact O-N 2.64Å; A85-Q89 WeakPolarHBondContact O-CG 3.26Å; A85-Q89 PolarHBondContact O-N 3.49Å
86	T	74.2	Confident	74.7	Confident	28 Å²	28	73.4 Å²	73.4	17%	0.172	37%	0.372	C	S	.	.	H	α-helix	trans	-65.7	-36.1	178.5	57.8	0	0	0	0	112.2	D82 Y83 Q89 R90 P107	D82-T86 WeakPolarHBondContact O-CB 3.44Å; D82-T86 VanDerWaalsContact O-CG2 3.31Å; D82-T86 WeakPolarHBondContact O-CG2 3.43Å; D82-T86 PolarHBondContact O-N 3.36Å; D82-T86 PolarHBondContact O-OG1 2.87Å; Y83-T86 WeakPolarHBondContact CA-OG1 3.3Å; Y83-T86 PolarHBondContact O-OG1 3.48Å; Y83-T86 VanDerWaalsContact O-OG1 3.11Å; T86-Q89 PolarHBondContact O-N 3.36Å; T86-R90 WeakPolarHBondContact O-CG 3.34Å; T86-R90 PolarHBondContact O-N 3Å; T86-R90 PolarHBondContact OG1-NH1 3.38Å; T86-P107 HydrophobicContact CG2-CG 3.96Å
87	R	75.7	Confident	75.3	Confident	141 Å²	141	72.5 Å²	72.5	53%	0.532	37%	0.371	S	S	.	.	H	α-helix	trans	-60.9	-45.4	172.9	-179.8	-178.6	177.4	-143.1	-1.2	111.2	Y83 E84 A85 Q89 R90 I91	Y83-R87 WeakPolarHBondContact O-CB 3.18Å; Y83-R87 PolarHBondContact O-N 2.89Å; E84-R87 PolarHBondContact O-N 3.37Å; A85-R87 PolarHBondContact O-N 2.85Å; R87-Q89 VanDerWaalsContact C-N 3.32Å; R87-Q89 PolarHBondContact O-N 2.93Å; R87-R90 PolarHBondContact O-N 3.21Å; R87-I91 HydrophobicContact CG-CD1 3.99Å; R87-I91 VanDerWaalsContact O-CG1 3.3Å; R87-I91 WeakPolarHBondContact O-CG1 3.32Å; R87-I91 PolarHBondContact O-N 3.03Å
88	S	78.3	Confident	75.7	Confident	55 Å²	55	74.3 Å²	74.3	39%	0.385	38%	0.377	S	S	.	.	H	α-helix	trans	-65.2	-37.1	179.5	-57.4	0	0	0	0	111.9	E84 A85 R92	E84-S88 WeakPolarHBondContact O-CB 3.46Å; E84-S88 PolarHBondContact O-N 3.37Å; E84-S88 PolarHBondContact O-OG 2.97Å; A85-S88 PolarHBondContact O-N 2.64Å; S88-R92 WeakPolarHBondContact O-CB 3.33Å; S88-R92 PolarHBondContact O-N 3.1Å
89	Q	79.5	Confident	76.1	Confident	83 Å²	83	76.6 Å²	76.6	39%	0.388	39%	0.386	S	S	.	.	H	α-helix	trans	-67.6	-45.7	172.8	-73.2	170.8	-20.8	0	0	111.9	A85 T86 R87 I91 R92 A93 I100 I106	A85-Q89 WeakPolarHBondContact O-CG 3.26Å; A85-Q89 PolarHBondContact O-N 3.49Å; T86-Q89 PolarHBondContact O-N 3.36Å; R87-Q89 VanDerWaalsContact C-N 3.32Å; R87-Q89 PolarHBondContact O-N 2.93Å; Q89-I91 VanDerWaalsContact C-N 3.32Å; Q89-I91 PolarHBondContact O-N 3.49Å; Q89-R92 CarbonylContact O-C 3.58Å; Q89-R92 PolarHBondContact O-N 2.99Å; Q89-A93 WeakPolarHBondContact O-CB 3.37Å; Q89-A93 PolarHBondContact O-N 3.44Å; Q89-I100 WeakPolarHBondContact O-CD1 3.22Å; Q89-I106 HydrophobicContact CB-CG2 4.42Å
90	R	76.2	Confident	76.3	Confident	45 Å²	45	74.6 Å²	74.6	17%	0.17	38%	0.376	C	S	.	.	H	α-helix	trans	-56.9	-44.5	174.8	-77.3	-170.4	-64.6	-86.9	-3.5	112.1	T86 R87 A93 A94 I106 P107	T86-R90 WeakPolarHBondContact O-CG 3.34Å; T86-R90 PolarHBondContact O-N 3Å; T86-R90 PolarHBondContact OG1-NH1 3.38Å; R87-R90 PolarHBondContact O-N 3.21Å; R90-A93 PolarHBondContact O-N 2.78Å; R90-A94 WeakPolarHBondContact O-CB 3.45Å; R90-A94 PolarHBondContact O-N 3.14Å; R90-I106 HydrophobicContact CB-CG2 4.22Å; R90-I106 HydrophobicContact CG-CG2 3.27Å; R90-P107 WeakPolarHBondContact CD-O 3.39Å; R90-P107 PolarHBondContact NH1-O 3.38Å
91	I	81.7	Confident	76.3	Confident	55 Å²	55	80.6 Å²	80.6	28%	0.282	40%	0.401	S	S	.	.	H	α-helix	trans	-64.5	-46.5	177	-67.8	170.1	0	0	0	110.2	R87 Q89 A93 A94 I95 V119	R87-I91 HydrophobicContact CG-CD1 3.99Å; R87-I91 VanDerWaalsContact O-CG1 3.3Å; R87-I91 WeakPolarHBondContact O-CG1 3.32Å; R87-I91 PolarHBondContact O-N 3.03Å; Q89-I91 VanDerWaalsContact C-N 3.32Å; Q89-I91 PolarHBondContact O-N 3.49Å; I91-A93 VanDerWaalsContact C-N 3.34Å; I91-A93 PolarHBondContact O-N 2.91Å; I91-A94 PolarHBondContact O-N 3.21Å; I91-I95 HydrophobicContact CG2-CD1 3.65Å; I91-I95 HydrophobicContact CG2-CG1 4.33Å; I91-I95 WeakPolarHBondContact O-CB 3.32Å; I91-I95 WeakPolarHBondContact O-CG1 3.24Å; I91-I95 PolarHBondContact O-N 3.21Å; I91-V119 HydrophobicContact CG1-CG1 4.14Å; I91-V119 HydrophobicContact CG1-CG2 3.88Å
92	R	82.8	Confident	76.2	Confident	124 Å²	124	81 Å²	81	47%	0.468	40%	0.404	S	S	.	.	H	α-helix	trans	-60.8	-40.3	175.2	-85.6	-174.2	-84.2	173.7	-7.9	112.5	S88 Q89 A94 I95 F96 I100	S88-R92 WeakPolarHBondContact O-CB 3.33Å; S88-R92 PolarHBondContact O-N 3.1Å; Q89-R92 CarbonylContact O-C 3.58Å; Q89-R92 PolarHBondContact O-N 2.99Å; R92-A94 VanDerWaalsContact C-N 3.33Å; R92-A94 PolarHBondContact O-N 3.41Å; R92-I95 PolarHBondContact O-N 3.37Å; R92-F96 CarbonylContact O-C 2.98Å; R92-F96 VanDerWaalsContact O-CA 3.24Å; R92-F96 WeakPolarHBondContact O-CA 3.5Å; R92-F96 PolarHBondContact O-N 3.02Å; R92-F96 VanDerWaalsContact O-O 3.1Å; R92-I100 HydrophobicContact CB-CD1 4.07Å; R92-I100 HydrophobicContact CB-CG1 4.34Å
93	A	80.2	Confident	75.7	Confident	29 Å²	29	80.8 Å²	80.8	24%	0.24	41%	0.406	C	S	.	.	H	α-helix	trans	-64.8	-40.7	179.1	0	0	0	0	0	111.7	Q89 R90 I91 P97 I100 I106	Q89-A93 WeakPolarHBondContact O-CB 3.37Å; Q89-A93 PolarHBondContact O-N 3.44Å; R90-A93 PolarHBondContact O-N 2.78Å; I91-A93 VanDerWaalsContact C-N 3.34Å; I91-A93 PolarHBondContact O-N 2.91Å; A93-P97 WeakPolarHBondContact O-CB 3.45Å; A93-I100 HydrophobicContact CB-CD1 3.43Å; A93-I100 VanDerWaalsContact CB-CD1 3.43Å; A93-I100 VanDerWaalsContact N-CD1 3.28Å; A93-I106 HydrophobicContact CB-CD1 3.44Å; A93-I106 VanDerWaalsContact CB-CD1 3.44Å
94	A	81.7	Confident	75.1	Confident	17 Å²	17	77.6 Å²	77.6	14%	0.14	41%	0.412	C	S	.	.	H	α-helix	trans	-69.6	-42.6	178	0	0	0	0	0	112.3	R90 I91 R92 V119 A123 Q127	R90-A94 WeakPolarHBondContact O-CB 3.45Å; R90-A94 PolarHBondContact O-N 3.14Å; I91-A94 PolarHBondContact O-N 3.21Å; R92-A94 VanDerWaalsContact C-N 3.33Å; R92-A94 PolarHBondContact O-N 3.41Å; A94-V119 HydrophobicContact CB-CG1 3.57Å; A94-A123 HydrophobicContact CB-CB 3.69Å; A94-A123 WeakPolarHBondContact O-CB 3.3Å; A94-Q127 PolarHBondContact O-NE2 3.29Å
95	I	80.3	Confident	74.7	Confident	36 Å²	36	79 Å²	79	19%	0.185	42%	0.423	C	S	.	.	H	α-helix	trans	-95.4	-37.7	-169.4	-62	-175.3	0	0	0	112.6	I91 R92	I91-I95 HydrophobicContact CG2-CD1 3.65Å; I91-I95 HydrophobicContact CG2-CG1 4.33Å; I91-I95 WeakPolarHBondContact O-CB 3.32Å; I91-I95 WeakPolarHBondContact O-CG1 3.24Å; I91-I95 PolarHBondContact O-N 3.21Å; R92-I95 PolarHBondContact O-N 3.37Å
96	F	82.4	Confident	74.2	Confident	86 Å²	86	78.3 Å²	78.3	38%	0.377	41%	0.412	S	S	.	.			trans	-138.4	61.1	-173.6	-58.2	-68.3	0	0	0	110.8	R92 E98 T99 K130	R92-F96 CarbonylContact O-C 2.98Å; R92-F96 VanDerWaalsContact O-CA 3.24Å; R92-F96 WeakPolarHBondContact O-CA 3.5Å; R92-F96 PolarHBondContact O-N 3.02Å; R92-F96 VanDerWaalsContact O-O 3.1Å; F96-E98 WeakPolarHBondContact CA-OE1 3.36Å; F96-E98 WeakPolarHBondContact CB-OE1 3.36Å; F96-E98 PolarHBondContact O-N 3.29Å; F96-E98 VanDerWaalsContact O-N 3.1Å; F96-T99 HydrophobicContact CB-CG2 3.81Å; F96-T99 WeakPolarHBondContact O-CB 3.45Å; F96-T99 PolarHBondContact O-N 3.48Å; F96-T99 PolarHBondContact O-OG1 3.29Å; F96-K130 HydrophobicContact CD1-CD 3.82Å; F96-K130 HydrophobicContact CE1-CB 4.43Å; F96-K130 HydrophobicContact CE1-CD 3.9Å; F96-K130 HydrophobicContact CE1-CG 4.09Å
97	P	80.2	Confident	73.6	Confident	52 Å²	52	80.3 Å²	80.3	34%	0.338	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-55.7	-32	-173.5	21.6	-32.8	0	0	0	113.2	A93 T99 I100	A93-P97 WeakPolarHBondContact O-CB 3.45Å; P97-T99 PolarHBondContact O-N 3.34Å; P97-T99 VanDerWaalsContact O-N 3.16Å; P97-I100 PolarHBondContact O-N 2.98Å; P97-I100 VanDerWaalsContact O-N 3.14Å
98	E	77.8	Confident	72.9	Confident	110 Å²	110	78 Å²	78	51%	0.514	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-64.5	-13.8	176.4	69.7	-69.2	162.3	0	0	114.9	F96 I100 K130	F96-E98 WeakPolarHBondContact CA-OE1 3.36Å; F96-E98 WeakPolarHBondContact CB-OE1 3.36Å; F96-E98 PolarHBondContact O-N 3.29Å; F96-E98 VanDerWaalsContact O-N 3.1Å; E98-I100 VanDerWaalsContact C-N 3.29Å; E98-K130 IonicContact OE1-NZ 2.78Å; E98-K130 PolarHBondContact OE1-NZ 3.41Å; E98-K130 IonicContact OE2-NZ 2.59Å; E98-K130 PolarHBondContact OE2-NZ 3.1Å
99	T	80.5	Confident	72.1	Confident	74 Å²	74	77.6 Å²	77.6	45%	0.454	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-87.3	-1.3	176.7	65.5	0	0	0	0	113	F96 P97	F96-T99 HydrophobicContact CB-CG2 3.81Å; F96-T99 WeakPolarHBondContact O-CB 3.45Å; F96-T99 PolarHBondContact O-N 3.48Å; F96-T99 PolarHBondContact O-OG1 3.29Å; P97-T99 PolarHBondContact O-N 3.34Å; P97-T99 VanDerWaalsContact O-N 3.16Å
100	I	74	Confident	71.2	Confident	35 Å²	35	75.2 Å²	75.2	18%	0.179	42%	0.416	C	S	.	.			trans	-110.3	112.7	-179.6	-60.4	-170.1	0	0	0	108.5	Q89 R92 A93 P97 E98 D102 V103 I106	Q89-I100 WeakPolarHBondContact O-CD1 3.22Å; R92-I100 HydrophobicContact CB-CD1 4.07Å; R92-I100 HydrophobicContact CB-CG1 4.34Å; A93-I100 HydrophobicContact CB-CD1 3.43Å; A93-I100 VanDerWaalsContact CB-CD1 3.43Å; A93-I100 VanDerWaalsContact N-CD1 3.28Å; P97-I100 PolarHBondContact O-N 2.98Å; P97-I100 VanDerWaalsContact O-N 3.14Å; E98-I100 VanDerWaalsContact C-N 3.29Å; I100-D102 VanDerWaalsContact C-N 3.33Å; I100-D102 WeakPolarHBondContact CG2-O 3.37Å; I100-V103 HydrophobicContact CG2-CG2 4.43Å; I100-I106 HydrophobicContact CD1-CD1 3.91Å
101	E	68.7	Low	70.5	Confident	203 Å²	203	83.9 Å²	83.9	95%	0.949	45%	0.451	S	S	*	.	S	Bend	trans	-71.3	-29.2	179.3	-65	-178.6	169.4	0	0	112.3
102	D	68.2	Low	69.6	Low	124 Å²	124	86.4 Å²	86.4	66%	0.663	46%	0.464	S	S	*	.			trans	-134.4	106.6	-177.7	-156.3	-12.7	0	0	0	111.6	I100 G104	I100-D102 VanDerWaalsContact C-N 3.33Å; I100-D102 WeakPolarHBondContact CG2-O 3.37Å; D102-G104 VanDerWaalsContact C-N 3.28Å; D102-G104 PolarHBondContact OD1-N 3.33Å
103	V	58	Low	68.8	Low	107 Å²	107	88.8 Å²	88.8	65%	0.648	48%	0.479	S	S	*	.			trans	-80.2	-13.9	-178	-177	0	0	0	0	111.3	I100 D105	I100-V103 HydrophobicContact CG2-CG2 4.43Å; V103-D105 VanDerWaalsContact C-N 3.34Å; V103-D105 PolarHBondContact O-N 2.94Å; V103-D105 VanDerWaalsContact O-N 3.17Å
104	G	58.4	Low	68.3	Low	59 Å²	59	90.7 Å²	90.7	61%	0.608	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-33	-162.5	0	0	0	0	0	116.3	D102	D102-G104 VanDerWaalsContact C-N 3.28Å; D102-G104 PolarHBondContact OD1-N 3.33Å
105	D	59.9	Low	67.8	Low	145 Å²	145	97.1 Å²	97.1	78%	0.775	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.9	34.1	-164.1	-73.1	-30.9	0	0	0	114.2	V103 P107	V103-D105 VanDerWaalsContact C-N 3.34Å; V103-D105 PolarHBondContact O-N 2.94Å; V103-D105 VanDerWaalsContact O-N 3.17Å; D105-P107 WeakPolarHBondContact O-CD 3.25Å
106	I	60.3	Low	67.6	Low	36 Å²	36	98.4 Å²	98.4	19%	0.185	54%	0.54	C	S	.	.			trans	-81.1	107.7	174.7	-47.5	-179.1	0	0	0	109.4	Q89 R90 A93 I100 T108	Q89-I106 HydrophobicContact CB-CG2 4.42Å; R90-I106 HydrophobicContact CB-CG2 4.22Å; R90-I106 HydrophobicContact CG-CG2 3.27Å; A93-I106 HydrophobicContact CB-CD1 3.44Å; A93-I106 VanDerWaalsContact CB-CD1 3.44Å; I100-I106 HydrophobicContact CD1-CD1 3.91Å; I106-T108 PolarHBondContact O-N 3.01Å
107	P	60.6	Low	67.5	Low	70 Å²	70	96.6 Å²	96.6	46%	0.455	54%	0.536	S	S	.	.			trans	-67.9	129.7	-173.6	-17.3	33.6	0	0	0	110.2	T86 R90 D105	T86-P107 HydrophobicContact CG2-CG 3.96Å; R90-P107 WeakPolarHBondContact CD-O 3.39Å; R90-P107 PolarHBondContact NH1-O 3.38Å; D105-P107 WeakPolarHBondContact O-CD 3.25Å
108	T	60.5	Low	67.5	Low	93 Å²	93	99.1 Å²	99.1	57%	0.571	55%	0.547	S	S	*	.			trans	-78.1	126	-179.5	-53.8	0	0	0	0	109.3	I106 Q110	I106-T108 PolarHBondContact O-N 3.01Å; T108-Q110 VanDerWaalsContact C-N 3.28Å; T108-Q110 HydrophobicContact CG2-CB 4.04Å; T108-Q110 PolarHBondContact O-N 3.28Å
109	A	62.8	Low	67.7	Low	47 Å²	47	95.9 Å²	95.9	39%	0.388	53%	0.534	S	S	.	.			trans	-83.3	0.7	179.9	0	0	0	0	0	113.8
110	Q	60.1	Low	67.8	Low	32 Å²	32	96.8 Å²	96.8	15%	0.15	53%	0.534	C	S	.	.			trans	-89.2	122.9	179.6	-78.1	165.9	-47.5	0	0	110.7	T108 Q115 T117	T108-Q110 VanDerWaalsContact C-N 3.28Å; T108-Q110 HydrophobicContact CG2-CB 4.04Å; T108-Q110 PolarHBondContact O-N 3.28Å; Q110-Q115 PolarHBondContact NE2-O 3.03Å; Q110-T117 HydrophobicContact CG-CG2 3.36Å; Q110-T117 VanDerWaalsContact NE2-CG2 3.25Å; Q110-T117 VanDerWaalsContact NE2-N 3.12Å
111	Y	61.8	Low	68.2	Low	228 Å²	228	102.4 Å²	102.4	89%	0.894	55%	0.553	S	S	*	*	S	Bend	trans	-85.4	-31.2	159.9	-70.6	-85.5	0	0	0	111.5
112	D	62.1	Low	69.1	Low	107 Å²	107	97.6 Å²	97.6	57%	0.572	53%	0.533	S	S	*	.			trans	-101.4	105.6	178.9	-169.1	-3.3	0	0	0	110.4	G114	D112-G114 PolarHBondContact O-N 2.73Å; D112-G114 PolarHBondContact OD1-N 2.73Å
113	F	66.8	Low	70	Confident	175 Å²	175	92.5 Å²	92.5	77%	0.768	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-7.7	-177.6	-65.5	-86.3	0	0	0	113.2
114	G	68.6	Low	71.4	Confident	69 Å²	69	94 Å²	94	71%	0.711	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-24.1	-177.6	0	0	0	0	0	115.1	D112	D112-G114 PolarHBondContact O-N 2.73Å; D112-G114 PolarHBondContact OD1-N 2.73Å
115	Q	72.4	Confident	72.9	Confident	152 Å²	152	94.3 Å²	94.3	71%	0.71	50%	0.499	S	S	*	.	S	Bend	trans	-116.4	115.8	-176.4	-68	-168.8	3.7	0	0	111.8	Q110 T117	Q110-Q115 PolarHBondContact NE2-O 3.03Å; Q115-T117 PolarHBondContact O-N 3.24Å
116	S	74.8	Confident	74.4	Confident	62 Å²	62	88.8 Å²	88.8	43%	0.434	47%	0.471	S	S	.	.			trans	-57	126.6	174.2	55	0	0	0	0	111.9	R121	S116-R121 PolarHBondContact O-NE 3.1Å; S116-R121 WeakPolarHBondContact OG-CD 3.44Å; S116-R121 WeakPolarHBondContact OG-CG 3.38Å
117	T	80.3	Confident	75.8	Confident	48 Å²	48	90.7 Å²	90.7	29%	0.294	48%	0.48	S	S	.	.			trans	-60.2	160.1	173.5	62.6	0	0	0	0	111.4	Q110 Q115 V119 Q120 R121	Q110-T117 HydrophobicContact CG-CG2 3.36Å; Q110-T117 VanDerWaalsContact NE2-CG2 3.25Å; Q110-T117 VanDerWaalsContact NE2-N 3.12Å; Q115-T117 PolarHBondContact O-N 3.24Å; T117-V119 PolarHBondContact O-N 2.95Å; T117-Q120 PolarHBondContact O-N 3.42Å; T117-Q120 WeakPolarHBondContact OG1-CG 3.36Å; T117-Q120 PolarHBondContact OG1-N 3.18Å; T117-Q120 VanDerWaalsContact OG1-N 3.16Å; T117-Q120 PolarHBondContact OG1-OE1 3.4Å; T117-R121 WeakPolarHBondContact O-CG 3.2Å; T117-R121 PolarHBondContact O-N 3.36Å
118	N	81.1	Confident	77.2	Confident	106 Å²	106	93.2 Å²	93.2	57%	0.567	49%	0.487	S	S	*	.	H	α-helix	trans	-55.9	-35.3	172.9	-64.6	-10.2	0	0	0	112.2	R121 L122	N118-R121 PolarHBondContact O-N 3.5Å; N118-R121 PolarHBondContact OD1-NH2 3.28Å; N118-L122 WeakPolarHBondContact O-CB 3.46Å; N118-L122 WeakPolarHBondContact O-CG 3.43Å; N118-L122 PolarHBondContact O-N 3.32Å
119	V	82.6	Confident	78.7	Confident	41 Å²	41	94.2 Å²	94.2	25%	0.248	49%	0.488	C	S	.	.	H	α-helix	trans	-67.5	-44.9	178.6	178.4	0	0	0	0	111.2	I91 A94 T117 L122 A123	I91-V119 HydrophobicContact CG1-CG1 4.14Å; I91-V119 HydrophobicContact CG1-CG2 3.88Å; A94-V119 HydrophobicContact CB-CG1 3.57Å; T117-V119 PolarHBondContact O-N 2.95Å; V119-L122 PolarHBondContact O-N 3.25Å; V119-A123 PolarHBondContact O-N 2.99Å
120	Q	81.4	Confident	79.9	Confident	94 Å²	94	95.3 Å²	95.3	44%	0.439	48%	0.484	S	S	.	.	H	α-helix	trans	-62.8	-42.8	175	-75	161.4	-23.4	0	0	111.5	T117 L122 A123	T117-Q120 PolarHBondContact O-N 3.42Å; T117-Q120 WeakPolarHBondContact OG1-CG 3.36Å; T117-Q120 PolarHBondContact OG1-N 3.18Å; T117-Q120 VanDerWaalsContact OG1-N 3.16Å; T117-Q120 PolarHBondContact OG1-OE1 3.4Å; Q120-L122 VanDerWaalsContact C-N 3.27Å; Q120-L122 PolarHBondContact O-N 3.03Å; Q120-A123 WeakPolarHBondContact O-CB 3.27Å; Q120-A123 PolarHBondContact O-N 3.48Å
121	R	83	Confident	81.3	Confident	153 Å²	153	96.9 Å²	96.9	58%	0.577	50%	0.499	S	S	*	.	H	α-helix	trans	-63.8	-30.5	176.7	-70.5	-167.8	-76.2	163.9	-4.8	113.3	S116 T117 N118 P125	S116-R121 PolarHBondContact O-NE 3.1Å; S116-R121 WeakPolarHBondContact OG-CD 3.44Å; S116-R121 WeakPolarHBondContact OG-CG 3.38Å; T117-R121 WeakPolarHBondContact O-CG 3.2Å; T117-R121 PolarHBondContact O-N 3.36Å; N118-R121 PolarHBondContact O-N 3.5Å; N118-R121 PolarHBondContact OD1-NH2 3.28Å; R121-P125 WeakPolarHBondContact O-CD 3.4Å
122	L	87.6	Confident	82.7	Confident	102 Å²	102	88.2 Å²	88.2	53%	0.534	47%	0.474	S	S	.	.	H	α-helix	trans	-92.4	-11	179.5	-69	172.2	0	0	0	114	N118 V119 Q120 S126	N118-L122 WeakPolarHBondContact O-CB 3.46Å; N118-L122 WeakPolarHBondContact O-CG 3.43Å; N118-L122 PolarHBondContact O-N 3.32Å; V119-L122 PolarHBondContact O-N 3.25Å; Q120-L122 VanDerWaalsContact C-N 3.27Å; Q120-L122 PolarHBondContact O-N 3.03Å; L122-S126 WeakPolarHBondContact O-CB 3.35Å; L122-S126 PolarHBondContact O-N 3.46Å; L122-S126 PolarHBondContact O-OG 3.1Å
123	A	87.1	Confident	84.1	Confident	16 Å²	16	86.4 Å²	86.4	13%	0.132	47%	0.467	C	S	.	.	H	α-helix	trans	-56.3	-60.1	-177.9	0	0	0	0	0	111.8	A94 V119 Q120 S126 Q127	A94-A123 HydrophobicContact CB-CB 3.69Å; A94-A123 WeakPolarHBondContact O-CB 3.3Å; V119-A123 PolarHBondContact O-N 2.99Å; Q120-A123 WeakPolarHBondContact O-CB 3.27Å; Q120-A123 PolarHBondContact O-N 3.48Å; A123-S126 PolarHBondContact O-N 2.98Å; A123-Q127 WeakPolarHBondContact O-CG 3.38Å; A123-Q127 PolarHBondContact O-N 3.25Å
124	E	88.3	Confident	85.3	Confident	140 Å²	140	81.1 Å²	81.1	65%	0.654	45%	0.449	S	S	*	.	H	α-helix	trans	-60.3	-50.4	-179.7	172.8	-178.6	-159.4	0	0	112	S126 Q127 M128	E124-S126 PolarHBondContact O-N 2.95Å; E124-Q127 PolarHBondContact O-N 3.22Å; E124-M128 HydrophobicContact CG-CG 4.44Å; E124-M128 HydrophobicContact CG-SD 4.18Å; E124-M128 WeakPolarHBondContact O-CG 3.43Å; E124-M128 PolarHBondContact O-N 3.34Å
125	P	90.1	Very high	86.3	Confident	65 Å²	65	82.9 Å²	82.9	42%	0.422	44%	0.442	S	S	.	.	H	α-helix	trans	-54	-37.5	174.4	-28.7	33.4	0	0	0	114.2	R121 L129	R121-P125 WeakPolarHBondContact O-CD 3.4Å; P125-L129 WeakPolarHBondContact O-CB 3.28Å; P125-L129 PolarHBondContact O-N 3.32Å
126	S	90.7	Very high	87.1	Confident	28 Å²	28	81.1 Å²	81.1	20%	0.196	44%	0.436	C	S	.	.	H	α-helix	trans	-75.5	-35.8	-179	-47.8	0	0	0	0	112.4	L122 A123 E124 L129 K130	L122-S126 WeakPolarHBondContact O-CB 3.35Å; L122-S126 PolarHBondContact O-N 3.46Å; L122-S126 PolarHBondContact O-OG 3.1Å; A123-S126 PolarHBondContact O-N 2.98Å; E124-S126 PolarHBondContact O-N 2.95Å; S126-L129 PolarHBondContact O-N 3.01Å; S126-K130 PolarHBondContact O-N 3.14Å
127	Q	89.3	Confident	87.9	Confident	76 Å²	76	82.3 Å²	82.3	36%	0.355	44%	0.437	S	S	.	.	H	α-helix	trans	-68.2	-38.7	173	-68.9	-179.3	13.6	0	0	112	A94 A123 E124 L129 K130 S131	A94-Q127 PolarHBondContact O-NE2 3.29Å; A123-Q127 WeakPolarHBondContact O-CG 3.38Å; A123-Q127 PolarHBondContact O-N 3.25Å; E124-Q127 PolarHBondContact O-N 3.22Å; Q127-L129 VanDerWaalsContact C-N 3.34Å; Q127-K130 PolarHBondContact O-N 2.92Å; Q127-S131 WeakPolarHBondContact O-CB 3.46Å; Q127-S131 PolarHBondContact O-N 3.17Å; Q127-S131 PolarHBondContact O-OG 2.87Å
128	M	89.8	Confident	88.4	Confident	124 Å²	124	83.9 Å²	83.9	61%	0.611	44%	0.443	S	S	*	.	H	α-helix	trans	-61.2	-43.7	171.6	-70.4	-177.8	75.8	0	0	111	E124 S131 A132	E124-M128 HydrophobicContact CG-CG 4.44Å; E124-M128 HydrophobicContact CG-SD 4.18Å; E124-M128 WeakPolarHBondContact O-CG 3.43Å; E124-M128 PolarHBondContact O-N 3.34Å; M128-S131 PolarHBondContact O-N 2.89Å; M128-A132 WeakPolarHBondContact O-CB 3.27Å; M128-A132 PolarHBondContact O-N 3.47Å
129	L	91.4	Very high	88.9	Confident	114 Å²	114	83.5 Å²	83.5	60%	0.597	44%	0.435	S	S	*	.	H	α-helix	trans	-61.6	-46.9	175.9	178.1	62	0	0	0	111.7	P125 S126 Q127 S131 A132 V133	P125-L129 WeakPolarHBondContact O-CB 3.28Å; P125-L129 PolarHBondContact O-N 3.32Å; S126-L129 PolarHBondContact O-N 3.01Å; Q127-L129 VanDerWaalsContact C-N 3.34Å; L129-S131 VanDerWaalsContact C-N 3.34Å; L129-S131 PolarHBondContact O-N 3.4Å; L129-A132 WeakPolarHBondContact O-CB 3.35Å; L129-A132 PolarHBondContact O-N 2.92Å; L129-V133 HydrophobicContact CD1-CG2 4.45Å; L129-V133 WeakPolarHBondContact O-CG2 3.25Å; L129-V133 PolarHBondContact O-N 3.45Å
130	K	88.3	Confident	89.2	Confident	69 Å²	69	86.8 Å²	86.8	30%	0.3	45%	0.447	S	S	.	.	H	α-helix	trans	-57.2	-48.1	175.9	-178.3	-160.2	174.6	-168.5	0	111.5	F96 E98 S126 Q127 A132 V133 V134	F96-K130 HydrophobicContact CD1-CD 3.82Å; F96-K130 HydrophobicContact CE1-CB 4.43Å; F96-K130 HydrophobicContact CE1-CD 3.9Å; F96-K130 HydrophobicContact CE1-CG 4.09Å; E98-K130 IonicContact OE1-NZ 2.78Å; E98-K130 PolarHBondContact OE1-NZ 3.41Å; E98-K130 IonicContact OE2-NZ 2.59Å; E98-K130 PolarHBondContact OE2-NZ 3.1Å; S126-K130 PolarHBondContact O-N 3.14Å; Q127-K130 PolarHBondContact O-N 2.92Å; K130-A132 VanDerWaalsContact C-N 3.31Å; K130-A132 PolarHBondContact O-N 3.48Å; K130-V133 WeakPolarHBondContact O-CB 3.41Å; K130-V133 PolarHBondContact O-N 3.32Å; K130-V133 VanDerWaalsContact O-N 3.17Å; K130-V134 WeakPolarHBondContact O-CG2 3.23Å; K130-V134 PolarHBondContact O-N 3.42Å
131	S	89.9	Confident	89.7	Confident	65 Å²	65	85.8 Å²	85.8	46%	0.455	45%	0.445	S	S	.	.	H	α-helix	trans	-62.1	-40.2	179	-56.9	0	0	0	0	111.4	Q127 M128 L129 V134 N135	Q127-S131 WeakPolarHBondContact O-CB 3.46Å; Q127-S131 PolarHBondContact O-N 3.17Å; Q127-S131 PolarHBondContact O-OG 2.87Å; M128-S131 PolarHBondContact O-N 2.89Å; L129-S131 VanDerWaalsContact C-N 3.34Å; L129-S131 PolarHBondContact O-N 3.4Å; S131-V134 PolarHBondContact O-N 3.02Å; S131-N135 WeakPolarHBondContact O-CB 3.41Å; S131-N135 VanDerWaalsContact O-CG 3.22Å; S131-N135 PolarHBondContact O-N 3.4Å; S131-N135 PolarHBondContact O-ND2 3.25Å
132	A	91.2	Very high	90.2	Very high	46 Å²	46	80.8 Å²	80.8	38%	0.38	43%	0.43	S	S	.	.	H	α-helix	trans	-62.1	-42	173.7	0	0	0	0	0	112.1	M128 L129 K130 N135 I136	M128-A132 WeakPolarHBondContact O-CB 3.27Å; M128-A132 PolarHBondContact O-N 3.47Å; L129-A132 WeakPolarHBondContact O-CB 3.35Å; L129-A132 PolarHBondContact O-N 2.92Å; K130-A132 VanDerWaalsContact C-N 3.31Å; K130-A132 PolarHBondContact O-N 3.48Å; A132-N135 PolarHBondContact O-N 3.48Å; A132-I136 VanDerWaalsContact O-CG1 3.27Å; A132-I136 WeakPolarHBondContact O-CG1 3.38Å; A132-I136 PolarHBondContact O-N 2.75Å
133	V	92	Very high	90.4	Very high	70 Å²	70	77 Å²	77	42%	0.424	41%	0.413	S	S	.	.	H	α-helix	trans	-62	-46.5	175.9	171.2	0	0	0	0	111.4	L129 K130 N135 I136 I137	L129-V133 HydrophobicContact CD1-CG2 4.45Å; L129-V133 WeakPolarHBondContact O-CG2 3.25Å; L129-V133 PolarHBondContact O-N 3.45Å; K130-V133 WeakPolarHBondContact O-CB 3.41Å; K130-V133 PolarHBondContact O-N 3.32Å; K130-V133 VanDerWaalsContact O-N 3.17Å; V133-N135 VanDerWaalsContact C-N 3.32Å; V133-N135 PolarHBondContact O-N 2.94Å; V133-I136 PolarHBondContact O-N 3.44Å; V133-I137 HydrophobicContact CG1-CD1 4.03Å; V133-I137 WeakPolarHBondContact O-CG1 3.48Å; V133-I137 PolarHBondContact O-N 3.42Å
134	V	90.7	Very high	90.6	Very high	64 Å²	64	80 Å²	80	39%	0.388	43%	0.425	S	S	.	.	H	α-helix	trans	-60.3	-43.1	176.9	172.7	0	0	0	0	111.1	K130 S131 I136 I137 N138	K130-V134 WeakPolarHBondContact O-CG2 3.23Å; K130-V134 PolarHBondContact O-N 3.42Å; S131-V134 PolarHBondContact O-N 3.02Å; V134-I136 VanDerWaalsContact C-N 3.32Å; V134-I136 PolarHBondContact O-N 3.43Å; V134-I137 PolarHBondContact O-N 3.15Å; V134-N138 PolarHBondContact O-N 3.04Å; V134-N138 PolarHBondContact O-ND2 3.2Å
135	N	90.2	Very high	90.9	Very high	105 Å²	105	78.7 Å²	78.7	56%	0.561	42%	0.421	S	S	*	.	H	α-helix	trans	-63.4	-37	177.3	-71	-19	0	0	0	112.4	S131 A132 V133 Y139	S131-N135 WeakPolarHBondContact O-CB 3.41Å; S131-N135 VanDerWaalsContact O-CG 3.22Å; S131-N135 PolarHBondContact O-N 3.4Å; S131-N135 PolarHBondContact O-ND2 3.25Å; A132-N135 PolarHBondContact O-N 3.48Å; V133-N135 VanDerWaalsContact C-N 3.32Å; V133-N135 PolarHBondContact O-N 2.94Å; N135-Y139 WeakPolarHBondContact O-CB 3.24Å; N135-Y139 PolarHBondContact O-N 2.82Å
136	I	90.5	Very high	91.1	Very high	116 Å²	116	76 Å²	76	60%	0.595	40%	0.404	S	S	*	.	H	α-helix	trans	-65.7	-42	175.5	-70.1	163.9	0	0	0	111.1	A132 V133 V134 Y139 H140	A132-I136 VanDerWaalsContact O-CG1 3.27Å; A132-I136 WeakPolarHBondContact O-CG1 3.38Å; A132-I136 PolarHBondContact O-N 2.75Å; V133-I136 PolarHBondContact O-N 3.44Å; V134-I136 VanDerWaalsContact C-N 3.32Å; V134-I136 PolarHBondContact O-N 3.43Å; I136-Y139 PolarHBondContact O-N 2.97Å; I136-H140 WeakPolarHBondContact O-CB 3.41Å; I136-H140 PolarHBondContact O-N 3.38Å
137	I	90.5	Very high	91.2	Very high	86 Å²	86	77 Å²	77	44%	0.441	41%	0.414	S	S	.	.	H	α-helix	trans	-62.1	-51.9	176.9	-65.9	166.3	0	0	0	109.9	V133 V134 Y139 H140 D141	V133-I137 HydrophobicContact CG1-CD1 4.03Å; V133-I137 WeakPolarHBondContact O-CG1 3.48Å; V133-I137 PolarHBondContact O-N 3.42Å; V134-I137 PolarHBondContact O-N 3.15Å; I137-Y139 VanDerWaalsContact C-N 3.27Å; I137-Y139 PolarHBondContact O-N 3.01Å; I137-H140 WeakPolarHBondContact O-CB 3.23Å; I137-H140 PolarHBondContact O-N 2.95Å; I137-H140 VanDerWaalsContact O-N 3.09Å; I137-D141 PolarHBondContact O-N 3.26Å
138	N	90.6	Very high	91.5	Very high	81 Å²	81	79.9 Å²	79.9	43%	0.433	43%	0.425	S	S	.	.	H	α-helix	trans	-59	-40.3	178.5	-67.9	-21.7	0	0	0	111.9	V134 D141 D142	V134-N138 PolarHBondContact O-N 3.04Å; V134-N138 PolarHBondContact O-ND2 3.2Å; N138-D141 PolarHBondContact O-N 3.37Å; N138-D142 WeakPolarHBondContact O-CB 3.21Å; N138-D142 PolarHBondContact O-N 2.72Å
139	Y	91.4	Very high	91.8	Very high	98 Å²	98	76 Å²	76	38%	0.384	41%	0.412	S	S	.	.	H	α-helix	trans	-61.9	-43.2	176.2	-174.3	-83.3	0	0	0	112	N135 I136 I137 A143 D179 A180 I183	N135-Y139 WeakPolarHBondContact O-CB 3.24Å; N135-Y139 PolarHBondContact O-N 2.82Å; I136-Y139 PolarHBondContact O-N 2.97Å; I137-Y139 VanDerWaalsContact C-N 3.27Å; I137-Y139 PolarHBondContact O-N 3.01Å; Y139-A143 WeakPolarHBondContact O-CB 3Å; Y139-A143 PolarHBondContact O-N 2.76Å; Y139-D179 HydrophobicContact CE2-CB 3.98Å; Y139-D179 PolarHBondContact OH-O 3.06Å; Y139-A180 HydrophobicContact CD1-CB 4.23Å; Y139-A180 HydrophobicContact CD2-CB 3.71Å; Y139-A180 HydrophobicContact CE1-CB 4.23Å; Y139-A180 HydrophobicContact CE2-CB 3.72Å; Y139-A180 HydrophobicContact CG-CB 3.96Å; Y139-A180 VanDerWaalsContact O-CB 3.28Å; Y139-A180 WeakPolarHBondContact O-CB 3.37Å; Y139-I183 WeakPolarHBondContact OH-CD1 3.34Å
140	H	89.3	Confident	92	Very high	111 Å²	111	71 Å²	71	51%	0.514	39%	0.387	S	S	.	.	H	α-helix	trans	-64.8	-46.5	176.9	-179.5	-81.6	0	0	0	111.4	I136 I137 A143 E144	I136-H140 WeakPolarHBondContact O-CB 3.41Å; I136-H140 PolarHBondContact O-N 3.38Å; I137-H140 WeakPolarHBondContact O-CB 3.23Å; I137-H140 PolarHBondContact O-N 2.95Å; I137-H140 VanDerWaalsContact O-N 3.09Å; H140-A143 PolarHBondContact O-N 3.06Å; H140-E144 IonicContact CE1-OE2 3.27Å; H140-E144 PolarHBondContact CE1-OE2 2.98Å; H140-E144 IonicContact ND1-OE2 2.74Å; H140-E144 WeakPolarHBondContact O-CB 3.39Å; H140-E144 PolarHBondContact O-N 3.27Å
141	D	92.3	Very high	92.5	Very high	73 Å²	73	71.9 Å²	71.9	39%	0.39	40%	0.399	S	S	.	.	H	α-helix	trans	-63.6	-44.6	-178.7	-69.6	-11.3	0	0	0	111.7	I137 N138 A143 E144 L145	I137-D141 PolarHBondContact O-N 3.26Å; N138-D141 PolarHBondContact O-N 3.37Å; D141-A143 VanDerWaalsContact C-N 3.34Å; D141-A143 PolarHBondContact O-N 3.21Å; D141-E144 PolarHBondContact O-N 3.38Å; D141-L145 WeakPolarHBondContact O-CB 3.17Å; D141-L145 VanDerWaalsContact O-CG 3.23Å; D141-L145 WeakPolarHBondContact O-CG 3.45Å; D141-L145 PolarHBondContact O-N 3.13Å
142	D	92.4	Very high	92.8	Very high	48 Å²	48	73.4 Å²	73.4	26%	0.257	40%	0.399	S	S	.	.	H	α-helix	trans	-61	-41.7	176.5	-80.4	-12.8	0	0	0	111.7	N138 T146 R178 A180	N138-D142 WeakPolarHBondContact O-CB 3.21Å; N138-D142 PolarHBondContact O-N 2.72Å; D142-T146 WeakPolarHBondContact O-CB 3.02Å; D142-T146 PolarHBondContact O-N 3.14Å; D142-T146 PolarHBondContact O-OG1 3.36Å; D142-R178 IonicContact OD2-CZ 2.67Å; D142-R178 IonicContact OD2-NH2 3.87Å; D142-R178 PolarHBondContact OD2-NH2 2.89Å; D142-A180 HydrophobicContact CB-CB 3.87Å
143	A	91.6	Very high	93.1	Very high	23 Å²	23	72 Å²	72	19%	0.19	39%	0.385	C	S	.	.	H	α-helix	trans	-66	-43	177	0	0	0	0	0	111.9	Y139 H140 D141 T146 A147 A180 A184	Y139-A143 WeakPolarHBondContact O-CB 3Å; Y139-A143 PolarHBondContact O-N 2.76Å; H140-A143 PolarHBondContact O-N 3.06Å; D141-A143 VanDerWaalsContact C-N 3.34Å; D141-A143 PolarHBondContact O-N 3.21Å; A143-T146 PolarHBondContact O-N 3.48Å; A143-A147 WeakPolarHBondContact O-CB 3.42Å; A143-A147 PolarHBondContact O-N 3.24Å; A143-A180 HydrophobicContact CB-CB 4.14Å; A143-A184 WeakPolarHBondContact O-CB 3.23Å
144	E	92.9	Very high	93.4	Very high	79 Å²	79	70.6 Å²	70.6	37%	0.369	38%	0.375	S	S	.	.	H	α-helix	trans	-68.5	-44.5	179.7	-171.3	-176.9	160.1	0	0	111.9	H140 D141 T146 A147 K148	H140-E144 IonicContact CE1-OE2 3.27Å; H140-E144 PolarHBondContact CE1-OE2 2.98Å; H140-E144 IonicContact ND1-OE2 2.74Å; H140-E144 WeakPolarHBondContact O-CB 3.39Å; H140-E144 PolarHBondContact O-N 3.27Å; D141-E144 PolarHBondContact O-N 3.38Å; E144-T146 VanDerWaalsContact C-N 3.29Å; E144-T146 PolarHBondContact O-N 2.73Å; E144-A147 PolarHBondContact O-N 3.08Å; E144-K148 WeakPolarHBondContact O-CG 3.43Å; E144-K148 PolarHBondContact O-N 3.45Å; E144-K148 WeakPolarHBondContact OE1-CE 3.47Å; E144-K148 IonicContact OE1-NZ 2.82Å; E144-K148 PolarHBondContact OE1-NZ 3.46Å
145	L	93.8	Very high	93.7	Very high	111 Å²	111	73.7 Å²	73.7	58%	0.581	38%	0.383	S	S	*	.	H	α-helix	trans	-59	-43.3	175.2	-74	172.4	0	0	0	111	D141 K148 A149	D141-L145 WeakPolarHBondContact O-CB 3.17Å; D141-L145 VanDerWaalsContact O-CG 3.23Å; D141-L145 WeakPolarHBondContact O-CG 3.45Å; D141-L145 PolarHBondContact O-N 3.13Å; L145-K148 PolarHBondContact O-N 3.01Å; L145-A149 PolarHBondContact O-N 3.15Å; L145-A149 VanDerWaalsContact O-N 3.12Å
146	T	94.1	Very high	94	Very high	9 Å²	9	71.2 Å²	71.2	6%	0.055	37%	0.369	C	S	.	.	H	α-helix	trans	-63.1	-47	175.5	-61.6	0	0	0	0	111.3	D142 A143 E144 K148 A149 I150 E181 A184 L185	D142-T146 WeakPolarHBondContact O-CB 3.02Å; D142-T146 PolarHBondContact O-N 3.14Å; D142-T146 PolarHBondContact O-OG1 3.36Å; A143-T146 PolarHBondContact O-N 3.48Å; E144-T146 VanDerWaalsContact C-N 3.29Å; E144-T146 PolarHBondContact O-N 2.73Å; T146-K148 PolarHBondContact O-N 2.78Å; T146-A149 PolarHBondContact O-N 3.24Å; T146-I150 WeakPolarHBondContact O-CG1 3.21Å; T146-I150 PolarHBondContact O-N 3.48Å; T146-I150 VanDerWaalsContact O-N 3.12Å; T146-E181 HydrophobicContact CG2-CB 3.99Å; T146-E181 HydrophobicContact CG2-CG 4.39Å; T146-E181 WeakPolarHBondContact OG1-CB 3.12Å; T146-E181 WeakPolarHBondContact OG1-CG 3.29Å; T146-A184 HydrophobicContact CG2-CB 3.97Å; T146-L185 HydrophobicContact CG2-CD2 3.79Å; T146-L185 HydrophobicContact CG2-CG 4.08Å
147	A	93.3	Very high	94.3	Very high	49 Å²	49	66.1 Å²	66.1	41%	0.405	34%	0.343	S	S	.	.	H	α-helix	trans	-57.1	-37.9	178	0	0	0	0	0	112.4	A143 E144 A184	A143-A147 WeakPolarHBondContact O-CB 3.42Å; A143-A147 PolarHBondContact O-N 3.24Å; E144-A147 PolarHBondContact O-N 3.08Å; A147-A184 HydrophobicContact CB-CB 4.36Å
148	K	95.2	Very high	94.5	Very high	136 Å²	136	66.2 Å²	66.2	59%	0.591	35%	0.352	S	S	*	.	H	α-helix	trans	-69.3	-29.6	175.1	-71.5	172.9	-176.2	166.2	0	113.4	E144 L145 T146 P151	E144-K148 WeakPolarHBondContact O-CG 3.43Å; E144-K148 PolarHBondContact O-N 3.45Å; E144-K148 WeakPolarHBondContact OE1-CE 3.47Å; E144-K148 IonicContact OE1-NZ 2.82Å; E144-K148 PolarHBondContact OE1-NZ 3.46Å; L145-K148 PolarHBondContact O-N 3.01Å; T146-K148 PolarHBondContact O-N 2.78Å; K148-P151 WeakPolarHBondContact O-CD 3.4Å
149	A	95.3	Very high	94.7	Very high	42 Å²	42	65.2 Å²	65.2	35%	0.347	35%	0.346	S	S	.	.	H	α-helix	trans	-80.6	-22.1	178.8	0	0	0	0	0	113.7	L145 T146 E152 L153	L145-A149 PolarHBondContact O-N 3.15Å; L145-A149 VanDerWaalsContact O-N 3.12Å; T146-A149 PolarHBondContact O-N 3.24Å; A149-E152 PolarHBondContact O-N 2.73Å; A149-L153 HydrophobicContact CB-CD1 4.38Å; A149-L153 WeakPolarHBondContact O-CG 3.28Å; A149-L153 PolarHBondContact O-N 2.68Å; A149-L153 VanDerWaalsContact O-N 3.11Å
150	I	97.2	Very high	94.7	Very high	11 Å²	11	67 Å²	67	6%	0.056	37%	0.367	C	S	.	.	H	α-helix	trans	-51.3	-47.3	-176	-75.1	172.5	0	0	0	114	T146 E152 L153 I154 A184 L185 S188 L191	T146-I150 WeakPolarHBondContact O-CG1 3.21Å; T146-I150 PolarHBondContact O-N 3.48Å; T146-I150 VanDerWaalsContact O-N 3.12Å; I150-E152 VanDerWaalsContact C-N 3.31Å; I150-E152 PolarHBondContact O-N 2.59Å; I150-L153 PolarHBondContact O-N 3.4Å; I150-L153 VanDerWaalsContact O-N 3.16Å; I150-I154 HydrophobicContact CG2-CD1 3.69Å; I150-I154 HydrophobicContact CG2-CG1 4.24Å; I150-I154 WeakPolarHBondContact O-CG1 3.38Å; I150-I154 PolarHBondContact O-N 2.97Å; I150-A184 WeakPolarHBondContact CD1-O 3.41Å; I150-L185 HydrophobicContact CD1-CD2 4.24Å; I150-L185 HydrophobicContact CG1-CD2 4.03Å; I150-S188 WeakPolarHBondContact CG2-OG 3.26Å; I150-L191 HydrophobicContact CG1-CD2 4.33Å; I150-L191 HydrophobicContact CG2-CB 4.03Å; I150-L191 HydrophobicContact CG2-CD1 4.47Å
151	P	97.2	Very high	95	Very high	86 Å²	86	65.4 Å²	65.4	56%	0.558	36%	0.362	S	S	*	.	H	α-helix	trans	-59.1	-38.6	-178.8	-26.3	36	0	0	0	113.7	K148 K155	K148-P151 WeakPolarHBondContact O-CD 3.4Å; P151-K155 PolarHBondContact O-N 3.04Å
152	E	97.4	Very high	95	Very high	97 Å²	97	66.2 Å²	66.2	45%	0.453	36%	0.364	S	S	.	.	H	α-helix	trans	-73	-38.3	177.1	-167.9	62.1	-158.6	0	0	110.9	A149 I150 I154 K155 L156	A149-E152 PolarHBondContact O-N 2.73Å; I150-E152 VanDerWaalsContact C-N 3.31Å; I150-E152 PolarHBondContact O-N 2.59Å; E152-I154 VanDerWaalsContact C-N 3.31Å; E152-I154 PolarHBondContact O-N 2.95Å; E152-K155 WeakPolarHBondContact O-CB 3.36Å; E152-K155 PolarHBondContact O-N 2.65Å; E152-K155 VanDerWaalsContact O-N 3.15Å; E152-K155 IonicContact OE1-NZ 3.76Å; E152-K155 PolarHBondContact OE1-NZ 3.47Å; E152-K155 IonicContact OE2-NZ 2.67Å; E152-L156 HydrophobicContact CG-CD1 4.48Å; E152-L156 WeakPolarHBondContact O-CG 3.45Å; E152-L156 PolarHBondContact O-N 3.49Å
153	L	97.3	Very high	95	Very high	16 Å²	16	67.9 Å²	67.9	8%	0.084	38%	0.376	C	S	.	.	H	α-helix	trans	-60.7	-38.9	174.4	-67.6	171.9	0	0	0	112.2	A149 I150 K155 L156 L157 V171 I172 L175 L191	A149-L153 HydrophobicContact CB-CD1 4.38Å; A149-L153 WeakPolarHBondContact O-CG 3.28Å; A149-L153 PolarHBondContact O-N 2.68Å; A149-L153 VanDerWaalsContact O-N 3.11Å; I150-L153 PolarHBondContact O-N 3.4Å; I150-L153 VanDerWaalsContact O-N 3.16Å; L153-K155 VanDerWaalsContact C-N 3.34Å; L153-L156 PolarHBondContact O-N 3.24Å; L153-L157 WeakPolarHBondContact O-CG 3.23Å; L153-L157 PolarHBondContact O-N 2.84Å; L153-V171 HydrophobicContact CD2-CG1 4.18Å; L153-I172 HydrophobicContact CB-CD1 4.2Å; L153-I172 HydrophobicContact CB-CG1 4.25Å; L153-I172 HydrophobicContact CD1-CG1 4.07Å; L153-I172 HydrophobicContact CD2-CG1 4.23Å; L153-I172 HydrophobicContact CG-CG1 4.42Å; L153-L175 HydrophobicContact CD1-CD1 4.08Å; L153-L191 HydrophobicContact CB-CD1 4.4Å
154	I	97.7	Very high	95.2	Very high	41 Å²	41	69 Å²	69	21%	0.21	38%	0.38	C	S	.	.	H	α-helix	trans	-60.9	-44.3	173.9	-70.8	167.7	0	0	0	110.9	I150 E152 L157 S158 D190 L191 A194	I150-I154 HydrophobicContact CG2-CD1 3.69Å; I150-I154 HydrophobicContact CG2-CG1 4.24Å; I150-I154 WeakPolarHBondContact O-CG1 3.38Å; I150-I154 PolarHBondContact O-N 2.97Å; E152-I154 VanDerWaalsContact C-N 3.31Å; E152-I154 PolarHBondContact O-N 2.95Å; I154-L157 PolarHBondContact O-N 3.42Å; I154-S158 PolarHBondContact O-N 3.31Å; I154-S158 PolarHBondContact O-OG 3.31Å; I154-S158 VanDerWaalsContact O-OG 3.13Å; I154-D190 HydrophobicContact CD1-CB 3.85Å; I154-L191 HydrophobicContact CD1-CB 4.16Å; I154-L191 HydrophobicContact CG1-CB 4.1Å; I154-L191 HydrophobicContact CG1-CD1 3.77Å; I154-A194 HydrophobicContact CG1-CB 4.39Å; I154-A194 HydrophobicContact CG2-CB 4.15Å
155	K	96.8	Very high	95.3	Very high	129 Å²	129	65.4 Å²	65.4	56%	0.561	36%	0.363	S	S	*	.	H	α-helix	trans	-63.3	-44.5	178.4	-176.5	-175.7	166.4	-155.5	0	111.3	P151 E152 L153 L157 S158 D159	P151-K155 PolarHBondContact O-N 3.04Å; E152-K155 WeakPolarHBondContact O-CB 3.36Å; E152-K155 PolarHBondContact O-N 2.65Å; E152-K155 VanDerWaalsContact O-N 3.15Å; E152-K155 IonicContact OE1-NZ 3.76Å; E152-K155 PolarHBondContact OE1-NZ 3.47Å; E152-K155 IonicContact OE2-NZ 2.67Å; L153-K155 VanDerWaalsContact C-N 3.34Å; K155-L157 VanDerWaalsContact C-N 3.34Å; K155-L157 PolarHBondContact O-N 3.02Å; K155-S158 CarbonylContact O-C 3.35Å; K155-S158 PolarHBondContact O-N 2.93Å; K155-D159 PolarHBondContact O-N 3.21Å
156	L	97.3	Very high	95.4	Very high	53 Å²	53	62.4 Å²	62.4	28%	0.277	35%	0.346	S	S	.	.	H	α-helix	trans	-65.5	-33.5	177.3	-64.5	172.5	0	0	0	112.9	E152 L153 S158 D159 V164 A168	E152-L156 HydrophobicContact CG-CD1 4.48Å; E152-L156 WeakPolarHBondContact O-CG 3.45Å; E152-L156 PolarHBondContact O-N 3.49Å; L153-L156 PolarHBondContact O-N 3.24Å; L156-S158 PolarHBondContact O-N 2.91Å; L156-D159 WeakPolarHBondContact O-CB 3.28Å; L156-D159 PolarHBondContact O-N 3.49Å; L156-V164 HydrophobicContact CB-CG1 4.3Å; L156-V164 HydrophobicContact CD2-CG1 3.77Å; L156-A168 HydrophobicContact CB-CB 3.67Å
157	L	96.7	Very high	95.5	Very high	10 Å²	10	66.6 Å²	66.6	5%	0.052	37%	0.365	C	S	.	.	H	α-helix	trans	-66.7	-19.3	172	-80.4	179.3	0	0	0	113.5	L153 I154 K155 V165 A168 A169 I172 L191 A194 V195 A198	L153-L157 WeakPolarHBondContact O-CG 3.23Å; L153-L157 PolarHBondContact O-N 2.84Å; I154-L157 PolarHBondContact O-N 3.42Å; K155-L157 VanDerWaalsContact C-N 3.34Å; K155-L157 PolarHBondContact O-N 3.02Å; L157-V165 HydrophobicContact CD2-CG1 4.38Å; L157-A168 HydrophobicContact CD2-CB 4.12Å; L157-A168 HydrophobicContact CG-CB 4.28Å; L157-A169 HydrophobicContact CD2-CB 4.05Å; L157-I172 HydrophobicContact CD1-CD1 3.44Å; L157-I172 VanDerWaalsContact CD1-CD1 3.44Å; L157-I172 HydrophobicContact CD2-CD1 4.08Å; L157-I172 HydrophobicContact CG-CD1 3.72Å; L157-L191 HydrophobicContact CD1-CD1 4.32Å; L157-A194 HydrophobicContact CB-CB 4.36Å; L157-A194 HydrophobicContact CD1-CB 3.87Å; L157-V195 HydrophobicContact CD1-CG2 3.72Å; L157-A198 HydrophobicContact CD2-CB 4.33Å
158	S	93.9	Very high	95.7	Very high	88 Å²	88	64.5 Å²	64.5	62%	0.615	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	12.7	179.2	-51.1	0	0	0	0	112.4	I154 K155 L156	I154-S158 PolarHBondContact O-N 3.31Å; I154-S158 PolarHBondContact O-OG 3.31Å; I154-S158 VanDerWaalsContact O-OG 3.13Å; K155-S158 CarbonylContact O-C 3.35Å; K155-S158 PolarHBondContact O-N 2.93Å; L156-S158 PolarHBondContact O-N 2.91Å
159	D	95.6	Very high	95.8	Very high	59 Å²	59	58.2 Å²	58.2	32%	0.316	32%	0.321	S	S	.	.			trans	-67.3	154.9	179	-158.2	-76.1	0	0	0	111.4	K155 L156 D161 V164 V165	K155-D159 PolarHBondContact O-N 3.21Å; L156-D159 WeakPolarHBondContact O-CB 3.28Å; L156-D159 PolarHBondContact O-N 3.49Å; D159-D161 PolarHBondContact OD1-N 3.5Å; D159-V164 HydrophobicContact CB-CB 4.12Å; D159-V164 HydrophobicContact CB-CG1 3.86Å; D159-V165 HydrophobicContact CB-CG2 4.25Å; D159-V165 WeakPolarHBondContact O-CG2 3.39Å
160	V	92.3	Very high	95.9	Very high	135 Å²	135	58.6 Å²	58.6	82%	0.818	32%	0.316	S	S	*	.	S	Bend	trans	-73	-32.5	176.5	-66.9	0	0	0	0	111.4	Q162	V160-Q162 PolarHBondContact O-N 3.15Å; V160-Q162 PolarHBondContact O-NE2 3.23Å
161	D	93.9	Very high	95.9	Very high	79 Å²	79	61.1 Å²	61.1	42%	0.422	33%	0.332	S	S	.	.			trans	-79.8	114.2	177.8	-172.8	-11.6	0	0	0	110.7	D159 V163 V164 V165	D159-D161 PolarHBondContact OD1-N 3.5Å; D161-V163 PolarHBondContact O-N 3.16Å; D161-V163 WeakPolarHBondContact OD1-CB 3.42Å; D161-V163 PolarHBondContact OD1-N 3.45Å; D161-V164 HydrophobicContact CB-CB 4.24Å; D161-V164 HydrophobicContact CB-CG2 3.86Å; D161-V164 WeakPolarHBondContact O-CB 3.38Å; D161-V164 PolarHBondContact O-N 3.18Å; D161-V165 PolarHBondContact O-N 3.2Å; D161-V165 VanDerWaalsContact O-N 3.13Å
162	Q	92.4	Very high	95.9	Very high	90 Å²	90	57 Å²	57	42%	0.421	31%	0.306	S	S	.	.	H	α-helix	trans	-65.9	-23.1	-178.3	-57.6	-50.2	-62	0	0	113	V160 Q166 N202	V160-Q162 PolarHBondContact O-N 3.15Å; V160-Q162 PolarHBondContact O-NE2 3.23Å; Q162-Q166 WeakPolarHBondContact O-CB 3.45Å; Q162-Q166 PolarHBondContact O-N 3.07Å; Q162-N202 PolarHBondContact OE1-ND2 2.93Å
163	V	93.6	Very high	95.9	Very high	83 Å²	83	52.8 Å²	52.8	50%	0.503	29%	0.286	S	S	.	.	H	α-helix	trans	-67.6	-41.8	172.5	-179	0	0	0	0	110	D161 Q166 Q167	D161-V163 PolarHBondContact O-N 3.16Å; D161-V163 WeakPolarHBondContact OD1-CB 3.42Å; D161-V163 PolarHBondContact OD1-N 3.45Å; V163-Q166 PolarHBondContact O-N 3.06Å; V163-Q167 VanDerWaalsContact O-CG 3.3Å; V163-Q167 WeakPolarHBondContact O-CG 3.44Å; V163-Q167 PolarHBondContact O-N 3.27Å
164	V	95.5	Very high	95.9	Very high	45 Å²	45	56.6 Å²	56.6	27%	0.273	30%	0.303	S	S	.	.	H	α-helix	trans	-63.6	-44.9	176.6	176.8	0	0	0	0	110.5	L156 D159 D161 Q166 Q167 A168	L156-V164 HydrophobicContact CB-CG1 4.3Å; L156-V164 HydrophobicContact CD2-CG1 3.77Å; D159-V164 HydrophobicContact CB-CB 4.12Å; D159-V164 HydrophobicContact CB-CG1 3.86Å; D161-V164 HydrophobicContact CB-CB 4.24Å; D161-V164 HydrophobicContact CB-CG2 3.86Å; D161-V164 WeakPolarHBondContact O-CB 3.38Å; D161-V164 PolarHBondContact O-N 3.18Å; V164-Q166 VanDerWaalsContact C-N 3.34Å; V164-Q166 PolarHBondContact O-N 3.32Å; V164-Q167 PolarHBondContact O-N 3.27Å; V164-A168 WeakPolarHBondContact O-CB 3.31Å; V164-A168 PolarHBondContact O-N 3.08Å
165	V	95.8	Very high	95.8	Very high	4 Å²	4	56.6 Å²	56.6	2%	0.024	30%	0.303	C	S	.	.	H	α-helix	trans	-59.1	-44.7	176.2	179	0	0	0	0	111.3	L157 D159 D161 A168 A169 A198 L207	L157-V165 HydrophobicContact CD2-CG1 4.38Å; D159-V165 HydrophobicContact CB-CG2 4.25Å; D159-V165 WeakPolarHBondContact O-CG2 3.39Å; D161-V165 PolarHBondContact O-N 3.2Å; D161-V165 VanDerWaalsContact O-N 3.13Å; V165-A168 PolarHBondContact O-N 3.1Å; V165-A169 WeakPolarHBondContact O-CB 3.43Å; V165-A169 PolarHBondContact O-N 3.15Å; V165-A198 HydrophobicContact CG1-CB 4.33Å; V165-L207 HydrophobicContact CG1-CD1 4.09Å; V165-L207 HydrophobicContact CG1-CD2 3.91Å
166	Q	94.9	Very high	95.8	Very high	49 Å²	49	50.4 Å²	50.4	23%	0.229	28%	0.276	C	S	.	.	H	α-helix	trans	-62.2	-44.8	177.2	-173	-173.7	3.6	0	0	111.9	Q162 V163 V164 A169 M170 E204 L207	Q162-Q166 WeakPolarHBondContact O-CB 3.45Å; Q162-Q166 PolarHBondContact O-N 3.07Å; V163-Q166 PolarHBondContact O-N 3.06Å; V164-Q166 VanDerWaalsContact C-N 3.34Å; V164-Q166 PolarHBondContact O-N 3.32Å; Q166-A169 PolarHBondContact O-N 3.28Å; Q166-M170 WeakPolarHBondContact O-CB 3.45Å; Q166-M170 PolarHBondContact O-N 3.2Å; Q166-E204 PolarHBondContact NE2-OE2 3.46Å; Q166-L207 HydrophobicContact CG-CB 4.36Å
167	Q	96.1	Very high	95.7	Very high	97 Å²	97	53.4 Å²	53.4	45%	0.453	29%	0.287	S	S	.	.	H	α-helix	trans	-64.4	-41.7	177.1	-68.9	-60.9	-28.3	0	0	111.8	V163 V164 M170 V171	V163-Q167 VanDerWaalsContact O-CG 3.3Å; V163-Q167 WeakPolarHBondContact O-CG 3.44Å; V163-Q167 PolarHBondContact O-N 3.27Å; V164-Q167 PolarHBondContact O-N 3.27Å; Q167-M170 WeakPolarHBondContact O-CB 3.44Å; Q167-M170 PolarHBondContact O-N 3.33Å; Q167-V171 WeakPolarHBondContact O-CG2 3.49Å; Q167-V171 PolarHBondContact O-N 3.45Å
168	A	96.8	Very high	95.6	Very high	5 Å²	5	59.4 Å²	59.4	4%	0.041	31%	0.309	C	S	.	.	H	α-helix	trans	-60.3	-47.4	175.2	0	0	0	0	0	111.4	L156 L157 V164 V165 M170 V171 I172	L156-A168 HydrophobicContact CB-CB 3.67Å; L157-A168 HydrophobicContact CD2-CB 4.12Å; L157-A168 HydrophobicContact CG-CB 4.28Å; V164-A168 WeakPolarHBondContact O-CB 3.31Å; V164-A168 PolarHBondContact O-N 3.08Å; V165-A168 PolarHBondContact O-N 3.1Å; A168-M170 VanDerWaalsContact C-N 3.32Å; A168-M170 PolarHBondContact O-N 3.45Å; A168-V171 PolarHBondContact O-N 2.63Å; A168-I172 WeakPolarHBondContact O-CD1 3.21Å; A168-I172 VanDerWaalsContact O-CG1 3.25Å; A168-I172 WeakPolarHBondContact O-CG1 3.5Å; A168-I172 PolarHBondContact O-N 3.15Å
169	A	97.4	Very high	95.4	Very high	3 Å²	3	59.8 Å²	59.8	3%	0.025	30%	0.304	C	S	.	.	H	α-helix	trans	-61.9	-38.7	176.5	0	0	0	0	0	112.7	L157 V165 Q166 H173 L207	L157-A169 HydrophobicContact CD2-CB 4.05Å; V165-A169 WeakPolarHBondContact O-CB 3.43Å; V165-A169 PolarHBondContact O-N 3.15Å; Q166-A169 PolarHBondContact O-N 3.28Å; A169-H173 VanDerWaalsContact O-CB 3.3Å; A169-H173 WeakPolarHBondContact O-CB 3.43Å; A169-H173 PolarHBondContact O-N 2.83Å; A169-L207 HydrophobicContact CB-CD1 3.21Å
170	M	97.1	Very high	95.1	Very high	51 Å²	51	57.1 Å²	57.1	25%	0.251	29%	0.29	S	S	.	.	H	α-helix	trans	-61.4	-47.4	174	-177	-172.7	72.4	0	0	111.3	Q166 Q167 A168 H173 H174 Y210	Q166-M170 WeakPolarHBondContact O-CB 3.45Å; Q166-M170 PolarHBondContact O-N 3.2Å; Q167-M170 WeakPolarHBondContact O-CB 3.44Å; Q167-M170 PolarHBondContact O-N 3.33Å; A168-M170 VanDerWaalsContact C-N 3.32Å; A168-M170 PolarHBondContact O-N 3.45Å; M170-H173 PolarHBondContact O-N 3.23Å; M170-H174 PolarHBondContact O-N 3.36Å; M170-H174 PolarHBondContact O-ND1 2.83Å; M170-Y210 HydrophobicContact CB-CD2 3.85Å; M170-Y210 HydrophobicContact CB-CE2 3.81Å; M170-Y210 HydrophobicContact CB-CG 4.29Å; M170-Y210 HydrophobicContact CG-CD2 4.36Å; M170-Y210 HydrophobicContact CG-CE1 4.16Å; M170-Y210 HydrophobicContact CG-CE2 3.94Å
171	V	97.3	Very high	95.3	Very high	64 Å²	64	51 Å²	51	39%	0.388	25%	0.253	S	S	.	.	H	α-helix	trans	-61.2	-48.5	178.5	171.1	0	0	0	0	110.7	L153 Q167 A168 H173 H174 L175	L153-V171 HydrophobicContact CD2-CG1 4.18Å; Q167-V171 WeakPolarHBondContact O-CG2 3.49Å; Q167-V171 PolarHBondContact O-N 3.45Å; A168-V171 PolarHBondContact O-N 2.63Å; V171-H173 VanDerWaalsContact C-N 3.27Å; V171-H173 PolarHBondContact O-N 3.32Å; V171-H174 PolarHBondContact O-N 3.47Å; V171-H174 VanDerWaalsContact O-N 3.12Å; V171-L175 HydrophobicContact CG1-CD1 4.09Å; V171-L175 HydrophobicContact CG1-CG 4.46Å; V171-L175 WeakPolarHBondContact O-CG 3.49Å; V171-L175 PolarHBondContact O-N 3.49Å
172	I	97.8	Very high	95.3	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-58.3	-42.3	177.1	-65.2	161.9	0	0	0	110.7	L153 L157 A168 H174 L175 S176 L185 L191 T214	L153-I172 HydrophobicContact CB-CD1 4.2Å; L153-I172 HydrophobicContact CB-CG1 4.25Å; L153-I172 HydrophobicContact CD1-CG1 4.07Å; L153-I172 HydrophobicContact CD2-CG1 4.23Å; L153-I172 HydrophobicContact CG-CG1 4.42Å; L157-I172 HydrophobicContact CD1-CD1 3.44Å; L157-I172 VanDerWaalsContact CD1-CD1 3.44Å; L157-I172 HydrophobicContact CD2-CD1 4.08Å; L157-I172 HydrophobicContact CG-CD1 3.72Å; A168-I172 WeakPolarHBondContact O-CD1 3.21Å; A168-I172 VanDerWaalsContact O-CG1 3.25Å; A168-I172 WeakPolarHBondContact O-CG1 3.5Å; A168-I172 PolarHBondContact O-N 3.15Å; I172-H174 PolarHBondContact O-N 3.18Å; I172-L175 PolarHBondContact O-N 3.26Å; I172-S176 WeakPolarHBondContact O-CB 3.48Å; I172-S176 PolarHBondContact O-N 3.1Å; I172-L185 HydrophobicContact CG2-CD1 4.35Å; I172-L191 HydrophobicContact CD1-CD1 4Å; I172-T214 HydrophobicContact CG2-CG2 3.64Å
173	H	97.4	Very high	95.3	Very high	8 Å²	8	45.3 Å²	45.3	4%	0.037	23%	0.225	C	C	.	.	H	α-helix	trans	-62.2	-42	177.2	-179	64.6	0	0	0	112.2	A169 M170 V171 S176 K177 Y210 T214	A169-H173 VanDerWaalsContact O-CB 3.3Å; A169-H173 WeakPolarHBondContact O-CB 3.43Å; A169-H173 PolarHBondContact O-N 2.83Å; M170-H173 PolarHBondContact O-N 3.23Å; V171-H173 VanDerWaalsContact C-N 3.27Å; V171-H173 PolarHBondContact O-N 3.32Å; H173-S176 PolarHBondContact O-N 3.48Å; H173-S176 PolarHBondContact O-OG 3.14Å; H173-K177 WeakPolarHBondContact NE2-CE 3.16Å; H173-K177 PolarHBondContact NE2-NZ 3.32Å; H173-Y210 HydrophobicContact CB-CD1 4.12Å; H173-Y210 HydrophobicContact CB-CG 4.42Å; H173-Y210 AromaticContact CD2-CD1 3.7Å; H173-Y210 AromaticContact CG-CD1 4Å; H173-Y210 PolarHBondContact ND1-O 3.19Å; H173-T214 VanDerWaalsContact CA-OG1 3.27Å; H173-T214 WeakPolarHBondContact CA-OG1 3.24Å; H173-T214 PolarHBondContact N-OG1 3.26Å; H173-T214 PolarHBondContact ND1-N 3.19Å
174	H	97	Very high	95.3	Very high	96 Å²	96	41.9 Å²	41.9	44%	0.444	21%	0.205	S	C	.	.	H	α-helix	trans	-64.1	-44.2	175.9	-74.6	89.7	0	0	0	112.2	M170 V171 I172 S176 K177	M170-H174 PolarHBondContact O-N 3.36Å; M170-H174 PolarHBondContact O-ND1 2.83Å; V171-H174 PolarHBondContact O-N 3.47Å; V171-H174 VanDerWaalsContact O-N 3.12Å; I172-H174 PolarHBondContact O-N 3.18Å; H174-S176 VanDerWaalsContact C-N 3.3Å; H174-S176 PolarHBondContact O-N 3.49Å; H174-K177 WeakPolarHBondContact O-CB 3.36Å; H174-K177 PolarHBondContact O-N 3.47Å
175	L	96.2	Very high	95.4	Very high	40 Å²	40	39.8 Å²	39.8	21%	0.209	19%	0.192	C	C	.	.	H	α-helix	trans	-59.5	-41.3	175.1	-66.8	173.6	0	0	0	111.3	L153 V171 I172 K177 R178 E181 L185	L153-L175 HydrophobicContact CD1-CD1 4.08Å; V171-L175 HydrophobicContact CG1-CD1 4.09Å; V171-L175 HydrophobicContact CG1-CG 4.46Å; V171-L175 WeakPolarHBondContact O-CG 3.49Å; V171-L175 PolarHBondContact O-N 3.49Å; I172-L175 PolarHBondContact O-N 3.26Å; L175-K177 PolarHBondContact O-N 3.25Å; L175-R178 PolarHBondContact O-N 2.86Å; L175-R178 VanDerWaalsContact O-N 3.08Å; L175-E181 HydrophobicContact CB-CB 4.2Å; L175-E181 HydrophobicContact CD2-CG 4.22Å; L175-E181 WeakPolarHBondContact O-CB 3.41Å; L175-L185 HydrophobicContact CB-CD1 3.93Å
176	S	96.7	Very high	95.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-8.7	179.7	77.3	0	0	0	0	115.3	I172 H173 H174 L182 N217	I172-S176 WeakPolarHBondContact O-CB 3.48Å; I172-S176 PolarHBondContact O-N 3.1Å; H173-S176 PolarHBondContact O-N 3.48Å; H173-S176 PolarHBondContact O-OG 3.14Å; H174-S176 VanDerWaalsContact C-N 3.3Å; H174-S176 PolarHBondContact O-N 3.49Å; S176-L182 WeakPolarHBondContact O-CD1 3.28Å; S176-N217 WeakPolarHBondContact O-CB 3.12Å; S176-N217 PolarHBondContact OG-ND2 3.21Å
177	K	95.2	Very high	95.3	Very high	116 Å²	116	44.2 Å²	44.2	50%	0.504	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-14.5	175.6	-67.4	178.2	-177.4	172.4	0	113.4	H173 H174 L175	H173-K177 WeakPolarHBondContact NE2-CE 3.16Å; H173-K177 PolarHBondContact NE2-NZ 3.32Å; H174-K177 WeakPolarHBondContact O-CB 3.36Å; H174-K177 PolarHBondContact O-N 3.47Å; L175-K177 PolarHBondContact O-N 3.25Å
178	R	93.6	Very high	95.3	Very high	135 Å²	135	40.4 Å²	40.4	51%	0.509	20%	0.195	S	C	.	.	S	Bend	trans	-106	135.1	-178.9	-62.3	176.1	62	168.6	-6.4	109.6	D142 L175 A180 E181 L182	D142-R178 IonicContact OD2-CZ 2.67Å; D142-R178 IonicContact OD2-NH2 3.87Å; D142-R178 PolarHBondContact OD2-NH2 2.89Å; L175-R178 PolarHBondContact O-N 2.86Å; L175-R178 VanDerWaalsContact O-N 3.08Å; R178-A180 PolarHBondContact O-N 3.14Å; R178-E181 VanDerWaalsContact CB-CD 3.5Å; R178-E181 WeakPolarHBondContact CB-OE2 3.25Å; R178-E181 WeakPolarHBondContact CD-OE1 3.49Å; R178-E181 IonicContact CZ-OE1 2.79Å; R178-E181 IonicContact NE-OE1 3.34Å; R178-E181 PolarHBondContact NE-OE1 3.5Å; R178-E181 IonicContact NE-OE2 3.89Å; R178-E181 IonicContact NH1-OE1 2.64Å; R178-E181 IonicContact NH2-OE1 3.83Å; R178-E181 PolarHBondContact NH2-OE1 3.43Å; R178-L182 WeakPolarHBondContact O-CB 3.34Å; R178-L182 PolarHBondContact O-N 2.82Å
179	D	90.1	Very high	95.2	Very high	96 Å²	96	43 Å²	43	51%	0.513	21%	0.211	S	C	.	.	H	α-helix	trans	-65.9	-38.1	-165.3	-75.1	-16.5	0	0	0	114.1	Y139 I183	Y139-D179 HydrophobicContact CE2-CB 3.98Å; Y139-D179 PolarHBondContact OH-O 3.06Å; D179-I183 WeakPolarHBondContact O-CG1 3.45Å; D179-I183 PolarHBondContact O-N 3.15Å
180	A	90.6	Very high	95.2	Very high	4 Å²	4	48 Å²	48	3%	0.033	24%	0.238	C	C	.	.	H	α-helix	trans	-64.6	-51.5	179.9	0	0	0	0	0	111.2	Y139 D142 A143 R178 I183 A184	Y139-A180 HydrophobicContact CD1-CB 4.23Å; Y139-A180 HydrophobicContact CD2-CB 3.71Å; Y139-A180 HydrophobicContact CE1-CB 4.23Å; Y139-A180 HydrophobicContact CE2-CB 3.72Å; Y139-A180 HydrophobicContact CG-CB 3.96Å; Y139-A180 VanDerWaalsContact O-CB 3.28Å; Y139-A180 WeakPolarHBondContact O-CB 3.37Å; D142-A180 HydrophobicContact CB-CB 3.87Å; A143-A180 HydrophobicContact CB-CB 4.14Å; R178-A180 PolarHBondContact O-N 3.14Å; A180-I183 PolarHBondContact O-N 2.8Å; A180-A184 PolarHBondContact O-N 3.28Å
181	E	95.4	Very high	95.2	Very high	7 Å²	7	45.8 Å²	45.8	3%	0.033	23%	0.227	C	C	.	.	H	α-helix	trans	-65	-42.5	179	-59.3	97.2	136.9	0	0	110.7	T146 L175 R178 I183 A184 L185	T146-E181 HydrophobicContact CG2-CB 3.99Å; T146-E181 HydrophobicContact CG2-CG 4.39Å; T146-E181 WeakPolarHBondContact OG1-CB 3.12Å; T146-E181 WeakPolarHBondContact OG1-CG 3.29Å; L175-E181 HydrophobicContact CB-CB 4.2Å; L175-E181 HydrophobicContact CD2-CG 4.22Å; L175-E181 WeakPolarHBondContact O-CB 3.41Å; R178-E181 VanDerWaalsContact CB-CD 3.5Å; R178-E181 WeakPolarHBondContact CB-OE2 3.25Å; R178-E181 WeakPolarHBondContact CD-OE1 3.49Å; R178-E181 IonicContact CZ-OE1 2.79Å; R178-E181 IonicContact NE-OE1 3.34Å; R178-E181 PolarHBondContact NE-OE1 3.5Å; R178-E181 IonicContact NE-OE2 3.89Å; R178-E181 IonicContact NH1-OE1 2.64Å; R178-E181 IonicContact NH2-OE1 3.83Å; R178-E181 PolarHBondContact NH2-OE1 3.43Å; E181-I183 VanDerWaalsContact C-N 3.33Å; E181-I183 PolarHBondContact O-N 3.41Å; E181-A184 WeakPolarHBondContact O-CB 3.31Å; E181-A184 PolarHBondContact O-N 3.37Å; E181-A184 VanDerWaalsContact O-N 3.07Å; E181-L185 VanDerWaalsContact O-CG 3.27Å; E181-L185 WeakPolarHBondContact O-CG 3.48Å; E181-L185 PolarHBondContact O-N 3.22Å
182	L	94.8	Very high	95.3	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-55.1	-45.4	176.5	175.9	59.3	0	0	0	112.9	S176 R178 A184 L185 A186 N217 I218 H221	S176-L182 WeakPolarHBondContact O-CD1 3.28Å; R178-L182 WeakPolarHBondContact O-CB 3.34Å; R178-L182 PolarHBondContact O-N 2.82Å; L182-A184 VanDerWaalsContact C-N 3.33Å; L182-L185 PolarHBondContact O-N 2.9Å; L182-A186 WeakPolarHBondContact O-CB 3.42Å; L182-A186 PolarHBondContact O-N 3.22Å; L182-N217 HydrophobicContact CD1-CB 4.07Å; L182-I218 HydrophobicContact CD1-CB 4.32Å; L182-I218 HydrophobicContact CD1-CG2 3.74Å; L182-H221 VanDerWaalsContact CD2-NE2 3.27Å; L182-H221 WeakPolarHBondContact CD2-NE2 3.33Å
183	I	91.8	Very high	95.3	Very high	48 Å²	48	46 Å²	46	25%	0.246	23%	0.225	C	C	.	.	H	α-helix	trans	-65.3	-39.4	177.5	-67.7	-174.5	0	0	0	110.8	Y139 D179 A180 E181 A186 K187	Y139-I183 WeakPolarHBondContact OH-CD1 3.34Å; D179-I183 WeakPolarHBondContact O-CG1 3.45Å; D179-I183 PolarHBondContact O-N 3.15Å; A180-I183 PolarHBondContact O-N 2.8Å; E181-I183 VanDerWaalsContact C-N 3.33Å; E181-I183 PolarHBondContact O-N 3.41Å; I183-A186 PolarHBondContact O-N 3.07Å; I183-K187 HydrophobicContact CG2-CD 4Å; I183-K187 HydrophobicContact CG2-CG 4.45Å; I183-K187 WeakPolarHBondContact O-CB 3.25Å; I183-K187 VanDerWaalsContact O-CG 3.29Å; I183-K187 WeakPolarHBondContact O-CG 3.26Å; I183-K187 PolarHBondContact O-N 3.22Å; I183-K187 VanDerWaalsContact O-N 3.09Å
184	A	94.5	Very high	95.3	Very high	11 Å²	11	45.9 Å²	45.9	9%	0.091	23%	0.226	C	C	.	.	H	α-helix	trans	-62	-46.3	175.8	0	0	0	0	0	111.6	A143 T146 A147 I150 A180 E181 L182 K187	A143-A184 WeakPolarHBondContact O-CB 3.23Å; T146-A184 HydrophobicContact CG2-CB 3.97Å; A147-A184 HydrophobicContact CB-CB 4.36Å; I150-A184 WeakPolarHBondContact CD1-O 3.41Å; A180-A184 PolarHBondContact O-N 3.28Å; E181-A184 WeakPolarHBondContact O-CB 3.31Å; E181-A184 PolarHBondContact O-N 3.37Å; E181-A184 VanDerWaalsContact O-N 3.07Å; L182-A184 VanDerWaalsContact C-N 3.33Å; A184-K187 PolarHBondContact O-N 2.8Å
185	L	96.6	Very high	95.3	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-63	-45.1	176.3	-58.8	171.9	0	0	0	111.5	T146 I150 I172 L175 E181 L182 K187 S188 L191 I218	T146-L185 HydrophobicContact CG2-CD2 3.79Å; T146-L185 HydrophobicContact CG2-CG 4.08Å; I150-L185 HydrophobicContact CD1-CD2 4.24Å; I150-L185 HydrophobicContact CG1-CD2 4.03Å; I172-L185 HydrophobicContact CG2-CD1 4.35Å; L175-L185 HydrophobicContact CB-CD1 3.93Å; E181-L185 VanDerWaalsContact O-CG 3.27Å; E181-L185 WeakPolarHBondContact O-CG 3.48Å; E181-L185 PolarHBondContact O-N 3.22Å; L182-L185 PolarHBondContact O-N 2.9Å; L185-K187 PolarHBondContact O-N 3.38Å; L185-S188 PolarHBondContact O-N 2.98Å; L185-S188 VanDerWaalsContact O-N 3.09Å; L185-L191 HydrophobicContact CB-CD2 3.88Å; L185-L191 HydrophobicContact CD2-CD2 3.36Å; L185-L191 HydrophobicContact CG-CD2 4.15Å; L185-I218 HydrophobicContact CB-CG2 4.48Å
186	A	94.1	Very high	95.4	Very high	2 Å²	2	39.7 Å²	39.7	2%	0.017	20%	0.197	C	C	.	.	H	α-helix	trans	-65.2	-23.6	-179.1	0	0	0	0	0	113.3	L182 I183 S188 I218 P223 G224	L182-A186 WeakPolarHBondContact O-CB 3.42Å; L182-A186 PolarHBondContact O-N 3.22Å; I183-A186 PolarHBondContact O-N 3.07Å; A186-S188 VanDerWaalsContact C-N 3.33Å; A186-I218 HydrophobicContact CB-CB 4.15Å; A186-I218 HydrophobicContact CB-CG2 4.31Å; A186-P223 CarbonylContact O-C 3.44Å; A186-G224 PolarHBondContact O-N 2.93Å
187	K	94.2	Very high	95.4	Very high	144 Å²	144	42.8 Å²	42.8	63%	0.626	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-0.1	175.4	-75.6	176.3	178	177.6	0	113.9	I183 A184 L185 P189 P223	I183-K187 HydrophobicContact CG2-CD 4Å; I183-K187 HydrophobicContact CG2-CG 4.45Å; I183-K187 WeakPolarHBondContact O-CB 3.25Å; I183-K187 VanDerWaalsContact O-CG 3.29Å; I183-K187 WeakPolarHBondContact O-CG 3.26Å; I183-K187 PolarHBondContact O-N 3.22Å; I183-K187 VanDerWaalsContact O-N 3.09Å; A184-K187 PolarHBondContact O-N 2.8Å; L185-K187 PolarHBondContact O-N 3.38Å; K187-P189 VanDerWaalsContact O-CD 3.3Å; K187-P189 WeakPolarHBondContact O-CD 3.44Å; K187-P223 HydrophobicContact CG-CB 4.29Å
188	S	95.8	Very high	95.4	Very high	17 Å²	17	37.7 Å²	37.7	12%	0.119	19%	0.193	C	C	.	.			trans	-109.6	96.1	178.2	-179.1	0	0	0	0	111.9	I150 L185 A186 D190 L191 V192	I150-S188 WeakPolarHBondContact CG2-OG 3.26Å; L185-S188 PolarHBondContact O-N 2.98Å; L185-S188 VanDerWaalsContact O-N 3.09Å; A186-S188 VanDerWaalsContact C-N 3.33Å; S188-D190 PolarHBondContact O-N 3.22Å; S188-L191 PolarHBondContact O-N 3.25Å; S188-L191 WeakPolarHBondContact OG-CB 3.42Å; S188-L191 PolarHBondContact OG-N 3.17Å; S188-V192 WeakPolarHBondContact O-CG2 3.36Å; S188-V192 PolarHBondContact O-N 3.44Å
189	P	95.4	Very high	95.4	Very high	60 Å²	60	31.6 Å²	31.6	39%	0.39	17%	0.17	S	C	.	.	H	α-helix	trans	-58.3	-35.2	175.3	-25.3	34.8	0	0	0	113.5	K187 V192 L193 S231	K187-P189 VanDerWaalsContact O-CD 3.3Å; K187-P189 WeakPolarHBondContact O-CD 3.44Å; P189-V192 PolarHBondContact O-N 2.95Å; P189-L193 WeakPolarHBondContact O-CB 3.17Å; P189-L193 PolarHBondContact O-N 3.48Å; P189-S231 PolarHBondContact O-OG 3.43Å
190	D	97.5	Very high	95.6	Very high	109 Å²	109	30 Å²	30	58%	0.583	16%	0.161	S	C	*	.	H	α-helix	trans	-65.8	-39.4	179.8	-60.7	-40.7	0	0	0	112	I154 S188 L193 A194	I154-D190 HydrophobicContact CD1-CB 3.85Å; S188-D190 PolarHBondContact O-N 3.22Å; D190-L193 PolarHBondContact O-N 2.8Å; D190-A194 WeakPolarHBondContact O-CB 3.5Å; D190-A194 PolarHBondContact O-N 3.24Å
191	L	97.9	Very high	95.6	Very high	3 Å²	3	36.3 Å²	36.3	2%	0.016	20%	0.195	C	C	.	.	H	α-helix	trans	-64.2	-45.8	172.9	-178.3	74.3	0	0	0	111.2	I150 L153 I154 L157 I172 L185 S188 L193 A194 V195	I150-L191 HydrophobicContact CG1-CD2 4.33Å; I150-L191 HydrophobicContact CG2-CB 4.03Å; I150-L191 HydrophobicContact CG2-CD1 4.47Å; L153-L191 HydrophobicContact CB-CD1 4.4Å; I154-L191 HydrophobicContact CD1-CB 4.16Å; I154-L191 HydrophobicContact CG1-CB 4.1Å; I154-L191 HydrophobicContact CG1-CD1 3.77Å; L157-L191 HydrophobicContact CD1-CD1 4.32Å; I172-L191 HydrophobicContact CD1-CD1 4Å; L185-L191 HydrophobicContact CB-CD2 3.88Å; L185-L191 HydrophobicContact CD2-CD2 3.36Å; L185-L191 HydrophobicContact CG-CD2 4.15Å; S188-L191 PolarHBondContact O-N 3.25Å; S188-L191 WeakPolarHBondContact OG-CB 3.42Å; S188-L191 PolarHBondContact OG-N 3.17Å; L191-L193 VanDerWaalsContact C-N 3.29Å; L191-L193 PolarHBondContact O-N 2.9Å; L191-A194 WeakPolarHBondContact O-CB 3.45Å; L191-A194 PolarHBondContact O-N 3.39Å; L191-A194 VanDerWaalsContact O-N 3.14Å; L191-V195 WeakPolarHBondContact O-CG2 3.4Å; L191-V195 PolarHBondContact O-N 3.36Å
192	V	98.1	Very high	95	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.012	20%	0.2	C	C	.	.	H	α-helix	trans	-61.1	-41.7	179	177.8	0	0	0	0	110.7	S188 P189 V195 I196 L215 I218 A227 I228	S188-V192 WeakPolarHBondContact O-CG2 3.36Å; S188-V192 PolarHBondContact O-N 3.44Å; P189-V192 PolarHBondContact O-N 2.95Å; V192-V195 PolarHBondContact O-N 3.49Å; V192-I196 HydrophobicContact CG1-CD1 3.89Å; V192-I196 WeakPolarHBondContact O-CD1 3.31Å; V192-I196 WeakPolarHBondContact O-CG1 3.45Å; V192-I196 PolarHBondContact O-N 3.3Å; V192-L215 HydrophobicContact CG1-CD2 4.25Å; V192-I218 HydrophobicContact CB-CD1 4.39Å; V192-I218 HydrophobicContact CG1-CD1 3.99Å; V192-I218 HydrophobicContact CG2-CD1 3.54Å; V192-A227 HydrophobicContact CB-CB 4.04Å; V192-A227 HydrophobicContact CG1-CB 4.14Å; V192-A227 HydrophobicContact CG2-CB 3.83Å; V192-I228 HydrophobicContact CG1-CB 4.48Å; V192-I228 HydrophobicContact CG1-CG1 3.86Å
193	L	98.1	Very high	94.3	Very high	66 Å²	66	42.8 Å²	42.8	35%	0.346	24%	0.239	S	C	.	.	H	α-helix	trans	-60.9	-44.4	172.7	-179.1	61.6	0	0	0	112	P189 D190 L191 V195 I196 N197	P189-L193 WeakPolarHBondContact O-CB 3.17Å; P189-L193 PolarHBondContact O-N 3.48Å; D190-L193 PolarHBondContact O-N 2.8Å; L191-L193 VanDerWaalsContact C-N 3.29Å; L191-L193 PolarHBondContact O-N 2.9Å; L193-V195 PolarHBondContact O-N 3.39Å; L193-I196 PolarHBondContact O-N 2.85Å; L193-N197 WeakPolarHBondContact O-CB 3.42Å; L193-N197 VanDerWaalsContact O-CG 3.29Å; L193-N197 PolarHBondContact O-N 3.03Å; L193-N197 PolarHBondContact O-ND2 3.06Å
194	A	97.7	Very high	94.3	Very high	7 Å²	7	43 Å²	43	6%	0.058	24%	0.239	C	C	.	.	H	α-helix	trans	-61.5	-41.7	176.9	0	0	0	0	0	112.1	I154 L157 D190 L191 N197 A198	I154-A194 HydrophobicContact CG1-CB 4.39Å; I154-A194 HydrophobicContact CG2-CB 4.15Å; L157-A194 HydrophobicContact CB-CB 4.36Å; L157-A194 HydrophobicContact CD1-CB 3.87Å; D190-A194 WeakPolarHBondContact O-CB 3.5Å; D190-A194 PolarHBondContact O-N 3.24Å; L191-A194 WeakPolarHBondContact O-CB 3.45Å; L191-A194 PolarHBondContact O-N 3.39Å; L191-A194 VanDerWaalsContact O-N 3.14Å; A194-N197 PolarHBondContact O-N 3.41Å; A194-A198 PolarHBondContact O-N 2.88Å
195	V	97.9	Very high	94.1	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.024	26%	0.255	C	S	.	.	H	α-helix	trans	-63.2	-43.1	175.1	173.6	0	0	0	0	111.2	L157 L191 V192 L193 A198 I199 A211 L215	L157-V195 HydrophobicContact CD1-CG2 3.72Å; L191-V195 WeakPolarHBondContact O-CG2 3.4Å; L191-V195 PolarHBondContact O-N 3.36Å; V192-V195 PolarHBondContact O-N 3.49Å; L193-V195 PolarHBondContact O-N 3.39Å; V195-A198 PolarHBondContact O-N 3.23Å; V195-I199 WeakPolarHBondContact O-CG1 3.25Å; V195-I199 PolarHBondContact O-N 2.94Å; V195-I199 VanDerWaalsContact O-N 3.13Å; V195-A211 HydrophobicContact CG1-CB 3.84Å; V195-L215 HydrophobicContact CB-CD2 4.39Å; V195-L215 HydrophobicContact CG1-CD2 3.8Å; V195-L215 HydrophobicContact CG1-CG 4.08Å
196	I	97.5	Very high	94	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-64.4	-41.1	176.4	-70.9	160.4	0	0	0	110.9	V192 L193 I199 N200 L215 G233 A236	V192-I196 HydrophobicContact CG1-CD1 3.89Å; V192-I196 WeakPolarHBondContact O-CD1 3.31Å; V192-I196 WeakPolarHBondContact O-CG1 3.45Å; V192-I196 PolarHBondContact O-N 3.3Å; L193-I196 PolarHBondContact O-N 2.85Å; I196-I199 WeakPolarHBondContact O-CB 3.38Å; I196-I199 PolarHBondContact O-N 3.18Å; I196-N200 VanDerWaalsContact O-CG 3.23Å; I196-N200 PolarHBondContact O-N 3.32Å; I196-N200 PolarHBondContact O-ND2 3.17Å; I196-L215 HydrophobicContact CG1-CD1 4.1Å; I196-L215 HydrophobicContact CG1-CD2 4.22Å; I196-G233 VanDerWaalsContact CD1-CA 3.49Å; I196-A236 HydrophobicContact CG2-CB 4.12Å
197	N	96.3	Very high	94	Very high	66 Å²	66	48.5 Å²	48.5	35%	0.353	27%	0.268	S	S	.	.	H	α-helix	trans	-64.1	-39.2	175.8	-73.6	-19.7	0	0	0	112.1	L193 A194 I199 N200 N201	L193-N197 WeakPolarHBondContact O-CB 3.42Å; L193-N197 VanDerWaalsContact O-CG 3.29Å; L193-N197 PolarHBondContact O-N 3.03Å; L193-N197 PolarHBondContact O-ND2 3.06Å; A194-N197 PolarHBondContact O-N 3.41Å; N197-I199 VanDerWaalsContact C-N 3.32Å; N197-I199 PolarHBondContact O-N 2.86Å; N197-N200 PolarHBondContact O-N 2.96Å; N197-N200 VanDerWaalsContact O-N 3.1Å; N197-N201 WeakPolarHBondContact O-CB 3.13Å; N197-N201 PolarHBondContact O-N 3.19Å; N197-N201 PolarHBondContact O-ND2 3.4Å
198	A	95.2	Very high	94.1	Very high	8 Å²	8	42.3 Å²	42.3	7%	0.066	24%	0.242	C	C	.	.	H	α-helix	trans	-60.5	-40.5	173.5	0	0	0	0	0	112	L157 V165 A194 V195 N200 N202 L207	L157-A198 HydrophobicContact CD2-CB 4.33Å; V165-A198 HydrophobicContact CG1-CB 4.33Å; A194-A198 PolarHBondContact O-N 2.88Å; V195-A198 PolarHBondContact O-N 3.23Å; A198-N200 VanDerWaalsContact C-N 3.34Å; A198-N202 WeakPolarHBondContact O-CB 3.4Å; A198-N202 PolarHBondContact O-N 3.48Å; A198-L207 HydrophobicContact CB-CD1 4.42Å
199	I	94.8	Very high	94.1	Very high	8 Å²	8	44.5 Å²	44.5	4%	0.041	25%	0.25	C	C	.	.	H	α-helix	trans	-64.5	-37.1	172.6	-66.4	165.9	0	0	0	111.8	V195 I196 N197 A211 L215 A236 L240	V195-I199 WeakPolarHBondContact O-CG1 3.25Å; V195-I199 PolarHBondContact O-N 2.94Å; V195-I199 VanDerWaalsContact O-N 3.13Å; I196-I199 WeakPolarHBondContact O-CB 3.38Å; I196-I199 PolarHBondContact O-N 3.18Å; N197-I199 VanDerWaalsContact C-N 3.32Å; N197-I199 PolarHBondContact O-N 2.86Å; I199-A211 HydrophobicContact CD1-CB 3.74Å; I199-A211 HydrophobicContact CG1-CB 3.48Å; I199-A211 VanDerWaalsContact CG1-CB 3.48Å; I199-L215 HydrophobicContact CD1-CD1 3.58Å; I199-L215 HydrophobicContact CD1-CG 4.33Å; I199-A236 HydrophobicContact CG2-CB 4.43Å; I199-L240 HydrophobicContact CD1-CD1 4.34Å; I199-L240 HydrophobicContact CG2-CD1 3.98Å; I199-L240 HydrophobicContact CG2-CD2 3.99Å; I199-L240 HydrophobicContact CG2-CG 4.13Å
200	N	93	Very high	94.2	Very high	61 Å²	61	44 Å²	44	33%	0.326	24%	0.24	S	C	.	.	H	α-helix	trans	-72.5	-36.4	-178.7	-69.5	-32	0	0	0	112.6	I196 N197 A198 R239	I196-N200 VanDerWaalsContact O-CG 3.23Å; I196-N200 PolarHBondContact O-N 3.32Å; I196-N200 PolarHBondContact O-ND2 3.17Å; N197-N200 PolarHBondContact O-N 2.96Å; N197-N200 VanDerWaalsContact O-N 3.1Å; A198-N200 VanDerWaalsContact C-N 3.34Å; N200-R239 VanDerWaalsContact OD1-CZ 3.24Å; N200-R239 PolarHBondContact OD1-NH1 3.49Å; N200-R239 PolarHBondContact OD1-NH2 2.81Å
201	N	90.3	Very high	94.2	Very high	137 Å²	137	38.9 Å²	38.9	73%	0.733	21%	0.213	S	C	*	.	H	α-helix	trans	-98	-10.4	-167.8	-63.3	-19.7	0	0	0	113.6	N197	N197-N201 WeakPolarHBondContact O-CB 3.13Å; N197-N201 PolarHBondContact O-N 3.19Å; N197-N201 PolarHBondContact O-ND2 3.4Å
202	N	83.6	Confident	94.2	Very high	26 Å²	26	38.7 Å²	38.7	14%	0.139	21%	0.212	C	C	.	.			trans	-129.3	147.5	-176	-165.5	-35.3	0	0	0	111.1	Q162 A198 E204 L207	Q162-N202 PolarHBondContact OE1-ND2 2.93Å; A198-N202 WeakPolarHBondContact O-CB 3.4Å; A198-N202 PolarHBondContact O-N 3.48Å; N202-E204 WeakPolarHBondContact OD1-CB 3.22Å; N202-E204 PolarHBondContact OD1-N 3.35Å; N202-L207 HydrophobicContact CB-CD2 3.49Å; N202-L207 VanDerWaalsContact CB-CD2 3.49Å; N202-L207 VanDerWaalsContact ND2-CD2 3.25Å; N202-L207 WeakPolarHBondContact ND2-CD2 3.39Å
203	S	80.7	Confident	94.2	Very high	117 Å²	117	38.6 Å²	38.6	82%	0.818	21%	0.212	S	C	*	.			trans	-112.5	9.5	179.1	-58.7	0	0	0	0	113.2	P205	S203-P205 WeakPolarHBondContact O-CD 3.47Å
204	E	90.5	Very high	94.2	Very high	53 Å²	53	35.7 Å²	35.7	25%	0.248	20%	0.196	C	C	.	.			trans	-70.9	125	-178.3	-162.3	-75	124	0	0	110.3	Q166 N202 E206 L207 T208	Q166-E204 PolarHBondContact NE2-OE2 3.46Å; N202-E204 WeakPolarHBondContact OD1-CB 3.22Å; N202-E204 PolarHBondContact OD1-N 3.35Å; E204-E206 PolarHBondContact O-N 2.68Å; E204-E206 PolarHBondContact OE1-N 3.03Å; E204-E206 WeakPolarHBondContact OE2-CA 3.39Å; E204-E206 WeakPolarHBondContact OE2-CB 3.37Å; E204-E206 PolarHBondContact OE2-N 2.97Å; E204-L207 HydrophobicContact CB-CB 4.29Å; E204-L207 WeakPolarHBondContact OE2-CB 3.48Å; E204-L207 PolarHBondContact OE2-N 3.02Å; E204-T208 WeakPolarHBondContact O-CB 3.45Å; E204-T208 PolarHBondContact O-N 3.27Å; E204-T208 PolarHBondContact O-OG1 3Å
205	P	91.9	Very high	94.3	Very high	65 Å²	65	35.3 Å²	35.3	42%	0.422	19%	0.194	S	C	.	.	H	α-helix	trans	-49.2	-50.8	-179.3	-37	41.6	0	0	0	116.4	S203 K209 I245	S203-P205 WeakPolarHBondContact O-CD 3.47Å; P205-K209 WeakPolarHBondContact O-CB 3.47Å; P205-K209 PolarHBondContact O-N 3.27Å; P205-I245 HydrophobicContact CB-CD1 3.5Å; P205-I245 VanDerWaalsContact CB-CD1 3.5Å; P205-I245 HydrophobicContact CG-CD1 4.23Å
206	E	93.4	Very high	94.3	Very high	64 Å²	64	38 Å²	38	30%	0.299	20%	0.204	S	C	.	.	H	α-helix	trans	-74.9	-41	-172.6	-73.5	-61.6	134.2	0	0	112.1	E204 T208 K209 Y210	E204-E206 PolarHBondContact O-N 2.68Å; E204-E206 PolarHBondContact OE1-N 3.03Å; E204-E206 WeakPolarHBondContact OE2-CA 3.39Å; E204-E206 WeakPolarHBondContact OE2-CB 3.37Å; E204-E206 PolarHBondContact OE2-N 2.97Å; E206-T208 VanDerWaalsContact C-N 3.32Å; E206-T208 PolarHBondContact O-N 3.04Å; E206-K209 WeakPolarHBondContact O-CB 3.34Å; E206-K209 PolarHBondContact O-N 3.07Å; E206-K209 IonicContact OE1-NZ 3.11Å; E206-K209 PolarHBondContact OE1-NZ 2.94Å; E206-K209 IonicContact OE2-NZ 2.71Å; E206-K209 PolarHBondContact OE2-NZ 3.38Å; E206-Y210 HydrophobicContact CB-CD2 4.46Å; E206-Y210 HydrophobicContact CB-CE2 4.09Å; E206-Y210 WeakPolarHBondContact O-CD2 3.42Å; E206-Y210 PolarHBondContact O-N 3.46Å
207	L	94.9	Very high	94.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-56	-49.1	170.7	168.9	61	0	0	0	109.9	V165 Q166 A169 A198 N202 E204 K209 Y210 A211	V165-L207 HydrophobicContact CG1-CD1 4.09Å; V165-L207 HydrophobicContact CG1-CD2 3.91Å; Q166-L207 HydrophobicContact CG-CB 4.36Å; A169-L207 HydrophobicContact CB-CD1 3.21Å; A198-L207 HydrophobicContact CB-CD1 4.42Å; N202-L207 HydrophobicContact CB-CD2 3.49Å; N202-L207 VanDerWaalsContact CB-CD2 3.49Å; N202-L207 VanDerWaalsContact ND2-CD2 3.25Å; N202-L207 WeakPolarHBondContact ND2-CD2 3.39Å; E204-L207 HydrophobicContact CB-CB 4.29Å; E204-L207 WeakPolarHBondContact OE2-CB 3.48Å; E204-L207 PolarHBondContact OE2-N 3.02Å; L207-K209 VanDerWaalsContact C-N 3.26Å; L207-K209 PolarHBondContact O-N 2.62Å; L207-Y210 PolarHBondContact O-N 2.83Å; L207-A211 WeakPolarHBondContact O-CB 3.48Å; L207-A211 PolarHBondContact O-N 3.32Å
208	T	95.7	Very high	94.4	Very high	14 Å²	14	35.5 Å²	35.5	9%	0.086	19%	0.19	C	C	.	.	H	α-helix	trans	-59.4	-41.1	178.7	-57.5	0	0	0	0	111	E204 E206 A212 L240 V248	E204-T208 WeakPolarHBondContact O-CB 3.45Å; E204-T208 PolarHBondContact O-N 3.27Å; E204-T208 PolarHBondContact O-OG1 3Å; E206-T208 VanDerWaalsContact C-N 3.32Å; E206-T208 PolarHBondContact O-N 3.04Å; T208-A212 WeakPolarHBondContact O-CB 3.33Å; T208-A212 PolarHBondContact O-N 3.07Å; T208-L240 HydrophobicContact CG2-CD1 4.39Å; T208-L240 HydrophobicContact CG2-CD2 3.48Å; T208-L240 VanDerWaalsContact CG2-CD2 3.48Å; T208-V248 HydrophobicContact CG2-CG1 3.82Å; T208-V248 HydrophobicContact CG2-CG2 4.17Å
209	K	96.7	Very high	94.5	Very high	64 Å²	64	35.2 Å²	35.2	28%	0.278	19%	0.188	S	C	.	.	H	α-helix	trans	-67.1	-45.4	177.2	177.4	-175.7	167.9	-161.3	0	112.7	P205 E206 L207 G213 V248	P205-K209 WeakPolarHBondContact O-CB 3.47Å; P205-K209 PolarHBondContact O-N 3.27Å; E206-K209 WeakPolarHBondContact O-CB 3.34Å; E206-K209 PolarHBondContact O-N 3.07Å; E206-K209 IonicContact OE1-NZ 3.11Å; E206-K209 PolarHBondContact OE1-NZ 2.94Å; E206-K209 IonicContact OE2-NZ 2.71Å; E206-K209 PolarHBondContact OE2-NZ 3.38Å; L207-K209 VanDerWaalsContact C-N 3.26Å; L207-K209 PolarHBondContact O-N 2.62Å; K209-G213 PolarHBondContact O-N 2.88Å; K209-V248 HydrophobicContact CB-CG2 3.9Å
210	Y	97.5	Very high	94.6	Very high	48 Å²	48	40 Å²	40	19%	0.188	21%	0.206	C	C	.	.	H	α-helix	trans	-65	-46.8	176.6	-67.1	-48	0	0	0	111.4	M170 H173 E206 L207 G213 T214	M170-Y210 HydrophobicContact CB-CD2 3.85Å; M170-Y210 HydrophobicContact CB-CE2 3.81Å; M170-Y210 HydrophobicContact CB-CG 4.29Å; M170-Y210 HydrophobicContact CG-CD2 4.36Å; M170-Y210 HydrophobicContact CG-CE1 4.16Å; M170-Y210 HydrophobicContact CG-CE2 3.94Å; H173-Y210 HydrophobicContact CB-CD1 4.12Å; H173-Y210 HydrophobicContact CB-CG 4.42Å; H173-Y210 AromaticContact CD2-CD1 3.7Å; H173-Y210 AromaticContact CG-CD1 4Å; H173-Y210 PolarHBondContact ND1-O 3.19Å; E206-Y210 HydrophobicContact CB-CD2 4.46Å; E206-Y210 HydrophobicContact CB-CE2 4.09Å; E206-Y210 WeakPolarHBondContact O-CD2 3.42Å; E206-Y210 PolarHBondContact O-N 3.46Å; L207-Y210 PolarHBondContact O-N 2.83Å; Y210-G213 PolarHBondContact O-N 3.41Å; Y210-T214 PolarHBondContact O-N 3.15Å; Y210-T214 PolarHBondContact O-OG1 3.03Å; Y210-T214 VanDerWaalsContact O-OG1 3.04Å
211	A	97.6	Very high	94.7	Very high	2 Å²	2	39.9 Å²	39.9	2%	0.017	20%	0.203	C	C	.	.	H	α-helix	trans	-62.3	-47.7	178.1	0	0	0	0	0	111.7	V195 I199 L207 G213 T214 L215	V195-A211 HydrophobicContact CG1-CB 3.84Å; I199-A211 HydrophobicContact CD1-CB 3.74Å; I199-A211 HydrophobicContact CG1-CB 3.48Å; I199-A211 VanDerWaalsContact CG1-CB 3.48Å; L207-A211 WeakPolarHBondContact O-CB 3.48Å; L207-A211 PolarHBondContact O-N 3.32Å; A211-G213 VanDerWaalsContact C-N 3.32Å; A211-G213 PolarHBondContact O-N 3.4Å; A211-T214 WeakPolarHBondContact O-CB 3.25Å; A211-T214 PolarHBondContact O-N 3.17Å; A211-L215 WeakPolarHBondContact O-CG 3.49Å; A211-L215 PolarHBondContact O-N 3.48Å
212	A	97.8	Very high	94.9	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.9	-39.7	175.2	0	0	0	0	0	112.1	T208 T214 L215 Y216 L240 V248 Y251	T208-A212 WeakPolarHBondContact O-CB 3.33Å; T208-A212 PolarHBondContact O-N 3.07Å; A212-T214 VanDerWaalsContact C-N 3.34Å; A212-L215 PolarHBondContact O-N 3.03Å; A212-Y216 PolarHBondContact O-N 3.06Å; A212-L240 HydrophobicContact CB-CD1 4Å; A212-V248 HydrophobicContact CB-CG1 4.47Å; A212-Y251 HydrophobicContact CB-CD2 4.44Å
213	G	98.1	Very high	95.5	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.9	-38.3	174.5	0	0	0	0	0	112.9	K209 Y210 A211 Y216 N217	K209-G213 PolarHBondContact O-N 2.88Å; Y210-G213 PolarHBondContact O-N 3.41Å; A211-G213 VanDerWaalsContact C-N 3.32Å; A211-G213 PolarHBondContact O-N 3.4Å; G213-Y216 PolarHBondContact O-N 2.71Å; G213-N217 VanDerWaalsContact O-CG 3.31Å; G213-N217 PolarHBondContact O-N 2.97Å; G213-N217 PolarHBondContact O-ND2 3Å
214	T	98.4	Very high	96.3	Very high	4 Å²	4	36 Å²	36	3%	0.025	17%	0.166	C	C	.	.	H	α-helix	trans	-62.7	-49.2	172.2	-62.3	0	0	0	0	111.1	I172 H173 Y210 A211 A212 Y216 N217 I218	I172-T214 HydrophobicContact CG2-CG2 3.64Å; H173-T214 VanDerWaalsContact CA-OG1 3.27Å; H173-T214 WeakPolarHBondContact CA-OG1 3.24Å; H173-T214 PolarHBondContact N-OG1 3.26Å; H173-T214 PolarHBondContact ND1-N 3.19Å; Y210-T214 PolarHBondContact O-N 3.15Å; Y210-T214 PolarHBondContact O-OG1 3.03Å; Y210-T214 VanDerWaalsContact O-OG1 3.04Å; A211-T214 WeakPolarHBondContact O-CB 3.25Å; A211-T214 PolarHBondContact O-N 3.17Å; A212-T214 VanDerWaalsContact C-N 3.34Å; T214-Y216 VanDerWaalsContact C-N 3.29Å; T214-Y216 PolarHBondContact O-N 2.84Å; T214-N217 PolarHBondContact O-N 2.99Å; T214-N217 VanDerWaalsContact O-N 3.11Å; T214-I218 HydrophobicContact CG2-CG2 4.46Å; T214-I218 WeakPolarHBondContact O-CG1 3.16Å; T214-I218 PolarHBondContact O-N 3.46Å
215	L	98.5	Very high	96.7	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-59.2	-41.3	177.7	-63.5	-172.9	0	0	0	111.7	V192 V195 I196 I199 A211 A212 I218 S219 I228 L237 T255	V192-L215 HydrophobicContact CG1-CD2 4.25Å; V195-L215 HydrophobicContact CB-CD2 4.39Å; V195-L215 HydrophobicContact CG1-CD2 3.8Å; V195-L215 HydrophobicContact CG1-CG 4.08Å; I196-L215 HydrophobicContact CG1-CD1 4.1Å; I196-L215 HydrophobicContact CG1-CD2 4.22Å; I199-L215 HydrophobicContact CD1-CD1 3.58Å; I199-L215 HydrophobicContact CD1-CG 4.33Å; A211-L215 WeakPolarHBondContact O-CG 3.49Å; A211-L215 PolarHBondContact O-N 3.48Å; A212-L215 PolarHBondContact O-N 3.03Å; L215-I218 HydrophobicContact CD2-CD1 3.86Å; L215-I218 VanDerWaalsContact O-CG1 3.27Å; L215-I218 WeakPolarHBondContact O-CG1 2.94Å; L215-S219 VanDerWaalsContact O-CB 3.31Å; L215-S219 WeakPolarHBondContact O-CB 3.43Å; L215-S219 PolarHBondContact O-N 2.7Å; L215-I228 HydrophobicContact CB-CD1 4.36Å; L215-I228 HydrophobicContact CD2-CG1 4.2Å; L215-I228 WeakPolarHBondContact O-CD1 3.46Å; L215-L237 HydrophobicContact CD1-CD2 4Å; L215-L237 HydrophobicContact CD1-CG 4.45Å; L215-T255 HydrophobicContact CB-CG2 4.37Å
216	Y	98.4	Very high	97	Very high	59 Å²	59	33.1 Å²	33.1	23%	0.231	15%	0.148	C	C	.	.	H	α-helix	trans	-58.1	-51	172.2	162.1	-106.9	0	0	0	111.7	A212 G213 T214 I218 S219 Y251 T254 T255	A212-Y216 PolarHBondContact O-N 3.06Å; G213-Y216 PolarHBondContact O-N 2.71Å; T214-Y216 VanDerWaalsContact C-N 3.29Å; T214-Y216 PolarHBondContact O-N 2.84Å; Y216-I218 PolarHBondContact O-N 3.23Å; Y216-S219 PolarHBondContact O-N 3.37Å; Y216-S219 PolarHBondContact O-OG 3.46Å; Y216-Y251 AromaticContact CD1-CD1 3.65Å; Y216-Y251 HydrophobicContact CD1-CD1 3.65Å; Y216-Y251 AromaticContact CD1-CE1 3.71Å; Y216-Y251 HydrophobicContact CD1-CE1 3.71Å; Y216-Y251 HydrophobicContact CE1-CD1 4.47Å; Y216-Y251 HydrophobicContact CE1-CE1 4.28Å; Y216-Y251 AromaticContact CG-CD1 3.69Å; Y216-Y251 HydrophobicContact CG-CD1 3.69Å; Y216-Y251 HydrophobicContact CG-CE1 4.24Å; Y216-T254 HydrophobicContact CD2-CG2 3.85Å; Y216-T254 HydrophobicContact CE2-CG2 3.52Å; Y216-T255 WeakPolarHBondContact CA-OG1 3.23Å; Y216-T255 WeakPolarHBondContact CB-OG1 3.44Å; Y216-T255 PolarHBondContact N-OG1 2.98Å
217	N	98.2	Very high	97.2	Very high	12 Å²	12	30.2 Å²	30.2	6%	0.064	14%	0.135	C	C	.	.	H	α-helix	trans	-61.7	-46.1	-177.1	-75.2	-24.3	0	0	0	112.2	S176 L182 G213 T214 S219 R220	S176-N217 WeakPolarHBondContact O-CB 3.12Å; S176-N217 PolarHBondContact OG-ND2 3.21Å; L182-N217 HydrophobicContact CD1-CB 4.07Å; G213-N217 VanDerWaalsContact O-CG 3.31Å; G213-N217 PolarHBondContact O-N 2.97Å; G213-N217 PolarHBondContact O-ND2 3Å; T214-N217 PolarHBondContact O-N 2.99Å; T214-N217 VanDerWaalsContact O-N 3.11Å; N217-S219 VanDerWaalsContact C-N 3.31Å; N217-S219 PolarHBondContact O-N 3.32Å; N217-R220 WeakPolarHBondContact O-CB 3.38Å; N217-R220 WeakPolarHBondContact O-CG 3.45Å; N217-R220 PolarHBondContact O-N 2.89Å; N217-R220 PolarHBondContact O-NE 3.49Å; N217-R220 VanDerWaalsContact O-NE 3.13Å
218	I	97.8	Very high	97.4	Very high	3 Å²	3	30.2 Å²	30.2	2%	0.015	14%	0.135	C	C	.	.	H	α-helix	trans	-67.6	-29.5	179	67.1	179.8	0	0	0	112.2	L182 L185 A186 V192 T214 L215 Y216 R220 H221 G224 I228	L182-I218 HydrophobicContact CD1-CB 4.32Å; L182-I218 HydrophobicContact CD1-CG2 3.74Å; L185-I218 HydrophobicContact CB-CG2 4.48Å; A186-I218 HydrophobicContact CB-CB 4.15Å; A186-I218 HydrophobicContact CB-CG2 4.31Å; V192-I218 HydrophobicContact CB-CD1 4.39Å; V192-I218 HydrophobicContact CG1-CD1 3.99Å; V192-I218 HydrophobicContact CG2-CD1 3.54Å; T214-I218 HydrophobicContact CG2-CG2 4.46Å; T214-I218 WeakPolarHBondContact O-CG1 3.16Å; T214-I218 PolarHBondContact O-N 3.46Å; L215-I218 HydrophobicContact CD2-CD1 3.86Å; L215-I218 VanDerWaalsContact O-CG1 3.27Å; L215-I218 WeakPolarHBondContact O-CG1 2.94Å; Y216-I218 PolarHBondContact O-N 3.23Å; I218-R220 PolarHBondContact O-N 2.83Å; I218-R220 VanDerWaalsContact O-N 3.1Å; I218-H221 PolarHBondContact O-N 2.84Å; I218-H221 VanDerWaalsContact O-N 3.1Å; I218-G224 WeakPolarHBondContact O-CA 3.47Å; I218-I228 HydrophobicContact CD1-CD1 3.8Å; I218-I228 HydrophobicContact CD1-CG1 3.76Å; I218-I228 HydrophobicContact CG1-CD1 3.64Å; I218-I228 HydrophobicContact CG1-CG1 4.18Å
219	S	98	Very high	97.5	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.014	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-10.5	178	77.2	0	0	0	0	114.1	L215 Y216 N217 H221 L225 N258	L215-S219 VanDerWaalsContact O-CB 3.31Å; L215-S219 WeakPolarHBondContact O-CB 3.43Å; L215-S219 PolarHBondContact O-N 2.7Å; Y216-S219 PolarHBondContact O-N 3.37Å; Y216-S219 PolarHBondContact O-OG 3.46Å; N217-S219 VanDerWaalsContact C-N 3.31Å; N217-S219 PolarHBondContact O-N 3.32Å; S219-H221 PolarHBondContact O-N 3.06Å; S219-L225 VanDerWaalsContact O-CD2 3.31Å; S219-L225 WeakPolarHBondContact O-CD2 3.43Å; S219-L225 VanDerWaalsContact O-CG 3.24Å; S219-L225 WeakPolarHBondContact O-CG 3.25Å; S219-N258 PolarHBondContact OG-ND2 2.91Å
220	R	96.2	Very high	97.5	Very high	110 Å²	110	35.6 Å²	35.6	42%	0.415	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-11.6	173.1	-60.8	-176.3	-66.9	166.3	-3.7	112.9	N217 I218	N217-R220 WeakPolarHBondContact O-CB 3.38Å; N217-R220 WeakPolarHBondContact O-CG 3.45Å; N217-R220 PolarHBondContact O-N 2.89Å; N217-R220 PolarHBondContact O-NE 3.49Å; N217-R220 VanDerWaalsContact O-NE 3.13Å; I218-R220 PolarHBondContact O-N 2.83Å; I218-R220 VanDerWaalsContact O-N 3.1Å
221	H	94.5	Very high	97.5	Very high	58 Å²	58	34.3 Å²	34.3	27%	0.269	16%	0.157	S	C	.	.	S	Bend	trans	-123.8	143.7	179.8	-58.7	-82.7	0	0	0	111	L182 I218 S219 G224 L225	L182-H221 VanDerWaalsContact CD2-NE2 3.27Å; L182-H221 WeakPolarHBondContact CD2-NE2 3.33Å; I218-H221 PolarHBondContact O-N 2.84Å; I218-H221 VanDerWaalsContact O-N 3.1Å; S219-H221 PolarHBondContact O-N 3.06Å; H221-G224 PolarHBondContact O-N 3.23Å; H221-L225 PolarHBondContact O-N 3.13Å
222	Y	95.9	Very high	97.4	Very high	146 Å²	146	36 Å²	36	57%	0.573	18%	0.176	S	C	*	.	H	α-helix	trans	-55.7	-44.5	-178.5	-180	-98.8	0	0	0	114.3	G224 L225 L226	Y222-G224 VanDerWaalsContact C-N 3.27Å; Y222-G224 PolarHBondContact O-N 3.4Å; Y222-L225 PolarHBondContact O-N 3.4Å; Y222-L226 PolarHBondContact O-N 3.3Å
223	P	95.9	Very high	97.4	Very high	52 Å²	52	36 Å²	36	34%	0.338	18%	0.176	S	C	.	.	H	α-helix	trans	-57.2	-39.7	175.4	-26.1	35.9	0	0	0	113.1	A186 K187 L226 A227	A186-P223 CarbonylContact O-C 3.44Å; K187-P223 HydrophobicContact CG-CB 4.29Å; P223-L226 PolarHBondContact O-N 2.98Å; P223-A227 WeakPolarHBondContact O-CB 3.23Å; P223-A227 PolarHBondContact O-N 3.47Å
224	G	97.6	Very high	97.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-69.6	-39.7	178.1	0	0	0	0	0	112.6	A186 I218 H221 Y222 A227 I228	A186-G224 PolarHBondContact O-N 2.93Å; I218-G224 WeakPolarHBondContact O-CA 3.47Å; H221-G224 PolarHBondContact O-N 3.23Å; Y222-G224 VanDerWaalsContact C-N 3.27Å; Y222-G224 PolarHBondContact O-N 3.4Å; G224-A227 PolarHBondContact O-N 3.21Å; G224-I228 WeakPolarHBondContact O-CB 3.41Å; G224-I228 WeakPolarHBondContact O-CG1 3.02Å; G224-I228 PolarHBondContact O-N 3.11Å
225	L	98.1	Very high	97.4	Very high	6 Å²	6	38 Å²	38	3%	0.031	19%	0.188	C	C	.	.	H	α-helix	trans	-58.9	-47.6	173.3	-73.1	169	0	0	0	111.9	S219 H221 Y222 I228 F229 N258 L259 H262	S219-L225 VanDerWaalsContact O-CD2 3.31Å; S219-L225 WeakPolarHBondContact O-CD2 3.43Å; S219-L225 VanDerWaalsContact O-CG 3.24Å; S219-L225 WeakPolarHBondContact O-CG 3.25Å; H221-L225 PolarHBondContact O-N 3.13Å; Y222-L225 PolarHBondContact O-N 3.4Å; L225-I228 PolarHBondContact O-N 2.85Å; L225-F229 WeakPolarHBondContact O-CB 3.39Å; L225-F229 PolarHBondContact O-N 3.36Å; L225-N258 HydrophobicContact CD2-CB 3.94Å; L225-L259 HydrophobicContact CB-CD2 4.34Å; L225-L259 HydrophobicContact CD2-CD2 3.67Å; L225-L259 HydrophobicContact CD2-CG 3.89Å; L225-H262 HydrophobicContact CD1-CB 3.67Å
226	L	97.9	Very high	97.4	Very high	52 Å²	52	38 Å²	38	27%	0.272	19%	0.188	S	C	.	.	H	α-helix	trans	-62.1	-45.7	178.4	-178.5	62.1	0	0	0	111.1	Y222 P223 F229 Q230	Y222-L226 PolarHBondContact O-N 3.3Å; P223-L226 PolarHBondContact O-N 2.98Å; L226-F229 PolarHBondContact O-N 3.33Å; L226-Q230 HydrophobicContact CD1-CG 4.13Å; L226-Q230 HydrophobicContact CG-CG 4.47Å; L226-Q230 WeakPolarHBondContact O-CB 3.2Å; L226-Q230 WeakPolarHBondContact O-CG 3.45Å; L226-Q230 PolarHBondContact O-N 3.32Å
227	A	97.7	Very high	97.4	Very high	3 Å²	3	35.2 Å²	35.2	3%	0.025	18%	0.177	C	C	.	.	H	α-helix	trans	-61.6	-46.8	177.4	0	0	0	0	0	111.9	V192 P223 G224 F229 Q230 S231	V192-A227 HydrophobicContact CB-CB 4.04Å; V192-A227 HydrophobicContact CG1-CB 4.14Å; V192-A227 HydrophobicContact CG2-CB 3.83Å; P223-A227 WeakPolarHBondContact O-CB 3.23Å; P223-A227 PolarHBondContact O-N 3.47Å; G224-A227 PolarHBondContact O-N 3.21Å; A227-F229 VanDerWaalsContact C-N 3.27Å; A227-F229 PolarHBondContact O-N 3.22Å; A227-Q230 PolarHBondContact O-N 3.33Å; A227-S231 VanDerWaalsContact O-CB 3.25Å; A227-S231 WeakPolarHBondContact O-CB 3.21Å; A227-S231 PolarHBondContact O-N 2.94Å; A227-S231 PolarHBondContact O-OG 3.44Å
228	I	98.6	Very high	97.4	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-57.9	-43.5	176.8	-69.4	165.1	0	0	0	110.9	V192 L215 I218 G224 L225 G233 L237 T255 L259	V192-I228 HydrophobicContact CG1-CB 4.48Å; V192-I228 HydrophobicContact CG1-CG1 3.86Å; L215-I228 HydrophobicContact CB-CD1 4.36Å; L215-I228 HydrophobicContact CD2-CG1 4.2Å; L215-I228 WeakPolarHBondContact O-CD1 3.46Å; I218-I228 HydrophobicContact CD1-CD1 3.8Å; I218-I228 HydrophobicContact CD1-CG1 3.76Å; I218-I228 HydrophobicContact CG1-CD1 3.64Å; I218-I228 HydrophobicContact CG1-CG1 4.18Å; G224-I228 WeakPolarHBondContact O-CB 3.41Å; G224-I228 WeakPolarHBondContact O-CG1 3.02Å; G224-I228 PolarHBondContact O-N 3.11Å; L225-I228 PolarHBondContact O-N 2.85Å; I228-G233 WeakPolarHBondContact O-CA 3.34Å; I228-G233 PolarHBondContact O-N 3.33Å; I228-L237 HydrophobicContact CG2-CD1 4.04Å; I228-T255 HydrophobicContact CD1-CG2 4.05Å; I228-L259 HydrophobicContact CG2-CD1 3.91Å; I228-L259 HydrophobicContact CG2-CD2 4.4Å
229	F	98.3	Very high	97.4	Very high	62 Å²	62	40.2 Å²	40.2	27%	0.272	20%	0.195	S	C	.	.	H	α-helix	trans	-64.8	-50.3	179.9	-179.8	-102.8	0	0	0	111.9	L225 L226 A227 S231 G232 I234 L259 Q263 E269	L225-F229 WeakPolarHBondContact O-CB 3.39Å; L225-F229 PolarHBondContact O-N 3.36Å; L226-F229 PolarHBondContact O-N 3.33Å; A227-F229 VanDerWaalsContact C-N 3.27Å; A227-F229 PolarHBondContact O-N 3.22Å; F229-S231 VanDerWaalsContact C-N 3.33Å; F229-S231 PolarHBondContact O-N 3.36Å; F229-G232 PolarHBondContact O-N 2.97Å; F229-I234 HydrophobicContact CD2-CD1 3.65Å; F229-I234 HydrophobicContact CE2-CD1 4.02Å; F229-L259 HydrophobicContact CB-CD2 4.48Å; F229-Q263 HydrophobicContact CB-CG 3.8Å; F229-Q263 HydrophobicContact CD1-CG 4.37Å; F229-Q263 HydrophobicContact CD2-CG 4.02Å; F229-Q263 HydrophobicContact CG-CG 3.8Å; F229-E269 HydrophobicContact CE2-CB 4.33Å
230	Q	97.1	Very high	97.4	Very high	129 Å²	129	40.9 Å²	40.9	60%	0.603	20%	0.199	S	C	*	.	H	α-helix	trans	-67.5	-31.3	-178	-71.8	179.5	-20.6	0	0	113.1	L226 A227 G232	L226-Q230 HydrophobicContact CD1-CG 4.13Å; L226-Q230 HydrophobicContact CG-CG 4.47Å; L226-Q230 WeakPolarHBondContact O-CB 3.2Å; L226-Q230 WeakPolarHBondContact O-CG 3.45Å; L226-Q230 PolarHBondContact O-N 3.32Å; A227-Q230 PolarHBondContact O-N 3.33Å; Q230-G232 PolarHBondContact O-N 3.03Å
231	S	96.9	Very high	97.5	Very high	20 Å²	20	35.9 Å²	35.9	14%	0.14	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	11.4	178.4	-58.7	0	0	0	0	114	P189 A227 F229 G233	P189-S231 PolarHBondContact O-OG 3.43Å; A227-S231 VanDerWaalsContact O-CB 3.25Å; A227-S231 WeakPolarHBondContact O-CB 3.21Å; A227-S231 PolarHBondContact O-N 2.94Å; A227-S231 PolarHBondContact O-OG 3.44Å; F229-S231 VanDerWaalsContact C-N 3.33Å; F229-S231 PolarHBondContact O-N 3.36Å; S231-G233 VanDerWaalsContact C-N 3.34Å; S231-G233 PolarHBondContact O-N 3.32Å
232	G	95.8	Very high	97.6	Very high	39 Å²	39	36.8 Å²	36.8	40%	0.402	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.5	29.5	179.4	0	0	0	0	0	113.6	F229 Q230 I234 P235	F229-G232 PolarHBondContact O-N 2.97Å; Q230-G232 PolarHBondContact O-N 3.03Å; G232-I234 VanDerWaalsContact C-N 3.35Å; G232-I234 PolarHBondContact O-N 2.81Å; G232-P235 WeakPolarHBondContact O-CD 3.38Å
233	G	98.2	Very high	97.6	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-70.7	-25.9	-176.2	0	0	0	0	0	114.3	I196 I228 S231 A236 L237	I196-G233 VanDerWaalsContact CD1-CA 3.49Å; I228-G233 WeakPolarHBondContact O-CA 3.34Å; I228-G233 PolarHBondContact O-N 3.33Å; S231-G233 VanDerWaalsContact C-N 3.34Å; S231-G233 PolarHBondContact O-N 3.32Å; G233-A236 PolarHBondContact O-N 3.23Å; G233-L237 WeakPolarHBondContact O-CB 3.41Å; G233-L237 VanDerWaalsContact O-CG 3.26Å; G233-L237 WeakPolarHBondContact O-CG 3.45Å; G233-L237 PolarHBondContact O-N 2.84Å
234	I	98.6	Very high	97.5	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-60.7	-52.9	-178.7	-72.9	172.8	0	0	0	112.1	F229 G232 A236 L237 V238 L256 L259 E269 V270 A273	F229-I234 HydrophobicContact CD2-CD1 3.65Å; F229-I234 HydrophobicContact CE2-CD1 4.02Å; G232-I234 VanDerWaalsContact C-N 3.35Å; G232-I234 PolarHBondContact O-N 2.81Å; I234-A236 VanDerWaalsContact C-N 3.27Å; I234-A236 PolarHBondContact O-N 2.9Å; I234-L237 PolarHBondContact O-N 3.16Å; I234-V238 HydrophobicContact CG2-CG2 4.25Å; I234-V238 WeakPolarHBondContact O-CB 3.4Å; I234-V238 WeakPolarHBondContact O-CG2 3.33Å; I234-V238 PolarHBondContact O-N 3.37Å; I234-L256 HydrophobicContact CG1-CD2 4.43Å; I234-L256 HydrophobicContact CG2-CD2 4.38Å; I234-L259 HydrophobicContact CD1-CD1 4.48Å; I234-L259 HydrophobicContact CG1-CD1 3.9Å; I234-E269 HydrophobicContact CB-CG 3.91Å; I234-E269 HydrophobicContact CD1-CB 3.81Å; I234-E269 HydrophobicContact CD1-CG 4Å; I234-E269 HydrophobicContact CG2-CB 4.19Å; I234-E269 HydrophobicContact CG2-CG 3.84Å; I234-V270 HydrophobicContact CD1-CG2 4.29Å; I234-V270 HydrophobicContact CG1-CG2 4.47Å; I234-V270 HydrophobicContact CG2-CB 4.29Å; I234-V270 HydrophobicContact CG2-CG2 3.57Å; I234-A273 HydrophobicContact CG2-CB 4.38Å
235	P	98.4	Very high	97.4	Very high	43 Å²	43	36.7 Å²	36.7	28%	0.279	21%	0.208	S	C	.	.	H	α-helix	trans	-53.1	-42.5	174	-29.7	34.3	0	0	0	113.6	G232 V238 R239 A273	G232-P235 WeakPolarHBondContact O-CD 3.38Å; P235-V238 PolarHBondContact O-N 3.21Å; P235-R239 WeakPolarHBondContact O-CG 3.32Å; P235-R239 PolarHBondContact O-N 3Å; P235-A273 HydrophobicContact CB-CB 4.49Å; P235-A273 HydrophobicContact CG-CB 4.4Å
236	A	97.6	Very high	97.2	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.008	23%	0.228	C	C	.	.	H	α-helix	trans	-63.1	-49.3	177.9	0	0	0	0	0	111.8	I196 I199 G233 I234 V238 R239 L240	I196-A236 HydrophobicContact CG2-CB 4.12Å; I199-A236 HydrophobicContact CG2-CB 4.43Å; G233-A236 PolarHBondContact O-N 3.23Å; I234-A236 VanDerWaalsContact C-N 3.27Å; I234-A236 PolarHBondContact O-N 2.9Å; A236-V238 VanDerWaalsContact C-N 3.32Å; A236-V238 PolarHBondContact O-N 3.32Å; A236-R239 WeakPolarHBondContact O-CB 3.29Å; A236-R239 PolarHBondContact O-N 3.19Å; A236-R239 VanDerWaalsContact O-N 3.14Å; A236-L240 WeakPolarHBondContact O-CG 3.34Å; A236-L240 PolarHBondContact O-N 3.12Å; A236-L240 VanDerWaalsContact O-N 3.1Å
237	L	98.5	Very high	97.1	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.5	-39.8	177	-69.1	166.5	0	0	0	112.1	L215 I228 G233 I234 R239 L240 L241 A252 T255 L256 L259	L215-L237 HydrophobicContact CD1-CD2 4Å; L215-L237 HydrophobicContact CD1-CG 4.45Å; I228-L237 HydrophobicContact CG2-CD1 4.04Å; G233-L237 WeakPolarHBondContact O-CB 3.41Å; G233-L237 VanDerWaalsContact O-CG 3.26Å; G233-L237 WeakPolarHBondContact O-CG 3.45Å; G233-L237 PolarHBondContact O-N 2.84Å; I234-L237 PolarHBondContact O-N 3.16Å; L237-R239 VanDerWaalsContact C-N 3.35Å; L237-R239 PolarHBondContact O-N 3.32Å; L237-L240 WeakPolarHBondContact O-CB 3.48Å; L237-L240 PolarHBondContact O-N 2.92Å; L237-L241 PolarHBondContact O-N 2.71Å; L237-A252 HydrophobicContact CD2-CB 4.46Å; L237-T255 HydrophobicContact CD1-CG2 3.55Å; L237-T255 HydrophobicContact CD2-CG2 4.03Å; L237-T255 HydrophobicContact CG-CG2 4.47Å; L237-L256 HydrophobicContact CB-CD1 4.24Å; L237-L256 HydrophobicContact CB-CD2 3.82Å; L237-L256 HydrophobicContact CB-CG 3.91Å; L237-L256 HydrophobicContact CD1-CD2 4.06Å; L237-L256 HydrophobicContact CD1-CG 4.38Å; L237-L259 HydrophobicContact CD1-CD1 3.88Å
238	V	98.7	Very high	97.1	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.012	23%	0.228	C	C	.	.	H	α-helix	trans	-64.4	-38.3	175.8	169.3	0	0	0	0	111.4	I234 P235 A236 L240 L241 L256 V270 A273 K278	I234-V238 HydrophobicContact CG2-CG2 4.25Å; I234-V238 WeakPolarHBondContact O-CB 3.4Å; I234-V238 WeakPolarHBondContact O-CG2 3.33Å; I234-V238 PolarHBondContact O-N 3.37Å; P235-V238 PolarHBondContact O-N 3.21Å; A236-V238 VanDerWaalsContact C-N 3.32Å; A236-V238 PolarHBondContact O-N 3.32Å; V238-L240 VanDerWaalsContact C-N 3.32Å; V238-L240 PolarHBondContact O-N 3.02Å; V238-L241 WeakPolarHBondContact O-CB 3.47Å; V238-L241 PolarHBondContact O-N 2.88Å; V238-L256 HydrophobicContact CG2-CD1 4.09Å; V238-L256 HydrophobicContact CG2-CD2 4.34Å; V238-V270 HydrophobicContact CG2-CG1 4.5Å; V238-A273 HydrophobicContact CB-CB 4.09Å; V238-A273 HydrophobicContact CG1-CB 4.17Å; V238-A273 VanDerWaalsContact CG1-O 3.28Å; V238-A273 WeakPolarHBondContact CG1-O 3.36Å; V238-A273 HydrophobicContact CG2-CB 3.98Å; V238-K278 HydrophobicContact CG1-CD 3.73Å; V238-K278 VanDerWaalsContact O-CD 3.25Å; V238-K278 WeakPolarHBondContact O-CD 3.19Å
239	R	97	Very high	97.1	Very high	118 Å²	118	39.9 Å²	39.9	45%	0.445	23%	0.228	S	C	.	.	H	α-helix	trans	-61.8	-41.8	172.5	-67.6	-168.7	-35.2	-104.7	-10.6	111.5	N200 P235 A236 L237 L241 S242	N200-R239 VanDerWaalsContact OD1-CZ 3.24Å; N200-R239 PolarHBondContact OD1-NH1 3.49Å; N200-R239 PolarHBondContact OD1-NH2 2.81Å; P235-R239 WeakPolarHBondContact O-CG 3.32Å; P235-R239 PolarHBondContact O-N 3Å; A236-R239 WeakPolarHBondContact O-CB 3.29Å; A236-R239 PolarHBondContact O-N 3.19Å; A236-R239 VanDerWaalsContact O-N 3.14Å; L237-R239 VanDerWaalsContact C-N 3.35Å; L237-R239 PolarHBondContact O-N 3.32Å; R239-L241 PolarHBondContact O-N 3.4Å; R239-S242 PolarHBondContact O-N 2.87Å; R239-S242 VanDerWaalsContact O-N 3.12Å
240	L	97.7	Very high	97.1	Very high	17 Å²	17	40.9 Å²	40.9	9%	0.089	23%	0.232	C	C	.	.	H	α-helix	trans	-63.6	-19.5	179.9	-66.3	-174.9	0	0	0	114.5	I199 T208 A212 A236 L237 V238 S242 S243 V248 A252	I199-L240 HydrophobicContact CD1-CD1 4.34Å; I199-L240 HydrophobicContact CG2-CD1 3.98Å; I199-L240 HydrophobicContact CG2-CD2 3.99Å; I199-L240 HydrophobicContact CG2-CG 4.13Å; T208-L240 HydrophobicContact CG2-CD1 4.39Å; T208-L240 HydrophobicContact CG2-CD2 3.48Å; T208-L240 VanDerWaalsContact CG2-CD2 3.48Å; A212-L240 HydrophobicContact CB-CD1 4Å; A236-L240 WeakPolarHBondContact O-CG 3.34Å; A236-L240 PolarHBondContact O-N 3.12Å; A236-L240 VanDerWaalsContact O-N 3.1Å; L237-L240 WeakPolarHBondContact O-CB 3.48Å; L237-L240 PolarHBondContact O-N 2.92Å; V238-L240 VanDerWaalsContact C-N 3.32Å; V238-L240 PolarHBondContact O-N 3.02Å; L240-S242 PolarHBondContact O-N 3.34Å; L240-S242 VanDerWaalsContact O-N 3.12Å; L240-S243 WeakPolarHBondContact O-CB 3.31Å; L240-S243 PolarHBondContact O-N 2.91Å; L240-V248 HydrophobicContact CB-CG1 4.07Å; L240-V248 HydrophobicContact CD1-CG1 4.17Å; L240-V248 HydrophobicContact CD2-CG1 4.03Å; L240-V248 HydrophobicContact CG-CG1 4.32Å; L240-A252 HydrophobicContact CB-CB 3.78Å
241	L	98.4	Very high	97.1	Very high	5 Å²	5	37.3 Å²	37.3	3%	0.026	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-18.6	172.2	-63.9	-177.5	0	0	0	113.5	L237 V238 R239 A252 I253 L256 K278 M279 L282	L237-L241 PolarHBondContact O-N 2.71Å; V238-L241 WeakPolarHBondContact O-CB 3.47Å; V238-L241 PolarHBondContact O-N 2.88Å; R239-L241 PolarHBondContact O-N 3.4Å; L241-A252 HydrophobicContact CD2-CB 3.98Å; L241-I253 HydrophobicContact CD2-CB 3.94Å; L241-I253 HydrophobicContact CD2-CD1 4.06Å; L241-L256 HydrophobicContact CD1-CD1 3.85Å; L241-L256 HydrophobicContact CD2-CD1 4.12Å; L241-L256 HydrophobicContact CG-CD1 4.11Å; L241-K278 HydrophobicContact CB-CB 4.23Å; L241-K278 HydrophobicContact CD1-CB 4.21Å; L241-M279 HydrophobicContact CD1-CE 4.14Å; L241-M279 HydrophobicContact CD1-CG 3.82Å; L241-L282 HydrophobicContact CB-CD1 4.1Å; L241-L282 HydrophobicContact CD2-CD1 3.92Å; L241-L282 HydrophobicContact CG-CD1 4.41Å
242	S	96.6	Very high	97.2	Very high	77 Å²	77	36.3 Å²	36.3	54%	0.538	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	9.7	175.4	-57.9	0	0	0	0	113.4	R239 L240 K278	R239-S242 PolarHBondContact O-N 2.87Å; R239-S242 VanDerWaalsContact O-N 3.12Å; L240-S242 PolarHBondContact O-N 3.34Å; L240-S242 VanDerWaalsContact O-N 3.12Å; S242-K278 PolarHBondContact OG-NZ 3.32Å
243	S	95.7	Very high	97.3	Very high	23 Å²	23	34.5 Å²	34.5	16%	0.161	19%	0.188	C	C	.	.			trans	-62.9	142.2	177.6	178.8	0	0	0	0	111.2	L240 I245 V249	L240-S243 WeakPolarHBondContact O-CB 3.31Å; L240-S243 PolarHBondContact O-N 2.91Å; S243-I245 PolarHBondContact O-N 2.89Å; S243-I245 PolarHBondContact OG-N 3.27Å; S243-V249 VanDerWaalsContact O-CG2 3.27Å; S243-V249 WeakPolarHBondContact O-CG2 3.31Å
244	P	94	Very high	97.4	Very high	124 Å²	124	35.1 Å²	35.1	81%	0.805	19%	0.192	S	C	*	.	S	Bend	trans	-70.6	-11.9	171.8	29.6	-34.4	0	0	0	112.9
245	I	95.4	Very high	97.4	Very high	48 Å²	48	35.1 Å²	35.1	25%	0.246	19%	0.192	C	C	.	.			trans	-96.7	111.9	-174.8	-53.1	167.5	0	0	0	109.7	P205 S243 S247 V248 V249	P205-I245 HydrophobicContact CB-CD1 3.5Å; P205-I245 VanDerWaalsContact CB-CD1 3.5Å; P205-I245 HydrophobicContact CG-CD1 4.23Å; S243-I245 PolarHBondContact O-N 2.89Å; S243-I245 PolarHBondContact OG-N 3.27Å; I245-S247 VanDerWaalsContact C-N 3.29Å; I245-S247 WeakPolarHBondContact CG2-OG 3.12Å; I245-S247 PolarHBondContact O-N 3.39Å; I245-V248 HydrophobicContact CB-CB 4.14Å; I245-V248 HydrophobicContact CB-CG2 3.84Å; I245-V248 HydrophobicContact CD1-CG2 4.17Å; I245-V248 HydrophobicContact CG2-CB 4.46Å; I245-V248 HydrophobicContact CG2-CG2 3.9Å; I245-V248 WeakPolarHBondContact O-CB 3.36Å; I245-V248 PolarHBondContact O-N 3.39Å; I245-V249 PolarHBondContact O-N 3.25Å; I245-V249 VanDerWaalsContact O-N 3.12Å
246	D	95.2	Very high	97.4	Very high	85 Å²	85	33 Å²	33	46%	0.455	18%	0.179	S	C	.	.	H	α-helix	trans	-57.9	-37.2	-175.1	-75.1	-26.6	0	0	0	113.6	V248 V249 F250 K285	D246-V248 VanDerWaalsContact C-N 3.32Å; D246-V248 PolarHBondContact O-N 3.49Å; D246-V249 PolarHBondContact O-N 2.9Å; D246-F250 WeakPolarHBondContact O-CB 3.33Å; D246-F250 PolarHBondContact O-N 2.93Å; D246-K285 IonicContact OD1-NZ 3.27Å; D246-K285 PolarHBondContact OD1-NZ 3.22Å
247	S	95.5	Very high	97.4	Very high	42 Å²	42	34.3 Å²	34.3	29%	0.294	18%	0.184	S	C	.	.	H	α-helix	trans	-64.8	-36.3	176.9	60.9	0	0	0	0	112.5	I245 F250 Y251	I245-S247 VanDerWaalsContact C-N 3.29Å; I245-S247 WeakPolarHBondContact CG2-OG 3.12Å; I245-S247 PolarHBondContact O-N 3.39Å; S247-F250 PolarHBondContact O-N 3.07Å; S247-Y251 WeakPolarHBondContact O-CD2 3.43Å; S247-Y251 PolarHBondContact O-N 2.96Å
248	V	97.3	Very high	97.5	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-65.8	-46.4	175.6	173.2	0	0	0	0	110	T208 K209 A212 L240 I245 D246 F250 Y251 A252	T208-V248 HydrophobicContact CG2-CG1 3.82Å; T208-V248 HydrophobicContact CG2-CG2 4.17Å; K209-V248 HydrophobicContact CB-CG2 3.9Å; A212-V248 HydrophobicContact CB-CG1 4.47Å; L240-V248 HydrophobicContact CB-CG1 4.07Å; L240-V248 HydrophobicContact CD1-CG1 4.17Å; L240-V248 HydrophobicContact CD2-CG1 4.03Å; L240-V248 HydrophobicContact CG-CG1 4.32Å; I245-V248 HydrophobicContact CB-CB 4.14Å; I245-V248 HydrophobicContact CB-CG2 3.84Å; I245-V248 HydrophobicContact CD1-CG2 4.17Å; I245-V248 HydrophobicContact CG2-CB 4.46Å; I245-V248 HydrophobicContact CG2-CG2 3.9Å; I245-V248 WeakPolarHBondContact O-CB 3.36Å; I245-V248 PolarHBondContact O-N 3.39Å; D246-V248 VanDerWaalsContact C-N 3.32Å; D246-V248 PolarHBondContact O-N 3.49Å; V248-F250 VanDerWaalsContact C-N 3.29Å; V248-F250 PolarHBondContact O-N 3.16Å; V248-Y251 PolarHBondContact O-N 3.29Å; V248-A252 WeakPolarHBondContact O-CB 3.35Å; V248-A252 PolarHBondContact O-N 3.22Å
249	V	98	Very high	97.5	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.012	19%	0.191	C	C	.	.	H	α-helix	trans	-60.8	-41.1	177.3	-179	0	0	0	0	110.7	S243 I245 D246 A252 I253 L282 F290	S243-V249 VanDerWaalsContact O-CG2 3.27Å; S243-V249 WeakPolarHBondContact O-CG2 3.31Å; I245-V249 PolarHBondContact O-N 3.25Å; I245-V249 VanDerWaalsContact O-N 3.12Å; D246-V249 PolarHBondContact O-N 2.9Å; V249-A252 PolarHBondContact O-N 2.61Å; V249-I253 WeakPolarHBondContact O-CG2 3.36Å; V249-I253 PolarHBondContact O-N 3.49Å; V249-L282 HydrophobicContact CG1-CD1 3.91Å; V249-L282 HydrophobicContact CG1-CD2 3.74Å; V249-L282 HydrophobicContact CG1-CG 4.49Å; V249-F290 HydrophobicContact CG1-CE2 3.94Å; V249-F290 HydrophobicContact CG1-CZ 3.75Å
250	F	98.1	Very high	97.5	Very high	82 Å²	82	30.2 Å²	30.2	36%	0.36	17%	0.171	S	C	.	.	H	α-helix	trans	-61.8	-47.4	176.8	-174.1	-88.3	0	0	0	112.3	D246 S247 V248 I253 T254 F290 I293	D246-F250 WeakPolarHBondContact O-CB 3.33Å; D246-F250 PolarHBondContact O-N 2.93Å; S247-F250 PolarHBondContact O-N 3.07Å; V248-F250 VanDerWaalsContact C-N 3.29Å; V248-F250 PolarHBondContact O-N 3.16Å; F250-I253 WeakPolarHBondContact O-CG2 3.39Å; F250-T254 WeakPolarHBondContact O-CB 3.39Å; F250-T254 PolarHBondContact O-N 3.25Å; F250-T254 VanDerWaalsContact O-N 3.1Å; F250-T254 PolarHBondContact O-OG1 3.32Å; F250-F290 AromaticContact CD2-CD2 3.99Å; F250-F290 HydrophobicContact CD2-CD2 3.99Å; F250-I293 HydrophobicContact CE2-CD1 4.36Å
251	Y	98.2	Very high	97.5	Very high	54 Å²	54	32.9 Å²	32.9	21%	0.212	19%	0.185	C	C	.	.	H	α-helix	trans	-62.1	-44.9	175	-70.5	-47.5	0	0	0	111.5	A212 Y216 S247 V248 T254 T255	A212-Y251 HydrophobicContact CB-CD2 4.44Å; Y216-Y251 AromaticContact CD1-CD1 3.65Å; Y216-Y251 HydrophobicContact CD1-CD1 3.65Å; Y216-Y251 AromaticContact CD1-CE1 3.71Å; Y216-Y251 HydrophobicContact CD1-CE1 3.71Å; Y216-Y251 HydrophobicContact CE1-CD1 4.47Å; Y216-Y251 HydrophobicContact CE1-CE1 4.28Å; Y216-Y251 AromaticContact CG-CD1 3.69Å; Y216-Y251 HydrophobicContact CG-CD1 3.69Å; Y216-Y251 HydrophobicContact CG-CE1 4.24Å; S247-Y251 WeakPolarHBondContact O-CD2 3.43Å; S247-Y251 PolarHBondContact O-N 2.96Å; V248-Y251 PolarHBondContact O-N 3.29Å; Y251-T254 PolarHBondContact O-N 2.83Å; Y251-T255 WeakPolarHBondContact O-CB 3.33Å; Y251-T255 PolarHBondContact O-N 3.07Å; Y251-T255 PolarHBondContact O-OG1 3.48Å
252	A	98.7	Very high	97.5	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60.5	-50.8	-179.4	0	0	0	0	0	112.2	L237 L240 L241 V248 V249 T254 T255 L256	L237-A252 HydrophobicContact CD2-CB 4.46Å; L240-A252 HydrophobicContact CB-CB 3.78Å; L241-A252 HydrophobicContact CD2-CB 3.98Å; V248-A252 WeakPolarHBondContact O-CB 3.35Å; V248-A252 PolarHBondContact O-N 3.22Å; V249-A252 PolarHBondContact O-N 2.61Å; A252-T254 PolarHBondContact O-N 2.67Å; A252-T255 PolarHBondContact O-N 3.35Å; A252-L256 WeakPolarHBondContact O-CG 3.43Å; A252-L256 PolarHBondContact O-N 3.4Å
253	I	98.6	Very high	97.6	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-66.3	-38.4	-178.8	-166.6	63.6	0	0	0	112	L241 V249 F250 L256 H257 M279 F290 I293 V294 C297	L241-I253 HydrophobicContact CD2-CB 3.94Å; L241-I253 HydrophobicContact CD2-CD1 4.06Å; V249-I253 WeakPolarHBondContact O-CG2 3.36Å; V249-I253 PolarHBondContact O-N 3.49Å; F250-I253 WeakPolarHBondContact O-CG2 3.39Å; I253-L256 PolarHBondContact O-N 3.42Å; I253-H257 WeakPolarHBondContact O-CB 3.24Å; I253-H257 PolarHBondContact O-N 3.35Å; I253-M279 HydrophobicContact CD1-CE 3.79Å; I253-M279 HydrophobicContact CD1-CG 3.92Å; I253-M279 HydrophobicContact CD1-SD 4.14Å; I253-F290 HydrophobicContact CB-CE2 4.38Å; I253-F290 HydrophobicContact CG2-CD2 3.94Å; I253-F290 HydrophobicContact CG2-CE2 3.5Å; I253-F290 HydrophobicContact CG2-CZ 4.4Å; I253-I293 HydrophobicContact CG1-CG2 4.1Å; I253-I293 HydrophobicContact CG2-CG2 4.38Å; I253-V294 HydrophobicContact CD1-CG2 4.39Å; I253-V294 HydrophobicContact CG1-CG2 3.95Å; I253-C297 HydrophobicContact CD1-CB 4.36Å
254	T	98.4	Very high	97.6	Very high	14 Å²	14	42.7 Å²	42.7	9%	0.086	22%	0.22	C	C	.	.	H	α-helix	trans	-70.4	-36.8	-179.2	-50.1	0	0	0	0	111	Y216 F250 Y251 A252 H257 N258	Y216-T254 HydrophobicContact CD2-CG2 3.85Å; Y216-T254 HydrophobicContact CE2-CG2 3.52Å; F250-T254 WeakPolarHBondContact O-CB 3.39Å; F250-T254 PolarHBondContact O-N 3.25Å; F250-T254 VanDerWaalsContact O-N 3.1Å; F250-T254 PolarHBondContact O-OG1 3.32Å; Y251-T254 PolarHBondContact O-N 2.83Å; A252-T254 PolarHBondContact O-N 2.67Å; T254-H257 WeakPolarHBondContact O-CB 3.32Å; T254-H257 PolarHBondContact O-N 3.5Å; T254-N258 PolarHBondContact O-N 3.39Å
255	T	98.8	Very high	97.7	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63.9	-45	173	-52.3	0	0	0	0	111.1	L215 Y216 I228 L237 Y251 A252 H257 N258 L259	L215-T255 HydrophobicContact CB-CG2 4.37Å; Y216-T255 WeakPolarHBondContact CA-OG1 3.23Å; Y216-T255 WeakPolarHBondContact CB-OG1 3.44Å; Y216-T255 PolarHBondContact N-OG1 2.98Å; I228-T255 HydrophobicContact CD1-CG2 4.05Å; L237-T255 HydrophobicContact CD1-CG2 3.55Å; L237-T255 HydrophobicContact CD2-CG2 4.03Å; L237-T255 HydrophobicContact CG-CG2 4.47Å; Y251-T255 WeakPolarHBondContact O-CB 3.33Å; Y251-T255 PolarHBondContact O-N 3.07Å; Y251-T255 PolarHBondContact O-OG1 3.48Å; A252-T255 PolarHBondContact O-N 3.35Å; T255-H257 VanDerWaalsContact C-N 3.31Å; T255-H257 PolarHBondContact O-N 3.08Å; T255-N258 PolarHBondContact O-N 3.48Å; T255-L259 HydrophobicContact CG2-CD1 4.43Å; T255-L259 WeakPolarHBondContact O-CG 3.37Å; T255-L259 PolarHBondContact O-N 2.92Å; T255-L259 VanDerWaalsContact O-N 3.08Å
256	L	98.9	Very high	97.9	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.1	-38.8	174.8	-71.9	172.7	0	0	0	111.8	I234 L237 V238 L241 A252 I253 L259 L260 V270 M279	I234-L256 HydrophobicContact CG1-CD2 4.43Å; I234-L256 HydrophobicContact CG2-CD2 4.38Å; L237-L256 HydrophobicContact CB-CD1 4.24Å; L237-L256 HydrophobicContact CB-CD2 3.82Å; L237-L256 HydrophobicContact CB-CG 3.91Å; L237-L256 HydrophobicContact CD1-CD2 4.06Å; L237-L256 HydrophobicContact CD1-CG 4.38Å; V238-L256 HydrophobicContact CG2-CD1 4.09Å; V238-L256 HydrophobicContact CG2-CD2 4.34Å; L241-L256 HydrophobicContact CD1-CD1 3.85Å; L241-L256 HydrophobicContact CD2-CD1 4.12Å; L241-L256 HydrophobicContact CG-CD1 4.11Å; A252-L256 WeakPolarHBondContact O-CG 3.43Å; A252-L256 PolarHBondContact O-N 3.4Å; I253-L256 PolarHBondContact O-N 3.42Å; L256-L259 HydrophobicContact CD2-CD1 4.4Å; L256-L259 PolarHBondContact O-N 3.4Å; L256-L260 VanDerWaalsContact O-CG 3.22Å; L256-L260 WeakPolarHBondContact O-CG 3.41Å; L256-L260 PolarHBondContact O-N 3.41Å; L256-V270 HydrophobicContact CD2-CG2 3.91Å; L256-M279 HydrophobicContact CB-CE 4.32Å; L256-M279 HydrophobicContact CD1-CE 3.81Å
257	H	98.8	Very high	98.1	Very high	27 Å²	27	35.6 Å²	35.6	13%	0.125	18%	0.18	C	C	.	.	H	α-helix	trans	-59.5	-48.7	175.8	-172.5	-145	0	0	0	111.7	I253 T254 T255 L259 L260 L261 I293 D296 C297	I253-H257 WeakPolarHBondContact O-CB 3.24Å; I253-H257 PolarHBondContact O-N 3.35Å; T254-H257 WeakPolarHBondContact O-CB 3.32Å; T254-H257 PolarHBondContact O-N 3.5Å; T255-H257 VanDerWaalsContact C-N 3.31Å; T255-H257 PolarHBondContact O-N 3.08Å; H257-L259 VanDerWaalsContact C-N 3.3Å; H257-L259 PolarHBondContact O-N 3.5Å; H257-L260 PolarHBondContact O-N 2.94Å; H257-L261 WeakPolarHBondContact O-CG 3.37Å; H257-L261 PolarHBondContact O-N 3.07Å; H257-L261 VanDerWaalsContact O-N 3.12Å; H257-I293 HydrophobicContact CB-CG2 3.84Å; H257-D296 IonicContact CD2-OD2 2.79Å; H257-D296 IonicContact CE1-OD2 3.6Å; H257-D296 IonicContact NE2-OD2 3.39Å; H257-D296 PolarHBondContact NE2-OD2 2.95Å; H257-C297 VanDerWaalsContact CB-SG 3.55Å
258	N	98.7	Very high	98.2	Very high	29 Å²	29	39.6 Å²	39.6	16%	0.155	19%	0.194	C	C	.	.	H	α-helix	trans	-58.9	-41.7	176.4	-66.6	-18.6	0	0	0	111.7	S219 L225 T254 T255 L261 H262	S219-N258 PolarHBondContact OG-ND2 2.91Å; L225-N258 HydrophobicContact CD2-CB 3.94Å; T254-N258 PolarHBondContact O-N 3.39Å; T255-N258 PolarHBondContact O-N 3.48Å; N258-L261 PolarHBondContact O-N 3.11Å; N258-H262 WeakPolarHBondContact O-CB 3.38Å; N258-H262 PolarHBondContact O-N 2.9Å
259	L	98.8	Very high	98.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-63	-44.5	175.6	-71.9	163.4	0	0	0	112.3	L225 I228 F229 I234 L237 T255 L256 H257 L261 H262 Q263 S266	L225-L259 HydrophobicContact CB-CD2 4.34Å; L225-L259 HydrophobicContact CD2-CD2 3.67Å; L225-L259 HydrophobicContact CD2-CG 3.89Å; I228-L259 HydrophobicContact CG2-CD1 3.91Å; I228-L259 HydrophobicContact CG2-CD2 4.4Å; F229-L259 HydrophobicContact CB-CD2 4.48Å; I234-L259 HydrophobicContact CD1-CD1 4.48Å; I234-L259 HydrophobicContact CG1-CD1 3.9Å; L237-L259 HydrophobicContact CD1-CD1 3.88Å; T255-L259 HydrophobicContact CG2-CD1 4.43Å; T255-L259 WeakPolarHBondContact O-CG 3.37Å; T255-L259 PolarHBondContact O-N 2.92Å; T255-L259 VanDerWaalsContact O-N 3.08Å; L256-L259 HydrophobicContact CD2-CD1 4.4Å; L256-L259 PolarHBondContact O-N 3.4Å; H257-L259 VanDerWaalsContact C-N 3.3Å; H257-L259 PolarHBondContact O-N 3.5Å; L259-L261 VanDerWaalsContact C-N 3.25Å; L259-L261 PolarHBondContact O-N 3.3Å; L259-H262 PolarHBondContact O-N 3.15Å; L259-Q263 HydrophobicContact CD2-CB 3.93Å; L259-Q263 HydrophobicContact CD2-CG 4.15Å; L259-Q263 WeakPolarHBondContact O-CA 3.34Å; L259-Q263 WeakPolarHBondContact O-CB 3.43Å; L259-Q263 PolarHBondContact O-N 3.17Å; L259-S266 VanDerWaalsContact C-OG 3.3Å; L259-S266 WeakPolarHBondContact O-CB 3.2Å; L259-S266 PolarHBondContact O-OG 3.22Å
260	L	98.6	Very high	98.3	Very high	5 Å²	5	42.1 Å²	42.1	3%	0.026	21%	0.206	C	C	.	.	H	α-helix	trans	-63.9	-30.5	-179.4	-70.7	171	0	0	0	113.2	L256 H257 S266 K267 V270 C297 N300 L301	L256-L260 VanDerWaalsContact O-CG 3.22Å; L256-L260 WeakPolarHBondContact O-CG 3.41Å; L256-L260 PolarHBondContact O-N 3.41Å; H257-L260 PolarHBondContact O-N 2.94Å; L260-S266 WeakPolarHBondContact CA-OG 3.36Å; L260-K267 HydrophobicContact CD2-CB 4.27Å; L260-K267 HydrophobicContact CD2-CG 3.76Å; L260-K267 WeakPolarHBondContact O-CE 3.48Å; L260-V270 HydrophobicContact CD2-CB 4.34Å; L260-V270 HydrophobicContact CD2-CG2 4.08Å; L260-C297 HydrophobicContact CD1-CB 3.82Å; L260-N300 HydrophobicContact CB-CB 4.48Å; L260-L301 HydrophobicContact CD1-CD1 4.2Å; L260-L301 HydrophobicContact CD1-CD2 4.49Å; L260-L301 HydrophobicContact CD1-CG 4.11Å; L260-L301 HydrophobicContact CD2-CD2 3.54Å; L260-L301 HydrophobicContact CD2-CG 4.02Å
261	L	97.9	Very high	98.3	Very high	74 Å²	74	40.8 Å²	40.8	39%	0.387	20%	0.198	S	C	.	.	H	α-helix	trans	-85.1	-36.9	179.8	-67.5	178.8	0	0	0	113.1	H257 N258 L259	H257-L261 WeakPolarHBondContact O-CG 3.37Å; H257-L261 PolarHBondContact O-N 3.07Å; H257-L261 VanDerWaalsContact O-N 3.12Å; N258-L261 PolarHBondContact O-N 3.11Å; L259-L261 VanDerWaalsContact C-N 3.25Å; L259-L261 PolarHBondContact O-N 3.3Å
262	H	97.3	Very high	98.3	Very high	119 Å²	119	47.3 Å²	47.3	55%	0.551	22%	0.223	S	C	*	.	H	α-helix	trans	-125.7	-5.5	-163.2	-58.1	-54.2	0	0	0	115	L225 N258 L259	L225-H262 HydrophobicContact CD1-CB 3.67Å; N258-H262 WeakPolarHBondContact O-CB 3.38Å; N258-H262 PolarHBondContact O-N 2.9Å; L259-H262 PolarHBondContact O-N 3.15Å
263	Q	97.9	Very high	98.3	Very high	19 Å²	19	48.8 Å²	48.8	9%	0.089	24%	0.235	C	C	.	.	S	Bend	trans	-117.8	116.5	177.9	179.3	55.6	39.4	0	0	111.3	F229 L259 S266	F229-Q263 HydrophobicContact CB-CG 3.8Å; F229-Q263 HydrophobicContact CD1-CG 4.37Å; F229-Q263 HydrophobicContact CD2-CG 4.02Å; F229-Q263 HydrophobicContact CG-CG 3.8Å; L259-Q263 HydrophobicContact CD2-CB 3.93Å; L259-Q263 HydrophobicContact CD2-CG 4.15Å; L259-Q263 WeakPolarHBondContact O-CA 3.34Å; L259-Q263 WeakPolarHBondContact O-CB 3.43Å; L259-Q263 PolarHBondContact O-N 3.17Å; Q263-S266 VanDerWaalsContact O-CB 3.29Å; Q263-S266 WeakPolarHBondContact O-CB 3.36Å; Q263-S266 PolarHBondContact O-N 2.94Å; Q263-S266 PolarHBondContact O-OG 3.09Å
264	Q	96.4	Very high	98.3	Very high	173 Å²	173	50.3 Å²	50.3	81%	0.808	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	142.6	174.8	-66	-66	-13	0	0	111.1	S266	Q264-S266 PolarHBondContact O-N 2.65Å
265	G	97.2	Very high	98.3	Very high	35 Å²	35	49.7 Å²	49.7	36%	0.361	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.1	-15.8	-176.8	0	0	0	0	0	115.4	K267 E268 E269	G265-K267 VanDerWaalsContact C-N 3.3Å; G265-K267 PolarHBondContact O-N 3.24Å; G265-E268 PolarHBondContact O-N 3.49Å; G265-E269 PolarHBondContact O-N 2.93Å
266	S	98.4	Very high	98.3	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.007	25%	0.248	C	C	.	.	H	α-helix	trans	-60.2	-36.6	-177.8	66.4	0	0	0	0	113.4	L259 L260 Q263 Q264 E268 E269 V270	L259-S266 VanDerWaalsContact C-OG 3.3Å; L259-S266 WeakPolarHBondContact O-CB 3.2Å; L259-S266 PolarHBondContact O-OG 3.22Å; L260-S266 WeakPolarHBondContact CA-OG 3.36Å; Q263-S266 VanDerWaalsContact O-CB 3.29Å; Q263-S266 WeakPolarHBondContact O-CB 3.36Å; Q263-S266 PolarHBondContact O-N 2.94Å; Q263-S266 PolarHBondContact O-OG 3.09Å; Q264-S266 PolarHBondContact O-N 2.65Å; S266-E268 PolarHBondContact O-N 2.67Å; S266-E269 PolarHBondContact O-N 3.25Å; S266-V270 VanDerWaalsContact O-CG2 3.3Å; S266-V270 WeakPolarHBondContact O-CG2 3.39Å; S266-V270 PolarHBondContact O-N 2.72Å
267	K	98.6	Very high	98.3	Very high	71 Å²	71	52.4 Å²	52.4	31%	0.309	26%	0.264	S	S	.	.	H	α-helix	trans	-59.6	-44.2	-179.7	-63.8	-176.4	179.6	-172.3	0	112	L260 G265 R271 L301	L260-K267 HydrophobicContact CD2-CB 4.27Å; L260-K267 HydrophobicContact CD2-CG 3.76Å; L260-K267 WeakPolarHBondContact O-CE 3.48Å; G265-K267 VanDerWaalsContact C-N 3.3Å; G265-K267 PolarHBondContact O-N 3.24Å; K267-R271 VanDerWaalsContact O-CG 3.26Å; K267-R271 WeakPolarHBondContact O-CG 3.22Å; K267-R271 PolarHBondContact O-N 3.46Å; K267-L301 HydrophobicContact CB-CD2 4.29Å
268	E	98.4	Very high	98.3	Very high	127 Å²	127	54 Å²	54	59%	0.593	27%	0.271	S	S	*	.	H	α-helix	trans	-67.4	-42.3	178.8	-66.5	-179.7	-179.5	0	0	111.3	G265 S266 R271 R272	G265-E268 PolarHBondContact O-N 3.49Å; S266-E268 PolarHBondContact O-N 2.67Å; E268-R271 WeakPolarHBondContact O-CB 3.34Å; E268-R271 PolarHBondContact O-N 3.4Å; E268-R272 WeakPolarHBondContact O-CB 3.36Å; E268-R272 PolarHBondContact O-N 3.26Å
269	E	98.5	Very high	98.3	Very high	55 Å²	55	52.7 Å²	52.7	26%	0.257	26%	0.264	S	S	.	.	H	α-helix	trans	-68.5	-38.8	-178.9	-167.2	57.2	-153.2	0	0	112.1	F229 I234 G265 S266 R271 R272 A273	F229-E269 HydrophobicContact CE2-CB 4.33Å; I234-E269 HydrophobicContact CB-CG 3.91Å; I234-E269 HydrophobicContact CD1-CB 3.81Å; I234-E269 HydrophobicContact CD1-CG 4Å; I234-E269 HydrophobicContact CG2-CB 4.19Å; I234-E269 HydrophobicContact CG2-CG 3.84Å; G265-E269 PolarHBondContact O-N 2.93Å; S266-E269 PolarHBondContact O-N 3.25Å; E269-R271 VanDerWaalsContact C-N 3.31Å; E269-R271 PolarHBondContact O-N 2.9Å; E269-R272 PolarHBondContact O-N 2.83Å; E269-R272 IonicContact OE2-NE 2.7Å; E269-A273 VanDerWaalsContact O-CB 3.32Å; E269-A273 WeakPolarHBondContact O-CB 3.46Å; E269-A273 PolarHBondContact O-N 3.05Å
270	V	98.9	Very high	98.3	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.9	-38.7	174.3	171.7	0	0	0	0	111.3	I234 V238 L256 L260 S266 G275 M279 L301	I234-V270 HydrophobicContact CD1-CG2 4.29Å; I234-V270 HydrophobicContact CG1-CG2 4.47Å; I234-V270 HydrophobicContact CG2-CB 4.29Å; I234-V270 HydrophobicContact CG2-CG2 3.57Å; V238-V270 HydrophobicContact CG2-CG1 4.5Å; L256-V270 HydrophobicContact CD2-CG2 3.91Å; L260-V270 HydrophobicContact CD2-CB 4.34Å; L260-V270 HydrophobicContact CD2-CG2 4.08Å; S266-V270 VanDerWaalsContact O-CG2 3.3Å; S266-V270 WeakPolarHBondContact O-CG2 3.39Å; S266-V270 PolarHBondContact O-N 2.72Å; V270-G275 WeakPolarHBondContact O-CA 3.27Å; V270-G275 PolarHBondContact O-N 3.45Å; V270-M279 HydrophobicContact CG1-CE 3.94Å; V270-L301 HydrophobicContact CB-CD2 4.05Å; V270-L301 HydrophobicContact CG1-CD1 3.74Å; V270-L301 HydrophobicContact CG1-CD2 3.94Å; V270-L301 HydrophobicContact CG1-CG 4.49Å
271	R	98.6	Very high	98.3	Very high	53 Å²	53	57 Å²	57	20%	0.2	29%	0.29	C	S	.	.	H	α-helix	trans	-64.3	-48.6	174.5	-68.3	169.5	-166.5	138.1	-4.3	110.7	K267 E268 E269 A273 G274 V276 L301 H305 T308	K267-R271 VanDerWaalsContact O-CG 3.26Å; K267-R271 WeakPolarHBondContact O-CG 3.22Å; K267-R271 PolarHBondContact O-N 3.46Å; E268-R271 WeakPolarHBondContact O-CB 3.34Å; E268-R271 PolarHBondContact O-N 3.4Å; E269-R271 VanDerWaalsContact C-N 3.31Å; E269-R271 PolarHBondContact O-N 2.9Å; R271-A273 VanDerWaalsContact C-N 3.3Å; R271-A273 PolarHBondContact O-N 2.97Å; R271-G274 PolarHBondContact O-N 3.32Å; R271-V276 HydrophobicContact CG-CG2 4.39Å; R271-L301 HydrophobicContact CG-CD2 4.09Å; R271-L301 PolarHBondContact NE-O 3.3Å; R271-L301 VanDerWaalsContact NE-O 3.15Å; R271-L301 PolarHBondContact NH2-O 3.49Å; R271-H305 PolarHBondContact NH1-CD2 3.27Å; R271-T308 WeakPolarHBondContact CD-OG1 3.22Å; R271-T308 PolarHBondContact NE-OG1 3.36Å
272	R	98.3	Very high	98.3	Very high	192 Å²	192	54 Å²	54	73%	0.725	27%	0.274	S	S	*	.	H	α-helix	trans	-60.1	-38.2	179.4	-170.4	-174.6	-55.7	-145.6	1.6	112.7	E268 E269 G274	E268-R272 WeakPolarHBondContact O-CB 3.36Å; E268-R272 PolarHBondContact O-N 3.26Å; E269-R272 PolarHBondContact O-N 2.83Å; E269-R272 IonicContact OE2-NE 2.7Å; R272-G274 PolarHBondContact O-N 3.29Å
273	A	98.3	Very high	98.4	Very high	31 Å²	31	48.4 Å²	48.4	26%	0.256	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-0.5	176.7	0	0	0	0	0	114	I234 P235 V238 E269 R271	I234-A273 HydrophobicContact CG2-CB 4.38Å; P235-A273 HydrophobicContact CB-CB 4.49Å; P235-A273 HydrophobicContact CG-CB 4.4Å; V238-A273 HydrophobicContact CB-CB 4.09Å; V238-A273 HydrophobicContact CG1-CB 4.17Å; V238-A273 VanDerWaalsContact CG1-O 3.28Å; V238-A273 WeakPolarHBondContact CG1-O 3.36Å; V238-A273 HydrophobicContact CG2-CB 3.98Å; E269-A273 VanDerWaalsContact O-CB 3.32Å; E269-A273 WeakPolarHBondContact O-CB 3.46Å; E269-A273 PolarHBondContact O-N 3.05Å; R271-A273 VanDerWaalsContact C-N 3.3Å; R271-A273 PolarHBondContact O-N 2.97Å
274	G	98.3	Very high	98.4	Very high	32 Å²	32	53.5 Å²	53.5	33%	0.33	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.4	30.6	-178	0	0	0	0	0	113.2	R271 R272 P277	R271-G274 PolarHBondContact O-N 3.32Å; R272-G274 PolarHBondContact O-N 3.29Å; G274-P277 WeakPolarHBondContact O-CD 3.48Å
275	G	98.8	Very high	98.4	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-68	-32.8	-178.2	0	0	0	0	0	113.9	V270 K278 M279	V270-G275 WeakPolarHBondContact O-CA 3.27Å; V270-G275 PolarHBondContact O-N 3.45Å; G275-K278 PolarHBondContact O-N 3.5Å; G275-M279 VanDerWaalsContact O-CG 3.3Å; G275-M279 WeakPolarHBondContact O-CG 3.1Å; G275-M279 PolarHBondContact O-N 3.33Å
276	V	98.9	Very high	98.3	Very high	5 Å²	5	51.4 Å²	51.4	3%	0.03	26%	0.259	C	S	.	.	H	α-helix	trans	-62.1	-54.1	-173.6	177.6	0	0	0	0	112.4	R271 K278 M279 V280 L298 L301 T308 V311 I312	R271-V276 HydrophobicContact CG-CG2 4.39Å; V276-K278 VanDerWaalsContact C-N 3.3Å; V276-K278 PolarHBondContact O-N 3.05Å; V276-M279 PolarHBondContact O-N 3.27Å; V276-V280 WeakPolarHBondContact O-CG2 3.33Å; V276-V280 PolarHBondContact O-N 2.98Å; V276-L298 HydrophobicContact CG1-CD2 3.99Å; V276-L301 HydrophobicContact CG2-CB 4.43Å; V276-L301 HydrophobicContact CG2-CD1 4.01Å; V276-T308 HydrophobicContact CG1-CG2 4.04Å; V276-T308 HydrophobicContact CG2-CG2 3.89Å; V276-V311 HydrophobicContact CB-CG1 4.02Å; V276-V311 HydrophobicContact CG1-CB 4.25Å; V276-V311 HydrophobicContact CG1-CG1 3.76Å; V276-I312 HydrophobicContact CG1-CD1 4.33Å; V276-I312 HydrophobicContact CG1-CG1 3.52Å
277	P	98.7	Very high	98.2	Very high	52 Å²	52	55.1 Å²	55.1	34%	0.338	28%	0.278	S	S	.	.	H	α-helix	trans	-59.7	-39.1	178.6	-23.8	34.2	0	0	0	113.1	G274 V280 V281 V311	G274-P277 WeakPolarHBondContact O-CD 3.48Å; P277-V280 PolarHBondContact O-N 2.94Å; P277-V281 WeakPolarHBondContact O-CG2 3.22Å; P277-V281 PolarHBondContact O-N 3.22Å; P277-V311 HydrophobicContact CG-CG1 3.64Å
278	K	98.7	Very high	98.2	Very high	62 Å²	62	53.7 Å²	53.7	27%	0.27	28%	0.276	S	S	.	.	H	α-helix	trans	-63.1	-43	177.3	-71.6	172.4	172.9	-96.8	0	111.5	V238 L241 S242 G275 V276 V280 V281 L282	V238-K278 HydrophobicContact CG1-CD 3.73Å; V238-K278 VanDerWaalsContact O-CD 3.25Å; V238-K278 WeakPolarHBondContact O-CD 3.19Å; L241-K278 HydrophobicContact CB-CB 4.23Å; L241-K278 HydrophobicContact CD1-CB 4.21Å; S242-K278 PolarHBondContact OG-NZ 3.32Å; G275-K278 PolarHBondContact O-N 3.5Å; V276-K278 VanDerWaalsContact C-N 3.3Å; V276-K278 PolarHBondContact O-N 3.05Å; K278-V280 VanDerWaalsContact C-N 3.34Å; K278-V281 PolarHBondContact O-N 3.26Å; K278-L282 WeakPolarHBondContact O-CG 3.34Å; K278-L282 PolarHBondContact O-N 3.2Å
279	M	98.8	Very high	98.2	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-64.1	-37.5	174.7	-71.7	177.9	-173.5	0	0	112.2	L241 I253 L256 V270 G275 V276 L282 L283 V294 C297 L298 L301	L241-M279 HydrophobicContact CD1-CE 4.14Å; L241-M279 HydrophobicContact CD1-CG 3.82Å; I253-M279 HydrophobicContact CD1-CE 3.79Å; I253-M279 HydrophobicContact CD1-CG 3.92Å; I253-M279 HydrophobicContact CD1-SD 4.14Å; L256-M279 HydrophobicContact CB-CE 4.32Å; L256-M279 HydrophobicContact CD1-CE 3.81Å; V270-M279 HydrophobicContact CG1-CE 3.94Å; G275-M279 VanDerWaalsContact O-CG 3.3Å; G275-M279 WeakPolarHBondContact O-CG 3.1Å; G275-M279 PolarHBondContact O-N 3.33Å; V276-M279 PolarHBondContact O-N 3.27Å; M279-L282 WeakPolarHBondContact O-CB 3.29Å; M279-L282 PolarHBondContact O-N 2.81Å; M279-L283 PolarHBondContact O-N 3.25Å; M279-V294 HydrophobicContact CB-CG1 4.26Å; M279-V294 WeakPolarHBondContact O-CG1 3.4Å; M279-C297 HydrophobicContact CE-CB 4.23Å; M279-C297 HydrophobicContact SD-CB 3.78Å; M279-L298 HydrophobicContact CB-CD1 4.33Å; M279-L298 HydrophobicContact CB-CD2 3.72Å; M279-L298 HydrophobicContact CB-CG 3.96Å; M279-L298 HydrophobicContact SD-CD2 4.38Å; M279-L301 HydrophobicContact CE-CD1 4.23Å; M279-L301 HydrophobicContact SD-CD1 3.72Å
280	V	98.8	Very high	98.2	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.012	27%	0.269	C	S	.	.	H	α-helix	trans	-63.5	-41.6	175.7	176.6	0	0	0	0	111.4	V276 P277 K278 L282 L283 L298 I312 S315	V276-V280 WeakPolarHBondContact O-CG2 3.33Å; V276-V280 PolarHBondContact O-N 2.98Å; P277-V280 PolarHBondContact O-N 2.94Å; K278-V280 VanDerWaalsContact C-N 3.34Å; V280-L282 PolarHBondContact O-N 3.17Å; V280-L283 HydrophobicContact CG1-CD1 4.38Å; V280-L283 VanDerWaalsContact O-CB 3.24Å; V280-L283 WeakPolarHBondContact O-CB 3.33Å; V280-L283 WeakPolarHBondContact O-CG 3.41Å; V280-L283 PolarHBondContact O-N 3.14Å; V280-L298 HydrophobicContact CG2-CD1 4.08Å; V280-L298 HydrophobicContact CG2-CD2 4.06Å; V280-I312 HydrophobicContact CG2-CG1 4.23Å; V280-I312 HydrophobicContact CG2-CG2 4.35Å; V280-S315 WeakPolarHBondContact CG1-O 3.39Å
281	V	98.4	Very high	98.1	Very high	94 Å²	94	52.8 Å²	52.8	57%	0.57	27%	0.269	S	S	*	.	H	α-helix	trans	-58.8	-35.9	174.5	173	0	0	0	0	111.9	P277 K278 L283 K284	P277-V281 WeakPolarHBondContact O-CG2 3.22Å; P277-V281 PolarHBondContact O-N 3.22Å; K278-V281 PolarHBondContact O-N 3.26Å; V281-L283 PolarHBondContact O-N 2.88Å; V281-K284 WeakPolarHBondContact O-CB 3.47Å; V281-K284 PolarHBondContact O-N 2.98Å
282	L	98.6	Very high	98.2	Very high	11 Å²	11	50.4 Å²	50.4	6%	0.058	26%	0.261	C	S	.	.	H	α-helix	trans	-67.3	-17	178.3	-66.8	176	0	0	0	113.8	L241 V249 K278 M279 V280 K284 K285 F290 V294	L241-L282 HydrophobicContact CB-CD1 4.1Å; L241-L282 HydrophobicContact CD2-CD1 3.92Å; L241-L282 HydrophobicContact CG-CD1 4.41Å; V249-L282 HydrophobicContact CG1-CD1 3.91Å; V249-L282 HydrophobicContact CG1-CD2 3.74Å; V249-L282 HydrophobicContact CG1-CG 4.49Å; K278-L282 WeakPolarHBondContact O-CG 3.34Å; K278-L282 PolarHBondContact O-N 3.2Å; M279-L282 WeakPolarHBondContact O-CB 3.29Å; M279-L282 PolarHBondContact O-N 2.81Å; V280-L282 PolarHBondContact O-N 3.17Å; L282-K284 PolarHBondContact O-N 2.68Å; L282-K284 VanDerWaalsContact O-N 3.09Å; L282-K285 HydrophobicContact CD2-CG 4.44Å; L282-K285 WeakPolarHBondContact O-CB 3.45Å; L282-K285 PolarHBondContact O-N 3.13Å; L282-F290 HydrophobicContact CB-CE1 4.02Å; L282-F290 HydrophobicContact CB-CZ 4.16Å; L282-F290 HydrophobicContact CD1-CZ 4.03Å; L282-F290 HydrophobicContact CD2-CZ 4.17Å; L282-F290 HydrophobicContact CG-CZ 4.34Å; L282-V294 HydrophobicContact CB-CG1 4.27Å; L282-V294 HydrophobicContact CB-CG2 4.2Å
283	L	98.6	Very high	98.2	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.005	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-16.3	173.7	-63.5	177.7	0	0	0	113.2	M279 V280 V281 L291 V294 T295 L298 E320 L321 R323 I324	M279-L283 PolarHBondContact O-N 3.25Å; V280-L283 HydrophobicContact CG1-CD1 4.38Å; V280-L283 VanDerWaalsContact O-CB 3.24Å; V280-L283 WeakPolarHBondContact O-CB 3.33Å; V280-L283 WeakPolarHBondContact O-CG 3.41Å; V280-L283 PolarHBondContact O-N 3.14Å; V281-L283 PolarHBondContact O-N 2.88Å; L283-L291 HydrophobicContact CD2-CD2 4.44Å; L283-L291 WeakPolarHBondContact O-CD2 3.4Å; L283-V294 HydrophobicContact CD2-CB 4.27Å; L283-V294 HydrophobicContact CD2-CG1 3.64Å; L283-V294 HydrophobicContact CG-CG1 4.22Å; L283-T295 HydrophobicContact CD2-CG2 3.6Å; L283-L298 HydrophobicContact CD1-CD1 3.94Å; L283-L298 HydrophobicContact CD2-CD1 4.24Å; L283-L298 HydrophobicContact CG-CD1 4.22Å; L283-E320 HydrophobicContact CB-CB 4.04Å; L283-E320 HydrophobicContact CD1-CB 4.14Å; L283-L321 HydrophobicContact CD1-CD2 4.03Å; L283-L321 HydrophobicContact CD1-CG 4.26Å; L283-R323 PolarHBondContact O-NH2 3.24Å; L283-I324 HydrophobicContact CB-CD1 4.03Å; L283-I324 HydrophobicContact CD2-CD1 3.93Å; L283-I324 HydrophobicContact CG-CD1 4.47Å
284	K	97.5	Very high	98.2	Very high	127 Å²	127	41.1 Å²	41.1	55%	0.552	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79	-13.9	176.2	-62.4	179.2	179.3	-179.4	0	113.7	V281 L282 E320	V281-K284 WeakPolarHBondContact O-CB 3.47Å; V281-K284 PolarHBondContact O-N 2.98Å; L282-K284 PolarHBondContact O-N 2.68Å; L282-K284 VanDerWaalsContact O-N 3.09Å; K284-E320 VanDerWaalsContact CE-OE1 3.25Å; K284-E320 WeakPolarHBondContact CE-OE1 3.31Å; K284-E320 HydrophobicContact CG-CG 4.49Å
285	K	96.1	Very high	98.2	Very high	65 Å²	65	39.6 Å²	39.6	28%	0.283	21%	0.205	S	C	.	.	S	Bend	trans	-69.7	133.2	179.5	-71.9	-81.5	-177.2	173.2	0	110.6	D246 L282 I287 F290 L291	D246-K285 IonicContact OD1-NZ 3.27Å; D246-K285 PolarHBondContact OD1-NZ 3.22Å; L282-K285 HydrophobicContact CD2-CG 4.44Å; L282-K285 WeakPolarHBondContact O-CB 3.45Å; L282-K285 PolarHBondContact O-N 3.13Å; K285-I287 PolarHBondContact O-N 3.49Å; K285-F290 HydrophobicContact CB-CD1 4.09Å; K285-F290 HydrophobicContact CB-CE1 3.93Å; K285-F290 HydrophobicContact CG-CE1 4.02Å; K285-L291 WeakPolarHBondContact O-CD1 3.3Å; K285-L291 WeakPolarHBondContact O-CD2 3.46Å; K285-L291 WeakPolarHBondContact O-CG 3.36Å
286	P	96	Very high	98.2	Very high	98 Å²	98	40.7 Å²	40.7	64%	0.636	21%	0.211	S	C	*	.			trans	-85.6	41.7	-172.5	35.9	-37.8	0	0	0	113.9	Y328	P286-Y328 VanDerWaalsContact CA-OH 3.28Å; P286-Y328 WeakPolarHBondContact CA-OH 3.48Å
287	I	97.2	Very high	98.2	Very high	79 Å²	79	40.5 Å²	40.5	41%	0.405	21%	0.21	S	C	.	.			trans	-121.7	102.1	-172.4	-56.5	173.3	0	0	0	109.7	K285 K289 F290 L291	K285-I287 PolarHBondContact O-N 3.49Å; I287-K289 PolarHBondContact O-N 3.31Å; I287-F290 HydrophobicContact CB-CB 3.89Å; I287-F290 HydrophobicContact CG2-CB 3.72Å; I287-F290 WeakPolarHBondContact O-CB 3.21Å; I287-F290 PolarHBondContact O-N 3.24Å; I287-F290 VanDerWaalsContact O-N 3.1Å; I287-L291 WeakPolarHBondContact O-CG 3.47Å; I287-L291 PolarHBondContact O-N 2.96Å
288	P	98.2	Very high	98.2	Very high	42 Å²	42	38 Å²	38	27%	0.273	19%	0.194	S	C	.	.	H	α-helix	trans	-58.7	-43.3	-168.6	-28.5	34.4	0	0	0	115.3	F290 L291 A292 Y328 Y330 L333	P288-F290 VanDerWaalsContact C-N 3.32Å; P288-F290 PolarHBondContact O-N 3.48Å; P288-L291 PolarHBondContact O-N 3.04Å; P288-A292 PolarHBondContact O-N 2.97Å; P288-Y328 HydrophobicContact CG-CD1 3.81Å; P288-Y328 HydrophobicContact CG-CE1 3.81Å; P288-Y330 HydrophobicContact CB-CD1 3.74Å; P288-Y330 HydrophobicContact CB-CG 4.18Å; P288-L333 HydrophobicContact CB-CD2 4.05Å
289	K	97.3	Very high	98.2	Very high	152 Å²	152	35.8 Å²	35.8	66%	0.661	18%	0.184	S	C	*	.	H	α-helix	trans	-65.9	-35.8	179	-68.6	-176.5	-179.4	178.7	0	112.4	I287 Y330	I287-K289 PolarHBondContact O-N 3.31Å; K289-Y330 HydrophobicContact CG-CE1 4.03Å
290	F	98.4	Very high	98.2	Very high	11 Å²	11	36.8 Å²	36.8	5%	0.048	19%	0.19	C	C	.	.	H	α-helix	trans	-70.2	-45.8	176.2	171.1	-94.9	0	0	0	111	V249 F250 I253 L282 K285 I287 P288 A292 I293 V294	V249-F290 HydrophobicContact CG1-CE2 3.94Å; V249-F290 HydrophobicContact CG1-CZ 3.75Å; F250-F290 AromaticContact CD2-CD2 3.99Å; F250-F290 HydrophobicContact CD2-CD2 3.99Å; I253-F290 HydrophobicContact CB-CE2 4.38Å; I253-F290 HydrophobicContact CG2-CD2 3.94Å; I253-F290 HydrophobicContact CG2-CE2 3.5Å; I253-F290 HydrophobicContact CG2-CZ 4.4Å; L282-F290 HydrophobicContact CB-CE1 4.02Å; L282-F290 HydrophobicContact CB-CZ 4.16Å; L282-F290 HydrophobicContact CD1-CZ 4.03Å; L282-F290 HydrophobicContact CD2-CZ 4.17Å; L282-F290 HydrophobicContact CG-CZ 4.34Å; K285-F290 HydrophobicContact CB-CD1 4.09Å; K285-F290 HydrophobicContact CB-CE1 3.93Å; K285-F290 HydrophobicContact CG-CE1 4.02Å; I287-F290 HydrophobicContact CB-CB 3.89Å; I287-F290 HydrophobicContact CG2-CB 3.72Å; I287-F290 WeakPolarHBondContact O-CB 3.21Å; I287-F290 PolarHBondContact O-N 3.24Å; I287-F290 VanDerWaalsContact O-N 3.1Å; P288-F290 VanDerWaalsContact C-N 3.32Å; P288-F290 PolarHBondContact O-N 3.48Å; F290-A292 PolarHBondContact O-N 3.3Å; F290-I293 WeakPolarHBondContact O-CB 3.36Å; F290-I293 PolarHBondContact O-N 3.09Å; F290-V294 HydrophobicContact CD1-CG2 3.98Å; F290-V294 HydrophobicContact CE1-CG2 3.6Å; F290-V294 HydrophobicContact CE2-CG2 4.33Å; F290-V294 HydrophobicContact CG-CG2 4.49Å; F290-V294 HydrophobicContact CZ-CG2 3.8Å; F290-V294 WeakPolarHBondContact O-CG2 3.42Å; F290-V294 PolarHBondContact O-N 2.88Å
291	L	98.7	Very high	98.2	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-58	-36	175.3	-68.5	177.4	0	0	0	112.2	L283 K285 I287 P288 I293 V294 T295 I324 Y328 L333	L283-L291 HydrophobicContact CD2-CD2 4.44Å; L283-L291 WeakPolarHBondContact O-CD2 3.4Å; K285-L291 WeakPolarHBondContact O-CD1 3.3Å; K285-L291 WeakPolarHBondContact O-CD2 3.46Å; K285-L291 WeakPolarHBondContact O-CG 3.36Å; I287-L291 WeakPolarHBondContact O-CG 3.47Å; I287-L291 PolarHBondContact O-N 2.96Å; P288-L291 PolarHBondContact O-N 3.04Å; L291-I293 VanDerWaalsContact C-N 3.28Å; L291-I293 PolarHBondContact O-N 3.41Å; L291-V294 PolarHBondContact O-N 3.33Å; L291-T295 WeakPolarHBondContact O-CB 3.43Å; L291-T295 WeakPolarHBondContact O-CG2 3.32Å; L291-T295 PolarHBondContact O-N 2.94Å; L291-T295 PolarHBondContact O-OG1 3.49Å; L291-I324 HydrophobicContact CD1-CD1 4.19Å; L291-I324 HydrophobicContact CD1-CG1 4.21Å; L291-I324 HydrophobicContact CD2-CD1 4.2Å; L291-Y328 HydrophobicContact CD1-CE2 3.79Å; L291-L333 HydrophobicContact CB-CD1 3.46Å; L291-L333 VanDerWaalsContact CB-CD1 3.46Å; L291-L333 HydrophobicContact CB-CD2 4.01Å; L291-L333 HydrophobicContact CB-CG 4.4Å; L291-L333 HydrophobicContact CD1-CD2 4.02Å
292	A	98.7	Very high	98.2	Very high	3 Å²	3	32.2 Å²	32.2	3%	0.025	16%	0.162	C	C	.	.	H	α-helix	trans	-62.7	-36.4	177.1	0	0	0	0	0	111.9	P288 F290 T295 D296 Y330 K332 L333	P288-A292 PolarHBondContact O-N 2.97Å; F290-A292 PolarHBondContact O-N 3.3Å; A292-T295 WeakPolarHBondContact CA-OG1 3.43Å; A292-T295 PolarHBondContact O-OG1 3.35Å; A292-T295 VanDerWaalsContact O-OG1 3.09Å; A292-D296 WeakPolarHBondContact O-CB 3.4Å; A292-D296 PolarHBondContact O-N 3.41Å; A292-Y330 HydrophobicContact CB-CE1 4.28Å; A292-K332 HydrophobicContact CB-CG 4.41Å; A292-L333 HydrophobicContact CB-CB 4.24Å; A292-L333 HydrophobicContact CB-CD1 4.4Å
293	I	98.6	Very high	98.2	Very high	28 Å²	28	35.7 Å²	35.7	14%	0.144	18%	0.175	C	C	.	.	H	α-helix	trans	-70.8	-48.3	175	-59.4	168.1	0	0	0	110	F250 I253 H257 F290 L291 T295 D296 C297	F250-I293 HydrophobicContact CE2-CD1 4.36Å; I253-I293 HydrophobicContact CG1-CG2 4.1Å; I253-I293 HydrophobicContact CG2-CG2 4.38Å; H257-I293 HydrophobicContact CB-CG2 3.84Å; F290-I293 WeakPolarHBondContact O-CB 3.36Å; F290-I293 PolarHBondContact O-N 3.09Å; L291-I293 VanDerWaalsContact C-N 3.28Å; L291-I293 PolarHBondContact O-N 3.41Å; I293-T295 VanDerWaalsContact C-N 3.34Å; I293-T295 PolarHBondContact O-N 2.87Å; I293-D296 PolarHBondContact O-N 3.19Å; I293-C297 PolarHBondContact O-N 3.4Å; I293-C297 PolarHBondContact O-SG 2.89Å; I293-C297 VanDerWaalsContact O-SG 3.34Å
294	V	98.9	Very high	98.1	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-58.5	-45.7	-179.8	177.4	0	0	0	0	111.4	I253 M279 L282 L283 F290 L291 C297 L298	I253-V294 HydrophobicContact CD1-CG2 4.39Å; I253-V294 HydrophobicContact CG1-CG2 3.95Å; M279-V294 HydrophobicContact CB-CG1 4.26Å; M279-V294 WeakPolarHBondContact O-CG1 3.4Å; L282-V294 HydrophobicContact CB-CG1 4.27Å; L282-V294 HydrophobicContact CB-CG2 4.2Å; L283-V294 HydrophobicContact CD2-CB 4.27Å; L283-V294 HydrophobicContact CD2-CG1 3.64Å; L283-V294 HydrophobicContact CG-CG1 4.22Å; F290-V294 HydrophobicContact CD1-CG2 3.98Å; F290-V294 HydrophobicContact CE1-CG2 3.6Å; F290-V294 HydrophobicContact CE2-CG2 4.33Å; F290-V294 HydrophobicContact CG-CG2 4.49Å; F290-V294 HydrophobicContact CZ-CG2 3.8Å; F290-V294 WeakPolarHBondContact O-CG2 3.42Å; F290-V294 PolarHBondContact O-N 2.88Å; L291-V294 PolarHBondContact O-N 3.33Å; V294-C297 WeakPolarHBondContact O-CB 3.4Å; V294-C297 PolarHBondContact O-N 2.84Å; V294-L298 HydrophobicContact CG1-CD1 4.24Å; V294-L298 WeakPolarHBondContact O-CG 3.18Å; V294-L298 PolarHBondContact O-N 3.45Å
295	T	98.8	Very high	98.1	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-64.9	-39.1	178.3	48.6	0	0	0	0	112.1	L283 L291 A292 I293 L298 Q299 L321 L333 T336	L283-T295 HydrophobicContact CD2-CG2 3.6Å; L291-T295 WeakPolarHBondContact O-CB 3.43Å; L291-T295 WeakPolarHBondContact O-CG2 3.32Å; L291-T295 PolarHBondContact O-N 2.94Å; L291-T295 PolarHBondContact O-OG1 3.49Å; A292-T295 WeakPolarHBondContact CA-OG1 3.43Å; A292-T295 PolarHBondContact O-OG1 3.35Å; A292-T295 VanDerWaalsContact O-OG1 3.09Å; I293-T295 VanDerWaalsContact C-N 3.34Å; I293-T295 PolarHBondContact O-N 2.87Å; T295-L298 PolarHBondContact O-N 3.2Å; T295-Q299 WeakPolarHBondContact O-CB 3.42Å; T295-Q299 PolarHBondContact O-N 3.23Å; T295-L321 HydrophobicContact CG2-CD2 3.83Å; T295-L333 HydrophobicContact CG2-CD1 4.43Å; T295-T336 WeakPolarHBondContact OG1-CB 3.42Å; T295-T336 PolarHBondContact OG1-OG1 3.46Å
296	D	98.7	Very high	98.2	Very high	23 Å²	23	38.9 Å²	38.9	12%	0.123	20%	0.2	C	C	.	.	H	α-helix	trans	-69.4	-36.6	175.9	-160.3	54	0	0	0	112.2	H257 A292 I293 Q299 N300 T336 R339	H257-D296 IonicContact CD2-OD2 2.79Å; H257-D296 IonicContact CE1-OD2 3.6Å; H257-D296 IonicContact NE2-OD2 3.39Å; H257-D296 PolarHBondContact NE2-OD2 2.95Å; A292-D296 WeakPolarHBondContact O-CB 3.4Å; A292-D296 PolarHBondContact O-N 3.41Å; I293-D296 PolarHBondContact O-N 3.19Å; D296-Q299 PolarHBondContact O-N 3.42Å; D296-N300 WeakPolarHBondContact O-CB 3.27Å; D296-N300 PolarHBondContact O-N 2.87Å; D296-N300 PolarHBondContact O-ND2 3.2Å; D296-T336 HydrophobicContact CB-CG2 4.16Å; D296-R339 IonicContact OD1-NH1 2.88Å
297	C	98.9	Very high	98.3	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-58.7	-50.3	170	-70.5	0	0	0	0	111.6	I253 H257 L260 M279 I293 V294 Q299 N300 L301	I253-C297 HydrophobicContact CD1-CB 4.36Å; H257-C297 VanDerWaalsContact CB-SG 3.55Å; L260-C297 HydrophobicContact CD1-CB 3.82Å; M279-C297 HydrophobicContact CE-CB 4.23Å; M279-C297 HydrophobicContact SD-CB 3.78Å; I293-C297 PolarHBondContact O-N 3.4Å; I293-C297 PolarHBondContact O-SG 2.89Å; I293-C297 VanDerWaalsContact O-SG 3.34Å; V294-C297 WeakPolarHBondContact O-CB 3.4Å; V294-C297 PolarHBondContact O-N 2.84Å; C297-Q299 VanDerWaalsContact C-N 3.33Å; C297-Q299 PolarHBondContact O-N 3.11Å; C297-N300 PolarHBondContact O-N 3.25Å; C297-L301 VanDerWaalsContact O-CG 3.29Å; C297-L301 WeakPolarHBondContact O-CG 3.46Å; C297-L301 PolarHBondContact O-N 3.05Å
298	L	98.9	Very high	98.4	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.4	-39.4	178.6	-75.2	172	0	0	0	111.8	V276 M279 V280 L283 V294 T295 L301 A302 I312 L340	V276-L298 HydrophobicContact CG1-CD2 3.99Å; M279-L298 HydrophobicContact CB-CD1 4.33Å; M279-L298 HydrophobicContact CB-CD2 3.72Å; M279-L298 HydrophobicContact CB-CG 3.96Å; M279-L298 HydrophobicContact SD-CD2 4.38Å; V280-L298 HydrophobicContact CG2-CD1 4.08Å; V280-L298 HydrophobicContact CG2-CD2 4.06Å; L283-L298 HydrophobicContact CD1-CD1 3.94Å; L283-L298 HydrophobicContact CD2-CD1 4.24Å; L283-L298 HydrophobicContact CG-CD1 4.22Å; V294-L298 HydrophobicContact CG1-CD1 4.24Å; V294-L298 WeakPolarHBondContact O-CG 3.18Å; V294-L298 PolarHBondContact O-N 3.45Å; T295-L298 PolarHBondContact O-N 3.2Å; L298-L301 PolarHBondContact O-N 3.25Å; L298-A302 VanDerWaalsContact O-CB 3.23Å; L298-A302 WeakPolarHBondContact O-CB 3.46Å; L298-A302 PolarHBondContact O-N 3.11Å; L298-I312 HydrophobicContact CB-CD1 4.49Å; L298-I312 HydrophobicContact CD2-CD1 4.19Å; L298-I312 HydrophobicContact CD2-CG1 4.27Å; L298-L340 HydrophobicContact CB-CD1 4.31Å; L298-L340 HydrophobicContact CB-CD2 3.52Å; L298-L340 HydrophobicContact CD1-CD2 4.14Å; L298-L340 HydrophobicContact CG-CD2 4.49Å
299	Q	98.8	Very high	98.4	Very high	15 Å²	15	35.6 Å²	35.6	7%	0.07	17%	0.17	C	C	.	.	H	α-helix	trans	-60	-48.2	174.8	-171.8	-77.6	-29.7	0	0	111.1	T295 D296 C297 L301 A302 Y303 R339 L340 V343	T295-Q299 WeakPolarHBondContact O-CB 3.42Å; T295-Q299 PolarHBondContact O-N 3.23Å; D296-Q299 PolarHBondContact O-N 3.42Å; C297-Q299 VanDerWaalsContact C-N 3.33Å; C297-Q299 PolarHBondContact O-N 3.11Å; Q299-L301 PolarHBondContact O-N 2.93Å; Q299-A302 PolarHBondContact O-N 3.35Å; Q299-Y303 WeakPolarHBondContact O-CB 3.27Å; Q299-Y303 PolarHBondContact O-N 2.82Å; Q299-R339 HydrophobicContact CG-CB 4.4Å; Q299-L340 HydrophobicContact CB-CB 4.18Å; Q299-L340 HydrophobicContact CB-CD1 4.33Å; Q299-V343 HydrophobicContact CG-CG2 4.17Å
300	N	98.6	Very high	98.5	Very high	22 Å²	22	31.4 Å²	31.4	12%	0.118	16%	0.155	C	C	.	.	H	α-helix	trans	-61.1	-32.7	178.3	-86.3	-77.7	0	0	0	112.9	L260 D296 C297	L260-N300 HydrophobicContact CB-CB 4.48Å; D296-N300 WeakPolarHBondContact O-CB 3.27Å; D296-N300 PolarHBondContact O-N 2.87Å; D296-N300 PolarHBondContact O-ND2 3.2Å; C297-N300 PolarHBondContact O-N 3.25Å
301	L	98.8	Very high	98.5	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-81	-29.4	178.5	-70.3	167.9	0	0	0	113.4	L260 K267 V270 R271 V276 M279 C297 L298 Q299 T308	L260-L301 HydrophobicContact CD1-CD1 4.2Å; L260-L301 HydrophobicContact CD1-CD2 4.49Å; L260-L301 HydrophobicContact CD1-CG 4.11Å; L260-L301 HydrophobicContact CD2-CD2 3.54Å; L260-L301 HydrophobicContact CD2-CG 4.02Å; K267-L301 HydrophobicContact CB-CD2 4.29Å; V270-L301 HydrophobicContact CB-CD2 4.05Å; V270-L301 HydrophobicContact CG1-CD1 3.74Å; V270-L301 HydrophobicContact CG1-CD2 3.94Å; V270-L301 HydrophobicContact CG1-CG 4.49Å; R271-L301 HydrophobicContact CG-CD2 4.09Å; R271-L301 PolarHBondContact NE-O 3.3Å; R271-L301 VanDerWaalsContact NE-O 3.15Å; R271-L301 PolarHBondContact NH2-O 3.49Å; V276-L301 HydrophobicContact CG2-CB 4.43Å; V276-L301 HydrophobicContact CG2-CD1 4.01Å; M279-L301 HydrophobicContact CE-CD1 4.23Å; M279-L301 HydrophobicContact SD-CD1 3.72Å; C297-L301 VanDerWaalsContact O-CG 3.29Å; C297-L301 WeakPolarHBondContact O-CG 3.46Å; C297-L301 PolarHBondContact O-N 3.05Å; L298-L301 PolarHBondContact O-N 3.25Å; Q299-L301 PolarHBondContact O-N 2.93Å; L301-T308 HydrophobicContact CB-CG2 4.14Å; L301-T308 WeakPolarHBondContact O-CB 3.49Å; L301-T308 WeakPolarHBondContact O-CG2 3.33Å; L301-T308 PolarHBondContact O-OG1 3.36Å
302	A	98.7	Very high	98.5	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-90.7	-25.5	-177.2	0	0	0	0	0	113.5	L298 Q299 R304 H305 T308 K309 I312 L340 V343 L344	L298-A302 VanDerWaalsContact O-CB 3.23Å; L298-A302 WeakPolarHBondContact O-CB 3.46Å; L298-A302 PolarHBondContact O-N 3.11Å; Q299-A302 PolarHBondContact O-N 3.35Å; A302-R304 PolarHBondContact O-N 3.15Å; A302-H305 PolarHBondContact O-N 3.49Å; A302-H305 VanDerWaalsContact O-N 3.1Å; A302-T308 HydrophobicContact CB-CG2 4Å; A302-K309 HydrophobicContact CB-CG 4.31Å; A302-K309 WeakPolarHBondContact O-CE 3.26Å; A302-I312 HydrophobicContact CB-CD1 3.8Å; A302-L340 HydrophobicContact CB-CD1 4.11Å; A302-V343 HydrophobicContact CB-CG1 3.84Å; A302-L344 HydrophobicContact CB-CD2 4.49Å
303	Y	98	Very high	98.5	Very high	83 Å²	83	35.1 Å²	35.1	33%	0.325	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	123.5	179.7	-174.3	-110.7	0	0	0	110.5	Q299 H305 V343 D783	Q299-Y303 WeakPolarHBondContact O-CB 3.27Å; Q299-Y303 PolarHBondContact O-N 2.82Å; Y303-H305 PolarHBondContact O-N 3.38Å; Y303-H305 VanDerWaalsContact O-N 3.13Å; Y303-V343 HydrophobicContact CD2-CG2 4.06Å; Y303-D783 WeakPolarHBondContact CE2-OD2 3.3Å; Y303-D783 PolarHBondContact OH-OD1 3.23Å; Y303-D783 PolarHBondContact OH-OD2 3.08Å
304	R	96.4	Very high	98.5	Very high	129 Å²	129	38.1 Å²	38.1	49%	0.487	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.6	33.5	-175.5	-55.8	-170.8	-167.6	169.8	16	115.4	A302 D783	A302-R304 PolarHBondContact O-N 3.15Å; R304-D783 VanDerWaalsContact CZ-C 3.44Å; R304-D783 IonicContact CZ-OD2 3.82Å; R304-D783 IonicContact NE-OD2 3.5Å; R304-D783 PolarHBondContact NE-OD2 2.97Å; R304-D783 PolarHBondContact NH1-O 3Å; R304-D783 PolarHBondContact NH2-O 3.2Å; R304-D783 IonicContact NH2-OD2 3.23Å
305	H	98.2	Very high	98.5	Very high	59 Å²	59	39.9 Å²	39.9	27%	0.273	22%	0.217	S	C	.	.			trans	-135.4	94	179.1	-164.7	-90.4	0	0	0	111.9	R271 A302 Y303 E307 T308 K309	R271-H305 PolarHBondContact NH1-CD2 3.27Å; A302-H305 PolarHBondContact O-N 3.49Å; A302-H305 VanDerWaalsContact O-N 3.1Å; Y303-H305 PolarHBondContact O-N 3.38Å; Y303-H305 VanDerWaalsContact O-N 3.13Å; H305-E307 PolarHBondContact O-N 2.83Å; H305-T308 WeakPolarHBondContact ND1-CB 3.47Å; H305-T308 PolarHBondContact ND1-N 3.15Å; H305-T308 VanDerWaalsContact ND1-N 3.17Å; H305-T308 PolarHBondContact ND1-OG1 3.28Å; H305-T308 PolarHBondContact O-N 2.97Å; H305-K309 PolarHBondContact O-N 2.93Å
306	A	98	Very high	98.5	Very high	73 Å²	73	43.2 Å²	43.2	60%	0.603	24%	0.235	S	C	*	.	H	α-helix	trans	-54.8	-48.5	-173.4	0	0	0	0	0	113	T308 K309 L310	A306-T308 VanDerWaalsContact C-N 3.28Å; A306-T308 PolarHBondContact O-N 2.74Å; A306-K309 WeakPolarHBondContact O-CB 3.46Å; A306-K309 PolarHBondContact O-N 3.47Å; A306-L310 PolarHBondContact O-N 3.37Å; A306-L310 VanDerWaalsContact O-N 3.17Å
307	E	98.3	Very high	98.5	Very high	126 Å²	126	42.1 Å²	42.1	59%	0.589	23%	0.229	S	C	*	.	H	α-helix	trans	-57.1	-40.6	-179.9	-168.8	71	-171.6	0	0	112.1	H305 K309 L310 V311	H305-E307 PolarHBondContact O-N 2.83Å; E307-K309 VanDerWaalsContact C-N 3.31Å; E307-K309 PolarHBondContact O-N 3.28Å; E307-L310 PolarHBondContact O-N 2.95Å; E307-V311 WeakPolarHBondContact O-CG2 3.38Å; E307-V311 PolarHBondContact O-N 3.22Å
308	T	98.8	Very high	98.5	Very high	4 Å²	4	42.3 Å²	42.3	3%	0.025	23%	0.23	C	C	.	.	H	α-helix	trans	-64.3	-39.6	178.1	-62	0	0	0	0	110.9	R271 V276 L301 A302 H305 A306 L310 V311 I312	R271-T308 WeakPolarHBondContact CD-OG1 3.22Å; R271-T308 PolarHBondContact NE-OG1 3.36Å; V276-T308 HydrophobicContact CG1-CG2 4.04Å; V276-T308 HydrophobicContact CG2-CG2 3.89Å; L301-T308 HydrophobicContact CB-CG2 4.14Å; L301-T308 WeakPolarHBondContact O-CB 3.49Å; L301-T308 WeakPolarHBondContact O-CG2 3.33Å; L301-T308 PolarHBondContact O-OG1 3.36Å; A302-T308 HydrophobicContact CB-CG2 4Å; H305-T308 WeakPolarHBondContact ND1-CB 3.47Å; H305-T308 PolarHBondContact ND1-N 3.15Å; H305-T308 VanDerWaalsContact ND1-N 3.17Å; H305-T308 PolarHBondContact ND1-OG1 3.28Å; H305-T308 PolarHBondContact O-N 2.97Å; A306-T308 VanDerWaalsContact C-N 3.28Å; A306-T308 PolarHBondContact O-N 2.74Å; T308-L310 VanDerWaalsContact C-N 3.25Å; T308-L310 PolarHBondContact O-N 3.06Å; T308-V311 PolarHBondContact O-N 3.19Å; T308-I312 HydrophobicContact CG2-CD1 3.9Å; T308-I312 HydrophobicContact CG2-CG1 4.28Å; T308-I312 WeakPolarHBondContact O-CG1 3.25Å; T308-I312 PolarHBondContact O-N 3.02Å
309	K	98.7	Very high	98.4	Very high	20 Å²	20	49.9 Å²	49.9	9%	0.087	26%	0.259	C	S	.	.	H	α-helix	trans	-62.4	-37	178.6	-56.3	-178.7	-172.8	-170.2	0	110.7	A302 H305 A306 E307 L313 V343 L344 C347 N350	A302-K309 HydrophobicContact CB-CG 4.31Å; A302-K309 WeakPolarHBondContact O-CE 3.26Å; H305-K309 PolarHBondContact O-N 2.93Å; A306-K309 WeakPolarHBondContact O-CB 3.46Å; A306-K309 PolarHBondContact O-N 3.47Å; E307-K309 VanDerWaalsContact C-N 3.31Å; E307-K309 PolarHBondContact O-N 3.28Å; K309-L313 PolarHBondContact O-N 3.02Å; K309-V343 VanDerWaalsContact CE-O 3.25Å; K309-V343 WeakPolarHBondContact CE-O 3.4Å; K309-V343 PolarHBondContact NZ-O 3.15Å; K309-L344 HydrophobicContact CB-CD2 3.9Å; K309-L344 HydrophobicContact CG-CD2 3.97Å; K309-C347 HydrophobicContact CB-CB 4.27Å; K309-C347 HydrophobicContact CD-CB 3.77Å; K309-N350 PolarHBondContact O-ND2 2.95Å
310	L	98.8	Very high	98.4	Very high	63 Å²	63	50 Å²	50	33%	0.33	26%	0.259	S	S	.	.	H	α-helix	trans	-69.8	-39.3	175.2	-61.1	179.9	0	0	0	112.4	A306 E307 T308 I312 L313 A314 Q349	A306-L310 PolarHBondContact O-N 3.37Å; A306-L310 VanDerWaalsContact O-N 3.17Å; E307-L310 PolarHBondContact O-N 2.95Å; T308-L310 VanDerWaalsContact C-N 3.25Å; T308-L310 PolarHBondContact O-N 3.06Å; L310-I312 VanDerWaalsContact C-N 3.35Å; L310-I312 PolarHBondContact O-N 3.25Å; L310-L313 WeakPolarHBondContact O-CB 3.23Å; L310-L313 PolarHBondContact O-N 3.2Å; L310-A314 WeakPolarHBondContact O-CB 3.36Å; L310-A314 PolarHBondContact O-N 3.2Å; L310-Q349 HydrophobicContact CD2-CB 3.75Å; L310-Q349 HydrophobicContact CD2-CG 3.96Å
311	V	98.8	Very high	98.4	Very high	44 Å²	44	49 Å²	49	27%	0.267	25%	0.254	S	S	.	.	H	α-helix	trans	-64.5	-39.8	174.7	175.5	0	0	0	0	111.5	V276 P277 E307 T308 A314 S315	V276-V311 HydrophobicContact CB-CG1 4.02Å; V276-V311 HydrophobicContact CG1-CB 4.25Å; V276-V311 HydrophobicContact CG1-CG1 3.76Å; P277-V311 HydrophobicContact CG-CG1 3.64Å; E307-V311 WeakPolarHBondContact O-CG2 3.38Å; E307-V311 PolarHBondContact O-N 3.22Å; T308-V311 PolarHBondContact O-N 3.19Å; V311-A314 PolarHBondContact O-N 3.02Å; V311-S315 WeakPolarHBondContact O-CB 3.19Å; V311-S315 PolarHBondContact O-N 2.64Å; V311-S315 PolarHBondContact O-OG 3.41Å
312	I	98.9	Very high	98.4	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62.5	-44.1	174.4	-68.9	171.1	0	0	0	110.5	V276 V280 L298 A302 T308 L310 S315 D316 G317 L340 L344	V276-I312 HydrophobicContact CG1-CD1 4.33Å; V276-I312 HydrophobicContact CG1-CG1 3.52Å; V280-I312 HydrophobicContact CG2-CG1 4.23Å; V280-I312 HydrophobicContact CG2-CG2 4.35Å; L298-I312 HydrophobicContact CB-CD1 4.49Å; L298-I312 HydrophobicContact CD2-CD1 4.19Å; L298-I312 HydrophobicContact CD2-CG1 4.27Å; A302-I312 HydrophobicContact CB-CD1 3.8Å; T308-I312 HydrophobicContact CG2-CD1 3.9Å; T308-I312 HydrophobicContact CG2-CG1 4.28Å; T308-I312 WeakPolarHBondContact O-CG1 3.25Å; T308-I312 PolarHBondContact O-N 3.02Å; L310-I312 VanDerWaalsContact C-N 3.35Å; L310-I312 PolarHBondContact O-N 3.25Å; I312-S315 PolarHBondContact O-N 3.44Å; I312-D316 PolarHBondContact O-N 2.91Å; I312-G317 WeakPolarHBondContact O-CA 3.44Å; I312-G317 PolarHBondContact O-N 2.94Å; I312-L340 HydrophobicContact CD1-CD1 4.29Å; I312-L344 HydrophobicContact CB-CD2 4.34Å; I312-L344 HydrophobicContact CD1-CD2 4.11Å; I312-L344 HydrophobicContact CG2-CD1 3.86Å; I312-L344 HydrophobicContact CG2-CD2 4.21Å
313	L	98.7	Very high	98.4	Very high	48 Å²	48	53 Å²	53	25%	0.251	27%	0.27	S	S	.	.	H	α-helix	trans	-58.9	-51.2	174.8	175.7	62.6	0	0	0	111.8	K309 L310 S315 D316 P318 Q349 A353	K309-L313 PolarHBondContact O-N 3.02Å; L310-L313 WeakPolarHBondContact O-CB 3.23Å; L310-L313 PolarHBondContact O-N 3.2Å; L313-S315 PolarHBondContact O-N 3.03Å; L313-S315 VanDerWaalsContact O-N 3.12Å; L313-D316 PolarHBondContact O-N 3.29Å; L313-P318 HydrophobicContact CD1-CG 4.07Å; L313-Q349 HydrophobicContact CD2-CB 3.97Å; L313-Q349 VanDerWaalsContact CD2-O 3.28Å; L313-Q349 WeakPolarHBondContact CD2-O 3.42Å; L313-A353 HydrophobicContact CD1-CB 3.47Å; L313-A353 VanDerWaalsContact CD1-CB 3.47Å
314	A	98.5	Very high	98.5	Very high	91 Å²	91	49 Å²	49	75%	0.752	25%	0.254	S	S	*	.	H	α-helix	trans	-62	-20.7	179.2	0	0	0	0	0	113.3	L310 V311	L310-A314 WeakPolarHBondContact O-CB 3.36Å; L310-A314 PolarHBondContact O-N 3.2Å; V311-A314 PolarHBondContact O-N 3.02Å
315	S	98.3	Very high	98.6	Very high	37 Å²	37	43 Å²	43	26%	0.259	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	10.8	177	-53	0	0	0	0	113.5	V280 V311 I312 L313 G317	V280-S315 WeakPolarHBondContact CG1-O 3.39Å; V311-S315 WeakPolarHBondContact O-CB 3.19Å; V311-S315 PolarHBondContact O-N 2.64Å; V311-S315 PolarHBondContact O-OG 3.41Å; I312-S315 PolarHBondContact O-N 3.44Å; L313-S315 PolarHBondContact O-N 3.03Å; L313-S315 VanDerWaalsContact O-N 3.12Å; S315-G317 VanDerWaalsContact C-N 3.28Å; S315-G317 PolarHBondContact O-N 3.11Å
316	D	97.9	Very high	98.6	Very high	71 Å²	71	43.9 Å²	43.9	38%	0.38	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.3	28	-177.2	-161.5	32.6	0	0	0	113.9	I312 L313 R319 E320	I312-D316 PolarHBondContact O-N 2.91Å; L313-D316 PolarHBondContact O-N 3.29Å; D316-R319 VanDerWaalsContact OD1-CB 3.31Å; D316-R319 WeakPolarHBondContact OD1-CB 3.2Å; D316-R319 WeakPolarHBondContact OD2-CD 3.49Å; D316-E320 PolarHBondContact O-N 3.37Å
317	G	98.7	Very high	98.6	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60	-47.7	-178.2	0	0	0	0	0	115	I312 S315 R319 E320 L321	I312-G317 WeakPolarHBondContact O-CA 3.44Å; I312-G317 PolarHBondContact O-N 2.94Å; S315-G317 VanDerWaalsContact C-N 3.28Å; S315-G317 PolarHBondContact O-N 3.11Å; G317-R319 VanDerWaalsContact C-N 3.32Å; G317-R319 PolarHBondContact O-N 3.4Å; G317-E320 PolarHBondContact O-N 3.17Å; G317-L321 VanDerWaalsContact O-CG 3.29Å; G317-L321 WeakPolarHBondContact O-CG 3.32Å; G317-L321 PolarHBondContact O-N 3.11Å
318	P	98.7	Very high	98.6	Very high	3 Å²	3	39.8 Å²	39.8	2%	0.019	21%	0.21	C	C	.	.	H	α-helix	trans	-52.7	-46.9	178.9	-31.6	38.5	0	0	0	113.5	L313 E320 L321 V322 N350 A353 I354	L313-P318 HydrophobicContact CD1-CG 4.07Å; P318-E320 PolarHBondContact O-N 3.19Å; P318-L321 PolarHBondContact O-N 3Å; P318-V322 WeakPolarHBondContact O-CG2 3.32Å; P318-V322 PolarHBondContact O-N 3.38Å; P318-N350 WeakPolarHBondContact CG-OD1 3.22Å; P318-A353 HydrophobicContact CB-CB 4.45Å; P318-A353 HydrophobicContact CG-CB 4.4Å; P318-I354 HydrophobicContact CB-CG1 3.81Å; P318-I354 HydrophobicContact CG-CG1 4.2Å
319	R	98.5	Very high	98.5	Very high	159 Å²	159	45.1 Å²	45.1	60%	0.6	24%	0.239	S	C	*	.	H	α-helix	trans	-61.7	-45.7	179.5	179.1	179.6	162.2	163.3	-0.1	112	D316 G317 L321 V322 R323	D316-R319 VanDerWaalsContact OD1-CB 3.31Å; D316-R319 WeakPolarHBondContact OD1-CB 3.2Å; D316-R319 WeakPolarHBondContact OD2-CD 3.49Å; G317-R319 VanDerWaalsContact C-N 3.32Å; G317-R319 PolarHBondContact O-N 3.4Å; R319-L321 VanDerWaalsContact C-N 3.34Å; R319-L321 PolarHBondContact O-N 3.04Å; R319-V322 PolarHBondContact O-N 2.9Å; R319-R323 WeakPolarHBondContact O-CB 3.38Å; R319-R323 PolarHBondContact O-N 3.44Å
320	E	98.6	Very high	98.5	Very high	18 Å²	18	48.2 Å²	48.2	8%	0.084	25%	0.251	C	S	.	.	H	α-helix	trans	-65.3	-37.1	178.5	-71.4	-61.2	155.3	0	0	112.4	L283 K284 D316 G317 P318 R323 I324	L283-E320 HydrophobicContact CB-CB 4.04Å; L283-E320 HydrophobicContact CD1-CB 4.14Å; K284-E320 VanDerWaalsContact CE-OE1 3.25Å; K284-E320 WeakPolarHBondContact CE-OE1 3.31Å; K284-E320 HydrophobicContact CG-CG 4.49Å; D316-E320 PolarHBondContact O-N 3.37Å; G317-E320 PolarHBondContact O-N 3.17Å; P318-E320 PolarHBondContact O-N 3.19Å; E320-R323 PolarHBondContact O-N 3.28Å; E320-R323 IonicContact OE2-CZ 2.65Å; E320-R323 VanDerWaalsContact OE2-CZ 3.27Å; E320-R323 IonicContact OE2-NE 3.55Å; E320-R323 PolarHBondContact OE2-NE 3.18Å; E320-R323 IonicContact OE2-NH2 3.73Å; E320-R323 PolarHBondContact OE2-NH2 3.32Å; E320-I324 VanDerWaalsContact O-CG1 3.29Å; E320-I324 WeakPolarHBondContact O-CG1 3.35Å; E320-I324 PolarHBondContact O-N 2.98Å
321	L	98.9	Very high	98.5	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-66.7	-43.5	177	-67.8	168.5	0	0	0	112.2	L283 T295 G317 P318 R319 I324 I325 L340 L341 L344	L283-L321 HydrophobicContact CD1-CD2 4.03Å; L283-L321 HydrophobicContact CD1-CG 4.26Å; T295-L321 HydrophobicContact CG2-CD2 3.83Å; G317-L321 VanDerWaalsContact O-CG 3.29Å; G317-L321 WeakPolarHBondContact O-CG 3.32Å; G317-L321 PolarHBondContact O-N 3.11Å; P318-L321 PolarHBondContact O-N 3Å; R319-L321 VanDerWaalsContact C-N 3.34Å; R319-L321 PolarHBondContact O-N 3.04Å; L321-I324 WeakPolarHBondContact O-CB 3.46Å; L321-I324 PolarHBondContact O-N 3.37Å; L321-I325 WeakPolarHBondContact O-CG1 3.05Å; L321-I325 PolarHBondContact O-N 3.37Å; L321-L340 HydrophobicContact CD1-CB 4.44Å; L321-L340 HydrophobicContact CD1-CD2 3.66Å; L321-L340 HydrophobicContact CD1-CG 3.68Å; L321-L340 HydrophobicContact CD2-CD2 3.69Å; L321-L340 HydrophobicContact CD2-CG 4.35Å; L321-L340 HydrophobicContact CG-CD2 4.29Å; L321-L341 HydrophobicContact CB-CD1 4.28Å; L321-L341 HydrophobicContact CB-CD2 3.79Å; L321-L341 HydrophobicContact CB-CG 3.93Å; L321-L341 HydrophobicContact CD1-CD2 3.93Å; L321-L341 HydrophobicContact CD1-CG 4.22Å; L321-L344 HydrophobicContact CD1-CD1 3.66Å
322	V	98.8	Very high	98.4	Very high	5 Å²	5	50 Å²	50	3%	0.03	25%	0.253	C	S	.	.	H	α-helix	trans	-63.6	-43.1	175.5	177.2	0	0	0	0	110.6	P318 R319 I324 I325 Q326 L341 A357 C359 V362	P318-V322 WeakPolarHBondContact O-CG2 3.32Å; P318-V322 PolarHBondContact O-N 3.38Å; R319-V322 PolarHBondContact O-N 2.9Å; V322-I324 VanDerWaalsContact C-N 3.31Å; V322-I324 PolarHBondContact O-N 2.88Å; V322-I325 PolarHBondContact O-N 3.41Å; V322-Q326 WeakPolarHBondContact O-CB 3.46Å; V322-Q326 PolarHBondContact O-N 2.98Å; V322-L341 HydrophobicContact CG2-CD1 4.33Å; V322-L341 HydrophobicContact CG2-CD2 4.46Å; V322-A357 HydrophobicContact CB-CB 4.16Å; V322-A357 VanDerWaalsContact CG1-O 3.31Å; V322-A357 WeakPolarHBondContact CG1-O 3.25Å; V322-A357 HydrophobicContact CG2-CB 3.93Å; V322-C359 HydrophobicContact CG2-CB 3.69Å; V322-V362 HydrophobicContact CG1-CB 3.98Å; V322-V362 HydrophobicContact CG1-CG1 4.18Å; V322-V362 HydrophobicContact CG1-CG2 3.53Å
323	R	98.6	Very high	98.4	Very high	80 Å²	80	50 Å²	50	30%	0.302	25%	0.253	S	S	.	.	H	α-helix	trans	-56.5	-44.2	173.8	-175	-168.8	62	70.3	2.5	111.8	L283 R319 E320 Q326 S327	L283-R323 PolarHBondContact O-NH2 3.24Å; R319-R323 WeakPolarHBondContact O-CB 3.38Å; R319-R323 PolarHBondContact O-N 3.44Å; E320-R323 PolarHBondContact O-N 3.28Å; E320-R323 IonicContact OE2-CZ 2.65Å; E320-R323 VanDerWaalsContact OE2-CZ 3.27Å; E320-R323 IonicContact OE2-NE 3.55Å; E320-R323 PolarHBondContact OE2-NE 3.18Å; E320-R323 IonicContact OE2-NH2 3.73Å; E320-R323 PolarHBondContact OE2-NH2 3.32Å; R323-Q326 PolarHBondContact O-N 3.08Å; R323-S327 VanDerWaalsContact O-CB 3.25Å; R323-S327 WeakPolarHBondContact O-CB 3.42Å; R323-S327 PolarHBondContact O-N 3.46Å; R323-S327 PolarHBondContact O-OG 2.96Å
324	I	98.8	Very high	98.4	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59.8	-49	178	-75.9	168.3	0	0	0	110.8	L283 L291 E320 L321 V322 Q326 S327 Y328 L333 S337	L283-I324 HydrophobicContact CB-CD1 4.03Å; L283-I324 HydrophobicContact CD2-CD1 3.93Å; L283-I324 HydrophobicContact CG-CD1 4.47Å; L291-I324 HydrophobicContact CD1-CD1 4.19Å; L291-I324 HydrophobicContact CD1-CG1 4.21Å; L291-I324 HydrophobicContact CD2-CD1 4.2Å; E320-I324 VanDerWaalsContact O-CG1 3.29Å; E320-I324 WeakPolarHBondContact O-CG1 3.35Å; E320-I324 PolarHBondContact O-N 2.98Å; L321-I324 WeakPolarHBondContact O-CB 3.46Å; L321-I324 PolarHBondContact O-N 3.37Å; V322-I324 VanDerWaalsContact C-N 3.31Å; V322-I324 PolarHBondContact O-N 2.88Å; I324-Q326 VanDerWaalsContact C-N 3.25Å; I324-Q326 PolarHBondContact O-N 3.27Å; I324-S327 PolarHBondContact O-N 3.32Å; I324-Y328 HydrophobicContact CB-CD2 4.46Å; I324-Y328 HydrophobicContact CG1-CE2 4.42Å; I324-Y328 HydrophobicContact CG2-CD2 4.13Å; I324-Y328 WeakPolarHBondContact O-CD2 3.24Å; I324-Y328 PolarHBondContact O-N 3.21Å; I324-L333 HydrophobicContact CG2-CD1 3.73Å; I324-L333 HydrophobicContact CG2-CD2 3.81Å; I324-L333 HydrophobicContact CG2-CG 3.67Å; I324-S337 WeakPolarHBondContact CG2-OG 3.35Å
325	I	98.7	Very high	98.4	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-65	-33.4	-180	-63	178.9	0	0	0	111.4	L321 V322 L334 L341 V362 L363 R366	L321-I325 WeakPolarHBondContact O-CG1 3.05Å; L321-I325 PolarHBondContact O-N 3.37Å; V322-I325 PolarHBondContact O-N 3.41Å; I325-L334 HydrophobicContact CB-CD2 4.28Å; I325-L334 HydrophobicContact CG1-CD2 4.41Å; I325-L334 HydrophobicContact CG2-CD2 4.16Å; I325-L341 HydrophobicContact CD1-CD1 3.42Å; I325-L341 VanDerWaalsContact CD1-CD1 3.42Å; I325-V362 HydrophobicContact CB-CG1 3.85Å; I325-V362 HydrophobicContact CG2-CG1 3.6Å; I325-L363 HydrophobicContact CD1-CD2 3.77Å; I325-L363 HydrophobicContact CG2-CD2 4.27Å; I325-R366 HydrophobicContact CG2-CG 3.77Å; I325-R366 VanDerWaalsContact O-CZ 3.3Å; I325-R366 PolarHBondContact O-NE 3.43Å; I325-R366 VanDerWaalsContact O-NE 3.09Å; I325-R366 PolarHBondContact O-NH2 3.26Å
326	Q	98.1	Very high	98.4	Very high	78 Å²	78	44.7 Å²	44.7	36%	0.364	21%	0.205	S	C	.	.	H	α-helix	trans	-71.1	-36.7	176.3	-172	60.4	66.6	0	0	113.1	V322 R323 I324 V362 R366	V322-Q326 WeakPolarHBondContact O-CB 3.46Å; V322-Q326 PolarHBondContact O-N 2.98Å; R323-Q326 PolarHBondContact O-N 3.08Å; I324-Q326 VanDerWaalsContact C-N 3.25Å; I324-Q326 PolarHBondContact O-N 3.27Å; Q326-V362 HydrophobicContact CB-CG1 4.04Å; Q326-V362 HydrophobicContact CB-CG2 4.28Å; Q326-R366 PolarHBondContact O-NH2 3.02Å
327	S	98	Very high	98.5	Very high	71 Å²	71	41.3 Å²	41.3	50%	0.497	19%	0.186	S	C	.	.	H	α-helix	trans	-96.8	-13.5	-164.6	-51.1	0	0	0	0	115.1	R323 I324	R323-S327 VanDerWaalsContact O-CB 3.25Å; R323-S327 WeakPolarHBondContact O-CB 3.42Å; R323-S327 PolarHBondContact O-N 3.46Å; R323-S327 PolarHBondContact O-OG 2.96Å; I324-S327 PolarHBondContact O-N 3.32Å
328	Y	98.3	Very high	98.5	Very high	41 Å²	41	41.3 Å²	41.3	16%	0.161	19%	0.186	C	C	.	.			trans	-124.7	157.4	-174.2	-65.2	-76.7	0	0	0	111.9	P286 P288 L291 I324 L333 L334 R366	P286-Y328 VanDerWaalsContact CA-OH 3.28Å; P286-Y328 WeakPolarHBondContact CA-OH 3.48Å; P288-Y328 HydrophobicContact CG-CD1 3.81Å; P288-Y328 HydrophobicContact CG-CE1 3.81Å; L291-Y328 HydrophobicContact CD1-CE2 3.79Å; I324-Y328 HydrophobicContact CB-CD2 4.46Å; I324-Y328 HydrophobicContact CG1-CE2 4.42Å; I324-Y328 HydrophobicContact CG2-CD2 4.13Å; I324-Y328 WeakPolarHBondContact O-CD2 3.24Å; I324-Y328 PolarHBondContact O-N 3.21Å; Y328-L333 HydrophobicContact CD2-CD2 3.88Å; Y328-L333 HydrophobicContact CE2-CD2 4.49Å; Y328-L333 HydrophobicContact CG-CD2 3.93Å; Y328-L334 WeakPolarHBondContact O-CD2 3.45Å; Y328-R366 PolarHBondContact O-NH2 2.93Å
329	D	97.1	Very high	98.5	Very high	117 Å²	117	44.2 Å²	44.2	63%	0.626	20%	0.197	S	C	*	.			trans	-118.1	2.4	174.6	-59.6	-50.2	0	0	0	112.7	E331 R366	D329-E331 PolarHBondContact O-N 3.15Å; D329-R366 IonicContact OD1-CZ 2.79Å; D329-R366 IonicContact OD1-NH1 3.06Å; D329-R366 PolarHBondContact OD1-NH1 2.99Å; D329-R366 IonicContact OD1-NH2 3.27Å
330	Y	98.4	Very high	98.5	Very high	84 Å²	84	36.7 Å²	36.7	33%	0.329	17%	0.169	S	C	.	.			trans	-67.9	103.9	177.8	177.9	-135.9	0	0	0	110.3	P288 K289 A292 K332 L333 L334	P288-Y330 HydrophobicContact CB-CD1 3.74Å; P288-Y330 HydrophobicContact CB-CG 4.18Å; K289-Y330 HydrophobicContact CG-CE1 4.03Å; A292-Y330 HydrophobicContact CB-CE1 4.28Å; Y330-K332 VanDerWaalsContact C-N 3.3Å; Y330-K332 HydrophobicContact CD1-CB 4.49Å; Y330-K332 HydrophobicContact CE1-CB 3.8Å; Y330-K332 HydrophobicContact CE2-CB 3.99Å; Y330-K332 PolarHBondContact O-N 2.89Å; Y330-K332 VanDerWaalsContact O-N 3.15Å; Y330-L333 HydrophobicContact CD1-CB 3.61Å; Y330-L333 HydrophobicContact CE1-CB 4.39Å; Y330-L333 HydrophobicContact CG-CB 4.3Å; Y330-L333 WeakPolarHBondContact O-CA 3.31Å; Y330-L333 WeakPolarHBondContact O-CB 3.03Å; Y330-L333 PolarHBondContact O-N 3.03Å; Y330-L334 PolarHBondContact O-N 3.36Å
331	E	98.4	Very high	98.5	Very high	45 Å²	45	35.8 Å²	35.8	21%	0.21	17%	0.165	C	C	.	.	H	α-helix	trans	-52.3	-42.2	-170.1	-172.9	-79.9	165.5	0	0	113.9	D329 L333 L334 W335 S371 R373	D329-E331 PolarHBondContact O-N 3.15Å; E331-L333 VanDerWaalsContact C-N 3.31Å; E331-L333 PolarHBondContact O-N 3.14Å; E331-L334 PolarHBondContact O-N 3.1Å; E331-W335 WeakPolarHBondContact O-CB 3.31Å; E331-W335 PolarHBondContact O-N 3.28Å; E331-S371 WeakPolarHBondContact OE1-CB 3.48Å; E331-S371 PolarHBondContact OE1-OG 3.48Å; E331-R373 IonicContact OE1-CZ 3.9Å; E331-R373 VanDerWaalsContact OE1-CZ 3.27Å; E331-R373 IonicContact OE1-NE 2.68Å; E331-R373 PolarHBondContact OE1-NE 3.09Å; E331-R373 IonicContact OE1-NH2 3Å; E331-R373 PolarHBondContact OE1-NH2 3.41Å; E331-R373 IonicContact OE2-CZ 3.36Å; E331-R373 IonicContact OE2-NE 3.47Å; E331-R373 IonicContact OE2-NH2 3.67Å; E331-R373 PolarHBondContact OE2-NH2 2.83Å
332	K	98.4	Very high	98.5	Very high	101 Å²	101	39 Å²	39	44%	0.439	18%	0.178	S	C	.	.	H	α-helix	trans	-62.1	-39.8	178.5	-173.6	179.8	179.7	178	0	111.8	A292 Y330 T336	A292-K332 HydrophobicContact CB-CG 4.41Å; Y330-K332 VanDerWaalsContact C-N 3.3Å; Y330-K332 HydrophobicContact CD1-CB 4.49Å; Y330-K332 HydrophobicContact CE1-CB 3.8Å; Y330-K332 HydrophobicContact CE2-CB 3.99Å; Y330-K332 PolarHBondContact O-N 2.89Å; Y330-K332 VanDerWaalsContact O-N 3.15Å; K332-T336 WeakPolarHBondContact O-CG2 3.21Å; K332-T336 PolarHBondContact O-N 3.49Å; K332-T336 PolarHBondContact O-OG1 3.44Å
333	L	98.7	Very high	98.5	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-68.4	-43.4	176.5	170.7	61.4	0	0	0	111.5	P288 L291 A292 T295 I324 Y328 Y330 E331 W335 T336 S337	P288-L333 HydrophobicContact CB-CD2 4.05Å; L291-L333 HydrophobicContact CB-CD1 3.46Å; L291-L333 VanDerWaalsContact CB-CD1 3.46Å; L291-L333 HydrophobicContact CB-CD2 4.01Å; L291-L333 HydrophobicContact CB-CG 4.4Å; L291-L333 HydrophobicContact CD1-CD2 4.02Å; A292-L333 HydrophobicContact CB-CB 4.24Å; A292-L333 HydrophobicContact CB-CD1 4.4Å; T295-L333 HydrophobicContact CG2-CD1 4.43Å; I324-L333 HydrophobicContact CG2-CD1 3.73Å; I324-L333 HydrophobicContact CG2-CD2 3.81Å; I324-L333 HydrophobicContact CG2-CG 3.67Å; Y328-L333 HydrophobicContact CD2-CD2 3.88Å; Y328-L333 HydrophobicContact CE2-CD2 4.49Å; Y328-L333 HydrophobicContact CG-CD2 3.93Å; Y330-L333 HydrophobicContact CD1-CB 3.61Å; Y330-L333 HydrophobicContact CE1-CB 4.39Å; Y330-L333 HydrophobicContact CG-CB 4.3Å; Y330-L333 WeakPolarHBondContact O-CA 3.31Å; Y330-L333 WeakPolarHBondContact O-CB 3.03Å; Y330-L333 PolarHBondContact O-N 3.03Å; E331-L333 VanDerWaalsContact C-N 3.31Å; E331-L333 PolarHBondContact O-N 3.14Å; L333-W335 VanDerWaalsContact C-N 3.28Å; L333-W335 PolarHBondContact O-N 3.04Å; L333-T336 PolarHBondContact O-N 3.19Å; L333-T336 PolarHBondContact O-OG1 3.33Å; L333-S337 WeakPolarHBondContact CD1-OG 3.01Å; L333-S337 WeakPolarHBondContact O-CB 3.21Å; L333-S337 PolarHBondContact O-N 3.04Å; L333-S337 PolarHBondContact O-OG 2.61Å
334	L	98.8	Very high	98.5	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-57.7	-46.5	176.1	-66.1	-175.4	0	0	0	110.7	I325 Y328 Y330 E331 S337 S338 L374	I325-L334 HydrophobicContact CB-CD2 4.28Å; I325-L334 HydrophobicContact CG1-CD2 4.41Å; I325-L334 HydrophobicContact CG2-CD2 4.16Å; Y328-L334 WeakPolarHBondContact O-CD2 3.45Å; Y330-L334 PolarHBondContact O-N 3.36Å; E331-L334 PolarHBondContact O-N 3.1Å; L334-S337 PolarHBondContact O-N 3.13Å; L334-S338 WeakPolarHBondContact O-CB 3.41Å; L334-S338 PolarHBondContact O-N 3.44Å; L334-S338 PolarHBondContact O-OG 3.06Å; L334-L374 HydrophobicContact CB-CD1 3.85Å; L334-L374 HydrophobicContact CB-CD2 3.82Å; L334-L374 HydrophobicContact CD1-CD2 3.92Å
335	W	98.6	Very high	98.5	Very high	61 Å²	61	35.5 Å²	35.5	23%	0.231	17%	0.166	C	C	.	.	H	α-helix	trans	-67.2	-42.9	-179.6	176.3	75.9	0	0	0	113.5	E331 L333 S337 S338 R339 R373 L374	E331-W335 WeakPolarHBondContact O-CB 3.31Å; E331-W335 PolarHBondContact O-N 3.28Å; L333-W335 VanDerWaalsContact C-N 3.28Å; L333-W335 PolarHBondContact O-N 3.04Å; W335-S337 VanDerWaalsContact C-N 3.34Å; W335-S338 PolarHBondContact O-OG 2.92Å; W335-R339 VanDerWaalsContact CZ2-CD 3.47Å; W335-R339 WeakPolarHBondContact O-CB 3.09Å; W335-R339 VanDerWaalsContact O-CG 3.27Å; W335-R339 WeakPolarHBondContact O-CG 3.04Å; W335-R339 PolarHBondContact O-N 2.93Å; W335-R373 VanDerWaalsContact CZ3-NH1 3.27Å; W335-L374 HydrophobicContact CB-CD1 4.33Å
336	T	98.5	Very high	98.4	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.012	19%	0.188	C	C	.	.	H	α-helix	trans	-67.7	-37	175.8	54.7	0	0	0	0	111.7	T295 D296 K332 L333 R339 L340	T295-T336 WeakPolarHBondContact OG1-CB 3.42Å; T295-T336 PolarHBondContact OG1-OG1 3.46Å; D296-T336 HydrophobicContact CB-CG2 4.16Å; K332-T336 WeakPolarHBondContact O-CG2 3.21Å; K332-T336 PolarHBondContact O-N 3.49Å; K332-T336 PolarHBondContact O-OG1 3.44Å; L333-T336 PolarHBondContact O-N 3.19Å; L333-T336 PolarHBondContact O-OG1 3.33Å; T336-R339 PolarHBondContact O-N 2.82Å; T336-L340 PolarHBondContact O-N 2.87Å
337	S	98.9	Very high	98.4	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-67.5	-44.1	177.2	-54.2	0	0	0	0	111.9	I324 L333 L334 W335 R339 L340 L341	I324-S337 WeakPolarHBondContact CG2-OG 3.35Å; L333-S337 WeakPolarHBondContact CD1-OG 3.01Å; L333-S337 WeakPolarHBondContact O-CB 3.21Å; L333-S337 PolarHBondContact O-N 3.04Å; L333-S337 PolarHBondContact O-OG 2.61Å; L334-S337 PolarHBondContact O-N 3.13Å; W335-S337 VanDerWaalsContact C-N 3.34Å; S337-R339 VanDerWaalsContact C-N 3.31Å; S337-R339 PolarHBondContact O-N 3.38Å; S337-L340 PolarHBondContact O-N 3.47Å; S337-L341 PolarHBondContact O-N 3.46Å
338	S	98.7	Very high	98.3	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-65.3	-35.5	176.5	67	0	0	0	0	111.7	L334 W335 L341 K342 S377	L334-S338 WeakPolarHBondContact O-CB 3.41Å; L334-S338 PolarHBondContact O-N 3.44Å; L334-S338 PolarHBondContact O-OG 3.06Å; W335-S338 PolarHBondContact O-OG 2.92Å; S338-L341 PolarHBondContact O-N 3.38Å; S338-K342 WeakPolarHBondContact O-CB 3.39Å; S338-K342 PolarHBondContact O-N 3.19Å; S338-S377 WeakPolarHBondContact CB-OG 3.28Å; S338-S377 VanDerWaalsContact OG-CB 3.32Å; S338-S377 WeakPolarHBondContact OG-CB 3.35Å; S338-S377 PolarHBondContact OG-OG 3.26Å
339	R	98.6	Very high	98.3	Very high	65 Å²	65	39.6 Å²	39.6	25%	0.245	19%	0.192	C	C	.	.	H	α-helix	trans	-64.7	-41.4	173.5	-77.9	-179.1	67.2	-140.1	-2.4	112.4	D296 Q299 W335 T336 S337 K342 V343 S377	D296-R339 IonicContact OD1-NH1 2.88Å; Q299-R339 HydrophobicContact CG-CB 4.4Å; W335-R339 VanDerWaalsContact CZ2-CD 3.47Å; W335-R339 WeakPolarHBondContact O-CB 3.09Å; W335-R339 VanDerWaalsContact O-CG 3.27Å; W335-R339 WeakPolarHBondContact O-CG 3.04Å; W335-R339 PolarHBondContact O-N 2.93Å; T336-R339 PolarHBondContact O-N 2.82Å; S337-R339 VanDerWaalsContact C-N 3.31Å; S337-R339 PolarHBondContact O-N 3.38Å; R339-K342 WeakPolarHBondContact O-CB 3.49Å; R339-K342 PolarHBondContact O-N 3.22Å; R339-V343 WeakPolarHBondContact O-CG2 3.49Å; R339-V343 PolarHBondContact O-N 2.91Å; R339-V343 VanDerWaalsContact O-N 3.1Å; R339-S377 PolarHBondContact N-OG 3.23Å
340	L	98.8	Very high	98.4	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-65.1	-45.9	174.3	176.7	53.6	0	0	0	111	L298 Q299 A302 I312 L321 T336 S337 K342 V343 L344	L298-L340 HydrophobicContact CB-CD1 4.31Å; L298-L340 HydrophobicContact CB-CD2 3.52Å; L298-L340 HydrophobicContact CD1-CD2 4.14Å; L298-L340 HydrophobicContact CG-CD2 4.49Å; Q299-L340 HydrophobicContact CB-CB 4.18Å; Q299-L340 HydrophobicContact CB-CD1 4.33Å; A302-L340 HydrophobicContact CB-CD1 4.11Å; I312-L340 HydrophobicContact CD1-CD1 4.29Å; L321-L340 HydrophobicContact CD1-CB 4.44Å; L321-L340 HydrophobicContact CD1-CD2 3.66Å; L321-L340 HydrophobicContact CD1-CG 3.68Å; L321-L340 HydrophobicContact CD2-CD2 3.69Å; L321-L340 HydrophobicContact CD2-CG 4.35Å; L321-L340 HydrophobicContact CG-CD2 4.29Å; T336-L340 PolarHBondContact O-N 2.87Å; S337-L340 PolarHBondContact O-N 3.47Å; L340-K342 VanDerWaalsContact C-N 3.29Å; L340-K342 PolarHBondContact O-N 3.28Å; L340-V343 WeakPolarHBondContact O-CB 3.5Å; L340-V343 PolarHBondContact O-N 2.92Å; L340-L344 HydrophobicContact CD1-CD1 4.19Å; L340-L344 HydrophobicContact CD1-CD2 4.42Å; L340-L344 HydrophobicContact CD1-CG 4.07Å; L340-L344 HydrophobicContact CG-CD1 4.18Å; L340-L344 HydrophobicContact CG-CG 4.48Å; L340-L344 WeakPolarHBondContact O-CG 3.41Å; L340-L344 PolarHBondContact O-N 3.03Å
341	L	98.8	Very high	98.4	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-57.4	-41.6	174.3	-76.5	174.3	0	0	0	112.2	L321 V322 I325 S337 S338 V343 L344 S345 I354	L321-L341 HydrophobicContact CB-CD1 4.28Å; L321-L341 HydrophobicContact CB-CD2 3.79Å; L321-L341 HydrophobicContact CB-CG 3.93Å; L321-L341 HydrophobicContact CD1-CD2 3.93Å; L321-L341 HydrophobicContact CD1-CG 4.22Å; V322-L341 HydrophobicContact CG2-CD1 4.33Å; V322-L341 HydrophobicContact CG2-CD2 4.46Å; I325-L341 HydrophobicContact CD1-CD1 3.42Å; I325-L341 VanDerWaalsContact CD1-CD1 3.42Å; S337-L341 PolarHBondContact O-N 3.46Å; S338-L341 PolarHBondContact O-N 3.38Å; L341-V343 VanDerWaalsContact C-N 3.32Å; L341-V343 PolarHBondContact O-N 3.37Å; L341-L344 CarbonylContact O-C 3.47Å; L341-L344 PolarHBondContact O-N 3.34Å; L341-L344 VanDerWaalsContact O-N 3.14Å; L341-S345 VanDerWaalsContact O-CB 3.3Å; L341-S345 WeakPolarHBondContact O-CB 3.44Å; L341-S345 PolarHBondContact O-N 3.41Å; L341-S345 PolarHBondContact O-OG 3.11Å; L341-I354 HydrophobicContact CD2-CD1 4.47Å; L341-I354 HydrophobicContact CD2-CG1 4.23Å; L341-I354 HydrophobicContact CD2-CG2 4.26Å
342	K	98.6	Very high	98.3	Very high	66 Å²	66	32.2 Å²	32.2	29%	0.287	16%	0.162	S	C	.	.	H	α-helix	trans	-56.4	-44	172.9	177.1	172.7	79.2	163	0	112.4	S338 R339 L340 L344 S345 D380 C381	S338-K342 WeakPolarHBondContact O-CB 3.39Å; S338-K342 PolarHBondContact O-N 3.19Å; R339-K342 WeakPolarHBondContact O-CB 3.49Å; R339-K342 PolarHBondContact O-N 3.22Å; L340-K342 VanDerWaalsContact C-N 3.29Å; L340-K342 PolarHBondContact O-N 3.28Å; K342-L344 VanDerWaalsContact C-N 3.31Å; K342-L344 PolarHBondContact O-N 2.98Å; K342-S345 PolarHBondContact O-N 3.38Å; K342-S345 PolarHBondContact O-OG 3.19Å; K342-D380 HydrophobicContact CD-CB 3.32Å; K342-D380 WeakPolarHBondContact CD-OD2 3.45Å; K342-D380 HydrophobicContact CG-CB 4.2Å; K342-D380 IonicContact NZ-OD2 3.71Å; K342-D380 PolarHBondContact NZ-OD2 3.01Å; K342-C381 HydrophobicContact CB-CB 4.1Å
343	V	98.5	Very high	98.3	Very high	12 Å²	12	28.7 Å²	28.7	7%	0.073	15%	0.152	C	C	.	.	H	α-helix	trans	-66.8	-34.9	178.2	169.1	0	0	0	0	111.7	Q299 A302 Y303 K309 R339 L340 L341 V346	Q299-V343 HydrophobicContact CG-CG2 4.17Å; A302-V343 HydrophobicContact CB-CG1 3.84Å; Y303-V343 HydrophobicContact CD2-CG2 4.06Å; K309-V343 VanDerWaalsContact CE-O 3.25Å; K309-V343 WeakPolarHBondContact CE-O 3.4Å; K309-V343 PolarHBondContact NZ-O 3.15Å; R339-V343 WeakPolarHBondContact O-CG2 3.49Å; R339-V343 PolarHBondContact O-N 2.91Å; R339-V343 VanDerWaalsContact O-N 3.1Å; L340-V343 WeakPolarHBondContact O-CB 3.5Å; L340-V343 PolarHBondContact O-N 2.92Å; L341-V343 VanDerWaalsContact C-N 3.32Å; L341-V343 PolarHBondContact O-N 3.37Å; V343-V346 WeakPolarHBondContact O-CG2 3.45Å
344	L	98.8	Very high	98.3	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-76.8	-33.2	177.5	-62.2	176.1	0	0	0	112.1	A302 K309 I312 L321 L340 L341 K342 V346 C347 N350 I354	A302-L344 HydrophobicContact CB-CD2 4.49Å; K309-L344 HydrophobicContact CB-CD2 3.9Å; K309-L344 HydrophobicContact CG-CD2 3.97Å; I312-L344 HydrophobicContact CB-CD2 4.34Å; I312-L344 HydrophobicContact CD1-CD2 4.11Å; I312-L344 HydrophobicContact CG2-CD1 3.86Å; I312-L344 HydrophobicContact CG2-CD2 4.21Å; L321-L344 HydrophobicContact CD1-CD1 3.66Å; L340-L344 HydrophobicContact CD1-CD1 4.19Å; L340-L344 HydrophobicContact CD1-CD2 4.42Å; L340-L344 HydrophobicContact CD1-CG 4.07Å; L340-L344 HydrophobicContact CG-CD1 4.18Å; L340-L344 HydrophobicContact CG-CG 4.48Å; L340-L344 WeakPolarHBondContact O-CG 3.41Å; L340-L344 PolarHBondContact O-N 3.03Å; L341-L344 CarbonylContact O-C 3.47Å; L341-L344 PolarHBondContact O-N 3.34Å; L341-L344 VanDerWaalsContact O-N 3.14Å; K342-L344 VanDerWaalsContact C-N 3.31Å; K342-L344 PolarHBondContact O-N 2.98Å; L344-V346 PolarHBondContact O-N 3.33Å; L344-V346 VanDerWaalsContact O-N 3.13Å; L344-C347 WeakPolarHBondContact O-CB 3.27Å; L344-C347 PolarHBondContact O-N 3.3Å; L344-N350 HydrophobicContact CB-CB 4.32Å; L344-N350 WeakPolarHBondContact O-CB 3.43Å; L344-I354 HydrophobicContact CB-CD1 3.79Å
345	S	98.4	Very high	98.3	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-8.4	-174.5	70.6	0	0	0	0	114.3	L341 K342 K351 N384	L341-S345 VanDerWaalsContact O-CB 3.3Å; L341-S345 WeakPolarHBondContact O-CB 3.44Å; L341-S345 PolarHBondContact O-N 3.41Å; L341-S345 PolarHBondContact O-OG 3.11Å; K342-S345 PolarHBondContact O-N 3.38Å; K342-S345 PolarHBondContact O-OG 3.19Å; S345-K351 WeakPolarHBondContact O-CE 3.39Å; S345-K351 WeakPolarHBondContact O-CG 3.18Å; S345-N384 WeakPolarHBondContact OG-CB 3.3Å; S345-N384 PolarHBondContact OG-ND2 3.43Å; S345-N384 VanDerWaalsContact OG-ND2 3.15Å
346	V	97.1	Very high	98.3	Very high	79 Å²	79	34.3 Å²	34.3	48%	0.479	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-3.5	170.2	-55.3	0	0	0	0	112.8	V343 L344 N384	V343-V346 WeakPolarHBondContact O-CG2 3.45Å; L344-V346 PolarHBondContact O-N 3.33Å; L344-V346 VanDerWaalsContact O-N 3.13Å; V346-N384 VanDerWaalsContact CG1-ND2 3.32Å; V346-N384 WeakPolarHBondContact CG1-ND2 3.38Å
347	C	97.3	Very high	98.2	Very high	9 Å²	9	35.9 Å²	35.9	6%	0.061	19%	0.194	C	C	.	.	S	Bend	trans	-93.9	117.7	176.1	167.4	0	0	0	0	109.5	K309 L344 Q349 N350 K351	K309-C347 HydrophobicContact CB-CB 4.27Å; K309-C347 HydrophobicContact CD-CB 3.77Å; L344-C347 WeakPolarHBondContact O-CB 3.27Å; L344-C347 PolarHBondContact O-N 3.3Å; C347-Q349 PolarHBondContact O-N 3.28Å; C347-Q349 VanDerWaalsContact O-N 3.14Å; C347-Q349 PolarHBondContact SG-OE1 3.27Å; C347-N350 HydrophobicContact CB-CB 4.09Å; C347-N350 PolarHBondContact O-N 3.01Å; C347-N350 PolarHBondContact SG-ND2 3.29Å; C347-N350 VanDerWaalsContact SG-ND2 3.45Å; C347-K351 PolarHBondContact O-N 3.21Å
348	P	97.6	Very high	98.2	Very high	80 Å²	80	36.8 Å²	36.8	52%	0.519	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-33.9	-176.9	-28.3	35.6	0	0	0	114	P352	P348-P352 WeakPolarHBondContact O-CD 3.2Å
349	Q	97.8	Very high	98.2	Very high	111 Å²	111	36.8 Å²	36.8	52%	0.519	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-27.3	178	-60.9	78.7	7.2	0	0	112.8	L310 L313 C347	L310-Q349 HydrophobicContact CD2-CB 3.75Å; L310-Q349 HydrophobicContact CD2-CG 3.96Å; L313-Q349 HydrophobicContact CD2-CB 3.97Å; L313-Q349 VanDerWaalsContact CD2-O 3.28Å; L313-Q349 WeakPolarHBondContact CD2-O 3.42Å; C347-Q349 PolarHBondContact O-N 3.28Å; C347-Q349 VanDerWaalsContact O-N 3.14Å; C347-Q349 PolarHBondContact SG-OE1 3.27Å
350	N	98.6	Very high	98.2	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-33.6	177.9	-91.7	-90.2	0	0	0	112.4	K309 P318 L344 C347 A353 I354	K309-N350 PolarHBondContact O-ND2 2.95Å; P318-N350 WeakPolarHBondContact CG-OD1 3.22Å; L344-N350 HydrophobicContact CB-CB 4.32Å; L344-N350 WeakPolarHBondContact O-CB 3.43Å; C347-N350 HydrophobicContact CB-CB 4.09Å; C347-N350 PolarHBondContact O-N 3.01Å; C347-N350 PolarHBondContact SG-ND2 3.29Å; C347-N350 VanDerWaalsContact SG-ND2 3.45Å; N350-A353 PolarHBondContact O-N 3.45Å; N350-A353 VanDerWaalsContact O-N 3.12Å; N350-I354 HydrophobicContact CB-CD1 4.03Å; N350-I354 VanDerWaalsContact O-CG1 3.31Å; N350-I354 WeakPolarHBondContact O-CG1 3.45Å; N350-I354 PolarHBondContact O-N 3.09Å
351	K	98	Very high	98.1	Very high	22 Å²	22	35.7 Å²	35.7	10%	0.096	20%	0.201	C	C	.	.	H	α-helix	trans	-51.1	-52.1	-175.5	-77.9	-174	175.7	-159.5	0	112.9	S345 C347 A353 I354 I355 N384 L385 D387 E388	S345-K351 WeakPolarHBondContact O-CE 3.39Å; S345-K351 WeakPolarHBondContact O-CG 3.18Å; C347-K351 PolarHBondContact O-N 3.21Å; K351-A353 VanDerWaalsContact C-N 3.33Å; K351-A353 PolarHBondContact O-N 2.85Å; K351-I354 PolarHBondContact O-N 3.15Å; K351-I355 WeakPolarHBondContact O-CG1 3.41Å; K351-I355 PolarHBondContact O-N 3.33Å; K351-N384 WeakPolarHBondContact CE-O 3.16Å; K351-N384 PolarHBondContact NZ-O 3.31Å; K351-L385 HydrophobicContact CB-CD2 4.36Å; K351-L385 HydrophobicContact CG-CD2 4.12Å; K351-D387 IonicContact NZ-OD1 3.79Å; K351-D387 PolarHBondContact NZ-OD1 2.86Å; K351-D387 IonicContact NZ-OD2 3.89Å; K351-D387 PolarHBondContact NZ-OD2 3.31Å; K351-E388 WeakPolarHBondContact CB-OE2 3.26Å; K351-E388 VanDerWaalsContact CD-CD 3.45Å; K351-E388 HydrophobicContact CD-CG 4.12Å; K351-E388 WeakPolarHBondContact CD-OE1 3.4Å
352	P	97.7	Very high	98.1	Very high	68 Å²	68	36.2 Å²	36.2	44%	0.442	20%	0.204	S	C	.	.	H	α-helix	trans	-60.9	-39.8	179.1	-25.1	34.3	0	0	0	113.1	P348 I355 Q356	P348-P352 WeakPolarHBondContact O-CD 3.2Å; P352-I355 PolarHBondContact O-N 2.96Å; P352-Q356 WeakPolarHBondContact O-CB 3.49Å; P352-Q356 PolarHBondContact O-N 3.4Å
353	A	98.3	Very high	98.1	Very high	27 Å²	27	33 Å²	33	22%	0.223	19%	0.191	C	C	.	.	H	α-helix	trans	-68.8	-36.9	179.8	0	0	0	0	0	112.2	L313 P318 N350 K351 A357	L313-A353 HydrophobicContact CD1-CB 3.47Å; L313-A353 VanDerWaalsContact CD1-CB 3.47Å; P318-A353 HydrophobicContact CB-CB 4.45Å; P318-A353 HydrophobicContact CG-CB 4.4Å; N350-A353 PolarHBondContact O-N 3.45Å; N350-A353 VanDerWaalsContact O-N 3.12Å; K351-A353 VanDerWaalsContact C-N 3.33Å; K351-A353 PolarHBondContact O-N 2.85Å; A353-A357 WeakPolarHBondContact O-CB 3.46Å; A353-A357 PolarHBondContact O-N 2.82Å; A353-A357 VanDerWaalsContact O-N 3.09Å
354	I	98.7	Very high	98.1	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-65.3	-46.5	174.4	-66.8	165.3	0	0	0	109.9	P318 L341 L344 N350 K351 A357 C359 L385	P318-I354 HydrophobicContact CB-CG1 3.81Å; P318-I354 HydrophobicContact CG-CG1 4.2Å; L341-I354 HydrophobicContact CD2-CD1 4.47Å; L341-I354 HydrophobicContact CD2-CG1 4.23Å; L341-I354 HydrophobicContact CD2-CG2 4.26Å; L344-I354 HydrophobicContact CB-CD1 3.79Å; N350-I354 HydrophobicContact CB-CD1 4.03Å; N350-I354 VanDerWaalsContact O-CG1 3.31Å; N350-I354 WeakPolarHBondContact O-CG1 3.45Å; N350-I354 PolarHBondContact O-N 3.09Å; K351-I354 PolarHBondContact O-N 3.15Å; I354-A357 PolarHBondContact O-N 2.77Å; I354-C359 HydrophobicContact CG2-CB 3.38Å; I354-C359 WeakPolarHBondContact CG2-SG 3.38Å; I354-C359 WeakPolarHBondContact O-CB 3.32Å; I354-C359 PolarHBondContact O-N 3.12Å; I354-L385 HydrophobicContact CB-CD2 4.17Å; I354-L385 HydrophobicContact CD1-CD2 4.45Å; I354-L385 HydrophobicContact CG2-CD1 3.64Å; I354-L385 HydrophobicContact CG2-CD2 3.91Å; I354-L385 HydrophobicContact CG2-CG 4.43Å
355	I	98.4	Very high	98	Very high	9 Å²	9	36.8 Å²	36.8	5%	0.046	21%	0.208	C	C	.	.	H	α-helix	trans	-62.7	-50.4	178.6	-68.6	167.9	0	0	0	110.4	K351 P352 A357 G358 L385 E388 A389 E392	K351-I355 WeakPolarHBondContact O-CG1 3.41Å; K351-I355 PolarHBondContact O-N 3.33Å; P352-I355 PolarHBondContact O-N 2.96Å; I355-A357 PolarHBondContact O-N 2.9Å; I355-A357 VanDerWaalsContact O-N 3.15Å; I355-G358 WeakPolarHBondContact O-CA 3.44Å; I355-G358 PolarHBondContact O-N 3.27Å; I355-L385 HydrophobicContact CD1-CB 4.47Å; I355-L385 HydrophobicContact CD1-CD2 4.49Å; I355-L385 HydrophobicContact CG1-CB 4.34Å; I355-L385 HydrophobicContact CG1-CD2 4.16Å; I355-E388 HydrophobicContact CD1-CB 3.71Å; I355-A389 HydrophobicContact CD1-CB 4.05Å; I355-A389 HydrophobicContact CG1-CB 4.42Å; I355-E392 HydrophobicContact CG2-CG 3.44Å; I355-E392 VanDerWaalsContact CG2-CG 3.44Å; I355-E392 WeakPolarHBondContact CG2-OE1 3.41Å
356	Q	97.6	Very high	98	Very high	171 Å²	171	38.2 Å²	38.2	80%	0.799	21%	0.213	S	C	*	.	H	α-helix	trans	-59.2	-28.4	178.7	-173.4	179.7	19.5	0	0	113.1	P352 G358	P352-Q356 WeakPolarHBondContact O-CB 3.49Å; P352-Q356 PolarHBondContact O-N 3.4Å; Q356-G358 PolarHBondContact O-N 3.22Å
357	A	97.7	Very high	98.1	Very high	34 Å²	34	34.7 Å²	34.7	28%	0.281	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-2.2	174.2	0	0	0	0	0	113.8	V322 A353 I354 I355	V322-A357 HydrophobicContact CB-CB 4.16Å; V322-A357 VanDerWaalsContact CG1-O 3.31Å; V322-A357 WeakPolarHBondContact CG1-O 3.25Å; V322-A357 HydrophobicContact CG2-CB 3.93Å; A353-A357 WeakPolarHBondContact O-CB 3.46Å; A353-A357 PolarHBondContact O-N 2.82Å; A353-A357 VanDerWaalsContact O-N 3.09Å; I354-A357 PolarHBondContact O-N 2.77Å; I355-A357 PolarHBondContact O-N 2.9Å; I355-A357 VanDerWaalsContact O-N 3.15Å
358	G	97.9	Very high	98	Very high	20 Å²	20	38.4 Å²	38.4	21%	0.206	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.9	21.8	-179.4	0	0	0	0	0	113.9	I355 Q356 M360 Q361 V362	I355-G358 WeakPolarHBondContact O-CA 3.44Å; I355-G358 PolarHBondContact O-N 3.27Å; Q356-G358 PolarHBondContact O-N 3.22Å; G358-M360 VanDerWaalsContact C-N 3.29Å; G358-M360 PolarHBondContact O-N 3.22Å; G358-Q361 VanDerWaalsContact CA-OE1 3.29Å; G358-Q361 PolarHBondContact O-N 2.92Å; G358-Q361 PolarHBondContact O-OE1 3.33Å; G358-V362 WeakPolarHBondContact O-CG2 3.4Å; G358-V362 PolarHBondContact O-N 2.94Å; G358-V362 VanDerWaalsContact O-N 3.1Å
359	C	98.5	Very high	98	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-61.2	-35.3	-172.8	-172	0	0	0	0	113.2	V322 I354 Q361 V362 L363 L385	V322-C359 HydrophobicContact CG2-CB 3.69Å; I354-C359 HydrophobicContact CG2-CB 3.38Å; I354-C359 WeakPolarHBondContact CG2-SG 3.38Å; I354-C359 WeakPolarHBondContact O-CB 3.32Å; I354-C359 PolarHBondContact O-N 3.12Å; C359-Q361 VanDerWaalsContact C-N 3.33Å; C359-Q361 PolarHBondContact O-N 2.78Å; C359-V362 PolarHBondContact O-N 2.95Å; C359-L363 WeakPolarHBondContact O-CB 3.3Å; C359-L363 WeakPolarHBondContact O-CG 3.45Å; C359-L363 PolarHBondContact O-N 3.2Å; C359-L363 WeakPolarHBondContact SG-CD1 3.2Å; C359-L385 HydrophobicContact CB-CD1 4.36Å
360	M	98.5	Very high	98	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-58.6	-46.9	-179.5	-63	-58	-69.6	0	0	111.2	G358 G364 L382 L385 A389 E392 V395 L398 L424	G358-M360 VanDerWaalsContact C-N 3.29Å; G358-M360 PolarHBondContact O-N 3.22Å; M360-G364 PolarHBondContact O-N 3.07Å; M360-L382 HydrophobicContact CE-CD2 3.8Å; M360-L382 HydrophobicContact SD-CD2 3.82Å; M360-L385 HydrophobicContact SD-CB 3.6Å; M360-L385 HydrophobicContact SD-CD1 3.98Å; M360-L385 HydrophobicContact SD-CG 4.46Å; M360-A389 HydrophobicContact CE-CB 3.72Å; M360-A389 HydrophobicContact CG-CB 3.86Å; M360-A389 HydrophobicContact SD-CB 3.83Å; M360-E392 HydrophobicContact CG-CG 4.36Å; M360-V395 HydrophobicContact CB-CG1 4.23Å; M360-L398 HydrophobicContact CB-CD2 4.36Å; M360-L398 HydrophobicContact CE-CD2 3.92Å; M360-L424 HydrophobicContact CE-CD1 4.17Å; M360-L424 HydrophobicContact CE-CD2 4.22Å
361	Q	98	Very high	98	Very high	41 Å²	41	37.7 Å²	37.7	19%	0.192	22%	0.215	C	C	.	.	H	α-helix	trans	-70.9	-45.6	-179.7	-56.8	80.8	-0.9	0	0	110.5	G358 C359 G364 Q365 E393 N394	G358-Q361 VanDerWaalsContact CA-OE1 3.29Å; G358-Q361 PolarHBondContact O-N 2.92Å; G358-Q361 PolarHBondContact O-OE1 3.33Å; C359-Q361 VanDerWaalsContact C-N 3.33Å; C359-Q361 PolarHBondContact O-N 2.78Å; Q361-G364 PolarHBondContact O-N 3.41Å; Q361-Q365 WeakPolarHBondContact O-CG 3.46Å; Q361-Q365 PolarHBondContact O-N 3.34Å; Q361-E393 PolarHBondContact NE2-O 2.91Å; Q361-N394 WeakPolarHBondContact CG-O 3.46Å
362	V	98.5	Very high	97.9	Very high	11 Å²	11	42 Å²	42	7%	0.067	24%	0.235	C	C	.	.	H	α-helix	trans	-63	-45.9	-178.8	174.3	0	0	0	0	111.9	V322 I325 Q326 G358 C359 G364 Q365	V322-V362 HydrophobicContact CG1-CB 3.98Å; V322-V362 HydrophobicContact CG1-CG1 4.18Å; V322-V362 HydrophobicContact CG1-CG2 3.53Å; I325-V362 HydrophobicContact CB-CG1 3.85Å; I325-V362 HydrophobicContact CG2-CG1 3.6Å; Q326-V362 HydrophobicContact CB-CG1 4.04Å; Q326-V362 HydrophobicContact CB-CG2 4.28Å; G358-V362 WeakPolarHBondContact O-CG2 3.4Å; G358-V362 PolarHBondContact O-N 2.94Å; G358-V362 VanDerWaalsContact O-N 3.1Å; C359-V362 PolarHBondContact O-N 2.95Å; V362-G364 VanDerWaalsContact C-N 3.35Å; V362-Q365 PolarHBondContact O-N 3.33Å
363	L	98.6	Very high	97.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-68.5	-36.3	175.6	-67.6	-179.4	0	0	0	111.4	I325 C359 Q365 R366 L367 C378 C381 L382	I325-L363 HydrophobicContact CD1-CD2 3.77Å; I325-L363 HydrophobicContact CG2-CD2 4.27Å; C359-L363 WeakPolarHBondContact O-CB 3.3Å; C359-L363 WeakPolarHBondContact O-CG 3.45Å; C359-L363 PolarHBondContact O-N 3.2Å; C359-L363 WeakPolarHBondContact SG-CD1 3.2Å; L363-Q365 VanDerWaalsContact C-N 3.28Å; L363-Q365 PolarHBondContact O-N 3.05Å; L363-R366 PolarHBondContact O-N 2.92Å; L363-L367 PolarHBondContact O-N 3.14Å; L363-C378 HydrophobicContact CB-CB 4.45Å; L363-C378 HydrophobicContact CD2-CB 4.34Å; L363-C381 HydrophobicContact CD1-CB 3.79Å; L363-L382 HydrophobicContact CB-CD1 4.12Å; L363-L382 HydrophobicContact CB-CD2 3.94Å; L363-L382 HydrophobicContact CB-CG 3.94Å; L363-L382 HydrophobicContact CD1-CD2 4.3Å; L363-L382 HydrophobicContact CD1-CG 4.09Å
364	G	98.3	Very high	97.9	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-55.3	-41.2	173.6	0	0	0	0	0	113	M360 Q361 V362 R366 L367 H401	M360-G364 PolarHBondContact O-N 3.07Å; Q361-G364 PolarHBondContact O-N 3.41Å; V362-G364 VanDerWaalsContact C-N 3.35Å; G364-R366 PolarHBondContact O-N 3.43Å; G364-L367 WeakPolarHBondContact O-CB 3.1Å; G364-L367 PolarHBondContact O-N 3.4Å; G364-H401 PolarHBondContact O-ND1 3.32Å
365	Q	97.5	Very high	97.9	Very high	90 Å²	90	42.7 Å²	42.7	42%	0.421	22%	0.224	S	C	.	.	H	α-helix	trans	-64.3	-23.7	175.2	-69.2	172.1	14.3	0	0	113.4	Q361 V362 L363 V368	Q361-Q365 WeakPolarHBondContact O-CG 3.46Å; Q361-Q365 PolarHBondContact O-N 3.34Å; V362-Q365 PolarHBondContact O-N 3.33Å; L363-Q365 VanDerWaalsContact C-N 3.28Å; L363-Q365 PolarHBondContact O-N 3.05Å; Q365-V368 WeakPolarHBondContact O-CG2 3.33Å
366	R	97.9	Very high	97.8	Very high	30 Å²	30	44.4 Å²	44.4	11%	0.113	23%	0.23	C	C	.	.	H	α-helix	trans	-89	-4.6	179.8	-57.3	-53.7	175.8	175.6	-2	113.5	I325 Q326 Y328 D329 L363 G364 V368 H369	I325-R366 HydrophobicContact CG2-CG 3.77Å; I325-R366 VanDerWaalsContact O-CZ 3.3Å; I325-R366 PolarHBondContact O-NE 3.43Å; I325-R366 VanDerWaalsContact O-NE 3.09Å; I325-R366 PolarHBondContact O-NH2 3.26Å; Q326-R366 PolarHBondContact O-NH2 3.02Å; Y328-R366 PolarHBondContact O-NH2 2.93Å; D329-R366 IonicContact OD1-CZ 2.79Å; D329-R366 IonicContact OD1-NH1 3.06Å; D329-R366 PolarHBondContact OD1-NH1 2.99Å; D329-R366 IonicContact OD1-NH2 3.27Å; L363-R366 PolarHBondContact O-N 2.92Å; G364-R366 PolarHBondContact O-N 3.43Å; R366-V368 PolarHBondContact O-N 3.38Å; R366-H369 WeakPolarHBondContact O-CB 3.41Å; R366-H369 PolarHBondContact O-N 2.93Å
367	L	98.4	Very high	97.9	Very high	4 Å²	4	36.5 Å²	36.5	2%	0.021	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-14.9	177.5	-64.9	-174.4	0	0	0	114.2	L363 G364 I375 C378 L379 L382 L398 H401 L402 L405	L363-L367 PolarHBondContact O-N 3.14Å; G364-L367 WeakPolarHBondContact O-CB 3.1Å; G364-L367 PolarHBondContact O-N 3.4Å; L367-I375 HydrophobicContact CD2-CG2 4.31Å; L367-C378 HydrophobicContact CD2-CB 3.89Å; L367-L379 HydrophobicContact CD1-CD2 4.15Å; L367-L379 HydrophobicContact CD2-CD2 3.78Å; L367-L379 HydrophobicContact CD2-CG 3.9Å; L367-L382 HydrophobicContact CD1-CD1 3.98Å; L367-L382 HydrophobicContact CD2-CD1 4.15Å; L367-L382 HydrophobicContact CG-CD1 4.34Å; L367-L398 HydrophobicContact CD1-CD1 3.65Å; L367-H401 HydrophobicContact CB-CB 4.04Å; L367-H401 HydrophobicContact CD1-CB 4.12Å; L367-L402 HydrophobicContact CD1-CD2 3.97Å; L367-L402 HydrophobicContact CD1-CG 4.39Å; L367-L405 HydrophobicContact CB-CD1 3.95Å; L367-L405 HydrophobicContact CD1-CD1 4.18Å; L367-L405 HydrophobicContact CD2-CD1 4.26Å; L367-L405 HydrophobicContact CG-CD1 4.35Å
368	V	96.5	Very high	97.9	Very high	88 Å²	88	34.9 Å²	34.9	53%	0.533	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	5	174.5	-61.7	0	0	0	0	113.5	Q365 R366 H401	Q365-V368 WeakPolarHBondContact O-CG2 3.33Å; R366-V368 PolarHBondContact O-N 3.38Å; V368-H401 WeakPolarHBondContact CG1-CD2 3.39Å; V368-H401 WeakPolarHBondContact CG1-NE2 3.24Å
369	H	97.5	Very high	98	Very high	45 Å²	45	34 Å²	34	21%	0.208	17%	0.17	C	C	.	.	S	Bend	trans	-75.5	140.9	-176	-171.7	-87.3	0	0	0	111.9	R366 S371 L374 I375	R366-H369 WeakPolarHBondContact O-CB 3.41Å; R366-H369 PolarHBondContact O-N 2.93Å; H369-S371 VanDerWaalsContact ND1-CB 3.28Å; H369-S371 WeakPolarHBondContact ND1-CB 3.39Å; H369-S371 PolarHBondContact ND1-N 2.97Å; H369-S371 PolarHBondContact O-N 3.48Å; H369-S371 VanDerWaalsContact O-N 3.08Å; H369-L374 HydrophobicContact CB-CD2 4.13Å; H369-I375 WeakPolarHBondContact O-CD1 3.47Å
370	P	97	Very high	97.9	Very high	112 Å²	112	34.7 Å²	34.7	73%	0.727	18%	0.175	S	C	*	.	S	Bend	trans	-59.3	-25.4	-178.6	-27.6	35	0	0	0	116	Q372	P370-Q372 PolarHBondContact O-N 3.26Å; P370-Q372 PolarHBondContact O-NE2 3.21Å
371	S	97.8	Very high	98	Very high	19 Å²	19	34.7 Å²	34.7	13%	0.133	18%	0.175	C	C	.	.			trans	-74.5	108.2	-178.9	178.9	0	0	0	0	112.3	E331 H369 R373 L374 I375	E331-S371 WeakPolarHBondContact OE1-CB 3.48Å; E331-S371 PolarHBondContact OE1-OG 3.48Å; H369-S371 VanDerWaalsContact ND1-CB 3.28Å; H369-S371 WeakPolarHBondContact ND1-CB 3.39Å; H369-S371 PolarHBondContact ND1-N 2.97Å; H369-S371 PolarHBondContact O-N 3.48Å; H369-S371 VanDerWaalsContact O-N 3.08Å; S371-R373 PolarHBondContact O-N 3.18Å; S371-R373 VanDerWaalsContact OG-CG 3.28Å; S371-R373 WeakPolarHBondContact OG-CG 3.29Å; S371-L374 WeakPolarHBondContact O-CB 3.11Å; S371-L374 PolarHBondContact O-N 3.12Å; S371-L374 VanDerWaalsContact O-N 3.15Å; S371-L374 PolarHBondContact OG-N 3.26Å; S371-I375 PolarHBondContact O-N 2.96Å
372	Q	97	Very high	98	Very high	111 Å²	111	32.8 Å²	32.8	52%	0.519	17%	0.165	S	C	.	.	H	α-helix	trans	-62.8	-39.7	179.5	-59.8	-52.9	-50.1	0	0	112.8	P370 L374 I375 R376	P370-Q372 PolarHBondContact O-N 3.26Å; P370-Q372 PolarHBondContact O-NE2 3.21Å; Q372-L374 PolarHBondContact O-N 3.24Å; Q372-I375 PolarHBondContact O-N 3.49Å; Q372-R376 WeakPolarHBondContact O-CB 3.48Å; Q372-R376 PolarHBondContact O-N 2.93Å
373	R	97	Very high	98	Very high	101 Å²	101	35.9 Å²	35.9	38%	0.381	18%	0.176	S	C	.	.	H	α-helix	trans	-64	-30.6	176.3	67.4	-179	-162.3	123.6	4.9	112.7	E331 W335 S371 S377	E331-R373 IonicContact OE1-CZ 3.9Å; E331-R373 VanDerWaalsContact OE1-CZ 3.27Å; E331-R373 IonicContact OE1-NE 2.68Å; E331-R373 PolarHBondContact OE1-NE 3.09Å; E331-R373 IonicContact OE1-NH2 3Å; E331-R373 PolarHBondContact OE1-NH2 3.41Å; E331-R373 IonicContact OE2-CZ 3.36Å; E331-R373 IonicContact OE2-NE 3.47Å; E331-R373 IonicContact OE2-NH2 3.67Å; E331-R373 PolarHBondContact OE2-NH2 2.83Å; W335-R373 VanDerWaalsContact CZ3-NH1 3.27Å; S371-R373 PolarHBondContact O-N 3.18Å; S371-R373 VanDerWaalsContact OG-CG 3.28Å; S371-R373 WeakPolarHBondContact OG-CG 3.29Å; R373-S377 WeakPolarHBondContact O-CB 3.44Å; R373-S377 PolarHBondContact O-N 3.35Å
374	L	98.3	Very high	98	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-72.3	-50.6	173.9	175.9	60.4	0	0	0	110	L334 W335 H369 S371 Q372 R376 S377 C378	L334-L374 HydrophobicContact CB-CD1 3.85Å; L334-L374 HydrophobicContact CB-CD2 3.82Å; L334-L374 HydrophobicContact CD1-CD2 3.92Å; W335-L374 HydrophobicContact CB-CD1 4.33Å; H369-L374 HydrophobicContact CB-CD2 4.13Å; S371-L374 WeakPolarHBondContact O-CB 3.11Å; S371-L374 PolarHBondContact O-N 3.12Å; S371-L374 VanDerWaalsContact O-N 3.15Å; S371-L374 PolarHBondContact OG-N 3.26Å; Q372-L374 PolarHBondContact O-N 3.24Å; L374-R376 VanDerWaalsContact C-N 3.3Å; L374-R376 PolarHBondContact O-N 3.08Å; L374-S377 PolarHBondContact O-N 3.23Å; L374-S377 VanDerWaalsContact O-N 3.11Å; L374-C378 PolarHBondContact O-N 3.27Å; L374-C378 PolarHBondContact O-SG 3.18Å; L374-C378 VanDerWaalsContact O-SG 3.35Å
375	I	98.4	Very high	98	Very high	8 Å²	8	37.5 Å²	37.5	4%	0.041	18%	0.184	C	C	.	.	H	α-helix	trans	-52	-51.2	176.1	-69	168.8	0	0	0	110.2	L367 H369 S371 Q372 S377 C378 L379 L405	L367-I375 HydrophobicContact CD2-CG2 4.31Å; H369-I375 WeakPolarHBondContact O-CD1 3.47Å; S371-I375 PolarHBondContact O-N 2.96Å; Q372-I375 PolarHBondContact O-N 3.49Å; I375-S377 VanDerWaalsContact C-N 3.35Å; I375-S377 PolarHBondContact O-N 3.11Å; I375-C378 WeakPolarHBondContact O-CB 2.97Å; I375-C378 PolarHBondContact O-N 2.87Å; I375-C378 VanDerWaalsContact O-N 3.12Å; I375-L379 HydrophobicContact CG2-CD1 3.86Å; I375-L379 HydrophobicContact CG2-CG 4.22Å; I375-L379 WeakPolarHBondContact O-CG 3.25Å; I375-L379 PolarHBondContact O-N 3.39Å; I375-L405 HydrophobicContact CG2-CD1 4.1Å; I375-L405 HydrophobicContact CG2-CD2 4.41Å
376	R	97.9	Very high	98	Very high	46 Å²	46	33.2 Å²	33.2	17%	0.174	16%	0.164	C	C	.	.	H	α-helix	trans	-56.4	-47.2	178.6	-171.3	76	-172.6	97.3	10	111.8	Q372 L374 C378 L379 D380 E412 C416	Q372-R376 WeakPolarHBondContact O-CB 3.48Å; Q372-R376 PolarHBondContact O-N 2.93Å; L374-R376 VanDerWaalsContact C-N 3.3Å; L374-R376 PolarHBondContact O-N 3.08Å; R376-C378 VanDerWaalsContact C-N 3.33Å; R376-C378 PolarHBondContact O-N 3.42Å; R376-L379 PolarHBondContact O-N 3.02Å; R376-D380 IonicContact CZ-OD1 3.7Å; R376-D380 VanDerWaalsContact CZ-OD1 3.25Å; R376-D380 IonicContact NH1-OD1 3.52Å; R376-D380 PolarHBondContact NH1-OD1 3.5Å; R376-D380 IonicContact NH2-OD1 2.74Å; R376-D380 PolarHBondContact NH2-OD1 3.46Å; R376-D380 PolarHBondContact O-N 3.26Å; R376-E412 VanDerWaalsContact CZ-CB 3.49Å; R376-E412 IonicContact CZ-OE2 3.96Å; R376-E412 VanDerWaalsContact CZ-OE2 3.32Å; R376-E412 IonicContact NE-OE2 3.87Å; R376-E412 PolarHBondContact NE-OE2 3.41Å; R376-E412 PolarHBondContact NH1-O 3.1Å; R376-E412 IonicContact NH2-OE2 2.89Å; R376-E412 PolarHBondContact NH2-OE2 3.37Å; R376-C416 PolarHBondContact NH1-SG 3.39Å
377	S	97.9	Very high	97.9	Very high	5 Å²	5	35.4 Å²	35.4	4%	0.035	18%	0.178	C	C	.	.	H	α-helix	trans	-64.5	-35.7	177.9	-177.1	0	0	0	0	113.1	S338 R339 R373 L374 I375 C381	S338-S377 WeakPolarHBondContact CB-OG 3.28Å; S338-S377 VanDerWaalsContact OG-CB 3.32Å; S338-S377 WeakPolarHBondContact OG-CB 3.35Å; S338-S377 PolarHBondContact OG-OG 3.26Å; R339-S377 PolarHBondContact N-OG 3.23Å; R373-S377 WeakPolarHBondContact O-CB 3.44Å; R373-S377 PolarHBondContact O-N 3.35Å; L374-S377 PolarHBondContact O-N 3.23Å; L374-S377 VanDerWaalsContact O-N 3.11Å; I375-S377 VanDerWaalsContact C-N 3.35Å; I375-S377 PolarHBondContact O-N 3.11Å; S377-C381 PolarHBondContact O-N 3.02Å
378	C	98.8	Very high	97.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-67.5	-45.9	175.4	-70.6	0	0	0	0	110.7	L363 L367 L374 I375 R376 D380 C381 L382	L363-C378 HydrophobicContact CB-CB 4.45Å; L363-C378 HydrophobicContact CD2-CB 4.34Å; L367-C378 HydrophobicContact CD2-CB 3.89Å; L374-C378 PolarHBondContact O-N 3.27Å; L374-C378 PolarHBondContact O-SG 3.18Å; L374-C378 VanDerWaalsContact O-SG 3.35Å; I375-C378 WeakPolarHBondContact O-CB 2.97Å; I375-C378 PolarHBondContact O-N 2.87Å; I375-C378 VanDerWaalsContact O-N 3.12Å; R376-C378 VanDerWaalsContact C-N 3.33Å; R376-C378 PolarHBondContact O-N 3.42Å; C378-D380 PolarHBondContact O-N 2.96Å; C378-C381 PolarHBondContact O-N 3.15Å; C378-L382 WeakPolarHBondContact O-CB 3.44Å; C378-L382 VanDerWaalsContact O-CG 3.3Å; C378-L382 WeakPolarHBondContact O-CG 3.34Å; C378-L382 PolarHBondContact O-N 3.33Å
379	L	98.8	Very high	97.8	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60.4	-44.5	177.2	-73.1	175.9	0	0	0	112.2	L367 I375 R376 C381 L382 R383 L402 L405 A413 C416 I420	L367-L379 HydrophobicContact CD1-CD2 4.15Å; L367-L379 HydrophobicContact CD2-CD2 3.78Å; L367-L379 HydrophobicContact CD2-CG 3.9Å; I375-L379 HydrophobicContact CG2-CD1 3.86Å; I375-L379 HydrophobicContact CG2-CG 4.22Å; I375-L379 WeakPolarHBondContact O-CG 3.25Å; I375-L379 PolarHBondContact O-N 3.39Å; R376-L379 PolarHBondContact O-N 3.02Å; L379-C381 VanDerWaalsContact C-N 3.29Å; L379-C381 PolarHBondContact O-N 3.31Å; L379-L382 PolarHBondContact O-N 2.95Å; L379-R383 WeakPolarHBondContact O-CB 3.34Å; L379-R383 PolarHBondContact O-N 2.9Å; L379-L402 HydrophobicContact CD2-CD2 3.69Å; L379-L405 HydrophobicContact CD1-CD1 4.37Å; L379-L405 HydrophobicContact CD2-CD1 4.3Å; L379-A413 HydrophobicContact CD1-CB 3.7Å; L379-C416 HydrophobicContact CB-CB 3.87Å; L379-I420 HydrophobicContact CD2-CD1 4.01Å
380	D	98.3	Very high	97.5	Very high	16 Å²	16	34.9 Å²	34.9	9%	0.086	17%	0.173	C	C	.	.	H	α-helix	trans	-58.3	-43.3	175.7	-75.1	-18.2	0	0	0	112.1	K342 R376 C378 N384	K342-D380 HydrophobicContact CD-CB 3.32Å; K342-D380 WeakPolarHBondContact CD-OD2 3.45Å; K342-D380 HydrophobicContact CG-CB 4.2Å; K342-D380 IonicContact NZ-OD2 3.71Å; K342-D380 PolarHBondContact NZ-OD2 3.01Å; R376-D380 IonicContact CZ-OD1 3.7Å; R376-D380 VanDerWaalsContact CZ-OD1 3.25Å; R376-D380 IonicContact NH1-OD1 3.52Å; R376-D380 PolarHBondContact NH1-OD1 3.5Å; R376-D380 IonicContact NH2-OD1 2.74Å; R376-D380 PolarHBondContact NH2-OD1 3.46Å; R376-D380 PolarHBondContact O-N 3.26Å; C378-D380 PolarHBondContact O-N 2.96Å; D380-N384 VanDerWaalsContact O-CG 3.25Å; D380-N384 PolarHBondContact O-N 2.69Å; D380-N384 VanDerWaalsContact O-N 3.15Å; D380-N384 PolarHBondContact O-ND2 2.99Å; D380-N384 PolarHBondContact O-OD1 2.94Å
381	C	98.6	Very high	97.3	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-67.7	-45.6	178.7	-173.8	0	0	0	0	111	K342 L363 S377 C378 L379 R383 N384 L385	K342-C381 HydrophobicContact CB-CB 4.1Å; L363-C381 HydrophobicContact CD1-CB 3.79Å; S377-C381 PolarHBondContact O-N 3.02Å; C378-C381 PolarHBondContact O-N 3.15Å; L379-C381 VanDerWaalsContact C-N 3.29Å; L379-C381 PolarHBondContact O-N 3.31Å; C381-R383 VanDerWaalsContact C-N 3.31Å; C381-R383 PolarHBondContact O-N 3.36Å; C381-N384 WeakPolarHBondContact O-CB 3.3Å; C381-N384 PolarHBondContact O-N 3.08Å; C381-L385 VanDerWaalsContact O-CG 3.29Å; C381-L385 WeakPolarHBondContact O-CG 3.42Å; C381-L385 PolarHBondContact O-N 3.22Å; C381-L385 VanDerWaalsContact O-N 3.13Å
382	L	98.8	Very high	97.1	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-58.4	-42.5	175.5	-74.2	165.5	0	0	0	111.7	M360 L363 L367 C378 L379 N384 L385 S386 L398 I420	M360-L382 HydrophobicContact CE-CD2 3.8Å; M360-L382 HydrophobicContact SD-CD2 3.82Å; L363-L382 HydrophobicContact CB-CD1 4.12Å; L363-L382 HydrophobicContact CB-CD2 3.94Å; L363-L382 HydrophobicContact CB-CG 3.94Å; L363-L382 HydrophobicContact CD1-CD2 4.3Å; L363-L382 HydrophobicContact CD1-CG 4.09Å; L367-L382 HydrophobicContact CD1-CD1 3.98Å; L367-L382 HydrophobicContact CD2-CD1 4.15Å; L367-L382 HydrophobicContact CG-CD1 4.34Å; C378-L382 WeakPolarHBondContact O-CB 3.44Å; C378-L382 VanDerWaalsContact O-CG 3.3Å; C378-L382 WeakPolarHBondContact O-CG 3.34Å; C378-L382 PolarHBondContact O-N 3.33Å; L379-L382 PolarHBondContact O-N 2.95Å; L382-N384 PolarHBondContact O-N 3.46Å; L382-L385 PolarHBondContact O-N 2.6Å; L382-L385 VanDerWaalsContact O-N 3.14Å; L382-S386 VanDerWaalsContact O-CB 3.32Å; L382-S386 WeakPolarHBondContact O-CB 3.43Å; L382-S386 PolarHBondContact O-N 3.49Å; L382-L398 HydrophobicContact CD1-CD1 3.74Å; L382-L398 HydrophobicContact CD2-CD1 4.23Å; L382-L398 HydrophobicContact CD2-CD2 3.98Å; L382-I420 HydrophobicContact CB-CD1 3.6Å; L382-I420 HydrophobicContact CB-CG1 4.22Å
383	R	98.5	Very high	96.8	Very high	77 Å²	77	40.6 Å²	40.6	29%	0.291	19%	0.185	S	C	.	.	H	α-helix	trans	-58.2	-48.4	175.9	-175.6	-178	63	175.4	3	110.9	L379 C381 L385 S386 D419 I420	L379-R383 WeakPolarHBondContact O-CB 3.34Å; L379-R383 PolarHBondContact O-N 2.9Å; C381-R383 VanDerWaalsContact C-N 3.31Å; C381-R383 PolarHBondContact O-N 3.36Å; R383-L385 PolarHBondContact O-N 3.35Å; R383-S386 PolarHBondContact O-N 3.14Å; R383-S386 PolarHBondContact O-OG 3.47Å; R383-D419 VanDerWaalsContact CD-OD2 3.24Å; R383-D419 WeakPolarHBondContact CD-OD2 3.24Å; R383-D419 HydrophobicContact CG-CB 3.98Å; R383-D419 IonicContact NH1-OD2 3.58Å; R383-I420 HydrophobicContact CB-CD1 4.35Å; R383-I420 HydrophobicContact CB-CG1 3.97Å
384	N	98.2	Very high	96.7	Very high	35 Å²	35	40.7 Å²	40.7	19%	0.187	19%	0.193	C	C	.	.	H	α-helix	trans	-62	-25.3	178.3	-68.9	-12.4	0	0	0	113.6	S345 V346 K351 D380 C381 L382	S345-N384 WeakPolarHBondContact OG-CB 3.3Å; S345-N384 PolarHBondContact OG-ND2 3.43Å; S345-N384 VanDerWaalsContact OG-ND2 3.15Å; V346-N384 VanDerWaalsContact CG1-ND2 3.32Å; V346-N384 WeakPolarHBondContact CG1-ND2 3.38Å; K351-N384 WeakPolarHBondContact CE-O 3.16Å; K351-N384 PolarHBondContact NZ-O 3.31Å; D380-N384 VanDerWaalsContact O-CG 3.25Å; D380-N384 PolarHBondContact O-N 2.69Å; D380-N384 VanDerWaalsContact O-N 3.15Å; D380-N384 PolarHBondContact O-ND2 2.99Å; D380-N384 PolarHBondContact O-OD1 2.94Å; C381-N384 WeakPolarHBondContact O-CB 3.3Å; C381-N384 PolarHBondContact O-N 3.08Å; L382-N384 PolarHBondContact O-N 3.46Å
385	L	98.6	Very high	96.6	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-94.9	-21.9	-179.7	-62.9	171.3	0	0	0	113.2	K351 I354 I355 C359 M360 C381 L382 R383 D387 E388 A389	K351-L385 HydrophobicContact CB-CD2 4.36Å; K351-L385 HydrophobicContact CG-CD2 4.12Å; I354-L385 HydrophobicContact CB-CD2 4.17Å; I354-L385 HydrophobicContact CD1-CD2 4.45Å; I354-L385 HydrophobicContact CG2-CD1 3.64Å; I354-L385 HydrophobicContact CG2-CD2 3.91Å; I354-L385 HydrophobicContact CG2-CG 4.43Å; I355-L385 HydrophobicContact CD1-CB 4.47Å; I355-L385 HydrophobicContact CD1-CD2 4.49Å; I355-L385 HydrophobicContact CG1-CB 4.34Å; I355-L385 HydrophobicContact CG1-CD2 4.16Å; C359-L385 HydrophobicContact CB-CD1 4.36Å; M360-L385 HydrophobicContact SD-CB 3.6Å; M360-L385 HydrophobicContact SD-CD1 3.98Å; M360-L385 HydrophobicContact SD-CG 4.46Å; C381-L385 VanDerWaalsContact O-CG 3.29Å; C381-L385 WeakPolarHBondContact O-CG 3.42Å; C381-L385 PolarHBondContact O-N 3.22Å; C381-L385 VanDerWaalsContact O-N 3.13Å; L382-L385 PolarHBondContact O-N 2.6Å; L382-L385 VanDerWaalsContact O-N 3.14Å; R383-L385 PolarHBondContact O-N 3.35Å; L385-D387 VanDerWaalsContact C-N 3.27Å; L385-D387 PolarHBondContact O-N 2.86Å; L385-E388 PolarHBondContact O-N 2.98Å; L385-E388 VanDerWaalsContact O-N 3.15Å; L385-A389 WeakPolarHBondContact O-CB 3.5Å; L385-A389 PolarHBondContact O-N 3.43Å
386	S	98.4	Very high	96.6	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63.2	-27.9	-166.3	62.3	0	0	0	0	114.8	L382 R383 N423	L382-S386 VanDerWaalsContact O-CB 3.32Å; L382-S386 WeakPolarHBondContact O-CB 3.43Å; L382-S386 PolarHBondContact O-N 3.49Å; R383-S386 PolarHBondContact O-N 3.14Å; R383-S386 PolarHBondContact O-OG 3.47Å; S386-N423 PolarHBondContact OG-ND2 2.88Å
387	D	95.6	Very high	96.6	Very high	76 Å²	76	44.1 Å²	44.1	41%	0.406	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-35.8	177.2	60.6	-29.2	0	0	0	112.6	K351 L385 T390	K351-D387 IonicContact NZ-OD1 3.79Å; K351-D387 PolarHBondContact NZ-OD1 2.86Å; K351-D387 IonicContact NZ-OD2 3.89Å; K351-D387 PolarHBondContact NZ-OD2 3.31Å; L385-D387 VanDerWaalsContact C-N 3.27Å; L385-D387 PolarHBondContact O-N 2.86Å; D387-T390 WeakPolarHBondContact O-CG2 3.17Å
388	E	95.6	Very high	96.7	Very high	81 Å²	81	44.1 Å²	44.1	38%	0.379	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-20.3	175.8	-69.8	-170.9	-161.3	0	0	113	K351 I355 L385 T390	K351-E388 WeakPolarHBondContact CB-OE2 3.26Å; K351-E388 VanDerWaalsContact CD-CD 3.45Å; K351-E388 HydrophobicContact CD-CG 4.12Å; K351-E388 WeakPolarHBondContact CD-OE1 3.4Å; I355-E388 HydrophobicContact CD1-CB 3.71Å; L385-E388 PolarHBondContact O-N 2.98Å; L385-E388 VanDerWaalsContact O-N 3.15Å; E388-T390 VanDerWaalsContact C-N 3.25Å; E388-T390 PolarHBondContact O-N 2.83Å
389	A	95.8	Very high	96.7	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-84	15.1	-179.2	0	0	0	0	0	114.5	I355 M360 L385 K391 E392 L424	I355-A389 HydrophobicContact CD1-CB 4.05Å; I355-A389 HydrophobicContact CG1-CB 4.42Å; M360-A389 HydrophobicContact CE-CB 3.72Å; M360-A389 HydrophobicContact CG-CB 3.86Å; M360-A389 HydrophobicContact SD-CB 3.83Å; L385-A389 WeakPolarHBondContact O-CB 3.5Å; L385-A389 PolarHBondContact O-N 3.43Å; A389-K391 PolarHBondContact O-N 3.4Å; A389-K391 VanDerWaalsContact O-N 3.12Å; A389-E392 HydrophobicContact CB-CB 4.38Å; A389-E392 HydrophobicContact CB-CG 3.77Å; A389-E392 WeakPolarHBondContact O-CB 3.46Å; A389-E392 PolarHBondContact O-N 2.62Å; A389-L424 HydrophobicContact CB-CD2 4.03Å; A389-L424 WeakPolarHBondContact O-CD2 3.5Å
390	T	92.4	Very high	96.6	Very high	45 Å²	45	49.4 Å²	49.4	28%	0.276	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-61.7	-22.3	-176	53.3	0	0	0	0	114.3	D387 E388 N428	D387-T390 WeakPolarHBondContact O-CG2 3.17Å; E388-T390 VanDerWaalsContact C-N 3.25Å; E388-T390 PolarHBondContact O-N 2.83Å; T390-N428 PolarHBondContact O-ND2 3.5Å
391	K	92.6	Very high	96.7	Very high	183 Å²	183	50.5 Å²	50.5	80%	0.796	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-103.8	2.9	178.5	-60.8	-177.5	-177.8	179.4	0	113.5	A389 E393	A389-K391 PolarHBondContact O-N 3.4Å; A389-K391 VanDerWaalsContact O-N 3.12Å; K391-E393 PolarHBondContact O-N 3.02Å
392	E	94.6	Very high	96.7	Very high	53 Å²	53	50.5 Å²	50.5	25%	0.248	24%	0.238	C	C	.	.			trans	-65.4	135.2	-179.5	-76.4	-62	118.2	0	0	111.5	I355 M360 A389 V395	I355-E392 HydrophobicContact CG2-CG 3.44Å; I355-E392 VanDerWaalsContact CG2-CG 3.44Å; I355-E392 WeakPolarHBondContact CG2-OE1 3.41Å; M360-E392 HydrophobicContact CG-CG 4.36Å; A389-E392 HydrophobicContact CB-CB 4.38Å; A389-E392 HydrophobicContact CB-CG 3.77Å; A389-E392 WeakPolarHBondContact O-CB 3.46Å; A389-E392 PolarHBondContact O-N 2.62Å; E392-V395 HydrophobicContact CB-CG1 3.96Å
393	E	90.4	Very high	96.7	Very high	125 Å²	125	51.3 Å²	51.3	58%	0.584	24%	0.242	S	C	*	.	S	Bend	trans	-92.5	164.9	175.7	-60.3	-171.3	174.4	0	0	111	Q361 K391 V395	Q361-E393 PolarHBondContact NE2-O 2.91Å; K391-E393 PolarHBondContact O-N 3.02Å; E393-V395 VanDerWaalsContact C-N 3.25Å; E393-V395 PolarHBondContact O-N 3.47Å
394	N	93.9	Very high	96.6	Very high	104 Å²	104	54.2 Å²	54.2	56%	0.556	26%	0.259	S	S	*	.	S	Bend	trans	61.1	30.4	174.5	-49.3	-54.1	0	0	0	114	Q361 E396	Q361-N394 WeakPolarHBondContact CG-O 3.46Å; N394-E396 WeakPolarHBondContact CA-OE2 3.44Å
395	V	97.3	Very high	96.6	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.257	C	S	.	.			trans	-94.6	11	176.8	-63.4	0	0	0	0	113	M360 E392 E393 D397 L398 L399 N431	M360-V395 HydrophobicContact CB-CG1 4.23Å; E392-V395 HydrophobicContact CB-CG1 3.96Å; E393-V395 VanDerWaalsContact C-N 3.25Å; E393-V395 PolarHBondContact O-N 3.47Å; V395-D397 PolarHBondContact O-N 3.46Å; V395-L398 HydrophobicContact CB-CB 4.45Å; V395-L398 HydrophobicContact CB-CD2 4.45Å; V395-L398 WeakPolarHBondContact O-CB 3.4Å; V395-L398 PolarHBondContact O-N 2.8Å; V395-L398 VanDerWaalsContact O-N 3.15Å; V395-L399 HydrophobicContact CG2-CD1 4.33Å; V395-L399 WeakPolarHBondContact O-CG 3.47Å; V395-L399 PolarHBondContact O-N 3.49Å; V395-N431 WeakPolarHBondContact CG2-OD1 3.28Å
396	E	98	Very high	96.6	Very high	31 Å²	31	54 Å²	54	15%	0.145	26%	0.258	C	S	.	.	H	α-helix	trans	-62.8	-40.1	-175.1	-66.4	89.8	155.8	0	0	113.1	N394 L398 L399 R400 R430 T434	N394-E396 WeakPolarHBondContact CA-OE2 3.44Å; E396-L398 VanDerWaalsContact C-N 3.35Å; E396-L399 PolarHBondContact O-N 3.49Å; E396-R400 WeakPolarHBondContact O-CG 3.43Å; E396-R400 PolarHBondContact O-N 3.13Å; E396-R430 IonicContact OE1-CZ 2.97Å; E396-R430 IonicContact OE1-NE 2.76Å; E396-R430 PolarHBondContact OE1-NE 3.03Å; E396-R430 IonicContact OE1-NH2 3.63Å; E396-R430 PolarHBondContact OE1-NH2 2.85Å; E396-T434 HydrophobicContact CB-CG2 3.75Å; E396-T434 HydrophobicContact CG-CG2 3.77Å; E396-T434 WeakPolarHBondContact CG-OG1 3.27Å
397	D	98	Very high	96.5	Very high	96 Å²	96	57.1 Å²	57.1	51%	0.513	29%	0.29	S	S	.	.	H	α-helix	trans	-66.4	-39.6	175.8	-70.3	-30	0	0	0	111.3	V395 L399 R400 H401	V395-D397 PolarHBondContact O-N 3.46Å; D397-L399 VanDerWaalsContact C-N 3.34Å; D397-L399 PolarHBondContact O-N 3.45Å; D397-R400 PolarHBondContact O-N 3.22Å; D397-R400 IonicContact OD1-CZ 3.49Å; D397-R400 IonicContact OD1-NH1 3.82Å; D397-R400 PolarHBondContact OD1-NH1 3.15Å; D397-H401 VanDerWaalsContact O-CG 3.28Å; D397-H401 PolarHBondContact O-N 3.47Å; D397-H401 PolarHBondContact O-ND1 2.81Å
398	L	98.7	Very high	96.5	Very high	4 Å²	4	54.9 Å²	54.9	2%	0.021	28%	0.28	C	S	.	.	H	α-helix	trans	-56.9	-49.2	172.6	167.7	62.8	0	0	0	110.4	M360 L367 L382 V395 E396 R400 H401 L402 L424	M360-L398 HydrophobicContact CB-CD2 4.36Å; M360-L398 HydrophobicContact CE-CD2 3.92Å; L367-L398 HydrophobicContact CD1-CD1 3.65Å; L382-L398 HydrophobicContact CD1-CD1 3.74Å; L382-L398 HydrophobicContact CD2-CD1 4.23Å; L382-L398 HydrophobicContact CD2-CD2 3.98Å; V395-L398 HydrophobicContact CB-CB 4.45Å; V395-L398 HydrophobicContact CB-CD2 4.45Å; V395-L398 WeakPolarHBondContact O-CB 3.4Å; V395-L398 PolarHBondContact O-N 2.8Å; V395-L398 VanDerWaalsContact O-N 3.15Å; E396-L398 VanDerWaalsContact C-N 3.35Å; L398-R400 VanDerWaalsContact C-N 3.33Å; L398-R400 PolarHBondContact O-N 3.2Å; L398-H401 PolarHBondContact O-N 3.22Å; L398-L402 HydrophobicContact CD1-CD1 3.93Å; L398-L402 HydrophobicContact CD1-CD2 4.3Å; L398-L402 HydrophobicContact CD1-CG 3.93Å; L398-L402 HydrophobicContact CG-CD1 3.96Å; L398-L402 HydrophobicContact CG-CG 4.4Å; L398-L402 VanDerWaalsContact O-CG 3.27Å; L398-L402 WeakPolarHBondContact O-CG 3.44Å; L398-L402 PolarHBondContact O-N 3.38Å; L398-L424 HydrophobicContact CD2-CD1 3.99Å
399	L	98.8	Very high	96.5	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-59.3	-41.7	178.8	-65	170.7	0	0	0	112.2	V395 E396 D397 L402 I403 L421 L424 N431 T434 V435	V395-L399 HydrophobicContact CG2-CD1 4.33Å; V395-L399 WeakPolarHBondContact O-CG 3.47Å; V395-L399 PolarHBondContact O-N 3.49Å; E396-L399 PolarHBondContact O-N 3.49Å; D397-L399 VanDerWaalsContact C-N 3.34Å; D397-L399 PolarHBondContact O-N 3.45Å; L399-L402 PolarHBondContact O-N 3.01Å; L399-I403 WeakPolarHBondContact O-CD1 3.49Å; L399-I403 VanDerWaalsContact O-CG1 3.27Å; L399-I403 WeakPolarHBondContact O-CG1 3.5Å; L399-I403 PolarHBondContact O-N 3.3Å; L399-L421 HydrophobicContact CD2-CD2 3.77Å; L399-L424 HydrophobicContact CD2-CB 4.21Å; L399-L424 HydrophobicContact CD2-CD1 4.14Å; L399-N431 HydrophobicContact CD1-CB 3.72Å; L399-T434 HydrophobicContact CB-CG2 4.25Å; L399-T434 HydrophobicContact CD1-CG2 4.01Å; L399-V435 HydrophobicContact CB-CG2 4.26Å; L399-V435 HydrophobicContact CD1-CG2 4.25Å; L399-V435 HydrophobicContact CD2-CG2 4.08Å; L399-V435 HydrophobicContact CG-CG2 4.43Å
400	R	98.6	Very high	96.4	Very high	111 Å²	111	59.5 Å²	59.5	42%	0.419	32%	0.317	S	S	.	.	H	α-helix	trans	-62.1	-44.6	176.1	-70.3	173.8	-165.9	112.7	7.4	112.1	E396 D397 L398 I403 Q404	E396-R400 WeakPolarHBondContact O-CG 3.43Å; E396-R400 PolarHBondContact O-N 3.13Å; D397-R400 PolarHBondContact O-N 3.22Å; D397-R400 IonicContact OD1-CZ 3.49Å; D397-R400 IonicContact OD1-NH1 3.82Å; D397-R400 PolarHBondContact OD1-NH1 3.15Å; L398-R400 VanDerWaalsContact C-N 3.33Å; L398-R400 PolarHBondContact O-N 3.2Å; R400-I403 PolarHBondContact O-N 3.49Å; R400-Q404 PolarHBondContact O-N 2.91Å
401	H	98.5	Very high	96.6	Very high	39 Å²	39	62.1 Å²	62.1	18%	0.181	33%	0.329	C	S	.	.	H	α-helix	trans	-65.3	-39.2	177.4	-63.1	130.6	0	0	0	112.2	G364 L367 V368 D397 L398 I403 Q404 L405	G364-H401 PolarHBondContact O-ND1 3.32Å; L367-H401 HydrophobicContact CB-CB 4.04Å; L367-H401 HydrophobicContact CD1-CB 4.12Å; V368-H401 WeakPolarHBondContact CG1-CD2 3.39Å; V368-H401 WeakPolarHBondContact CG1-NE2 3.24Å; D397-H401 VanDerWaalsContact O-CG 3.28Å; D397-H401 PolarHBondContact O-N 3.47Å; D397-H401 PolarHBondContact O-ND1 2.81Å; L398-H401 PolarHBondContact O-N 3.22Å; H401-I403 PolarHBondContact O-N 2.91Å; H401-Q404 PolarHBondContact O-N 3.13Å; H401-L405 WeakPolarHBondContact O-CG 3.35Å; H401-L405 PolarHBondContact O-N 2.77Å
402	L	98.8	Very high	96.8	Very high	0 Å²	0	59 Å²	59	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-61.1	-44.1	175	-67.2	169.8	0	0	0	111.3	L367 L379 L398 L399 Q404 L405 L406 C417 I420 L421	L367-L402 HydrophobicContact CD1-CD2 3.97Å; L367-L402 HydrophobicContact CD1-CG 4.39Å; L379-L402 HydrophobicContact CD2-CD2 3.69Å; L398-L402 HydrophobicContact CD1-CD1 3.93Å; L398-L402 HydrophobicContact CD1-CD2 4.3Å; L398-L402 HydrophobicContact CD1-CG 3.93Å; L398-L402 HydrophobicContact CG-CD1 3.96Å; L398-L402 HydrophobicContact CG-CG 4.4Å; L398-L402 VanDerWaalsContact O-CG 3.27Å; L398-L402 WeakPolarHBondContact O-CG 3.44Å; L398-L402 PolarHBondContact O-N 3.38Å; L399-L402 PolarHBondContact O-N 3.01Å; L402-Q404 VanDerWaalsContact C-N 3.32Å; L402-Q404 PolarHBondContact O-N 2.93Å; L402-L405 PolarHBondContact O-N 3.08Å; L402-L406 PolarHBondContact O-N 3.43Å; L402-L406 VanDerWaalsContact O-N 3.11Å; L402-C417 HydrophobicContact CD2-CB 4.31Å; L402-I420 HydrophobicContact CD1-CB 4.08Å; L402-I420 HydrophobicContact CD1-CG2 3.47Å; L402-I420 VanDerWaalsContact CD1-CG2 3.47Å; L402-I420 HydrophobicContact CD2-CB 4.49Å; L402-I420 HydrophobicContact CD2-CD1 3.92Å; L402-I420 HydrophobicContact CD2-CG2 4.47Å; L402-L421 HydrophobicContact CB-CD1 4.31Å; L402-L421 HydrophobicContact CB-CD2 4.07Å; L402-L421 HydrophobicContact CB-CG 4.1Å; L402-L421 HydrophobicContact CD1-CD2 4.11Å; L402-L421 HydrophobicContact CD1-CG 4.23Å
403	I	98.6	Very high	96.9	Very high	17 Å²	17	56.6 Å²	56.6	9%	0.087	31%	0.307	C	S	.	.	H	α-helix	trans	-61.6	-40.2	176.6	-67.6	162.5	0	0	0	111.4	L399 R400 H401 L406 V435 A443	L399-I403 WeakPolarHBondContact O-CD1 3.49Å; L399-I403 VanDerWaalsContact O-CG1 3.27Å; L399-I403 WeakPolarHBondContact O-CG1 3.5Å; L399-I403 PolarHBondContact O-N 3.3Å; R400-I403 PolarHBondContact O-N 3.49Å; H401-I403 PolarHBondContact O-N 2.91Å; I403-L406 WeakPolarHBondContact O-CB 3.4Å; I403-L406 PolarHBondContact O-N 2.96Å; I403-V435 HydrophobicContact CD1-CB 4.25Å; I403-V435 HydrophobicContact CD1-CG1 3.96Å; I403-V435 HydrophobicContact CD1-CG2 4.28Å; I403-V435 HydrophobicContact CG1-CG1 4.48Å; I403-A443 HydrophobicContact CG2-CB 3.81Å
404	Q	97.9	Very high	97.3	Very high	139 Å²	139	50.7 Å²	50.7	65%	0.65	28%	0.279	S	S	*	.	H	α-helix	trans	-63.6	-41.9	175.2	-174.2	-179.7	5.6	0	0	111.7	R400 H401 L402 L406 G407	R400-Q404 PolarHBondContact O-N 2.91Å; H401-Q404 PolarHBondContact O-N 3.13Å; L402-Q404 VanDerWaalsContact C-N 3.32Å; L402-Q404 PolarHBondContact O-N 2.93Å; Q404-L406 VanDerWaalsContact C-N 3.25Å; Q404-L406 PolarHBondContact O-N 3.42Å; Q404-G407 PolarHBondContact O-N 3.45Å
405	L	98.2	Very high	97.5	Very high	25 Å²	25	46.3 Å²	46.3	13%	0.131	26%	0.258	C	S	.	.	H	α-helix	trans	-71.1	-14.6	179.9	-75.7	173.3	0	0	0	114.1	L367 I375 L379 H401 L402 G407 S408	L367-L405 HydrophobicContact CB-CD1 3.95Å; L367-L405 HydrophobicContact CD1-CD1 4.18Å; L367-L405 HydrophobicContact CD2-CD1 4.26Å; L367-L405 HydrophobicContact CG-CD1 4.35Å; I375-L405 HydrophobicContact CG2-CD1 4.1Å; I375-L405 HydrophobicContact CG2-CD2 4.41Å; L379-L405 HydrophobicContact CD1-CD1 4.37Å; L379-L405 HydrophobicContact CD2-CD1 4.3Å; H401-L405 WeakPolarHBondContact O-CG 3.35Å; H401-L405 PolarHBondContact O-N 2.77Å; L402-L405 PolarHBondContact O-N 3.08Å; L405-G407 PolarHBondContact O-N 3Å; L405-G407 VanDerWaalsContact O-N 3.14Å; L405-S408 WeakPolarHBondContact O-CB 3.38Å; L405-S408 PolarHBondContact O-N 3.38Å
406	L	98.2	Very high	97.5	Very high	5 Å²	5	46.3 Å²	46.3	3%	0.026	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-20.8	170	-68	178.9	0	0	0	113.1	L402 I403 Q404 S408 V414 C417 V418 L421 A443 L444	L402-L406 PolarHBondContact O-N 3.43Å; L402-L406 VanDerWaalsContact O-N 3.11Å; I403-L406 WeakPolarHBondContact O-CB 3.4Å; I403-L406 PolarHBondContact O-N 2.96Å; Q404-L406 VanDerWaalsContact C-N 3.25Å; Q404-L406 PolarHBondContact O-N 3.42Å; L406-S408 VanDerWaalsContact C-N 3.33Å; L406-V414 HydrophobicContact CD2-CG1 4.49Å; L406-C417 HydrophobicContact CD2-CB 3.79Å; L406-V418 HydrophobicContact CD2-CG1 3.47Å; L406-V418 VanDerWaalsContact CD2-CG1 3.47Å; L406-L421 HydrophobicContact CD1-CD1 4.05Å; L406-L421 HydrophobicContact CD2-CD1 4.31Å; L406-L421 HydrophobicContact CG-CD1 4.39Å; L406-A443 HydrophobicContact CD1-CB 3.96Å; L406-L444 HydrophobicContact CD1-CD2 3.78Å; L406-L444 HydrophobicContact CD1-CG 4.06Å
407	G	95.9	Very high	97.6	Very high	65 Å²	65	44.9 Å²	44.9	67%	0.67	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	7.2	174	0	0	0	0	0	115	Q404 L405	Q404-G407 PolarHBondContact O-N 3.45Å; L405-G407 PolarHBondContact O-N 3Å; L405-G407 VanDerWaalsContact O-N 3.14Å
408	S	95.7	Very high	97.6	Very high	30 Å²	30	40.3 Å²	40.3	21%	0.21	23%	0.226	C	C	.	.			trans	-69.2	148.3	179.2	-175.2	0	0	0	0	112.1	L405 L406 D410	L405-S408 WeakPolarHBondContact O-CB 3.38Å; L405-S408 PolarHBondContact O-N 3.38Å; L406-S408 VanDerWaalsContact C-N 3.33Å; S408-D410 VanDerWaalsContact C-N 3.28Å; S408-D410 PolarHBondContact OG-N 3.48Å; S408-D410 VanDerWaalsContact OG-N 3.12Å
409	S	94.8	Very high	97.6	Very high	124 Å²	124	41.8 Å²	41.8	87%	0.867	23%	0.234	S	C	*	.	S	Bend	trans	-77.3	-13.7	169.1	58.4	0	0	0	0	113.4	L411	S409-L411 PolarHBondContact O-N 3.12Å
410	D	95.4	Very high	97.6	Very high	53 Å²	53	41.8 Å²	41.8	28%	0.283	23%	0.234	S	C	.	.			trans	-81.7	101.8	175.3	178.5	-1.8	0	0	0	109.9	S408 E412 A413 V414	S408-D410 VanDerWaalsContact C-N 3.28Å; S408-D410 PolarHBondContact OG-N 3.48Å; S408-D410 VanDerWaalsContact OG-N 3.12Å; D410-E412 PolarHBondContact O-N 3.07Å; D410-E412 WeakPolarHBondContact OD1-CB 3.49Å; D410-E412 PolarHBondContact OD1-N 3.23Å; D410-A413 HydrophobicContact CB-CB 3.91Å; D410-A413 WeakPolarHBondContact O-CB 3.29Å; D410-A413 PolarHBondContact O-N 2.87Å; D410-A413 VanDerWaalsContact O-N 3.16Å; D410-A413 PolarHBondContact OD1-N 3.43Å; D410-V414 WeakPolarHBondContact O-CG2 3.29Å; D410-V414 PolarHBondContact O-N 3.28Å
411	L	96	Very high	97.6	Very high	100 Å²	100	36.5 Å²	36.5	52%	0.524	21%	0.214	S	C	.	.	H	α-helix	trans	-62.6	-29.2	-178.9	-66.8	-178.1	0	0	0	113.1	S409 V414 A415 I457	S409-L411 PolarHBondContact O-N 3.12Å; L411-V414 PolarHBondContact O-N 2.94Å; L411-A415 WeakPolarHBondContact O-CB 3.33Å; L411-A415 PolarHBondContact O-N 3.23Å; L411-I457 HydrophobicContact CB-CD1 4.38Å; L411-I457 HydrophobicContact CD2-CD1 4.33Å
412	E	96.1	Very high	97.6	Very high	117 Å²	117	35.1 Å²	35.1	55%	0.547	21%	0.209	S	C	.	.	H	α-helix	trans	-71.8	-38	176.7	-59.1	-172.7	-176	0	0	111.3	R376 D410 V414 A415 C416	R376-E412 VanDerWaalsContact CZ-CB 3.49Å; R376-E412 IonicContact CZ-OE2 3.96Å; R376-E412 VanDerWaalsContact CZ-OE2 3.32Å; R376-E412 IonicContact NE-OE2 3.87Å; R376-E412 PolarHBondContact NE-OE2 3.41Å; R376-E412 PolarHBondContact NH1-O 3.1Å; R376-E412 IonicContact NH2-OE2 2.89Å; R376-E412 PolarHBondContact NH2-OE2 3.37Å; D410-E412 PolarHBondContact O-N 3.07Å; D410-E412 WeakPolarHBondContact OD1-CB 3.49Å; D410-E412 PolarHBondContact OD1-N 3.23Å; E412-V414 VanDerWaalsContact C-N 3.34Å; E412-A415 PolarHBondContact O-N 3.23Å; E412-C416 PolarHBondContact O-N 2.97Å
413	A	97.5	Very high	97.6	Very high	3 Å²	3	37.8 Å²	37.8	3%	0.025	22%	0.224	C	C	.	.	H	α-helix	trans	-63.2	-42.1	172.1	0	0	0	0	0	111.3	L379 D410 C416 C417	L379-A413 HydrophobicContact CD1-CB 3.7Å; D410-A413 HydrophobicContact CB-CB 3.91Å; D410-A413 WeakPolarHBondContact O-CB 3.29Å; D410-A413 PolarHBondContact O-N 2.87Å; D410-A413 VanDerWaalsContact O-N 3.16Å; D410-A413 PolarHBondContact OD1-N 3.43Å; A413-C416 PolarHBondContact O-N 3.05Å; A413-C417 PolarHBondContact O-N 3.19Å; A413-C417 PolarHBondContact O-SG 3.3Å
414	V	98.3	Very high	97.6	Very high	2 Å²	2	37 Å²	37	1%	0.012	22%	0.219	C	C	.	.	H	α-helix	trans	-61	-45.8	175.3	174.7	0	0	0	0	111	L406 D410 L411 E412 C416 C417 V418 T447 I457	L406-V414 HydrophobicContact CD2-CG1 4.49Å; D410-V414 WeakPolarHBondContact O-CG2 3.29Å; D410-V414 PolarHBondContact O-N 3.28Å; L411-V414 PolarHBondContact O-N 2.94Å; E412-V414 VanDerWaalsContact C-N 3.34Å; V414-C416 PolarHBondContact O-N 3.45Å; V414-C417 WeakPolarHBondContact O-CB 3.42Å; V414-C417 PolarHBondContact O-N 3.35Å; V414-C417 VanDerWaalsContact O-N 3.08Å; V414-V418 PolarHBondContact O-N 2.83Å; V414-T447 HydrophobicContact CG1-CG2 3.67Å; V414-I457 HydrophobicContact CB-CD1 4.4Å; V414-I457 HydrophobicContact CG1-CD1 4.14Å; V414-I457 HydrophobicContact CG1-CG2 4.14Å
415	A	98.1	Very high	97.6	Very high	12 Å²	12	30.4 Å²	30.4	10%	0.099	19%	0.188	C	C	.	.	H	α-helix	trans	-55.5	-50.1	175.7	0	0	0	0	0	111.6	L411 E412 C417 V418 D419 I457	L411-A415 WeakPolarHBondContact O-CB 3.33Å; L411-A415 PolarHBondContact O-N 3.23Å; E412-A415 PolarHBondContact O-N 3.23Å; A415-C417 VanDerWaalsContact C-N 3.31Å; A415-C417 PolarHBondContact O-N 3.29Å; A415-V418 WeakPolarHBondContact O-CG2 3.47Å; A415-V418 PolarHBondContact O-N 3.2Å; A415-D419 PolarHBondContact O-N 2.98Å; A415-I457 HydrophobicContact CB-CD1 4.37Å; A415-I457 HydrophobicContact CB-CG1 3.82Å
416	C	98.3	Very high	97.4	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-59.8	-40	174.8	-76.4	0	0	0	0	112.9	R376 L379 E412 A413 V414 V418 D419 I420	R376-C416 PolarHBondContact NH1-SG 3.39Å; L379-C416 HydrophobicContact CB-CB 3.87Å; E412-C416 PolarHBondContact O-N 2.97Å; A413-C416 PolarHBondContact O-N 3.05Å; V414-C416 PolarHBondContact O-N 3.45Å; C416-V418 PolarHBondContact O-N 3.3Å; C416-D419 PolarHBondContact O-N 3.17Å; C416-I420 WeakPolarHBondContact O-CB 3.35Å; C416-I420 WeakPolarHBondContact O-CD1 3.39Å; C416-I420 WeakPolarHBondContact O-CG1 3.48Å; C416-I420 PolarHBondContact O-N 3.24Å
417	C	98.8	Very high	97.2	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61.6	-45.7	179.5	-68.4	0	0	0	0	112	L402 L406 A413 V414 A415 I420 L421	L402-C417 HydrophobicContact CD2-CB 4.31Å; L406-C417 HydrophobicContact CD2-CB 3.79Å; A413-C417 PolarHBondContact O-N 3.19Å; A413-C417 PolarHBondContact O-SG 3.3Å; V414-C417 WeakPolarHBondContact O-CB 3.42Å; V414-C417 PolarHBondContact O-N 3.35Å; V414-C417 VanDerWaalsContact O-N 3.08Å; A415-C417 VanDerWaalsContact C-N 3.31Å; A415-C417 PolarHBondContact O-N 3.29Å; C417-I420 PolarHBondContact O-N 3.14Å; C417-L421 WeakPolarHBondContact O-CB 3.25Å; C417-L421 WeakPolarHBondContact O-CG 3.49Å; C417-L421 PolarHBondContact O-N 2.92Å
418	V	98.7	Very high	97.2	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-71.2	-34	-179.7	-62	0	0	0	0	112.3	L406 V414 A415 C416 L421 S422 L444 T447 I457 T461	L406-V418 HydrophobicContact CD2-CG1 3.47Å; L406-V418 VanDerWaalsContact CD2-CG1 3.47Å; V414-V418 PolarHBondContact O-N 2.83Å; A415-V418 WeakPolarHBondContact O-CG2 3.47Å; A415-V418 PolarHBondContact O-N 3.2Å; C416-V418 PolarHBondContact O-N 3.3Å; V418-L421 PolarHBondContact O-N 2.81Å; V418-S422 VanDerWaalsContact O-CB 3.25Å; V418-S422 WeakPolarHBondContact O-CB 3.32Å; V418-S422 PolarHBondContact O-N 2.87Å; V418-L444 HydrophobicContact CG1-CD2 4.23Å; V418-T447 HydrophobicContact CG1-CG2 4.33Å; V418-I457 HydrophobicContact CG2-CG2 4.33Å; V418-T461 WeakPolarHBondContact CG1-OG1 3.48Å
419	D	98.4	Very high	97.2	Very high	35 Å²	35	36.6 Å²	36.6	19%	0.187	20%	0.202	C	C	.	.	H	α-helix	trans	-62.8	-47.4	173.5	-66.9	-17.1	0	0	0	111.1	R383 A415 C416 S422 N423 S460	R383-D419 VanDerWaalsContact CD-OD2 3.24Å; R383-D419 WeakPolarHBondContact CD-OD2 3.24Å; R383-D419 HydrophobicContact CG-CB 3.98Å; R383-D419 IonicContact NH1-OD2 3.58Å; A415-D419 PolarHBondContact O-N 2.98Å; C416-D419 PolarHBondContact O-N 3.17Å; D419-S422 PolarHBondContact O-N 3.12Å; D419-N423 PolarHBondContact O-N 2.91Å; D419-N423 VanDerWaalsContact O-N 3.11Å; D419-S460 WeakPolarHBondContact OD1-CB 3.45Å; D419-S460 PolarHBondContact OD1-OG 3.21Å
420	I	98.8	Very high	97.3	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.3	-46.7	178.3	-63.3	157.8	0	0	0	110.2	L379 L382 R383 L402 C416 C417 S422 N423 L424	L379-I420 HydrophobicContact CD2-CD1 4.01Å; L382-I420 HydrophobicContact CB-CD1 3.6Å; L382-I420 HydrophobicContact CB-CG1 4.22Å; R383-I420 HydrophobicContact CB-CD1 4.35Å; R383-I420 HydrophobicContact CB-CG1 3.97Å; L402-I420 HydrophobicContact CD1-CB 4.08Å; L402-I420 HydrophobicContact CD1-CG2 3.47Å; L402-I420 VanDerWaalsContact CD1-CG2 3.47Å; L402-I420 HydrophobicContact CD2-CB 4.49Å; L402-I420 HydrophobicContact CD2-CD1 3.92Å; L402-I420 HydrophobicContact CD2-CG2 4.47Å; C416-I420 WeakPolarHBondContact O-CB 3.35Å; C416-I420 WeakPolarHBondContact O-CD1 3.39Å; C416-I420 WeakPolarHBondContact O-CG1 3.48Å; C416-I420 PolarHBondContact O-N 3.24Å; C417-I420 PolarHBondContact O-N 3.14Å; I420-S422 VanDerWaalsContact C-N 3.34Å; I420-S422 PolarHBondContact O-N 3.37Å; I420-N423 PolarHBondContact O-N 3.24Å; I420-L424 HydrophobicContact CG2-CD1 3.64Å; I420-L424 HydrophobicContact CG2-CG 4.07Å; I420-L424 WeakPolarHBondContact O-CB 3.38Å; I420-L424 WeakPolarHBondContact O-CG 3.18Å; I420-L424 PolarHBondContact O-N 3.42Å
421	L	98.8	Very high	97.4	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61.6	-41.8	178.6	-74.2	169.1	0	0	0	111.7	L399 L402 L406 C417 V418 N423 L424 T425 V435 L444 T464	L399-L421 HydrophobicContact CD2-CD2 3.77Å; L402-L421 HydrophobicContact CB-CD1 4.31Å; L402-L421 HydrophobicContact CB-CD2 4.07Å; L402-L421 HydrophobicContact CB-CG 4.1Å; L402-L421 HydrophobicContact CD1-CD2 4.11Å; L402-L421 HydrophobicContact CD1-CG 4.23Å; L406-L421 HydrophobicContact CD1-CD1 4.05Å; L406-L421 HydrophobicContact CD2-CD1 4.31Å; L406-L421 HydrophobicContact CG-CD1 4.39Å; C417-L421 WeakPolarHBondContact O-CB 3.25Å; C417-L421 WeakPolarHBondContact O-CG 3.49Å; C417-L421 PolarHBondContact O-N 2.92Å; V418-L421 PolarHBondContact O-N 2.81Å; L421-N423 PolarHBondContact O-N 3.09Å; L421-L424 PolarHBondContact O-N 3.38Å; L421-T425 VanDerWaalsContact O-CB 3.32Å; L421-T425 WeakPolarHBondContact O-CB 3.38Å; L421-T425 VanDerWaalsContact O-CG2 3.24Å; L421-T425 WeakPolarHBondContact O-CG2 3.28Å; L421-T425 PolarHBondContact O-N 3.03Å; L421-T425 PolarHBondContact O-OG1 2.94Å; L421-V435 HydrophobicContact CD2-CG2 4.02Å; L421-L444 HydrophobicContact CD1-CD2 4.34Å; L421-T464 HydrophobicContact CB-CG2 3.9Å
422	S	98.4	Very high	97.5	Very high	11 Å²	11	29.3 Å²	29.3	8%	0.077	15%	0.145	C	C	.	.	H	α-helix	trans	-58.7	-49.4	177.9	-177.3	0	0	0	0	110.8	V418 D419 I420 T425 C426 C463 T464 H467	V418-S422 VanDerWaalsContact O-CB 3.25Å; V418-S422 WeakPolarHBondContact O-CB 3.32Å; V418-S422 PolarHBondContact O-N 2.87Å; D419-S422 PolarHBondContact O-N 3.12Å; I420-S422 VanDerWaalsContact C-N 3.34Å; I420-S422 PolarHBondContact O-N 3.37Å; S422-T425 PolarHBondContact O-OG1 3.36Å; S422-C426 PolarHBondContact O-N 2.95Å; S422-C463 WeakPolarHBondContact OG-CB 3.44Å; S422-T464 VanDerWaalsContact CA-OG1 3.26Å; S422-T464 WeakPolarHBondContact CA-OG1 3.41Å; S422-T464 WeakPolarHBondContact CB-OG1 3.5Å; S422-T464 PolarHBondContact N-OG1 3.2Å; S422-H467 PolarHBondContact O-CE1 2.77Å; S422-H467 VanDerWaalsContact O-CE1 3.25Å; S422-H467 PolarHBondContact O-ND1 3.45Å; S422-H467 VanDerWaalsContact O-ND1 3.11Å
423	N	98.2	Very high	97.6	Very high	56 Å²	56	24.7 Å²	24.7	30%	0.299	13%	0.125	S	C	.	.	H	α-helix	trans	-65.5	-49.9	178.7	-72.2	-18.1	0	0	0	111.9	S386 D419 I420 L421 T425 C426	S386-N423 PolarHBondContact OG-ND2 2.88Å; D419-N423 PolarHBondContact O-N 2.91Å; D419-N423 VanDerWaalsContact O-N 3.11Å; I420-N423 PolarHBondContact O-N 3.24Å; L421-N423 PolarHBondContact O-N 3.09Å; N423-T425 VanDerWaalsContact C-N 3.26Å; N423-T425 PolarHBondContact O-N 3.27Å; N423-C426 WeakPolarHBondContact O-CB 3.33Å; N423-C426 PolarHBondContact O-N 3.41Å
424	L	98.4	Very high	97.6	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-70	-18.7	-176.1	-65.7	-175	0	0	0	114	M360 A389 L398 L399 I420 L421 N428 N431	M360-L424 HydrophobicContact CE-CD1 4.17Å; M360-L424 HydrophobicContact CE-CD2 4.22Å; A389-L424 HydrophobicContact CB-CD2 4.03Å; A389-L424 WeakPolarHBondContact O-CD2 3.5Å; L398-L424 HydrophobicContact CD2-CD1 3.99Å; L399-L424 HydrophobicContact CD2-CB 4.21Å; L399-L424 HydrophobicContact CD2-CD1 4.14Å; I420-L424 HydrophobicContact CG2-CD1 3.64Å; I420-L424 HydrophobicContact CG2-CG 4.07Å; I420-L424 WeakPolarHBondContact O-CB 3.38Å; I420-L424 WeakPolarHBondContact O-CG 3.18Å; I420-L424 PolarHBondContact O-N 3.42Å; L421-L424 PolarHBondContact O-N 3.38Å; L424-N428 WeakPolarHBondContact O-CB 3.47Å; L424-N431 VanDerWaalsContact O-CB 3.23Å; L424-N431 WeakPolarHBondContact O-CB 3.45Å; L424-N431 PolarHBondContact O-ND2 3.48Å
425	T	97.8	Very high	97.6	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-92.1	-16.8	175	56.1	0	0	0	0	113.4	L421 S422 N423 N427 N428 K432 V435 T464 H467 L468	L421-T425 VanDerWaalsContact O-CB 3.32Å; L421-T425 WeakPolarHBondContact O-CB 3.38Å; L421-T425 VanDerWaalsContact O-CG2 3.24Å; L421-T425 WeakPolarHBondContact O-CG2 3.28Å; L421-T425 PolarHBondContact O-N 3.03Å; L421-T425 PolarHBondContact O-OG1 2.94Å; S422-T425 PolarHBondContact O-OG1 3.36Å; N423-T425 VanDerWaalsContact C-N 3.26Å; N423-T425 PolarHBondContact O-N 3.27Å; T425-N427 PolarHBondContact O-N 3.19Å; T425-N428 PolarHBondContact O-N 2.86Å; T425-K432 WeakPolarHBondContact O-CE 3.48Å; T425-V435 HydrophobicContact CG2-CG2 3.99Å; T425-T464 HydrophobicContact CG2-CG2 4.46Å; T425-H467 PolarHBondContact OG1-ND1 3.07Å; T425-H467 VanDerWaalsContact OG1-ND1 3.13Å; T425-L468 HydrophobicContact CG2-CD2 4.03Å
426	C	95.6	Very high	97.6	Very high	21 Å²	21	25.6 Å²	25.6	14%	0.142	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	124.9	177	-174.4	0	0	0	0	110.3	S422 N423 N428	S422-C426 PolarHBondContact O-N 2.95Å; N423-C426 WeakPolarHBondContact O-CB 3.33Å; N423-C426 PolarHBondContact O-N 3.41Å; C426-N428 PolarHBondContact O-N 3.22Å
427	N	92.4	Very high	97.5	Very high	102 Å²	102	33.9 Å²	33.9	55%	0.545	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	47	23.1	-175.9	-68.7	-53.5	0	0	0	117	T425 R471 D709	T425-N427 PolarHBondContact O-N 3.19Å; N427-R471 PolarHBondContact OD1-NH1 3.25Å; N427-D709 VanDerWaalsContact CG-CB 3.41Å; N427-D709 PolarHBondContact N-OD2 2.83Å; N427-D709 WeakPolarHBondContact ND2-CB 3.03Å; N427-D709 VanDerWaalsContact OD1-CB 3.23Å; N427-D709 WeakPolarHBondContact OD1-CB 3.2Å; N427-D709 PolarHBondContact OD1-OD2 3.33Å
428	N	95.8	Very high	97.4	Very high	22 Å²	22	35.3 Å²	35.3	12%	0.118	17%	0.171	C	C	.	.			trans	-122.5	96.4	-178.1	-169.8	-42.3	0	0	0	111.6	T390 L424 T425 C426 R430 N431 K432	T390-N428 PolarHBondContact O-ND2 3.5Å; L424-N428 WeakPolarHBondContact O-CB 3.47Å; T425-N428 PolarHBondContact O-N 2.86Å; C426-N428 PolarHBondContact O-N 3.22Å; N428-R430 VanDerWaalsContact C-N 3.33Å; N428-R430 PolarHBondContact O-N 3.29Å; N428-R430 PolarHBondContact OD1-N 2.96Å; N428-N431 HydrophobicContact CB-CB 4.06Å; N428-N431 VanDerWaalsContact CG-CG 3.45Å; N428-N431 PolarHBondContact ND2-ND2 3.05Å; N428-N431 PolarHBondContact O-N 3.35Å; N428-N431 WeakPolarHBondContact OD1-CB 3.44Å; N428-N431 PolarHBondContact OD1-N 3.37Å; N428-K432 VanDerWaalsContact O-CG 3.25Å; N428-K432 WeakPolarHBondContact O-CG 3.37Å; N428-K432 PolarHBondContact O-N 2.88Å
429	Q	96.4	Very high	97.3	Very high	111 Å²	111	40.9 Å²	40.9	52%	0.519	20%	0.198	S	C	.	.	H	α-helix	trans	-59.8	-39.4	-177.4	-174	176.1	-0.5	0	0	112.9	K432 V433 N472 P473	Q429-K432 PolarHBondContact O-N 3.43Å; Q429-V433 WeakPolarHBondContact O-CB 3.22Å; Q429-V433 VanDerWaalsContact O-CG2 3.28Å; Q429-V433 WeakPolarHBondContact O-CG2 3.32Å; Q429-V433 PolarHBondContact O-N 3.46Å; Q429-N472 HydrophobicContact CG-CB 4.01Å; Q429-P473 VanDerWaalsContact NE2-CD 3.27Å; Q429-P473 VanDerWaalsContact NE2-CG 3.32Å
430	R	96.5	Very high	97.3	Very high	120 Å²	120	39.2 Å²	39.2	45%	0.453	19%	0.189	S	C	.	.	H	α-helix	trans	-66.2	-42.9	-179.5	-176.2	173.8	-179.8	167.1	-5	111.5	E396 N428 T434	E396-R430 IonicContact OE1-CZ 2.97Å; E396-R430 IonicContact OE1-NE 2.76Å; E396-R430 PolarHBondContact OE1-NE 3.03Å; E396-R430 IonicContact OE1-NH2 3.63Å; E396-R430 PolarHBondContact OE1-NH2 2.85Å; N428-R430 VanDerWaalsContact C-N 3.33Å; N428-R430 PolarHBondContact O-N 3.29Å; N428-R430 PolarHBondContact OD1-N 2.96Å; R430-T434 WeakPolarHBondContact O-CB 3.4Å; R430-T434 PolarHBondContact O-N 3.41Å; R430-T434 PolarHBondContact O-OG1 3.26Å
431	N	97.9	Very high	97.2	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.011	19%	0.191	C	C	.	.	H	α-helix	trans	-68.6	-42.1	177.6	-69.3	-4.1	0	0	0	111.1	V395 L399 L424 N428 V433 T434 V435	V395-N431 WeakPolarHBondContact CG2-OD1 3.28Å; L399-N431 HydrophobicContact CD1-CB 3.72Å; L424-N431 VanDerWaalsContact O-CB 3.23Å; L424-N431 WeakPolarHBondContact O-CB 3.45Å; L424-N431 PolarHBondContact O-ND2 3.48Å; N428-N431 HydrophobicContact CB-CB 4.06Å; N428-N431 VanDerWaalsContact CG-CG 3.45Å; N428-N431 PolarHBondContact ND2-ND2 3.05Å; N428-N431 PolarHBondContact O-N 3.35Å; N428-N431 WeakPolarHBondContact OD1-CB 3.44Å; N428-N431 PolarHBondContact OD1-N 3.37Å; N431-V433 PolarHBondContact O-N 2.93Å; N431-T434 PolarHBondContact O-N 3.15Å; N431-V435 WeakPolarHBondContact O-CG2 3.45Å; N431-V435 PolarHBondContact O-N 3.09Å
432	K	97.8	Very high	97.1	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.009	20%	0.195	C	C	.	.	H	α-helix	trans	-54.9	-52.4	173.4	-69.9	172	-176.9	-154.9	0	111.7	T425 N428 Q429 T434 V435 C436 H467 L468 C470 N472	T425-K432 WeakPolarHBondContact O-CE 3.48Å; N428-K432 VanDerWaalsContact O-CG 3.25Å; N428-K432 WeakPolarHBondContact O-CG 3.37Å; N428-K432 PolarHBondContact O-N 2.88Å; Q429-K432 PolarHBondContact O-N 3.43Å; K432-T434 VanDerWaalsContact C-N 3.3Å; K432-T434 PolarHBondContact O-N 3.48Å; K432-V435 PolarHBondContact O-N 2.99Å; K432-C436 PolarHBondContact O-N 3.05Å; K432-C436 PolarHBondContact O-SG 3.26Å; K432-H467 VanDerWaalsContact CD-O 3.24Å; K432-H467 WeakPolarHBondContact CD-O 3.45Å; K432-H467 WeakPolarHBondContact CE-O 3.46Å; K432-H467 PolarHBondContact NZ-O 3.05Å; K432-L468 HydrophobicContact CB-CD2 4.1Å; K432-L468 HydrophobicContact CG-CD2 4.26Å; K432-C470 PolarHBondContact NZ-O 2.89Å; K432-N472 HydrophobicContact CB-CB 4.02Å; K432-N472 HydrophobicContact CD-CB 4.09Å
433	V	98	Very high	97.1	Very high	20 Å²	20	40 Å²	40	12%	0.121	19%	0.193	C	C	.	.	H	α-helix	trans	-57.1	-44.4	177.2	166.9	0	0	0	0	111.4	Q429 N431 V435 C436 R437 N472 P473	Q429-V433 WeakPolarHBondContact O-CB 3.22Å; Q429-V433 VanDerWaalsContact O-CG2 3.28Å; Q429-V433 WeakPolarHBondContact O-CG2 3.32Å; Q429-V433 PolarHBondContact O-N 3.46Å; N431-V433 PolarHBondContact O-N 2.93Å; V433-V435 PolarHBondContact O-N 2.85Å; V433-C436 PolarHBondContact O-N 3.41Å; V433-R437 HydrophobicContact CG1-CG 4.42Å; V433-R437 VanDerWaalsContact CG1-CZ 3.47Å; V433-R437 VanDerWaalsContact CG1-NE 3.33Å; V433-R437 WeakPolarHBondContact O-CB 3.41Å; V433-R437 VanDerWaalsContact O-CG 3.31Å; V433-R437 WeakPolarHBondContact O-CG 3.38Å; V433-R437 PolarHBondContact O-N 3.35Å; V433-N472 HydrophobicContact CG2-CB 4.35Å; V433-P473 HydrophobicContact CG2-CG 4.35Å
434	T	98.1	Very high	97.1	Very high	14 Å²	14	37.3 Å²	37.3	9%	0.086	18%	0.179	C	C	.	.	H	α-helix	trans	-62	-44.2	179.5	-59.5	0	0	0	0	112	E396 L399 R430 N431 K432 R437 S438	E396-T434 HydrophobicContact CB-CG2 3.75Å; E396-T434 HydrophobicContact CG-CG2 3.77Å; E396-T434 WeakPolarHBondContact CG-OG1 3.27Å; L399-T434 HydrophobicContact CB-CG2 4.25Å; L399-T434 HydrophobicContact CD1-CG2 4.01Å; R430-T434 WeakPolarHBondContact O-CB 3.4Å; R430-T434 PolarHBondContact O-N 3.41Å; R430-T434 PolarHBondContact O-OG1 3.26Å; N431-T434 PolarHBondContact O-N 3.15Å; K432-T434 VanDerWaalsContact C-N 3.3Å; K432-T434 PolarHBondContact O-N 3.48Å; T434-R437 PolarHBondContact O-N 3.26Å; T434-S438 VanDerWaalsContact O-CB 3.31Å; T434-S438 WeakPolarHBondContact O-CB 3.35Å; T434-S438 PolarHBondContact O-N 2.97Å; T434-S438 VanDerWaalsContact O-N 3.09Å; T434-S438 PolarHBondContact O-OG 2.87Å
435	V	98.5	Very high	97.1	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-66	-44.7	178.3	174.4	0	0	0	0	110.7	L399 I403 L421 T425 N431 K432 V433 R437 S438 G440 L468	L399-V435 HydrophobicContact CB-CG2 4.26Å; L399-V435 HydrophobicContact CD1-CG2 4.25Å; L399-V435 HydrophobicContact CD2-CG2 4.08Å; L399-V435 HydrophobicContact CG-CG2 4.43Å; I403-V435 HydrophobicContact CD1-CB 4.25Å; I403-V435 HydrophobicContact CD1-CG1 3.96Å; I403-V435 HydrophobicContact CD1-CG2 4.28Å; I403-V435 HydrophobicContact CG1-CG1 4.48Å; L421-V435 HydrophobicContact CD2-CG2 4.02Å; T425-V435 HydrophobicContact CG2-CG2 3.99Å; N431-V435 WeakPolarHBondContact O-CG2 3.45Å; N431-V435 PolarHBondContact O-N 3.09Å; K432-V435 PolarHBondContact O-N 2.99Å; V433-V435 PolarHBondContact O-N 2.85Å; V435-R437 PolarHBondContact O-N 3.14Å; V435-S438 PolarHBondContact O-N 3.5Å; V435-G440 VanDerWaalsContact O-CA 3.31Å; V435-G440 WeakPolarHBondContact O-CA 3.42Å; V435-G440 PolarHBondContact O-N 3.26Å; V435-L468 HydrophobicContact CB-CD1 4.44Å; V435-L468 HydrophobicContact CB-CD2 3.75Å; V435-L468 HydrophobicContact CG1-CD1 3.55Å; V435-L468 HydrophobicContact CG1-CD2 3.78Å; V435-L468 HydrophobicContact CG1-CG 4.29Å
436	C	97.5	Very high	97	Very high	21 Å²	21	42.8 Å²	42.8	14%	0.142	20%	0.2	C	C	.	.	H	α-helix	trans	-56.9	-49.8	175.5	-70	0	0	0	0	111.7	K432 V433 S438 M439 D474	K432-C436 PolarHBondContact O-N 3.05Å; K432-C436 PolarHBondContact O-SG 3.26Å; V433-C436 PolarHBondContact O-N 3.41Å; C436-S438 PolarHBondContact O-N 3.39Å; C436-M439 PolarHBondContact O-N 2.75Å; C436-D474 HydrophobicContact CB-CB 4.15Å
437	R	97.2	Very high	97.1	Very high	174 Å²	174	41.9 Å²	41.9	66%	0.657	19%	0.194	S	C	*	.	H	α-helix	trans	-69.5	-16.4	-178.9	-68.6	177.7	-175.1	-174.2	-0.4	114.4	V433 T434 V435 M439 D474	V433-R437 HydrophobicContact CG1-CG 4.42Å; V433-R437 VanDerWaalsContact CG1-CZ 3.47Å; V433-R437 VanDerWaalsContact CG1-NE 3.33Å; V433-R437 WeakPolarHBondContact O-CB 3.41Å; V433-R437 VanDerWaalsContact O-CG 3.31Å; V433-R437 WeakPolarHBondContact O-CG 3.38Å; V433-R437 PolarHBondContact O-N 3.35Å; T434-R437 PolarHBondContact O-N 3.26Å; V435-R437 PolarHBondContact O-N 3.14Å; R437-M439 VanDerWaalsContact C-N 3.31Å; R437-D474 WeakPolarHBondContact CG-OD2 3.27Å; R437-D474 IonicContact CZ-OD2 2.95Å; R437-D474 IonicContact NE-OD2 2.67Å; R437-D474 PolarHBondContact NE-OD2 3.17Å; R437-D474 IonicContact NH2-OD1 3.35Å; R437-D474 PolarHBondContact NH2-OD1 2.93Å; R437-D474 IonicContact NH2-OD2 3.73Å
438	S	97	Very high	97.3	Very high	31 Å²	31	37.1 Å²	37.1	22%	0.217	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	22.3	177.6	-53.5	0	0	0	0	112.2	T434 V435 C436 G440	T434-S438 VanDerWaalsContact O-CB 3.31Å; T434-S438 WeakPolarHBondContact O-CB 3.35Å; T434-S438 PolarHBondContact O-N 2.97Å; T434-S438 VanDerWaalsContact O-N 3.09Å; T434-S438 PolarHBondContact O-OG 2.87Å; V435-S438 PolarHBondContact O-N 3.5Å; C436-S438 PolarHBondContact O-N 3.39Å; S438-G440 PolarHBondContact O-N 3.05Å
439	M	96.3	Very high	97.3	Very high	117 Å²	117	40.2 Å²	40.2	58%	0.576	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.1	26.4	-176.3	-54.1	-62.1	-64.5	0	0	113.2	C436 R437 V441 D442 A443	C436-M439 PolarHBondContact O-N 2.75Å; R437-M439 VanDerWaalsContact C-N 3.31Å; M439-V441 VanDerWaalsContact C-N 3.32Å; M439-V441 PolarHBondContact O-N 3.35Å; M439-D442 WeakPolarHBondContact CE-OD2 3.41Å; M439-D442 PolarHBondContact O-N 2.92Å; M439-A443 PolarHBondContact O-N 2.78Å; M439-A443 VanDerWaalsContact O-N 3.11Å
440	G	97.9	Very high	97.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-65.1	-33.6	-175.6	0	0	0	0	0	113.1	V435 S438 A443 L444	V435-G440 VanDerWaalsContact O-CA 3.31Å; V435-G440 WeakPolarHBondContact O-CA 3.42Å; V435-G440 PolarHBondContact O-N 3.26Å; S438-G440 PolarHBondContact O-N 3.05Å; G440-A443 PolarHBondContact O-N 2.91Å; G440-L444 WeakPolarHBondContact O-CB 3.41Å; G440-L444 WeakPolarHBondContact O-CD1 3.4Å; G440-L444 WeakPolarHBondContact O-CG 3.32Å; G440-L444 PolarHBondContact O-N 3.06Å
441	V	97.7	Very high	97.2	Very high	6 Å²	6	36.1 Å²	36.1	4%	0.036	17%	0.169	C	C	.	.	H	α-helix	trans	-61.2	-51.3	176.8	179.9	0	0	0	0	110.8	M439 A443 L444 I445 L465 L468 A478 A481 F484	M439-V441 VanDerWaalsContact C-N 3.32Å; M439-V441 PolarHBondContact O-N 3.35Å; V441-A443 VanDerWaalsContact C-N 3.3Å; V441-A443 PolarHBondContact O-N 3.5Å; V441-L444 PolarHBondContact O-N 2.92Å; V441-I445 HydrophobicContact CG1-CD1 3.97Å; V441-I445 WeakPolarHBondContact O-CG1 3.36Å; V441-I445 PolarHBondContact O-N 3.01Å; V441-L465 HydrophobicContact CG1-CD2 3.95Å; V441-L468 HydrophobicContact CG2-CB 4.48Å; V441-L468 HydrophobicContact CG2-CD1 3.9Å; V441-A478 HydrophobicContact CG2-CB 4.14Å; V441-A481 HydrophobicContact CB-CB 4.17Å; V441-A481 HydrophobicContact CG1-CB 3.57Å; V441-F484 HydrophobicContact CG1-CD2 4.25Å; V441-F484 HydrophobicContact CG1-CE2 3.56Å; V441-F484 HydrophobicContact CG1-CZ 4.03Å
442	D	96.6	Very high	96.9	Very high	15 Å²	15	40.2 Å²	40.2	8%	0.08	19%	0.189	C	C	.	.	H	α-helix	trans	-64.3	-35	177.9	-63.2	-77.2	0	0	0	112.3	M439 R446 G483	M439-D442 WeakPolarHBondContact CE-OD2 3.41Å; M439-D442 PolarHBondContact O-N 2.92Å; D442-R446 WeakPolarHBondContact O-CG 3.43Å; D442-R446 PolarHBondContact O-N 3.24Å; D442-R446 VanDerWaalsContact O-N 3.08Å; D442-R446 PolarHBondContact O-NH1 3.08Å; D442-G483 VanDerWaalsContact OD1-CA 3.3Å; D442-G483 WeakPolarHBondContact OD1-CA 3.44Å; D442-G483 PolarHBondContact OD1-N 3.19Å
443	A	97.7	Very high	96.6	Very high	6 Å²	6	46.8 Å²	46.8	5%	0.05	22%	0.224	C	C	.	.	H	α-helix	trans	-63.6	-48	174.4	0	0	0	0	0	111.8	I403 L406 M439 G440 V441 I445 R446 T447	I403-A443 HydrophobicContact CG2-CB 3.81Å; L406-A443 HydrophobicContact CD1-CB 3.96Å; M439-A443 PolarHBondContact O-N 2.78Å; M439-A443 VanDerWaalsContact O-N 3.11Å; G440-A443 PolarHBondContact O-N 2.91Å; V441-A443 VanDerWaalsContact C-N 3.3Å; V441-A443 PolarHBondContact O-N 3.5Å; A443-I445 VanDerWaalsContact C-N 3.34Å; A443-I445 PolarHBondContact O-N 3.33Å; A443-R446 WeakPolarHBondContact O-CB 3.42Å; A443-R446 PolarHBondContact O-N 3.17Å; A443-T447 PolarHBondContact O-N 3.31Å; A443-T447 PolarHBondContact O-OG1 2.87Å; A443-T447 VanDerWaalsContact O-OG1 3.09Å
444	L	98.4	Very high	96.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-63.5	-37.7	178.2	-70.1	163	0	0	0	112	L406 V418 L421 G440 V441 T447 L448 T461 T464 L465 L468	L406-L444 HydrophobicContact CD1-CD2 3.78Å; L406-L444 HydrophobicContact CD1-CG 4.06Å; V418-L444 HydrophobicContact CG1-CD2 4.23Å; L421-L444 HydrophobicContact CD1-CD2 4.34Å; G440-L444 WeakPolarHBondContact O-CB 3.41Å; G440-L444 WeakPolarHBondContact O-CD1 3.4Å; G440-L444 WeakPolarHBondContact O-CG 3.32Å; G440-L444 PolarHBondContact O-N 3.06Å; V441-L444 PolarHBondContact O-N 2.92Å; L444-T447 WeakPolarHBondContact O-CB 3.21Å; L444-T447 PolarHBondContact O-N 3.12Å; L444-L448 PolarHBondContact O-N 3.39Å; L444-T461 HydrophobicContact CB-CG2 3.89Å; L444-T461 HydrophobicContact CD2-CG2 3.87Å; L444-T461 HydrophobicContact CG-CG2 4.49Å; L444-T461 VanDerWaalsContact O-CG2 3.3Å; L444-T461 WeakPolarHBondContact O-CG2 3.26Å; L444-T464 HydrophobicContact CD1-CG2 3.53Å; L444-T464 HydrophobicContact CD2-CG2 4.2Å; L444-L465 HydrophobicContact CB-CD1 4.27Å; L444-L465 HydrophobicContact CB-CD2 3.77Å; L444-L465 HydrophobicContact CB-CG 3.91Å; L444-L465 HydrophobicContact CD1-CD2 3.96Å; L444-L465 HydrophobicContact CD1-CG 4.17Å; L444-L468 HydrophobicContact CD1-CD1 3.63Å
445	I	97.6	Very high	96.1	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-65.6	-41.2	175.2	-65.5	169.8	0	0	0	110.9	V441 A443 T447 L448 Q449 L465 G483 F484 Y486	V441-I445 HydrophobicContact CG1-CD1 3.97Å; V441-I445 WeakPolarHBondContact O-CG1 3.36Å; V441-I445 PolarHBondContact O-N 3.01Å; A443-I445 VanDerWaalsContact C-N 3.34Å; A443-I445 PolarHBondContact O-N 3.33Å; I445-T447 VanDerWaalsContact C-N 3.32Å; I445-T447 PolarHBondContact O-N 3.36Å; I445-L448 WeakPolarHBondContact O-CB 3.48Å; I445-L448 PolarHBondContact O-N 3.26Å; I445-Q449 WeakPolarHBondContact O-CG 3.41Å; I445-Q449 PolarHBondContact O-N 3.18Å; I445-Q449 VanDerWaalsContact O-N 3.12Å; I445-L465 HydrophobicContact CG1-CD1 4.29Å; I445-L465 HydrophobicContact CG1-CD2 4.35Å; I445-G483 VanDerWaalsContact CD1-C 3.42Å; I445-F484 HydrophobicContact CD1-CD1 3.67Å; I445-F484 HydrophobicContact CD1-CD2 4.1Å; I445-F484 HydrophobicContact CD1-CE1 3.78Å; I445-F484 HydrophobicContact CD1-CE2 4.18Å; I445-F484 HydrophobicContact CD1-CG 3.83Å; I445-F484 HydrophobicContact CD1-CZ 4.04Å; I445-F484 HydrophobicContact CG1-CD1 4.47Å; I445-F484 HydrophobicContact CG1-CE1 4.26Å; I445-Y486 HydrophobicContact CG2-CD2 4.11Å; I445-Y486 HydrophobicContact CG2-CE2 3.6Å
446	R	96.6	Very high	95.8	Very high	114 Å²	114	56.9 Å²	56.9	43%	0.43	27%	0.272	S	S	.	.	H	α-helix	trans	-62.1	-40.4	172.7	-73.5	-172.4	-61.3	-88.7	1.5	111.6	D442 A443 L448 Q449 Q450	D442-R446 WeakPolarHBondContact O-CG 3.43Å; D442-R446 PolarHBondContact O-N 3.24Å; D442-R446 VanDerWaalsContact O-N 3.08Å; D442-R446 PolarHBondContact O-NH1 3.08Å; A443-R446 WeakPolarHBondContact O-CB 3.42Å; A443-R446 PolarHBondContact O-N 3.17Å; R446-L448 VanDerWaalsContact C-N 3.35Å; R446-L448 PolarHBondContact O-N 3.37Å; R446-Q449 PolarHBondContact O-N 2.93Å; R446-Q450 WeakPolarHBondContact O-CG 3.41Å; R446-Q450 PolarHBondContact O-N 3.06Å
447	T	97.7	Very high	95.8	Very high	2 Å²	2	56 Å²	56	1%	0.012	27%	0.266	C	S	.	.	H	α-helix	trans	-59.8	-43.1	174.3	-57.5	0	0	0	0	111.5	V414 V418 A443 L444 I445 Q449 Q450 C451 I457	V414-T447 HydrophobicContact CG1-CG2 3.67Å; V418-T447 HydrophobicContact CG1-CG2 4.33Å; A443-T447 PolarHBondContact O-N 3.31Å; A443-T447 PolarHBondContact O-OG1 2.87Å; A443-T447 VanDerWaalsContact O-OG1 3.09Å; L444-T447 WeakPolarHBondContact O-CB 3.21Å; L444-T447 PolarHBondContact O-N 3.12Å; I445-T447 VanDerWaalsContact C-N 3.32Å; I445-T447 PolarHBondContact O-N 3.36Å; T447-Q449 VanDerWaalsContact C-N 3.33Å; T447-Q449 PolarHBondContact O-N 2.96Å; T447-Q450 PolarHBondContact O-N 3.02Å; T447-C451 VanDerWaalsContact O-CB 3.27Å; T447-C451 WeakPolarHBondContact O-CB 3.46Å; T447-C451 PolarHBondContact O-N 3.15Å; T447-I457 HydrophobicContact CG2-CG2 3.72Å
448	L	96.5	Very high	95.9	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.01	24%	0.235	C	C	.	.	H	α-helix	trans	-58.1	-43.7	173.8	-74.8	178.5	0	0	0	112.3	L444 I445 R446 M452 V458 T461 L462 L465 L490 I491 F494	L444-L448 PolarHBondContact O-N 3.39Å; I445-L448 WeakPolarHBondContact O-CB 3.48Å; I445-L448 PolarHBondContact O-N 3.26Å; R446-L448 VanDerWaalsContact C-N 3.35Å; R446-L448 PolarHBondContact O-N 3.37Å; L448-M452 WeakPolarHBondContact O-CA 3.46Å; L448-M452 WeakPolarHBondContact O-CB 3.4Å; L448-M452 PolarHBondContact O-N 2.93Å; L448-M452 VanDerWaalsContact O-N 3.08Å; L448-V458 HydrophobicContact CD2-CB 4.4Å; L448-V458 HydrophobicContact CD2-CG1 4.19Å; L448-V458 HydrophobicContact CD2-CG2 4.32Å; L448-T461 HydrophobicContact CD1-CG2 4.3Å; L448-T461 HydrophobicContact CD2-CG2 3.69Å; L448-T461 HydrophobicContact CG-CG2 3.55Å; L448-L462 HydrophobicContact CD1-CD2 3.95Å; L448-L462 HydrophobicContact CD2-CD2 4.39Å; L448-L462 HydrophobicContact CD2-CG 4.2Å; L448-L465 HydrophobicContact CD1-CD1 3.67Å; L448-L490 HydrophobicContact CB-CD2 3.91Å; L448-I491 HydrophobicContact CD1-CG1 4.1Å; L448-F494 HydrophobicContact CD2-CE2 4.31Å
449	Q	94.8	Very high	95.9	Very high	86 Å²	86	49.4 Å²	49.4	40%	0.402	24%	0.239	S	C	.	.	H	α-helix	trans	-64.9	-41.5	179.4	-69.2	178.6	-50.1	0	0	112.2	I445 R446 T447 L490	I445-Q449 WeakPolarHBondContact O-CG 3.41Å; I445-Q449 PolarHBondContact O-N 3.18Å; I445-Q449 VanDerWaalsContact O-N 3.12Å; R446-Q449 PolarHBondContact O-N 2.93Å; T447-Q449 VanDerWaalsContact C-N 3.33Å; T447-Q449 PolarHBondContact O-N 2.96Å; Q449-L490 HydrophobicContact CB-CD2 4.33Å; Q449-L490 HydrophobicContact CG-CD2 3.75Å
450	Q	95.4	Very high	96	Very high	135 Å²	135	44.8 Å²	44.8	63%	0.631	22%	0.218	S	C	*	.	H	α-helix	trans	-76.8	-30.4	-177.4	-69.6	174	-15	0	0	112.6	R446 T447	R446-Q450 WeakPolarHBondContact O-CG 3.41Å; R446-Q450 PolarHBondContact O-N 3.06Å; T447-Q450 PolarHBondContact O-N 3.02Å
451	C	95.4	Very high	96	Very high	11 Å²	11	44.8 Å²	44.8	7%	0.074	22%	0.218	C	C	.	.	S	Bend	trans	-116.5	22.7	-171.2	-56.5	0	0	0	0	113.4	T447 N453 S454 I457 V458	T447-C451 VanDerWaalsContact O-CB 3.27Å; T447-C451 WeakPolarHBondContact O-CB 3.46Å; T447-C451 PolarHBondContact O-N 3.15Å; C451-N453 PolarHBondContact O-N 3.34Å; C451-S454 PolarHBondContact O-N 2.86Å; C451-I457 HydrophobicContact CB-CB 4.16Å; C451-I457 HydrophobicContact CB-CD1 4.07Å; C451-I457 HydrophobicContact CB-CG2 3.63Å; C451-V458 WeakPolarHBondContact O-CG2 3.47Å
452	M	92	Very high	96	Very high	87 Å²	87	44.5 Å²	44.5	43%	0.429	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-21.3	-174.4	67.8	-178.7	-66	0	0	115.3	L448 L490 F494	L448-M452 WeakPolarHBondContact O-CA 3.46Å; L448-M452 WeakPolarHBondContact O-CB 3.4Å; L448-M452 PolarHBondContact O-N 2.93Å; L448-M452 VanDerWaalsContact O-N 3.08Å; M452-L490 HydrophobicContact CB-CD1 4.39Å; M452-L490 HydrophobicContact CE-CD1 4.17Å; M452-F494 HydrophobicContact CB-CZ 4.43Å
453	N	91.5	Very high	96.1	Very high	141 Å²	141	43.9 Å²	43.9	75%	0.754	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-5.1	178.4	-62.7	-35.1	0	0	0	113.6	C451	C451-N453 PolarHBondContact O-N 3.34Å
454	S	95	Very high	96.1	Very high	36 Å²	36	43.6 Å²	43.6	25%	0.252	21%	0.212	S	C	.	.			trans	-98.5	97.2	177.4	-178.8	0	0	0	0	109.7	C451 E456 I457 V458	C451-S454 PolarHBondContact O-N 2.86Å; S454-E456 VanDerWaalsContact C-N 3.28Å; S454-E456 PolarHBondContact O-N 3.27Å; S454-I457 PolarHBondContact O-N 3.04Å; S454-I457 WeakPolarHBondContact OG-CD1 3.23Å; S454-I457 WeakPolarHBondContact OG-CG1 3.3Å; S454-V458 WeakPolarHBondContact O-CB 3.4Å; S454-V458 VanDerWaalsContact O-CG2 3.32Å; S454-V458 WeakPolarHBondContact O-CG2 3.25Å; S454-V458 PolarHBondContact O-N 2.88Å
455	F	91.8	Very high	96.1	Very high	71 Å²	71	43.6 Å²	43.6	31%	0.311	21%	0.212	S	C	.	.	H	α-helix	trans	-55.1	-42.6	-175.1	-62	-62.3	0	0	0	113	V458 E459 R504	F455-V458 PolarHBondContact O-N 3.35Å; F455-E459 WeakPolarHBondContact O-CB 3.49Å; F455-E459 PolarHBondContact O-N 3.32Å; F455-R504 HydrophobicContact CD1-CG 4.34Å; F455-R504 HydrophobicContact CE1-CG 4.39Å
456	E	92	Very high	96.2	Very high	139 Å²	139	44.4 Å²	44.4	65%	0.65	22%	0.215	S	C	*	.	H	α-helix	trans	-63	-45.8	180	-64.2	174.4	-175.3	0	0	111.2	S454 S460	S454-E456 VanDerWaalsContact C-N 3.28Å; S454-E456 PolarHBondContact O-N 3.27Å; E456-S460 PolarHBondContact O-N 3.15Å
457	I	97.9	Very high	96.2	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-65.1	-45.9	176.7	-65.3	172.7	0	0	0	110.2	L411 V414 A415 V418 T447 C451 S454 E459 T461	L411-I457 HydrophobicContact CB-CD1 4.38Å; L411-I457 HydrophobicContact CD2-CD1 4.33Å; V414-I457 HydrophobicContact CB-CD1 4.4Å; V414-I457 HydrophobicContact CG1-CD1 4.14Å; V414-I457 HydrophobicContact CG1-CG2 4.14Å; A415-I457 HydrophobicContact CB-CD1 4.37Å; A415-I457 HydrophobicContact CB-CG1 3.82Å; V418-I457 HydrophobicContact CG2-CG2 4.33Å; T447-I457 HydrophobicContact CG2-CG2 3.72Å; C451-I457 HydrophobicContact CB-CB 4.16Å; C451-I457 HydrophobicContact CB-CD1 4.07Å; C451-I457 HydrophobicContact CB-CG2 3.63Å; S454-I457 PolarHBondContact O-N 3.04Å; S454-I457 WeakPolarHBondContact OG-CD1 3.23Å; S454-I457 WeakPolarHBondContact OG-CG1 3.3Å; I457-E459 PolarHBondContact O-N 3.11Å; I457-T461 WeakPolarHBondContact O-CB 3.42Å; I457-T461 PolarHBondContact O-N 3.48Å; I457-T461 PolarHBondContact O-OG1 3.16Å
458	V	97.9	Very high	96.3	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.012	19%	0.194	C	C	.	.	H	α-helix	trans	-60.1	-48	-178	167.9	0	0	0	0	111.1	L448 C451 S454 F455 T461 L462 F494 V507	L448-V458 HydrophobicContact CD2-CB 4.4Å; L448-V458 HydrophobicContact CD2-CG1 4.19Å; L448-V458 HydrophobicContact CD2-CG2 4.32Å; C451-V458 WeakPolarHBondContact O-CG2 3.47Å; S454-V458 WeakPolarHBondContact O-CB 3.4Å; S454-V458 VanDerWaalsContact O-CG2 3.32Å; S454-V458 WeakPolarHBondContact O-CG2 3.25Å; S454-V458 PolarHBondContact O-N 2.88Å; F455-V458 PolarHBondContact O-N 3.35Å; V458-T461 PolarHBondContact O-N 3.44Å; V458-L462 HydrophobicContact CG1-CD1 3.69Å; V458-L462 HydrophobicContact CG1-CG 4.3Å; V458-L462 WeakPolarHBondContact O-CB 3.48Å; V458-L462 VanDerWaalsContact O-CG 3.23Å; V458-L462 WeakPolarHBondContact O-CG 3.49Å; V458-L462 PolarHBondContact O-N 3Å; V458-F494 HydrophobicContact CG1-CD1 4.17Å; V458-F494 HydrophobicContact CG1-CD2 4.24Å; V458-F494 HydrophobicContact CG1-CE1 3.78Å; V458-F494 HydrophobicContact CG1-CE2 3.85Å; V458-F494 HydrophobicContact CG1-CG 4.4Å; V458-F494 HydrophobicContact CG1-CZ 3.61Å; V458-F494 HydrophobicContact CG2-CE1 4.42Å; V458-F494 HydrophobicContact CG2-CZ 4.03Å; V458-V507 HydrophobicContact CG1-CG1 3.75Å; V458-V507 HydrophobicContact CG1-CG2 4.3Å
459	E	97.2	Very high	96.3	Very high	64 Å²	64	39 Å²	39	30%	0.299	19%	0.194	S	C	.	.	H	α-helix	trans	-58.7	-54.2	-179.6	-176.3	-177.1	165.8	0	0	111.7	F455 I457 T461 L462 C463 P506 V507	F455-E459 WeakPolarHBondContact O-CB 3.49Å; F455-E459 PolarHBondContact O-N 3.32Å; I457-E459 PolarHBondContact O-N 3.11Å; E459-T461 VanDerWaalsContact C-N 3.29Å; E459-T461 PolarHBondContact O-N 3.26Å; E459-L462 PolarHBondContact O-N 3.3Å; E459-C463 PolarHBondContact O-N 2.98Å; E459-C463 PolarHBondContact O-SG 3.41Å; E459-P506 VanDerWaalsContact CD-CB 3.4Å; E459-P506 HydrophobicContact CG-CB 4.28Å; E459-P506 WeakPolarHBondContact OE1-CB 3.34Å; E459-P506 VanDerWaalsContact OE2-CB 3.24Å; E459-P506 WeakPolarHBondContact OE2-CB 3.33Å; E459-V507 HydrophobicContact CB-CG2 4.1Å
460	S	97.9	Very high	96.3	Very high	20 Å²	20	35.2 Å²	35.2	14%	0.14	18%	0.177	C	C	.	.	H	α-helix	trans	-64.2	-34.8	-179.3	-71.3	0	0	0	0	112.2	D419 E456 C463 T464	D419-S460 WeakPolarHBondContact OD1-CB 3.45Å; D419-S460 PolarHBondContact OD1-OG 3.21Å; E456-S460 PolarHBondContact O-N 3.15Å; S460-C463 PolarHBondContact O-N 3.46Å; S460-T464 PolarHBondContact O-N 3.22Å; S460-T464 PolarHBondContact O-OG1 2.67Å
461	T	98.6	Very high	96.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-66.5	-45.2	175.7	-55.8	0	0	0	0	111.6	V418 L444 L448 I457 V458 E459 T464 L465	V418-T461 WeakPolarHBondContact CG1-OG1 3.48Å; L444-T461 HydrophobicContact CB-CG2 3.89Å; L444-T461 HydrophobicContact CD2-CG2 3.87Å; L444-T461 HydrophobicContact CG-CG2 4.49Å; L444-T461 VanDerWaalsContact O-CG2 3.3Å; L444-T461 WeakPolarHBondContact O-CG2 3.26Å; L448-T461 HydrophobicContact CD1-CG2 4.3Å; L448-T461 HydrophobicContact CD2-CG2 3.69Å; L448-T461 HydrophobicContact CG-CG2 3.55Å; I457-T461 WeakPolarHBondContact O-CB 3.42Å; I457-T461 PolarHBondContact O-N 3.48Å; I457-T461 PolarHBondContact O-OG1 3.16Å; V458-T461 PolarHBondContact O-N 3.44Å; E459-T461 VanDerWaalsContact C-N 3.29Å; E459-T461 PolarHBondContact O-N 3.26Å; T461-T464 PolarHBondContact O-N 3.25Å; T461-L465 HydrophobicContact CG2-CD1 4.33Å; T461-L465 WeakPolarHBondContact O-CG 3.28Å; T461-L465 PolarHBondContact O-N 2.92Å
462	L	98.5	Very high	96.2	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.2	-41.2	175.8	-71.3	168.8	0	0	0	111.5	L448 V458 E459 L465 R466 I491 F494 V507 A510 A511 L514	L448-L462 HydrophobicContact CD1-CD2 3.95Å; L448-L462 HydrophobicContact CD2-CD2 4.39Å; L448-L462 HydrophobicContact CD2-CG 4.2Å; V458-L462 HydrophobicContact CG1-CD1 3.69Å; V458-L462 HydrophobicContact CG1-CG 4.3Å; V458-L462 WeakPolarHBondContact O-CB 3.48Å; V458-L462 VanDerWaalsContact O-CG 3.23Å; V458-L462 WeakPolarHBondContact O-CG 3.49Å; V458-L462 PolarHBondContact O-N 3Å; E459-L462 PolarHBondContact O-N 3.3Å; L462-L465 PolarHBondContact O-N 3Å; L462-R466 WeakPolarHBondContact O-CB 3.4Å; L462-R466 PolarHBondContact O-N 3.38Å; L462-I491 HydrophobicContact CD2-CG1 4.24Å; L462-I491 HydrophobicContact CD2-CG2 4.4Å; L462-F494 HydrophobicContact CD1-CD2 4.06Å; L462-F494 HydrophobicContact CD1-CG 4.42Å; L462-F494 HydrophobicContact CD2-CD2 4.33Å; L462-V507 HydrophobicContact CD1-CG1 3.96Å; L462-A510 HydrophobicContact CB-CB 3.71Å; L462-A510 HydrophobicContact CD1-CB 4.27Å; L462-A511 HydrophobicContact CD1-CB 4.03Å; L462-L514 HydrophobicContact CD2-CD2 3.79Å
463	C	97.7	Very high	96.4	Very high	3 Å²	3	32.5 Å²	32.5	2%	0.02	17%	0.167	C	C	.	.	H	α-helix	trans	-60.3	-46.6	174.9	-68	0	0	0	0	111.5	S422 E459 S460 R466 H467 Y712	S422-C463 WeakPolarHBondContact OG-CB 3.44Å; E459-C463 PolarHBondContact O-N 2.98Å; E459-C463 PolarHBondContact O-SG 3.41Å; S460-C463 PolarHBondContact O-N 3.46Å; C463-R466 WeakPolarHBondContact O-CB 3.42Å; C463-R466 PolarHBondContact O-N 3.18Å; C463-R466 PolarHBondContact SG-NH2 3.39Å; C463-R466 VanDerWaalsContact SG-NH2 3.42Å; C463-H467 PolarHBondContact O-CD2 3Å; C463-H467 VanDerWaalsContact O-CD2 3.3Å; C463-H467 PolarHBondContact O-N 2.87Å; C463-H467 PolarHBondContact O-ND1 3.43Å; C463-H467 PolarHBondContact O-NE2 2.9Å; C463-Y712 PolarHBondContact SG-OH 2.85Å
464	T	98.6	Very high	96.6	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-60	-50.5	177.1	-53.6	0	0	0	0	110.9	L421 S422 T425 L444 S460 T461 R466 H467 L468	L421-T464 HydrophobicContact CB-CG2 3.9Å; S422-T464 VanDerWaalsContact CA-OG1 3.26Å; S422-T464 WeakPolarHBondContact CA-OG1 3.41Å; S422-T464 WeakPolarHBondContact CB-OG1 3.5Å; S422-T464 PolarHBondContact N-OG1 3.2Å; T425-T464 HydrophobicContact CG2-CG2 4.46Å; L444-T464 HydrophobicContact CD1-CG2 3.53Å; L444-T464 HydrophobicContact CD2-CG2 4.2Å; S460-T464 PolarHBondContact O-N 3.22Å; S460-T464 PolarHBondContact O-OG1 2.67Å; T461-T464 PolarHBondContact O-N 3.25Å; T464-R466 VanDerWaalsContact C-N 3.28Å; T464-R466 PolarHBondContact O-N 2.89Å; T464-H467 WeakPolarHBondContact O-CB 3.38Å; T464-H467 PolarHBondContact O-N 2.75Å; T464-L468 HydrophobicContact CG2-CD1 4.32Å; T464-L468 HydrophobicContact CG2-CG 4.49Å; T464-L468 WeakPolarHBondContact O-CG 3.45Å; T464-L468 PolarHBondContact O-N 3.09Å
465	L	98.5	Very high	96.7	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-58.4	-39.3	177.1	-74.6	170.2	0	0	0	112.4	V441 L444 I445 L448 T461 L462 H467 L468 T469 F484 L514	V441-L465 HydrophobicContact CG1-CD2 3.95Å; L444-L465 HydrophobicContact CB-CD1 4.27Å; L444-L465 HydrophobicContact CB-CD2 3.77Å; L444-L465 HydrophobicContact CB-CG 3.91Å; L444-L465 HydrophobicContact CD1-CD2 3.96Å; L444-L465 HydrophobicContact CD1-CG 4.17Å; I445-L465 HydrophobicContact CG1-CD1 4.29Å; I445-L465 HydrophobicContact CG1-CD2 4.35Å; L448-L465 HydrophobicContact CD1-CD1 3.67Å; T461-L465 HydrophobicContact CG2-CD1 4.33Å; T461-L465 WeakPolarHBondContact O-CG 3.28Å; T461-L465 PolarHBondContact O-N 2.92Å; L462-L465 PolarHBondContact O-N 3Å; L465-H467 VanDerWaalsContact C-N 3.34Å; L465-H467 PolarHBondContact O-N 2.8Å; L465-L468 PolarHBondContact O-N 3.04Å; L465-T469 WeakPolarHBondContact O-CG2 3.36Å; L465-T469 PolarHBondContact O-N 2.81Å; L465-T469 VanDerWaalsContact O-N 3.13Å; L465-T469 PolarHBondContact O-OG1 3.18Å; L465-F484 HydrophobicContact CD2-CZ 4.15Å; L465-L514 HydrophobicContact CB-CD1 3.95Å; L465-L514 HydrophobicContact CB-CD2 3.76Å; L465-L514 HydrophobicContact CD1-CD2 4.11Å
466	R	98.3	Very high	96.8	Very high	18 Å²	18	29.6 Å²	29.6	7%	0.068	15%	0.148	C	C	.	.	H	α-helix	trans	-59.8	-45.1	173.8	179.1	-173.9	66.3	-139.3	-7.3	110.6	L462 C463 T464 L468 T469 L514 N517 Y712	L462-R466 WeakPolarHBondContact O-CB 3.4Å; L462-R466 PolarHBondContact O-N 3.38Å; C463-R466 WeakPolarHBondContact O-CB 3.42Å; C463-R466 PolarHBondContact O-N 3.18Å; C463-R466 PolarHBondContact SG-NH2 3.39Å; C463-R466 VanDerWaalsContact SG-NH2 3.42Å; T464-R466 VanDerWaalsContact C-N 3.28Å; T464-R466 PolarHBondContact O-N 2.89Å; R466-L468 VanDerWaalsContact C-N 3.35Å; R466-L468 PolarHBondContact O-N 3.1Å; R466-T469 PolarHBondContact O-N 2.67Å; R466-T469 PolarHBondContact O-OG1 3.39Å; R466-T469 VanDerWaalsContact O-OG1 3.06Å; R466-L514 HydrophobicContact CB-CB 4.23Å; R466-N517 PolarHBondContact O-ND2 2.93Å; R466-Y712 PolarHBondContact NH1-OH 3.06Å; R466-Y712 VanDerWaalsContact NH2-CZ 3.32Å; R466-Y712 PolarHBondContact NH2-OH 3.31Å; R466-Y712 VanDerWaalsContact NH2-OH 3.11Å
467	H	97.9	Very high	96.9	Very high	4 Å²	4	26.2 Å²	26.2	2%	0.019	15%	0.145	C	C	.	.	H	α-helix	trans	-62.7	-40.5	178	-57.8	158.1	0	0	0	112.4	S422 T425 K432 C463 T464 L465 T469 C470	S422-H467 PolarHBondContact O-CE1 2.77Å; S422-H467 VanDerWaalsContact O-CE1 3.25Å; S422-H467 PolarHBondContact O-ND1 3.45Å; S422-H467 VanDerWaalsContact O-ND1 3.11Å; T425-H467 PolarHBondContact OG1-ND1 3.07Å; T425-H467 VanDerWaalsContact OG1-ND1 3.13Å; K432-H467 VanDerWaalsContact CD-O 3.24Å; K432-H467 WeakPolarHBondContact CD-O 3.45Å; K432-H467 WeakPolarHBondContact CE-O 3.46Å; K432-H467 PolarHBondContact NZ-O 3.05Å; C463-H467 PolarHBondContact O-CD2 3Å; C463-H467 VanDerWaalsContact O-CD2 3.3Å; C463-H467 PolarHBondContact O-N 2.87Å; C463-H467 PolarHBondContact O-ND1 3.43Å; C463-H467 PolarHBondContact O-NE2 2.9Å; T464-H467 WeakPolarHBondContact O-CB 3.38Å; T464-H467 PolarHBondContact O-N 2.75Å; L465-H467 VanDerWaalsContact C-N 3.34Å; L465-H467 PolarHBondContact O-N 2.8Å; H467-T469 VanDerWaalsContact C-N 3.32Å; H467-T469 PolarHBondContact O-N 3.48Å; H467-C470 VanDerWaalsContact O-O 3.14Å
468	L	98.2	Very high	96.8	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-69.9	-26.9	-178.3	-62	178.1	0	0	0	113.6	T425 K432 V435 V441 L444 T464 L465 R466 C470 N472	T425-L468 HydrophobicContact CG2-CD2 4.03Å; K432-L468 HydrophobicContact CB-CD2 4.1Å; K432-L468 HydrophobicContact CG-CD2 4.26Å; V435-L468 HydrophobicContact CB-CD1 4.44Å; V435-L468 HydrophobicContact CB-CD2 3.75Å; V435-L468 HydrophobicContact CG1-CD1 3.55Å; V435-L468 HydrophobicContact CG1-CD2 3.78Å; V435-L468 HydrophobicContact CG1-CG 4.29Å; V441-L468 HydrophobicContact CG2-CB 4.48Å; V441-L468 HydrophobicContact CG2-CD1 3.9Å; L444-L468 HydrophobicContact CD1-CD1 3.63Å; T464-L468 HydrophobicContact CG2-CD1 4.32Å; T464-L468 HydrophobicContact CG2-CG 4.49Å; T464-L468 WeakPolarHBondContact O-CG 3.45Å; T464-L468 PolarHBondContact O-N 3.09Å; L465-L468 PolarHBondContact O-N 3.04Å; R466-L468 VanDerWaalsContact C-N 3.35Å; R466-L468 PolarHBondContact O-N 3.1Å; L468-C470 VanDerWaalsContact C-N 3.33Å; L468-C470 PolarHBondContact O-N 3Å; L468-N472 PolarHBondContact O-ND2 3.4Å
469	T	97	Very high	96.7	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	9.2	-176	50	0	0	0	0	113.6	L465 R466 H467 A478 Q479 F484 L514 N517 L518	L465-T469 WeakPolarHBondContact O-CG2 3.36Å; L465-T469 PolarHBondContact O-N 2.81Å; L465-T469 VanDerWaalsContact O-N 3.13Å; L465-T469 PolarHBondContact O-OG1 3.18Å; R466-T469 PolarHBondContact O-N 2.67Å; R466-T469 PolarHBondContact O-OG1 3.39Å; R466-T469 VanDerWaalsContact O-OG1 3.06Å; H467-T469 VanDerWaalsContact C-N 3.32Å; H467-T469 PolarHBondContact O-N 3.48Å; T469-A478 HydrophobicContact CG2-CB 4.38Å; T469-Q479 HydrophobicContact CG2-CG 4.18Å; T469-Q479 PolarHBondContact O-NE2 3.26Å; T469-F484 HydrophobicContact CG2-CE2 4.29Å; T469-F484 HydrophobicContact CG2-CZ 4.27Å; T469-L514 HydrophobicContact CG2-CD1 4.12Å; T469-N517 WeakPolarHBondContact OG1-CB 3.39Å; T469-N517 PolarHBondContact OG1-ND2 3.36Å; T469-L518 HydrophobicContact CG2-CD2 3.86Å
470	C	95.4	Very high	96.5	Very high	7 Å²	7	27.5 Å²	27.5	5%	0.047	15%	0.154	C	C	.	.	S	Bend	trans	-147.2	161.3	175.7	72	0	0	0	0	113.2	K432 H467 L468 N472	K432-C470 PolarHBondContact NZ-O 2.89Å; H467-C470 VanDerWaalsContact O-O 3.14Å; L468-C470 VanDerWaalsContact C-N 3.33Å; L468-C470 PolarHBondContact O-N 3Å; C470-N472 VanDerWaalsContact C-N 3.26Å; C470-N472 PolarHBondContact O-N 3.45Å; C470-N472 VanDerWaalsContact O-N 3.14Å; C470-N472 PolarHBondContact O-ND2 3.18Å
471	R	92.7	Very high	96.2	Very high	73 Å²	73	27 Å²	27	28%	0.275	15%	0.151	S	C	.	.	S	Bend	trans	50	40.5	170.9	-55.2	176.9	177.6	-176.2	-12.3	114.6	N427 D705 D706 D709	N427-R471 PolarHBondContact OD1-NH1 3.25Å; R471-D705 HydrophobicContact CG-CB 4.41Å; R471-D705 PolarHBondContact NE-O 3.38Å; R471-D705 PolarHBondContact NH2-O 2.89Å; R471-D706 VanDerWaalsContact NH2-CA 3.34Å; R471-D706 PolarHBondContact NH2-O 3.39Å; R471-D709 IonicContact NH1-OD2 3.58Å
472	N	95.2	Very high	95.6	Very high	15 Å²	15	31.6 Å²	31.6	8%	0.08	18%	0.181	C	C	.	.	S	Bend	trans	-152.2	158.1	171.3	72.3	91.5	0	0	0	110.3	Q429 K432 V433 L468 C470 D474 A475	Q429-N472 HydrophobicContact CG-CB 4.01Å; K432-N472 HydrophobicContact CB-CB 4.02Å; K432-N472 HydrophobicContact CD-CB 4.09Å; V433-N472 HydrophobicContact CG2-CB 4.35Å; L468-N472 PolarHBondContact O-ND2 3.4Å; C470-N472 VanDerWaalsContact C-N 3.26Å; C470-N472 PolarHBondContact O-N 3.45Å; C470-N472 VanDerWaalsContact O-N 3.14Å; C470-N472 PolarHBondContact O-ND2 3.18Å; N472-D474 PolarHBondContact O-N 2.85Å; N472-D474 WeakPolarHBondContact OD1-CA 3.43Å; N472-D474 PolarHBondContact OD1-N 2.85Å; N472-D474 VanDerWaalsContact OD1-N 3.15Å; N472-A475 WeakPolarHBondContact O-CB 3.42Å; N472-A475 PolarHBondContact O-N 2.99Å; N472-A475 PolarHBondContact OD1-N 3.31Å; N472-A475 VanDerWaalsContact OD1-N 3.15Å
473	P	97	Very high	94.9	Very high	88 Å²	88	31.6 Å²	31.6	57%	0.571	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-25.3	-173.9	-20.2	35.5	0	0	0	113	Q429 V433 A475	Q429-P473 VanDerWaalsContact NE2-CD 3.27Å; Q429-P473 VanDerWaalsContact NE2-CG 3.32Å; V433-P473 HydrophobicContact CG2-CG 4.35Å; P473-A475 VanDerWaalsContact C-N 3.34Å
474	D	96.3	Very high	94.4	Very high	31 Å²	31	31.6 Å²	31.6	17%	0.166	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	10.5	-179.9	-61.1	-9.9	0	0	0	111.2	C436 R437 N472 E476 A477 A478	C436-D474 HydrophobicContact CB-CB 4.15Å; R437-D474 WeakPolarHBondContact CG-OD2 3.27Å; R437-D474 IonicContact CZ-OD2 2.95Å; R437-D474 IonicContact NE-OD2 2.67Å; R437-D474 PolarHBondContact NE-OD2 3.17Å; R437-D474 IonicContact NH2-OD1 3.35Å; R437-D474 PolarHBondContact NH2-OD1 2.93Å; R437-D474 IonicContact NH2-OD2 3.73Å; N472-D474 PolarHBondContact O-N 2.85Å; N472-D474 WeakPolarHBondContact OD1-CA 3.43Å; N472-D474 PolarHBondContact OD1-N 2.85Å; N472-D474 VanDerWaalsContact OD1-N 3.15Å; D474-E476 PolarHBondContact O-N 2.92Å; D474-A477 PolarHBondContact O-N 3.28Å; D474-A478 WeakPolarHBondContact O-CB 3.5Å; D474-A478 PolarHBondContact O-N 2.81Å
475	A	95.6	Very high	93.7	Very high	10 Å²	10	36.1 Å²	36.1	8%	0.083	21%	0.212	C	C	.	.	H	α-helix	trans	-64.2	-42.3	-174.7	0	0	0	0	0	113.1	N472 P473 A478 Q479	N472-A475 WeakPolarHBondContact O-CB 3.42Å; N472-A475 PolarHBondContact O-N 2.99Å; N472-A475 PolarHBondContact OD1-N 3.31Å; N472-A475 VanDerWaalsContact OD1-N 3.15Å; P473-A475 VanDerWaalsContact C-N 3.34Å; A475-A478 WeakPolarHBondContact O-CB 3.17Å; A475-A478 PolarHBondContact O-N 3.25Å; A475-Q479 WeakPolarHBondContact O-CB 3.43Å; A475-Q479 WeakPolarHBondContact O-CG 3.29Å; A475-Q479 PolarHBondContact O-N 2.88Å
476	E	94.7	Very high	93.1	Very high	145 Å²	145	40.6 Å²	40.6	68%	0.678	23%	0.229	S	C	*	.	H	α-helix	trans	-65	-41.8	176.9	-175.1	-178.3	177.3	0	0	111.1	D474 A478 Q479 N480	D474-E476 PolarHBondContact O-N 2.92Å; E476-A478 VanDerWaalsContact C-N 3.32Å; E476-A478 PolarHBondContact O-N 3.1Å; E476-Q479 PolarHBondContact O-N 3.2Å; E476-N480 PolarHBondContact O-N 3.21Å; E476-N480 PolarHBondContact O-ND2 2.81Å
477	A	94.5	Very high	92.9	Very high	69 Å²	69	39.8 Å²	39.8	57%	0.57	23%	0.227	S	C	*	.	H	α-helix	trans	-63.2	-40.1	173.9	0	0	0	0	0	111.3	D474 N480 A481	D474-A477 PolarHBondContact O-N 3.28Å; A477-N480 CarbonylContact O-C 3.34Å; A477-N480 PolarHBondContact O-N 3.13Å; A477-A481 PolarHBondContact O-N 2.93Å
478	A	95.7	Very high	92.7	Very high	5 Å²	5	39.6 Å²	39.6	4%	0.041	23%	0.226	C	C	.	.	H	α-helix	trans	-64.3	-45.1	175.4	0	0	0	0	0	111.8	V441 T469 D474 A475 E476 N480 A481 F484	V441-A478 HydrophobicContact CG2-CB 4.14Å; T469-A478 HydrophobicContact CG2-CB 4.38Å; D474-A478 WeakPolarHBondContact O-CB 3.5Å; D474-A478 PolarHBondContact O-N 2.81Å; A475-A478 WeakPolarHBondContact O-CB 3.17Å; A475-A478 PolarHBondContact O-N 3.25Å; E476-A478 VanDerWaalsContact C-N 3.32Å; E476-A478 PolarHBondContact O-N 3.1Å; A478-N480 PolarHBondContact O-N 2.97Å; A478-A481 VanDerWaalsContact O-CB 3.25Å; A478-A481 WeakPolarHBondContact O-CB 3.37Å; A478-A481 PolarHBondContact O-N 2.75Å; A478-F484 WeakPolarHBondContact O-CD2 3.28Å; A478-F484 WeakPolarHBondContact O-CE2 3.48Å
479	Q	94.8	Very high	92.4	Very high	20 Å²	20	42 Å²	42	9%	0.093	24%	0.241	C	C	.	.	H	α-helix	trans	-60	-26.6	177.1	-71.7	164	14.5	0	0	113.1	T469 A475 E476 L518 N524	T469-Q479 HydrophobicContact CG2-CG 4.18Å; T469-Q479 PolarHBondContact O-NE2 3.26Å; A475-Q479 WeakPolarHBondContact O-CB 3.43Å; A475-Q479 WeakPolarHBondContact O-CG 3.29Å; A475-Q479 PolarHBondContact O-N 2.88Å; E476-Q479 PolarHBondContact O-N 3.2Å; Q479-L518 HydrophobicContact CB-CD2 4.25Å; Q479-L518 HydrophobicContact CG-CD2 4.33Å; Q479-N524 PolarHBondContact O-ND2 3.32Å
480	N	92.6	Very high	92.3	Very high	70 Å²	70	43.2 Å²	43.2	37%	0.374	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.5	16.9	179	-64	-62.5	0	0	0	112.8	E476 A477 A478 S521	E476-N480 PolarHBondContact O-N 3.21Å; E476-N480 PolarHBondContact O-ND2 2.81Å; A477-N480 CarbonylContact O-C 3.34Å; A477-N480 PolarHBondContact O-N 3.13Å; A478-N480 PolarHBondContact O-N 2.97Å; N480-S521 WeakPolarHBondContact OD1-CB 3.46Å; N480-S521 PolarHBondContact OD1-OG 3.38Å
481	A	93	Very high	92.4	Very high	10 Å²	10	43 Å²	43	8%	0.083	25%	0.246	C	C	.	.			trans	-59.3	139.7	-179	0	0	0	0	0	110.9	V441 A477 A478 G483 F484	V441-A481 HydrophobicContact CB-CB 4.17Å; V441-A481 HydrophobicContact CG1-CB 3.57Å; A477-A481 PolarHBondContact O-N 2.93Å; A478-A481 VanDerWaalsContact O-CB 3.25Å; A478-A481 WeakPolarHBondContact O-CB 3.37Å; A478-A481 PolarHBondContact O-N 2.75Å; A481-G483 PolarHBondContact O-N 3.5Å; A481-G483 VanDerWaalsContact O-N 3.07Å; A481-F484 HydrophobicContact CB-CD2 3.98Å; A481-F484 HydrophobicContact CB-CE2 4.33Å; A481-F484 WeakPolarHBondContact O-CB 3.3Å; A481-F484 PolarHBondContact O-N 3.15Å
482	P	86.3	Confident	92.5	Very high	96 Å²	96	39.6 Å²	39.6	62%	0.623	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-35.9	-175.5	-27.7	35.1	0	0	0	113.6	F484 S485	P482-F484 PolarHBondContact O-N 3.21Å; P482-F484 VanDerWaalsContact O-N 3.15Å; P482-S485 WeakPolarHBondContact O-CB 3.35Å; P482-S485 PolarHBondContact O-N 2.94Å; P482-S485 VanDerWaalsContact O-N 3.11Å; P482-S485 PolarHBondContact O-OG 3.02Å
483	G	83.5	Confident	92.5	Very high	0 Å²	0	41 Å²	41	0%	0	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-27.6	177.4	0	0	0	0	0	114.7	D442 I445 A481 S485 Y486 G487	D442-G483 VanDerWaalsContact OD1-CA 3.3Å; D442-G483 WeakPolarHBondContact OD1-CA 3.44Å; D442-G483 PolarHBondContact OD1-N 3.19Å; I445-G483 VanDerWaalsContact CD1-C 3.42Å; A481-G483 PolarHBondContact O-N 3.5Å; A481-G483 VanDerWaalsContact O-N 3.07Å; G483-S485 PolarHBondContact O-N 3.28Å; G483-Y486 VanDerWaalsContact CA-CZ 3.49Å; G483-Y486 WeakPolarHBondContact O-CD2 3.32Å; G483-Y486 WeakPolarHBondContact O-CE2 3.42Å; G483-Y486 PolarHBondContact O-N 2.77Å; G483-G487 PolarHBondContact O-N 3.15Å
484	F	87.7	Confident	92.5	Very high	3 Å²	3	37.6 Å²	37.6	1%	0.013	22%	0.221	C	C	.	.	H	α-helix	trans	-69.1	-21.1	179.6	-78.7	-59.7	0	0	0	113.4	V441 I445 L465 T469 A478 A481 P482 Y486 G487 I488 I491 L518	V441-F484 HydrophobicContact CG1-CD2 4.25Å; V441-F484 HydrophobicContact CG1-CE2 3.56Å; V441-F484 HydrophobicContact CG1-CZ 4.03Å; I445-F484 HydrophobicContact CD1-CD1 3.67Å; I445-F484 HydrophobicContact CD1-CD2 4.1Å; I445-F484 HydrophobicContact CD1-CE1 3.78Å; I445-F484 HydrophobicContact CD1-CE2 4.18Å; I445-F484 HydrophobicContact CD1-CG 3.83Å; I445-F484 HydrophobicContact CD1-CZ 4.04Å; I445-F484 HydrophobicContact CG1-CD1 4.47Å; I445-F484 HydrophobicContact CG1-CE1 4.26Å; L465-F484 HydrophobicContact CD2-CZ 4.15Å; T469-F484 HydrophobicContact CG2-CE2 4.29Å; T469-F484 HydrophobicContact CG2-CZ 4.27Å; A478-F484 WeakPolarHBondContact O-CD2 3.28Å; A478-F484 WeakPolarHBondContact O-CE2 3.48Å; A481-F484 HydrophobicContact CB-CD2 3.98Å; A481-F484 HydrophobicContact CB-CE2 4.33Å; A481-F484 WeakPolarHBondContact O-CB 3.3Å; A481-F484 PolarHBondContact O-N 3.15Å; P482-F484 PolarHBondContact O-N 3.21Å; P482-F484 VanDerWaalsContact O-N 3.15Å; F484-Y486 PolarHBondContact O-N 3.28Å; F484-G487 PolarHBondContact O-N 3.01Å; F484-I488 HydrophobicContact CB-CD1 3.95Å; F484-I488 HydrophobicContact CB-CG1 3.98Å; F484-I488 HydrophobicContact CD1-CG1 3.96Å; F484-I488 HydrophobicContact CG-CG1 4.35Å; F484-I488 WeakPolarHBondContact O-CB 3.42Å; F484-I488 WeakPolarHBondContact O-CG1 3.41Å; F484-I488 PolarHBondContact O-N 3.37Å; F484-I491 HydrophobicContact CD1-CD1 3.86Å; F484-I491 HydrophobicContact CE1-CD1 3.54Å; F484-L518 HydrophobicContact CD1-CD1 4.03Å; F484-L518 HydrophobicContact CD1-CD2 4.48Å; F484-L518 HydrophobicContact CD2-CD2 4.21Å; F484-L518 HydrophobicContact CE1-CD1 3.75Å; F484-L518 HydrophobicContact CE1-CD2 4.17Å; F484-L518 HydrophobicContact CE2-CD2 3.89Å; F484-L518 HydrophobicContact CZ-CD1 4.23Å; F484-L518 HydrophobicContact CZ-CD2 3.86Å
485	S	83.1	Confident	92.5	Very high	95 Å²	95	36.1 Å²	36.1	66%	0.664	21%	0.213	S	C	*	.	H	α-helix	trans	-54.6	-35.4	174.9	61.8	0	0	0	0	113.1	P482 G483	P482-S485 WeakPolarHBondContact O-CB 3.35Å; P482-S485 PolarHBondContact O-N 2.94Å; P482-S485 VanDerWaalsContact O-N 3.11Å; P482-S485 PolarHBondContact O-OG 3.02Å; G483-S485 PolarHBondContact O-N 3.28Å
486	Y	85.8	Confident	92.4	Very high	93 Å²	93	38.2 Å²	38.2	37%	0.365	22%	0.223	S	C	.	.	H	α-helix	trans	-109.6	-18	174.7	56.5	-99.7	0	0	0	113.1	I445 G483 F484	I445-Y486 HydrophobicContact CG2-CD2 4.11Å; I445-Y486 HydrophobicContact CG2-CE2 3.6Å; G483-Y486 VanDerWaalsContact CA-CZ 3.49Å; G483-Y486 WeakPolarHBondContact O-CD2 3.32Å; G483-Y486 WeakPolarHBondContact O-CE2 3.42Å; G483-Y486 PolarHBondContact O-N 2.77Å; F484-Y486 PolarHBondContact O-N 3.28Å
487	G	93	Very high	92.1	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-78.2	-33.6	-179.9	0	0	0	0	0	114.3	G483 F484 L490 I491	G483-G487 PolarHBondContact O-N 3.15Å; F484-G487 PolarHBondContact O-N 3.01Å; G487-L490 WeakPolarHBondContact O-CB 3.32Å; G487-L490 PolarHBondContact O-N 2.79Å; G487-I491 WeakPolarHBondContact O-CG1 3.49Å; G487-I491 PolarHBondContact O-N 2.65Å
488	I	93.9	Very high	91.8	Very high	1 Å²	1	36 Å²	36	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-59.2	-47.2	-176.4	-76.2	170.9	0	0	0	113.1	F484 L490 I491 C492 L518 N524 T527 F528	F484-I488 HydrophobicContact CB-CD1 3.95Å; F484-I488 HydrophobicContact CB-CG1 3.98Å; F484-I488 HydrophobicContact CD1-CG1 3.96Å; F484-I488 HydrophobicContact CG-CG1 4.35Å; F484-I488 WeakPolarHBondContact O-CB 3.42Å; F484-I488 WeakPolarHBondContact O-CG1 3.41Å; F484-I488 PolarHBondContact O-N 3.37Å; I488-L490 PolarHBondContact O-N 2.62Å; I488-I491 PolarHBondContact O-N 3.03Å; I488-C492 PolarHBondContact O-N 3.36Å; I488-C492 PolarHBondContact O-SG 3.01Å; I488-C492 VanDerWaalsContact O-SG 3.33Å; I488-L518 HydrophobicContact CG1-CD1 4.32Å; I488-N524 HydrophobicContact CD1-CB 3.9Å; I488-N524 VanDerWaalsContact CD1-CG 3.5Å; I488-N524 VanDerWaalsContact CD1-OD1 3.22Å; I488-N524 WeakPolarHBondContact CD1-OD1 3.49Å; I488-T527 HydrophobicContact CB-CG2 4.12Å; I488-T527 HydrophobicContact CG2-CG2 3.53Å; I488-F528 HydrophobicContact CG2-CD1 3.72Å; I488-F528 HydrophobicContact CG2-CE1 3.58Å
489	P	93.6	Very high	91.4	Very high	50 Å²	50	36.9 Å²	36.9	33%	0.325	21%	0.209	S	C	.	.	H	α-helix	trans	-56	-38.8	177.1	-27.6	36	0	0	0	113	C492 S493 T527	P489-C492 PolarHBondContact O-N 3.16Å; P489-S493 PolarHBondContact O-N 3.19Å; P489-S493 VanDerWaalsContact O-N 3.13Å; P489-T527 HydrophobicContact CG-CG2 4.21Å
490	L	94.7	Very high	91	Very high	26 Å²	26	44.6 Å²	44.6	14%	0.136	24%	0.244	C	C	.	.	H	α-helix	trans	-65.9	-45	174.7	177.9	61.2	0	0	0	111.3	L448 Q449 M452 G487 I488 C492 S493 F494	L448-L490 HydrophobicContact CB-CD2 3.91Å; Q449-L490 HydrophobicContact CB-CD2 4.33Å; Q449-L490 HydrophobicContact CG-CD2 3.75Å; M452-L490 HydrophobicContact CB-CD1 4.39Å; M452-L490 HydrophobicContact CE-CD1 4.17Å; G487-L490 WeakPolarHBondContact O-CB 3.32Å; G487-L490 PolarHBondContact O-N 2.79Å; I488-L490 PolarHBondContact O-N 2.62Å; L490-C492 VanDerWaalsContact C-N 3.31Å; L490-C492 PolarHBondContact O-N 2.93Å; L490-S493 WeakPolarHBondContact O-CB 3.12Å; L490-S493 PolarHBondContact O-N 3.06Å; L490-S493 VanDerWaalsContact O-N 3.1Å; L490-S493 PolarHBondContact O-OG 3.28Å; L490-F494 HydrophobicContact CD1-CE2 4.25Å; L490-F494 HydrophobicContact CD1-CZ 4.14Å; L490-F494 HydrophobicContact CG-CE2 4.09Å; L490-F494 HydrophobicContact CG-CZ 4.42Å; L490-F494 WeakPolarHBondContact O-CD2 3.35Å
491	I	96.6	Very high	90.8	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-60.4	-41.8	176.4	-66.9	159.8	0	0	0	111.2	L448 L462 F484 G487 I488 S493 F494 L514 I515 L518	L448-I491 HydrophobicContact CD1-CG1 4.1Å; L462-I491 HydrophobicContact CD2-CG1 4.24Å; L462-I491 HydrophobicContact CD2-CG2 4.4Å; F484-I491 HydrophobicContact CD1-CD1 3.86Å; F484-I491 HydrophobicContact CE1-CD1 3.54Å; G487-I491 WeakPolarHBondContact O-CG1 3.49Å; G487-I491 PolarHBondContact O-N 2.65Å; I488-I491 PolarHBondContact O-N 3.03Å; I491-S493 PolarHBondContact O-N 3.41Å; I491-F494 WeakPolarHBondContact O-CB 3.45Å; I491-F494 PolarHBondContact O-N 3.46Å; I491-F494 VanDerWaalsContact O-N 3.14Å; I491-L514 HydrophobicContact CD1-CD2 3.76Å; I491-L514 HydrophobicContact CG1-CD2 4.19Å; I491-L514 HydrophobicContact CG2-CD2 4.06Å; I491-L514 HydrophobicContact CG2-CG 4.47Å; I491-I515 HydrophobicContact CG2-CD1 4.35Å; I491-I515 HydrophobicContact CG2-CG1 4.01Å; I491-L518 HydrophobicContact CD1-CD1 4.42Å
492	C	95.7	Very high	90.6	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.014	28%	0.278	C	S	.	.	H	α-helix	trans	-61.4	-32.6	176	-69.1	0	0	0	0	112.5	I488 P489 L490 F494 V495 N496 N531 I533	I488-C492 PolarHBondContact O-N 3.36Å; I488-C492 PolarHBondContact O-SG 3.01Å; I488-C492 VanDerWaalsContact O-SG 3.33Å; P489-C492 PolarHBondContact O-N 3.16Å; L490-C492 VanDerWaalsContact C-N 3.31Å; L490-C492 PolarHBondContact O-N 2.93Å; C492-F494 PolarHBondContact O-N 3.1Å; C492-V495 PolarHBondContact O-N 3.04Å; C492-N496 PolarHBondContact O-N 3.26Å; C492-N531 HydrophobicContact CB-CB 3.82Å; C492-I533 HydrophobicContact CB-CD1 4.19Å
493	S	94.8	Very high	90.9	Very high	46 Å²	46	45.8 Å²	45.8	32%	0.322	25%	0.253	S	S	.	.	H	α-helix	trans	-62	-28.4	176.7	82.2	0	0	0	0	113	P489 L490 I491 V495 N496	P489-S493 PolarHBondContact O-N 3.19Å; P489-S493 VanDerWaalsContact O-N 3.13Å; L490-S493 WeakPolarHBondContact O-CB 3.12Å; L490-S493 PolarHBondContact O-N 3.06Å; L490-S493 VanDerWaalsContact O-N 3.1Å; L490-S493 PolarHBondContact O-OG 3.28Å; I491-S493 PolarHBondContact O-N 3.41Å; S493-V495 PolarHBondContact O-N 3.21Å; S493-N496 WeakPolarHBondContact O-CB 3.43Å; S493-N496 PolarHBondContact O-N 3.12Å
494	F	96.1	Very high	91.4	Very high	16 Å²	16	51.3 Å²	51.3	7%	0.07	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	0.3	175.9	-61	-53.3	0	0	0	114.2	L448 M452 V458 L462 L490 I491 C492 V503 V507 A511	L448-F494 HydrophobicContact CD2-CE2 4.31Å; M452-F494 HydrophobicContact CB-CZ 4.43Å; V458-F494 HydrophobicContact CG1-CD1 4.17Å; V458-F494 HydrophobicContact CG1-CD2 4.24Å; V458-F494 HydrophobicContact CG1-CE1 3.78Å; V458-F494 HydrophobicContact CG1-CE2 3.85Å; V458-F494 HydrophobicContact CG1-CG 4.4Å; V458-F494 HydrophobicContact CG1-CZ 3.61Å; V458-F494 HydrophobicContact CG2-CE1 4.42Å; V458-F494 HydrophobicContact CG2-CZ 4.03Å; L462-F494 HydrophobicContact CD1-CD2 4.06Å; L462-F494 HydrophobicContact CD1-CG 4.42Å; L462-F494 HydrophobicContact CD2-CD2 4.33Å; L490-F494 HydrophobicContact CD1-CE2 4.25Å; L490-F494 HydrophobicContact CD1-CZ 4.14Å; L490-F494 HydrophobicContact CG-CE2 4.09Å; L490-F494 HydrophobicContact CG-CZ 4.42Å; L490-F494 WeakPolarHBondContact O-CD2 3.35Å; I491-F494 WeakPolarHBondContact O-CB 3.45Å; I491-F494 PolarHBondContact O-N 3.46Å; I491-F494 VanDerWaalsContact O-N 3.14Å; C492-F494 PolarHBondContact O-N 3.1Å; F494-V503 WeakPolarHBondContact O-CG1 3.4Å; F494-V507 HydrophobicContact CB-CG1 3.96Å; F494-V507 HydrophobicContact CD1-CG1 3.88Å; F494-V507 HydrophobicContact CG-CG1 4Å; F494-A511 HydrophobicContact CB-CB 3.82Å
495	V	96	Very high	91.8	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121	11.2	170.1	-168.8	0	0	0	0	110.4	C492 S493 L497 A511 L512 I515 I533 N536 V537 Y540	C492-V495 PolarHBondContact O-N 3.04Å; S493-V495 PolarHBondContact O-N 3.21Å; V495-L497 PolarHBondContact O-N 3Å; V495-A511 HydrophobicContact CG2-CB 3.54Å; V495-L512 HydrophobicContact CG1-CD2 3.69Å; V495-L512 HydrophobicContact CG1-CG 4.18Å; V495-L512 HydrophobicContact CG2-CD2 4.36Å; V495-L512 HydrophobicContact CG2-CG 4.28Å; V495-I515 HydrophobicContact CB-CD1 4.28Å; V495-I515 HydrophobicContact CG2-CD1 3.51Å; V495-I533 HydrophobicContact CB-CD1 4.05Å; V495-I533 HydrophobicContact CG1-CD1 4.39Å; V495-N536 WeakPolarHBondContact O-CB 3.46Å; V495-V537 HydrophobicContact CG1-CG2 4.17Å; V495-Y540 HydrophobicContact CG1-CD2 3.82Å; V495-Y540 HydrophobicContact CG1-CE2 3.99Å; V495-Y540 WeakPolarHBondContact O-CE2 3.4Å
496	N	94.2	Very high	92.4	Very high	54 Å²	54	48.7 Å²	48.7	29%	0.289	25%	0.253	S	S	.	.			trans	-78.9	105.8	173.8	-178	0.7	0	0	0	110.3	C492 S493 H498 A499	C492-N496 PolarHBondContact O-N 3.26Å; S493-N496 WeakPolarHBondContact O-CB 3.43Å; S493-N496 PolarHBondContact O-N 3.12Å; N496-H498 PolarHBondContact O-N 2.88Å; N496-H498 VanDerWaalsContact O-N 3.15Å; N496-H498 PolarHBondContact OD1-N 3.2Å; N496-A499 HydrophobicContact CB-CB 4.2Å; N496-A499 VanDerWaalsContact O-CB 3.22Å; N496-A499 WeakPolarHBondContact O-CB 3.34Å; N496-A499 PolarHBondContact O-N 3.34Å
497	L	87.8	Confident	92.9	Very high	33 Å²	33	44.4 Å²	44.4	17%	0.173	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-21.7	-179.4	-167.9	67.7	0	0	0	113.1	V495 M539 Y540	V495-L497 PolarHBondContact O-N 3Å; L497-M539 HydrophobicContact CD2-CB 3.74Å; L497-Y540 HydrophobicContact CB-CD2 4.3Å; L497-Y540 HydrophobicContact CB-CE2 3.87Å; L497-Y540 HydrophobicContact CD1-CD1 4.4Å; L497-Y540 HydrophobicContact CD1-CD2 4.22Å; L497-Y540 HydrophobicContact CD1-CE1 4.03Å; L497-Y540 HydrophobicContact CD1-CE2 3.79Å; L497-Y540 HydrophobicContact CG-CE2 4.44Å
498	H	88.4	Confident	93.1	Very high	134 Å²	134	44.3 Å²	44.3	62%	0.62	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.9	7.5	178.2	-59.2	-63.7	0	0	0	113.3	N496	N496-H498 PolarHBondContact O-N 2.88Å; N496-H498 VanDerWaalsContact O-N 3.15Å; N496-H498 PolarHBondContact OD1-N 3.2Å
499	A	88.7	Confident	93.2	Very high	24 Å²	24	46.3 Å²	46.3	20%	0.198	25%	0.245	C	C	.	.			trans	-61.9	145.7	175.3	0	0	0	0	0	111.5	N496 P501 V502 V503	N496-A499 HydrophobicContact CB-CB 4.2Å; N496-A499 VanDerWaalsContact O-CB 3.22Å; N496-A499 WeakPolarHBondContact O-CB 3.34Å; N496-A499 PolarHBondContact O-N 3.34Å; A499-P501 CarbonylContact C-O 3.57Å; A499-P501 CarbonylContact O-C 3.39Å; A499-V502 PolarHBondContact O-N 2.99Å; A499-V503 HydrophobicContact CB-CG2 3.99Å
500	H	85.1	Confident	93.4	Very high	182 Å²	182	44 Å²	44	84%	0.843	23%	0.229	S	C	*	.	S	Bend	trans	-124.4	119.5	172.3	-125	-69.4	0	0	0	108.9
501	P	88.4	Confident	93.5	Very high	94 Å²	94	42.7 Å²	42.7	61%	0.61	22%	0.223	S	C	*	.	S	Bend	cis	-65.3	160.6	-2.4	31	-36.4	0	0	0	113.2	A499 V503	A499-P501 CarbonylContact C-O 3.57Å; A499-P501 CarbonylContact O-C 3.39Å; P501-V503 PolarHBondContact O-N 2.84Å
502	V	89.4	Confident	93.6	Very high	90 Å²	90	42.7 Å²	42.7	55%	0.545	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-60.8	133.3	177.7	178.1	0	0	0	0	109.8	A499 R504	A499-V502 PolarHBondContact O-N 2.99Å; V502-R504 PolarHBondContact O-N 3.45Å
503	V	93.2	Very high	93.7	Very high	17 Å²	17	42.7 Å²	42.7	10%	0.103	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-69.3	129.4	178.2	-171.5	0	0	0	0	110.4	F494 A499 P501 V507 A508	F494-V503 WeakPolarHBondContact O-CG1 3.4Å; A499-V503 HydrophobicContact CB-CG2 3.99Å; P501-V503 PolarHBondContact O-N 2.84Å; V503-V507 HydrophobicContact CG1-CB 3.99Å; V503-V507 HydrophobicContact CG1-CG1 3.72Å; V503-A508 HydrophobicContact CG1-CB 4.34Å
504	R	93.9	Very high	93.9	Very high	116 Å²	116	40.5 Å²	40.5	44%	0.438	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-65.1	144.4	175.9	-62.1	-168.1	179.8	-171.7	-1.1	111.1	F455 V502 V507 A508	F455-R504 HydrophobicContact CD1-CG 4.34Å; F455-R504 HydrophobicContact CE1-CG 4.39Å; V502-R504 PolarHBondContact O-N 3.45Å; R504-V507 PolarHBondContact O-N 3.17Å; R504-A508 PolarHBondContact O-N 2.96Å
505	L	95	Very high	93.9	Very high	27 Å²	27	39.8 Å²	39.8	14%	0.141	20%	0.204	C	C	.	.	H	α-helix	trans	-60.3	-38	-176.3	-68.5	-169	0	0	0	114.9	V507 A508 K509 Y540 I561 V564 I569	L505-V507 VanDerWaalsContact C-N 3.34Å; L505-V507 PolarHBondContact O-N 3.32Å; L505-A508 PolarHBondContact O-N 3.12Å; L505-K509 WeakPolarHBondContact O-CB 3.4Å; L505-K509 PolarHBondContact O-N 3.12Å; L505-Y540 HydrophobicContact CD2-CE1 4.24Å; L505-I561 HydrophobicContact CD1-CB 3.82Å; L505-I561 HydrophobicContact CD1-CD1 4.22Å; L505-I561 HydrophobicContact CD1-CG2 4.29Å; L505-V564 HydrophobicContact CB-CB 4.09Å; L505-V564 HydrophobicContact CB-CG1 4.32Å; L505-V564 HydrophobicContact CB-CG2 4.48Å; L505-I569 HydrophobicContact CB-CD1 4.44Å; L505-I569 HydrophobicContact CD1-CG1 4.31Å; L505-I569 HydrophobicContact CD2-CD1 4.42Å; L505-I569 HydrophobicContact CD2-CG1 4.42Å
506	P	95.7	Very high	94	Very high	15 Å²	15	41.4 Å²	41.4	10%	0.097	21%	0.211	C	C	.	.	H	α-helix	trans	-57.7	-45.4	174.5	-25.2	32.8	0	0	0	112.8	E459 K509 A510 D562 V564	E459-P506 VanDerWaalsContact CD-CB 3.4Å; E459-P506 HydrophobicContact CG-CB 4.28Å; E459-P506 WeakPolarHBondContact OE1-CB 3.34Å; E459-P506 VanDerWaalsContact OE2-CB 3.24Å; E459-P506 WeakPolarHBondContact OE2-CB 3.33Å; P506-K509 PolarHBondContact O-N 3.21Å; P506-A510 WeakPolarHBondContact O-CB 3.46Å; P506-A510 PolarHBondContact O-N 3.06Å; P506-D562 HydrophobicContact CG-CB 3.92Å; P506-D562 WeakPolarHBondContact CG-O 3.22Å; P506-V564 HydrophobicContact CB-CG2 4.22Å; P506-V564 HydrophobicContact CG-CG2 3.79Å
507	V	96.9	Very high	94.1	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.018	20%	0.197	C	C	.	.	H	α-helix	trans	-63.2	-46	175.9	172.6	0	0	0	0	111	V458 E459 L462 F494 V503 R504 L505 K509 A510 A511	V458-V507 HydrophobicContact CG1-CG1 3.75Å; V458-V507 HydrophobicContact CG1-CG2 4.3Å; E459-V507 HydrophobicContact CB-CG2 4.1Å; L462-V507 HydrophobicContact CD1-CG1 3.96Å; F494-V507 HydrophobicContact CB-CG1 3.96Å; F494-V507 HydrophobicContact CD1-CG1 3.88Å; F494-V507 HydrophobicContact CG-CG1 4Å; V503-V507 HydrophobicContact CG1-CB 3.99Å; V503-V507 HydrophobicContact CG1-CG1 3.72Å; R504-V507 PolarHBondContact O-N 3.17Å; L505-V507 VanDerWaalsContact C-N 3.34Å; L505-V507 PolarHBondContact O-N 3.32Å; V507-K509 PolarHBondContact O-N 3.34Å; V507-A510 PolarHBondContact O-N 3.27Å; V507-A511 WeakPolarHBondContact O-CB 3.39Å; V507-A511 PolarHBondContact O-N 3.1Å
508	A	96.7	Very high	94.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-62.5	-42.9	177.8	0	0	0	0	0	112	V503 R504 L505 A510 A511 L512 Y540	V503-A508 HydrophobicContact CG1-CB 4.34Å; R504-A508 PolarHBondContact O-N 2.96Å; L505-A508 PolarHBondContact O-N 3.12Å; A508-A510 PolarHBondContact O-N 2.71Å; A508-A511 PolarHBondContact O-N 3.47Å; A508-L512 WeakPolarHBondContact O-CB 3.45Å; A508-L512 WeakPolarHBondContact O-CG 3.48Å; A508-L512 PolarHBondContact O-N 3.49Å; A508-Y540 HydrophobicContact CB-CE1 3.76Å
509	K	96.8	Very high	94.8	Very high	43 Å²	43	31 Å²	31	19%	0.187	16%	0.16	C	C	.	.	H	α-helix	trans	-61.2	-43.3	175.5	-174.6	178	177.2	-177	0	111.2	L505 P506 V507 G513 V564 D568 I569 C572	L505-K509 WeakPolarHBondContact O-CB 3.4Å; L505-K509 PolarHBondContact O-N 3.12Å; P506-K509 PolarHBondContact O-N 3.21Å; V507-K509 PolarHBondContact O-N 3.34Å; K509-G513 PolarHBondContact O-N 2.87Å; K509-G513 VanDerWaalsContact O-N 3.15Å; K509-V564 HydrophobicContact CD-CG1 3.88Å; K509-V564 HydrophobicContact CD-CG2 4.43Å; K509-D568 HydrophobicContact CD-CB 4.28Å; K509-D568 IonicContact NZ-OD2 3.64Å; K509-D568 PolarHBondContact NZ-OD2 3.29Å; K509-I569 HydrophobicContact CB-CD1 3.88Å; K509-I569 HydrophobicContact CG-CD1 4.42Å; K509-C572 HydrophobicContact CG-CB 4.45Å
510	A	97.3	Very high	94.9	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-63.9	-45.7	176.4	0	0	0	0	0	112	L462 P506 V507 A508 G513 L514	L462-A510 HydrophobicContact CB-CB 3.71Å; L462-A510 HydrophobicContact CD1-CB 4.27Å; P506-A510 WeakPolarHBondContact O-CB 3.46Å; P506-A510 PolarHBondContact O-N 3.06Å; V507-A510 PolarHBondContact O-N 3.27Å; A508-A510 PolarHBondContact O-N 2.71Å; A510-G513 PolarHBondContact O-N 2.77Å; A510-L514 PolarHBondContact O-N 3.41Å; A510-L514 VanDerWaalsContact O-N 3.09Å
511	A	97.9	Very high	95.1	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-63.9	-44	177.6	0	0	0	0	0	112.5	L462 F494 V495 V507 A508 G513 L514 I515	L462-A511 HydrophobicContact CD1-CB 4.03Å; F494-A511 HydrophobicContact CB-CB 3.82Å; V495-A511 HydrophobicContact CG2-CB 3.54Å; V507-A511 WeakPolarHBondContact O-CB 3.39Å; V507-A511 PolarHBondContact O-N 3.1Å; A508-A511 PolarHBondContact O-N 3.47Å; A511-G513 PolarHBondContact O-N 3.18Å; A511-L514 PolarHBondContact O-N 3.39Å; A511-I515 WeakPolarHBondContact O-CD1 3.47Å; A511-I515 WeakPolarHBondContact O-CG1 3.26Å; A511-I515 PolarHBondContact O-N 2.79Å
512	L	98.3	Very high	95	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-56	-48.8	174.9	-77.5	169.8	0	0	0	111.3	V495 A508 L514 I515 R516 V537 C572 T576	V495-L512 HydrophobicContact CG1-CD2 3.69Å; V495-L512 HydrophobicContact CG1-CG 4.18Å; V495-L512 HydrophobicContact CG2-CD2 4.36Å; V495-L512 HydrophobicContact CG2-CG 4.28Å; A508-L512 WeakPolarHBondContact O-CB 3.45Å; A508-L512 WeakPolarHBondContact O-CG 3.48Å; A508-L512 PolarHBondContact O-N 3.49Å; L512-L514 VanDerWaalsContact C-N 3.31Å; L512-L514 PolarHBondContact O-N 3.02Å; L512-I515 PolarHBondContact O-N 2.89Å; L512-R516 WeakPolarHBondContact O-CB 3.43Å; L512-R516 PolarHBondContact O-N 3.42Å; L512-V537 HydrophobicContact CD2-CB 4.32Å; L512-V537 HydrophobicContact CD2-CG1 3.89Å; L512-V537 HydrophobicContact CD2-CG2 3.71Å; L512-C572 VanDerWaalsContact CB-SG 3.51Å; L512-T576 HydrophobicContact CD2-CG2 4.19Å; L512-T576 PolarHBondContact O-OG1 3.14Å
513	G	97.3	Very high	94.8	Very high	3 Å²	3	22.8 Å²	22.8	3%	0.031	13%	0.13	C	C	.	.	H	α-helix	trans	-61.1	-38.1	177.4	0	0	0	0	0	113.2	K509 A510 A511 N517	K509-G513 PolarHBondContact O-N 2.87Å; K509-G513 VanDerWaalsContact O-N 3.15Å; A510-G513 PolarHBondContact O-N 2.77Å; A511-G513 PolarHBondContact O-N 3.18Å; G513-N517 PolarHBondContact O-N 3.27Å; G513-N517 PolarHBondContact O-OD1 2.85Å
514	L	98	Very high	94.8	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-67.4	-46	174.2	177.2	56	0	0	0	111.7	L462 L465 R466 T469 I491 A510 A511 L512 R516 N517 L518	L462-L514 HydrophobicContact CD2-CD2 3.79Å; L465-L514 HydrophobicContact CB-CD1 3.95Å; L465-L514 HydrophobicContact CB-CD2 3.76Å; L465-L514 HydrophobicContact CD1-CD2 4.11Å; R466-L514 HydrophobicContact CB-CB 4.23Å; T469-L514 HydrophobicContact CG2-CD1 4.12Å; I491-L514 HydrophobicContact CD1-CD2 3.76Å; I491-L514 HydrophobicContact CG1-CD2 4.19Å; I491-L514 HydrophobicContact CG2-CD2 4.06Å; I491-L514 HydrophobicContact CG2-CG 4.47Å; A510-L514 PolarHBondContact O-N 3.41Å; A510-L514 VanDerWaalsContact O-N 3.09Å; A511-L514 PolarHBondContact O-N 3.39Å; L512-L514 VanDerWaalsContact C-N 3.31Å; L512-L514 PolarHBondContact O-N 3.02Å; L514-R516 VanDerWaalsContact C-N 3.31Å; L514-R516 PolarHBondContact O-N 3.23Å; L514-N517 PolarHBondContact O-N 2.88Å; L514-N517 VanDerWaalsContact O-N 3.11Å; L514-L518 HydrophobicContact CD1-CD1 3.93Å; L514-L518 HydrophobicContact CD1-CD2 4.4Å; L514-L518 HydrophobicContact CD1-CG 3.89Å; L514-L518 HydrophobicContact CG-CD1 3.87Å; L514-L518 HydrophobicContact CG-CG 4.26Å; L514-L518 WeakPolarHBondContact O-CG 3.29Å; L514-L518 PolarHBondContact O-N 3.01Å
515	I	97.9	Very high	94.7	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-58.9	-43.6	178	-72.7	157	0	0	0	110.9	I491 V495 A511 L512 N517 L518 A519 F528 I533 T576	I491-I515 HydrophobicContact CG2-CD1 4.35Å; I491-I515 HydrophobicContact CG2-CG1 4.01Å; V495-I515 HydrophobicContact CB-CD1 4.28Å; V495-I515 HydrophobicContact CG2-CD1 3.51Å; A511-I515 WeakPolarHBondContact O-CD1 3.47Å; A511-I515 WeakPolarHBondContact O-CG1 3.26Å; A511-I515 PolarHBondContact O-N 2.79Å; L512-I515 PolarHBondContact O-N 2.89Å; I515-N517 VanDerWaalsContact C-N 3.29Å; I515-N517 PolarHBondContact O-N 2.89Å; I515-L518 PolarHBondContact O-N 3.32Å; I515-A519 WeakPolarHBondContact O-CB 3.37Å; I515-A519 PolarHBondContact O-N 3.43Å; I515-F528 HydrophobicContact CB-CZ 4.31Å; I515-F528 HydrophobicContact CG1-CE1 4.35Å; I515-F528 HydrophobicContact CG1-CZ 4.3Å; I515-F528 HydrophobicContact CG2-CE1 4.36Å; I515-F528 HydrophobicContact CG2-CE2 3.98Å; I515-F528 HydrophobicContact CG2-CZ 3.87Å; I515-I533 HydrophobicContact CD1-CD1 3.77Å; I515-I533 HydrophobicContact CD1-CG1 4Å; I515-I533 HydrophobicContact CG2-CG1 4.04Å; I515-T576 HydrophobicContact CB-CG2 4.3Å; I515-T576 HydrophobicContact CG2-CG2 3.79Å
516	R	97.2	Very high	94.4	Very high	35 Å²	35	20.6 Å²	20.6	13%	0.132	13%	0.127	C	C	.	.	H	α-helix	trans	-53.3	-46.9	174.4	-178.5	-164.2	68	174.7	5.4	111.5	L512 L514 T576 A579 S708	L512-R516 WeakPolarHBondContact O-CB 3.43Å; L512-R516 PolarHBondContact O-N 3.42Å; L514-R516 VanDerWaalsContact C-N 3.31Å; L514-R516 PolarHBondContact O-N 3.23Å; R516-T576 HydrophobicContact CB-CG2 4.35Å; R516-A579 HydrophobicContact CG-CB 3.83Å; R516-S708 PolarHBondContact NH1-OG 2.74Å; R516-S708 PolarHBondContact NH2-OG 3.21Å
517	N	96.1	Very high	94.1	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-67.8	-43	179.6	-65.5	-1.4	0	0	0	111.6	R466 T469 G513 L514 I515 A519 N520	R466-N517 PolarHBondContact O-ND2 2.93Å; T469-N517 WeakPolarHBondContact OG1-CB 3.39Å; T469-N517 PolarHBondContact OG1-ND2 3.36Å; G513-N517 PolarHBondContact O-N 3.27Å; G513-N517 PolarHBondContact O-OD1 2.85Å; L514-N517 PolarHBondContact O-N 2.88Å; L514-N517 VanDerWaalsContact O-N 3.11Å; I515-N517 VanDerWaalsContact C-N 3.29Å; I515-N517 PolarHBondContact O-N 2.89Å; N517-A519 VanDerWaalsContact C-N 3.29Å; N517-A519 PolarHBondContact O-N 3.33Å; N517-N520 PolarHBondContact O-N 3.3Å; N517-N520 PolarHBondContact O-ND2 3.41Å
518	L	96.6	Very high	94	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-68.7	-24.5	179.9	-69	179.9	0	0	0	113.3	T469 Q479 F484 I488 I491 L514 I515 N520 S521 N524 F528	T469-L518 HydrophobicContact CG2-CD2 3.86Å; Q479-L518 HydrophobicContact CB-CD2 4.25Å; Q479-L518 HydrophobicContact CG-CD2 4.33Å; F484-L518 HydrophobicContact CD1-CD1 4.03Å; F484-L518 HydrophobicContact CD1-CD2 4.48Å; F484-L518 HydrophobicContact CD2-CD2 4.21Å; F484-L518 HydrophobicContact CE1-CD1 3.75Å; F484-L518 HydrophobicContact CE1-CD2 4.17Å; F484-L518 HydrophobicContact CE2-CD2 3.89Å; F484-L518 HydrophobicContact CZ-CD1 4.23Å; F484-L518 HydrophobicContact CZ-CD2 3.86Å; I488-L518 HydrophobicContact CG1-CD1 4.32Å; I491-L518 HydrophobicContact CD1-CD1 4.42Å; L514-L518 HydrophobicContact CD1-CD1 3.93Å; L514-L518 HydrophobicContact CD1-CD2 4.4Å; L514-L518 HydrophobicContact CD1-CG 3.89Å; L514-L518 HydrophobicContact CG-CD1 3.87Å; L514-L518 HydrophobicContact CG-CG 4.26Å; L514-L518 WeakPolarHBondContact O-CG 3.29Å; L514-L518 PolarHBondContact O-N 3.01Å; I515-L518 PolarHBondContact O-N 3.32Å; L518-N520 PolarHBondContact O-N 2.88Å; L518-S521 PolarHBondContact O-N 3.44Å; L518-S521 VanDerWaalsContact O-N 3.14Å; L518-N524 WeakPolarHBondContact O-CB 3.47Å; L518-N524 PolarHBondContact O-ND2 3.06Å; L518-F528 HydrophobicContact CB-CE2 4.22Å; L518-F528 HydrophobicContact CB-CZ 3.73Å; L518-F528 HydrophobicContact CD1-CZ 4.46Å
519	A	95.4	Very high	93.8	Very high	2 Å²	2	25.8 Å²	25.8	2%	0.017	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-12.8	177.5	0	0	0	0	0	113.5	I515 N517 S521 L525 F528 A579 L580	I515-A519 WeakPolarHBondContact O-CB 3.37Å; I515-A519 PolarHBondContact O-N 3.43Å; N517-A519 VanDerWaalsContact C-N 3.29Å; N517-A519 PolarHBondContact O-N 3.33Å; A519-S521 PolarHBondContact O-N 3.32Å; A519-L525 HydrophobicContact CB-CD2 4.26Å; A519-F528 HydrophobicContact CB-CD2 4.5Å; A519-F528 HydrophobicContact CB-CE2 4.01Å; A519-A579 HydrophobicContact CB-CB 3.99Å; A519-L580 HydrophobicContact CB-CD2 3.98Å
520	N	90.3	Very high	93.6	Very high	72 Å²	72	31.3 Å²	31.3	39%	0.385	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-18.1	172.3	-67.3	-46.9	0	0	0	113.1	N517 L518 K582	N517-N520 PolarHBondContact O-N 3.3Å; N517-N520 PolarHBondContact O-ND2 3.41Å; L518-N520 PolarHBondContact O-N 2.88Å; N520-K582 PolarHBondContact OD1-NZ 2.96Å
521	S	89.1	Confident	93.4	Very high	11 Å²	11	34 Å²	34	8%	0.077	19%	0.188	C	C	.	.	S	Bend	trans	-90.5	122.2	171.9	171.6	0	0	0	0	111	N480 L518 A519 A523 N524 L525	N480-S521 WeakPolarHBondContact OD1-CB 3.46Å; N480-S521 PolarHBondContact OD1-OG 3.38Å; L518-S521 PolarHBondContact O-N 3.44Å; L518-S521 VanDerWaalsContact O-N 3.14Å; A519-S521 PolarHBondContact O-N 3.32Å; S521-A523 PolarHBondContact O-N 2.93Å; S521-A523 PolarHBondContact OG-N 3.36Å; S521-N524 PolarHBondContact O-N 2.74Å; S521-N524 VanDerWaalsContact O-N 3.1Å; S521-L525 PolarHBondContact O-N 3.1Å
522	A	85.4	Confident	93.2	Very high	74 Å²	74	35.3 Å²	35.3	61%	0.612	20%	0.202	S	C	*	.	H	α-helix	trans	-59.1	-29.6	176.2	0	0	0	0	0	113.1	N524 L525	A522-N524 VanDerWaalsContact C-N 3.31Å; A522-N524 PolarHBondContact O-N 3.45Å; A522-L525 PolarHBondContact O-N 3.43Å
523	A	86.4	Confident	93.1	Very high	60 Å²	60	35.4 Å²	35.4	50%	0.496	20%	0.203	S	C	.	.	H	α-helix	trans	-64.3	-37.3	177.7	0	0	0	0	0	111.9	S521	S521-A523 PolarHBondContact O-N 2.93Å; S521-A523 PolarHBondContact OG-N 3.36Å
524	N	92.4	Very high	93.1	Very high	12 Å²	12	35.4 Å²	35.4	6%	0.064	20%	0.202	C	C	.	.	H	α-helix	trans	-75.2	-28.6	-177.4	-64.7	-20.2	0	0	0	112.5	Q479 I488 L518 S521 A522 N526 T527 F528	Q479-N524 PolarHBondContact O-ND2 3.32Å; I488-N524 HydrophobicContact CD1-CB 3.9Å; I488-N524 VanDerWaalsContact CD1-CG 3.5Å; I488-N524 VanDerWaalsContact CD1-OD1 3.22Å; I488-N524 WeakPolarHBondContact CD1-OD1 3.49Å; L518-N524 WeakPolarHBondContact O-CB 3.47Å; L518-N524 PolarHBondContact O-ND2 3.06Å; S521-N524 PolarHBondContact O-N 2.74Å; S521-N524 VanDerWaalsContact O-N 3.1Å; A522-N524 VanDerWaalsContact C-N 3.31Å; A522-N524 PolarHBondContact O-N 3.45Å; N524-N526 PolarHBondContact O-N 3.03Å; N524-T527 PolarHBondContact O-N 2.65Å; N524-F528 HydrophobicContact CB-CE2 4.32Å; N524-F528 HydrophobicContact CB-CZ 4.48Å; N524-F528 WeakPolarHBondContact O-CB 3.43Å; N524-F528 WeakPolarHBondContact O-CG 3.4Å; N524-F528 PolarHBondContact O-N 3.45Å
525	L	91	Very high	93	Very high	22 Å²	22	38 Å²	38	12%	0.115	22%	0.217	C	C	.	.	H	α-helix	trans	-58.6	-35.3	180	-66	174.7	0	0	0	112.4	A519 S521 A522 F528 R529 L580 D583	A519-L525 HydrophobicContact CB-CD2 4.26Å; S521-L525 PolarHBondContact O-N 3.1Å; A522-L525 PolarHBondContact O-N 3.43Å; L525-F528 HydrophobicContact CD2-CD2 4.37Å; L525-F528 WeakPolarHBondContact O-CB 3.12Å; L525-F528 PolarHBondContact O-N 3.35Å; L525-R529 WeakPolarHBondContact O-CG 3.45Å; L525-R529 PolarHBondContact O-N 2.74Å; L525-L580 HydrophobicContact CD2-CD2 4.45Å; L525-D583 HydrophobicContact CD1-CB 4.18Å; L525-D583 HydrophobicContact CD2-CB 4.37Å
526	N	89	Confident	93	Very high	79 Å²	79	38.9 Å²	38.9	42%	0.422	22%	0.221	S	C	.	.	H	α-helix	trans	-61.3	-51.2	176.8	-65.3	-14	0	0	0	111.3	N524 F528 R529 E530	N524-N526 PolarHBondContact O-N 3.03Å; N526-F528 VanDerWaalsContact C-N 3.3Å; N526-F528 PolarHBondContact O-N 3.12Å; N526-R529 PolarHBondContact O-N 2.88Å; N526-R529 VanDerWaalsContact O-N 3.17Å; N526-R529 PolarHBondContact OD1-NH2 3.4Å; N526-E530 PolarHBondContact O-N 2.99Å; N526-E530 VanDerWaalsContact O-N 3.15Å
527	T	91	Very high	93	Very high	33 Å²	33	37.2 Å²	37.2	20%	0.202	22%	0.215	C	C	.	.	H	α-helix	trans	-64.7	-36	179.2	-48.5	0	0	0	0	111.7	I488 P489 N524 R529 E530 N531	I488-T527 HydrophobicContact CB-CG2 4.12Å; I488-T527 HydrophobicContact CG2-CG2 3.53Å; P489-T527 HydrophobicContact CG-CG2 4.21Å; N524-T527 PolarHBondContact O-N 2.65Å; T527-R529 VanDerWaalsContact C-N 3.35Å; T527-R529 PolarHBondContact O-N 3.44Å; T527-E530 PolarHBondContact O-N 2.93Å; T527-N531 PolarHBondContact O-N 2.84Å; T527-N531 PolarHBondContact O-ND2 3.34Å
528	F	94.9	Very high	93.1	Very high	3 Å²	3	37.1 Å²	37.1	1%	0.013	21%	0.214	C	C	.	.	H	α-helix	trans	-61.3	-38.9	173.3	-79.2	-8.6	0	0	0	113.5	I488 I515 L518 A519 N524 L525 N526 N531 G532 I533 L580	I488-F528 HydrophobicContact CG2-CD1 3.72Å; I488-F528 HydrophobicContact CG2-CE1 3.58Å; I515-F528 HydrophobicContact CB-CZ 4.31Å; I515-F528 HydrophobicContact CG1-CE1 4.35Å; I515-F528 HydrophobicContact CG1-CZ 4.3Å; I515-F528 HydrophobicContact CG2-CE1 4.36Å; I515-F528 HydrophobicContact CG2-CE2 3.98Å; I515-F528 HydrophobicContact CG2-CZ 3.87Å; L518-F528 HydrophobicContact CB-CE2 4.22Å; L518-F528 HydrophobicContact CB-CZ 3.73Å; L518-F528 HydrophobicContact CD1-CZ 4.46Å; A519-F528 HydrophobicContact CB-CD2 4.5Å; A519-F528 HydrophobicContact CB-CE2 4.01Å; N524-F528 HydrophobicContact CB-CE2 4.32Å; N524-F528 HydrophobicContact CB-CZ 4.48Å; N524-F528 WeakPolarHBondContact O-CB 3.43Å; N524-F528 WeakPolarHBondContact O-CG 3.4Å; N524-F528 PolarHBondContact O-N 3.45Å; L525-F528 HydrophobicContact CD2-CD2 4.37Å; L525-F528 WeakPolarHBondContact O-CB 3.12Å; L525-F528 PolarHBondContact O-N 3.35Å; N526-F528 VanDerWaalsContact C-N 3.3Å; N526-F528 PolarHBondContact O-N 3.12Å; F528-N531 PolarHBondContact O-N 3.18Å; F528-G532 PolarHBondContact O-N 3.36Å; F528-I533 HydrophobicContact CB-CB 4.34Å; F528-I533 HydrophobicContact CB-CG2 3.46Å; F528-I533 VanDerWaalsContact CB-CG2 3.46Å; F528-I533 HydrophobicContact CD1-CG2 4.32Å; F528-I533 HydrophobicContact CD2-CG2 4.33Å; F528-I533 HydrophobicContact CG-CG2 3.8Å; F528-I533 PolarHBondContact O-N 2.78Å; F528-L580 HydrophobicContact CD2-CD2 3.91Å; F528-L580 HydrophobicContact CE2-CD2 4.46Å
529	R	91.8	Very high	93.1	Very high	92 Å²	92	39.1 Å²	39.1	35%	0.347	22%	0.224	S	C	.	.	H	α-helix	trans	-66.2	-44.7	174	-69.4	-170.4	-52.6	-98.2	-3.2	111.6	L525 N526 T527 N531 G532 D583	L525-R529 WeakPolarHBondContact O-CG 3.45Å; L525-R529 PolarHBondContact O-N 2.74Å; N526-R529 PolarHBondContact O-N 2.88Å; N526-R529 VanDerWaalsContact O-N 3.17Å; N526-R529 PolarHBondContact OD1-NH2 3.4Å; T527-R529 VanDerWaalsContact C-N 3.35Å; T527-R529 PolarHBondContact O-N 3.44Å; R529-N531 PolarHBondContact O-N 2.89Å; R529-G532 PolarHBondContact O-N 3.33Å; R529-D583 IonicContact CZ-OD1 3.32Å; R529-D583 IonicContact NH1-OD1 2.89Å; R529-D583 PolarHBondContact NH1-OD1 2.98Å
530	E	91.4	Very high	93.2	Very high	159 Å²	159	39.5 Å²	39.5	74%	0.743	23%	0.225	S	C	*	.	H	α-helix	trans	-60.6	-32.5	177.9	-69	172.2	179.4	0	0	112.6	N526 T527	N526-E530 PolarHBondContact O-N 2.99Å; N526-E530 VanDerWaalsContact O-N 3.15Å; T527-E530 PolarHBondContact O-N 2.93Å
531	N	93.2	Very high	93.6	Very high	55 Å²	55	36 Å²	36	29%	0.294	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	7.4	177.8	-71.8	-89	0	0	0	113.7	C492 T527 F528 R529 I533	C492-N531 HydrophobicContact CB-CB 3.82Å; T527-N531 PolarHBondContact O-N 2.84Å; T527-N531 PolarHBondContact O-ND2 3.34Å; F528-N531 PolarHBondContact O-N 3.18Å; R529-N531 PolarHBondContact O-N 2.89Å; N531-I533 VanDerWaalsContact C-N 3.27Å; N531-I533 PolarHBondContact O-N 2.75Å
532	G	94.5	Very high	94	Very high	28 Å²	28	37.2 Å²	37.2	29%	0.289	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	29.4	176.3	0	0	0	0	0	114.3	F528 R529 A534 N535 N536	F528-G532 PolarHBondContact O-N 3.36Å; R529-G532 PolarHBondContact O-N 3.33Å; G532-A534 VanDerWaalsContact C-N 3.33Å; G532-A534 PolarHBondContact O-N 3.23Å; G532-N535 WeakPolarHBondContact O-CB 3.09Å; G532-N535 PolarHBondContact O-N 3.27Å; G532-N535 VanDerWaalsContact O-N 3.14Å; G532-N536 PolarHBondContact O-N 3.06Å
533	I	96.4	Very high	94.5	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-63.8	-38.1	-167.6	-157	53.1	0	0	0	112.7	C492 V495 I515 F528 N531 N535 N536 V537 L580	C492-I533 HydrophobicContact CB-CD1 4.19Å; V495-I533 HydrophobicContact CB-CD1 4.05Å; V495-I533 HydrophobicContact CG1-CD1 4.39Å; I515-I533 HydrophobicContact CD1-CD1 3.77Å; I515-I533 HydrophobicContact CD1-CG1 4Å; I515-I533 HydrophobicContact CG2-CG1 4.04Å; F528-I533 HydrophobicContact CB-CB 4.34Å; F528-I533 HydrophobicContact CB-CG2 3.46Å; F528-I533 VanDerWaalsContact CB-CG2 3.46Å; F528-I533 HydrophobicContact CD1-CG2 4.32Å; F528-I533 HydrophobicContact CD2-CG2 4.33Å; F528-I533 HydrophobicContact CG-CG2 3.8Å; F528-I533 PolarHBondContact O-N 2.78Å; N531-I533 VanDerWaalsContact C-N 3.27Å; N531-I533 PolarHBondContact O-N 2.75Å; I533-N535 VanDerWaalsContact C-N 3.28Å; I533-N535 PolarHBondContact O-N 3.29Å; I533-N536 HydrophobicContact CD1-CB 4.41Å; I533-N536 PolarHBondContact O-N 2.79Å; I533-V537 HydrophobicContact CD1-CG2 4.41Å; I533-V537 HydrophobicContact CG1-CG2 4.13Å; I533-V537 VanDerWaalsContact O-CG2 3.25Å; I533-V537 WeakPolarHBondContact O-CG2 3.25Å; I533-V537 PolarHBondContact O-N 2.9Å; I533-L580 HydrophobicContact CG2-CD1 4.02Å; I533-L580 HydrophobicContact CG2-CD2 3.96Å
534	A	96.7	Very high	94.9	Very high	3 Å²	3	37 Å²	37	3%	0.025	18%	0.183	C	C	.	.	H	α-helix	trans	-59.6	-40.4	178.5	0	0	0	0	0	111.6	G532 C538 I589	G532-A534 VanDerWaalsContact C-N 3.33Å; G532-A534 PolarHBondContact O-N 3.23Å; A534-C538 WeakPolarHBondContact O-CB 3.48Å; A534-C538 PolarHBondContact O-N 2.89Å; A534-C538 PolarHBondContact O-SG 2.91Å; A534-I589 HydrophobicContact CB-CB 4.25Å; A534-I589 HydrophobicContact CB-CD1 4.04Å; A534-I589 HydrophobicContact CB-CG2 4.01Å
535	N	96.8	Very high	95.2	Very high	56 Å²	56	36.7 Å²	36.7	30%	0.299	18%	0.181	S	C	.	.	H	α-helix	trans	-64.5	-48.6	176.5	-174.3	33.6	0	0	0	111.1	G532 I533 V537 C538 M539 I589 M593	G532-N535 WeakPolarHBondContact O-CB 3.09Å; G532-N535 PolarHBondContact O-N 3.27Å; G532-N535 VanDerWaalsContact O-N 3.14Å; I533-N535 VanDerWaalsContact C-N 3.28Å; I533-N535 PolarHBondContact O-N 3.29Å; N535-V537 PolarHBondContact O-N 3.28Å; N535-C538 WeakPolarHBondContact O-CB 3.18Å; N535-C538 PolarHBondContact O-N 3.27Å; N535-M539 WeakPolarHBondContact O-CG 3.44Å; N535-M539 PolarHBondContact O-N 2.77Å; N535-I589 HydrophobicContact CB-CG2 4.31Å; N535-M593 WeakPolarHBondContact OD1-CE 3.31Å; N535-M593 PolarHBondContact OD1-SD 3.3Å
536	N	97	Very high	95.5	Very high	17 Å²	17	40.2 Å²	40.2	9%	0.091	20%	0.197	C	C	.	.	H	α-helix	trans	-60.1	-45.7	179.3	-75.3	-14.7	0	0	0	112.4	V495 G532 I533 M539 Y540	V495-N536 WeakPolarHBondContact O-CB 3.46Å; G532-N536 PolarHBondContact O-N 3.06Å; I533-N536 HydrophobicContact CD1-CB 4.41Å; I533-N536 PolarHBondContact O-N 2.79Å; N536-M539 WeakPolarHBondContact O-CB 3.31Å; N536-M539 PolarHBondContact O-N 3.21Å; N536-Y540 WeakPolarHBondContact O-CD2 3.48Å; N536-Y540 PolarHBondContact O-N 2.97Å; N536-Y540 VanDerWaalsContact O-N 3.08Å
537	V	97.9	Very high	95.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-64.6	-41.7	177.1	-178.9	0	0	0	0	110.8	V495 L512 I533 N535 M539 Y540 F541 T576 L577 L580	V495-V537 HydrophobicContact CG1-CG2 4.17Å; L512-V537 HydrophobicContact CD2-CB 4.32Å; L512-V537 HydrophobicContact CD2-CG1 3.89Å; L512-V537 HydrophobicContact CD2-CG2 3.71Å; I533-V537 HydrophobicContact CD1-CG2 4.41Å; I533-V537 HydrophobicContact CG1-CG2 4.13Å; I533-V537 VanDerWaalsContact O-CG2 3.25Å; I533-V537 WeakPolarHBondContact O-CG2 3.25Å; I533-V537 PolarHBondContact O-N 2.9Å; N535-V537 PolarHBondContact O-N 3.28Å; V537-M539 VanDerWaalsContact C-N 3.3Å; V537-M539 PolarHBondContact O-N 3.42Å; V537-Y540 PolarHBondContact O-N 3.34Å; V537-F541 WeakPolarHBondContact O-CB 3.49Å; V537-F541 PolarHBondContact O-N 2.95Å; V537-T576 HydrophobicContact CG1-CG2 4.07Å; V537-T576 HydrophobicContact CG2-CG2 3.99Å; V537-L577 HydrophobicContact CB-CD2 4.04Å; V537-L577 HydrophobicContact CG1-CD1 4.4Å; V537-L577 HydrophobicContact CG1-CD2 3.7Å; V537-L577 HydrophobicContact CG1-CG 3.65Å; V537-L580 HydrophobicContact CG2-CD1 4.15Å
538	C	98.3	Very high	96	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-57.4	-41.7	172.9	-76.7	0	0	0	0	111.9	A534 N535 F541 I542 L577 M593 I595	A534-C538 WeakPolarHBondContact O-CB 3.48Å; A534-C538 PolarHBondContact O-N 2.89Å; A534-C538 PolarHBondContact O-SG 2.91Å; N535-C538 WeakPolarHBondContact O-CB 3.18Å; N535-C538 PolarHBondContact O-N 3.27Å; C538-F541 PolarHBondContact O-N 3.1Å; C538-I542 WeakPolarHBondContact O-CB 3.37Å; C538-I542 WeakPolarHBondContact O-CD1 3.2Å; C538-I542 WeakPolarHBondContact O-CG1 3.16Å; C538-I542 PolarHBondContact O-N 3.31Å; C538-L577 VanDerWaalsContact SG-CD2 3.59Å; C538-M593 HydrophobicContact CB-CB 3.93Å; C538-M593 HydrophobicContact CB-CE 3.84Å; C538-M593 HydrophobicContact CB-CG 3.92Å; C538-I595 HydrophobicContact CB-CG2 4.13Å
539	M	97.3	Very high	96.1	Very high	42 Å²	42	39.1 Å²	39.1	21%	0.207	19%	0.187	C	C	.	.	H	α-helix	trans	-64.1	-43.3	177.7	-68.7	177.9	175.5	0	0	112.4	L497 N535 N536 V537 R543 M593	L497-M539 HydrophobicContact CD2-CB 3.74Å; N535-M539 WeakPolarHBondContact O-CG 3.44Å; N535-M539 PolarHBondContact O-N 2.77Å; N536-M539 WeakPolarHBondContact O-CB 3.31Å; N536-M539 PolarHBondContact O-N 3.21Å; V537-M539 VanDerWaalsContact C-N 3.3Å; V537-M539 PolarHBondContact O-N 3.42Å; M539-R543 VanDerWaalsContact O-CB 3.27Å; M539-R543 WeakPolarHBondContact O-CB 3.44Å; M539-R543 PolarHBondContact O-N 2.64Å; M539-M593 HydrophobicContact CE-CE 4.45Å; M539-M593 HydrophobicContact CG-CE 3.76Å
540	Y	96.3	Very high	96.3	Very high	9 Å²	9	40.7 Å²	40.7	4%	0.035	20%	0.198	C	C	.	.	H	α-helix	trans	-60.9	-45.3	173.6	-91	-87.2	0	0	0	111.6	V495 L497 L505 A508 N536 V537 R543 A544 I569	V495-Y540 HydrophobicContact CG1-CD2 3.82Å; V495-Y540 HydrophobicContact CG1-CE2 3.99Å; V495-Y540 WeakPolarHBondContact O-CE2 3.4Å; L497-Y540 HydrophobicContact CB-CD2 4.3Å; L497-Y540 HydrophobicContact CB-CE2 3.87Å; L497-Y540 HydrophobicContact CD1-CD1 4.4Å; L497-Y540 HydrophobicContact CD1-CD2 4.22Å; L497-Y540 HydrophobicContact CD1-CE1 4.03Å; L497-Y540 HydrophobicContact CD1-CE2 3.79Å; L497-Y540 HydrophobicContact CG-CE2 4.44Å; L505-Y540 HydrophobicContact CD2-CE1 4.24Å; A508-Y540 HydrophobicContact CB-CE1 3.76Å; N536-Y540 WeakPolarHBondContact O-CD2 3.48Å; N536-Y540 PolarHBondContact O-N 2.97Å; N536-Y540 VanDerWaalsContact O-N 3.08Å; V537-Y540 PolarHBondContact O-N 3.34Å; Y540-R543 PolarHBondContact O-N 2.98Å; Y540-A544 WeakPolarHBondContact O-CB 3.47Å; Y540-A544 PolarHBondContact O-N 3.12Å; Y540-I569 HydrophobicContact CD1-CG2 4.22Å
541	F	98.1	Very high	96.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-59.1	-51	178.2	179.8	-118.2	0	0	0	112.2	V537 C538 F545 V570 S573 A574 L577 I595 I598 L599 L602	V537-F541 WeakPolarHBondContact O-CB 3.49Å; V537-F541 PolarHBondContact O-N 2.95Å; C538-F541 PolarHBondContact O-N 3.1Å; F541-F545 VanDerWaalsContact O-CB 3.29Å; F541-F545 WeakPolarHBondContact O-CB 3.46Å; F541-F545 PolarHBondContact O-N 3.25Å; F541-V570 HydrophobicContact CD2-CG1 4.32Å; F541-V570 HydrophobicContact CE2-CG1 3.88Å; F541-S573 WeakPolarHBondContact CA-OG 3.37Å; F541-S573 WeakPolarHBondContact CB-OG 3.39Å; F541-S573 WeakPolarHBondContact CD2-OG 3.21Å; F541-A574 HydrophobicContact CD2-CB 4.25Å; F541-A574 HydrophobicContact CE2-CB 3.78Å; F541-L577 HydrophobicContact CB-CD1 3.87Å; F541-L577 HydrophobicContact CD1-CD1 3.79Å; F541-L577 HydrophobicContact CD2-CD1 4.33Å; F541-L577 HydrophobicContact CE1-CD1 4.39Å; F541-L577 HydrophobicContact CG-CD1 3.75Å; F541-I595 HydrophobicContact CD1-CB 4.12Å; F541-I595 HydrophobicContact CD1-CG2 4.09Å; F541-I595 HydrophobicContact CE1-CB 4.06Å; F541-I598 HydrophobicContact CD1-CG2 4.38Å; F541-I598 HydrophobicContact CE1-CB 3.77Å; F541-I598 HydrophobicContact CE1-CD1 4.37Å; F541-I598 HydrophobicContact CE1-CG2 3.47Å; F541-I598 VanDerWaalsContact CE1-CG2 3.47Å; F541-I598 HydrophobicContact CE2-CG2 4.25Å; F541-I598 HydrophobicContact CZ-CB 4.12Å; F541-I598 HydrophobicContact CZ-CG2 3.4Å; F541-L599 HydrophobicContact CE1-CD2 4.16Å; F541-L599 HydrophobicContact CE1-CG 4.32Å; F541-L599 HydrophobicContact CZ-CD2 3.8Å; F541-L599 HydrophobicContact CZ-CG 4.32Å; F541-L602 HydrophobicContact CE2-CD1 3.57Å; F541-L602 HydrophobicContact CZ-CD1 3.55Å
542	I	98.2	Very high	96.4	Very high	36 Å²	36	35.7 Å²	35.7	19%	0.185	17%	0.174	C	C	.	.	H	α-helix	trans	-61.3	-48.9	179.3	-67.4	162.3	0	0	0	110.6	C538 F545 Q546 M593 I595 I598	C538-I542 WeakPolarHBondContact O-CB 3.37Å; C538-I542 WeakPolarHBondContact O-CD1 3.2Å; C538-I542 WeakPolarHBondContact O-CG1 3.16Å; C538-I542 PolarHBondContact O-N 3.31Å; I542-F545 PolarHBondContact O-N 3.45Å; I542-Q546 VanDerWaalsContact O-CG 3.29Å; I542-Q546 WeakPolarHBondContact O-CG 3.34Å; I542-Q546 PolarHBondContact O-N 2.89Å; I542-M593 HydrophobicContact CD1-CE 4.16Å; I542-I595 HydrophobicContact CD1-CG2 4.01Å; I542-I595 HydrophobicContact CG1-CG2 4.05Å; I542-I598 HydrophobicContact CB-CD1 4.32Å; I542-I598 HydrophobicContact CG1-CD1 3.82Å; I542-I598 HydrophobicContact CG2-CD1 4.48Å
543	R	95.8	Very high	96.4	Very high	126 Å²	126	43 Å²	43	48%	0.475	19%	0.193	S	C	.	.	H	α-helix	trans	-63.8	-45.3	-177.5	-177.1	176.4	176.9	168.1	-0.7	111.9	M539 Y540 Q546 Q547	M539-R543 VanDerWaalsContact O-CB 3.27Å; M539-R543 WeakPolarHBondContact O-CB 3.44Å; M539-R543 PolarHBondContact O-N 2.64Å; Y540-R543 PolarHBondContact O-N 2.98Å; R543-Q546 PolarHBondContact O-N 2.92Å; R543-Q547 WeakPolarHBondContact O-CG 3.1Å; R543-Q547 PolarHBondContact O-N 2.87Å
544	A	96.3	Very high	96.3	Very high	3 Å²	3	45.9 Å²	45.9	3%	0.025	22%	0.218	C	C	.	.	H	α-helix	trans	-65.4	-40.1	178.4	0	0	0	0	0	111.5	Y540 Q546 Q547 V548 I569 V570	Y540-A544 WeakPolarHBondContact O-CB 3.47Å; Y540-A544 PolarHBondContact O-N 3.12Å; A544-Q546 PolarHBondContact O-N 3.46Å; A544-Q547 WeakPolarHBondContact O-CB 3.33Å; A544-Q547 PolarHBondContact O-N 3.06Å; A544-V548 WeakPolarHBondContact O-CG2 3.4Å; A544-V548 PolarHBondContact O-N 3.47Å; A544-I569 HydrophobicContact CB-CB 3.8Å; A544-I569 HydrophobicContact CB-CG2 3.57Å; A544-V570 HydrophobicContact CB-CG2 3.68Å
545	F	97.6	Very high	96.2	Very high	6 Å²	6	55.1 Å²	55.1	3%	0.026	26%	0.257	C	S	.	.	H	α-helix	trans	-65.5	-38.1	176.3	-175.2	-101.2	0	0	0	112.5	F541 I542 Q547 V548 Q549 V570 I598 Q601 L602 F605	F541-F545 VanDerWaalsContact O-CB 3.29Å; F541-F545 WeakPolarHBondContact O-CB 3.46Å; F541-F545 PolarHBondContact O-N 3.25Å; I542-F545 PolarHBondContact O-N 3.45Å; F545-Q547 VanDerWaalsContact C-N 3.29Å; F545-Q547 PolarHBondContact O-N 2.9Å; F545-V548 PolarHBondContact O-N 3.23Å; F545-Q549 WeakPolarHBondContact O-CB 3.34Å; F545-Q549 PolarHBondContact O-N 3.36Å; F545-V570 HydrophobicContact CB-CG2 4.08Å; F545-I598 HydrophobicContact CB-CG2 3.9Å; F545-I598 HydrophobicContact CD1-CB 4.27Å; F545-I598 HydrophobicContact CD1-CD1 4.09Å; F545-I598 HydrophobicContact CD1-CG1 3.9Å; F545-I598 HydrophobicContact CD1-CG2 3.52Å; F545-I598 HydrophobicContact CD2-CG2 3.58Å; F545-I598 HydrophobicContact CE1-CB 4.42Å; F545-I598 HydrophobicContact CE1-CG1 4.18Å; F545-I598 HydrophobicContact CE1-CG2 3.86Å; F545-I598 HydrophobicContact CE2-CG2 3.92Å; F545-I598 HydrophobicContact CG-CG2 3.36Å; F545-I598 HydrophobicContact CZ-CG2 4.04Å; F545-Q601 HydrophobicContact CZ-CB 3.91Å; F545-L602 HydrophobicContact CD2-CD2 3.92Å; F545-L602 HydrophobicContact CE2-CD2 3.69Å; F545-L602 HydrophobicContact CE2-CG 4.38Å; F545-F605 HydrophobicContact CE2-CE1 4.27Å; F545-F605 AromaticContact CE2-CZ 3.91Å; F545-F605 HydrophobicContact CE2-CZ 3.91Å
546	Q	97.1	Very high	96.1	Very high	95 Å²	95	56.5 Å²	56.5	44%	0.444	27%	0.268	S	S	.	.	H	α-helix	trans	-59.3	-40.6	173.2	-74.7	171.3	-6.3	0	0	111.8	I542 R543 A544 Q549 Q550	I542-Q546 VanDerWaalsContact O-CG 3.29Å; I542-Q546 WeakPolarHBondContact O-CG 3.34Å; I542-Q546 PolarHBondContact O-N 2.89Å; R543-Q546 PolarHBondContact O-N 2.92Å; A544-Q546 PolarHBondContact O-N 3.46Å; Q546-Q549 PolarHBondContact O-N 3.29Å; Q546-Q550 WeakPolarHBondContact O-CB 3.27Å; Q546-Q550 WeakPolarHBondContact O-CG 3.39Å; Q546-Q550 PolarHBondContact O-N 2.88Å
547	Q	95.9	Very high	95.9	Very high	43 Å²	43	63.9 Å²	63.9	20%	0.201	30%	0.302	C	S	.	.	H	α-helix	trans	-65.2	-43.4	175.9	-67.8	171.1	-48.5	0	0	111.7	R543 A544 F545 Q549 Q550 A551 P559 S566	R543-Q547 WeakPolarHBondContact O-CG 3.1Å; R543-Q547 PolarHBondContact O-N 2.87Å; A544-Q547 WeakPolarHBondContact O-CB 3.33Å; A544-Q547 PolarHBondContact O-N 3.06Å; F545-Q547 VanDerWaalsContact C-N 3.29Å; F545-Q547 PolarHBondContact O-N 2.9Å; Q547-Q549 PolarHBondContact O-N 2.89Å; Q547-Q550 PolarHBondContact O-N 3.44Å; Q547-A551 WeakPolarHBondContact O-CB 3.43Å; Q547-A551 PolarHBondContact O-N 3.27Å; Q547-P559 HydrophobicContact CB-CG 4.01Å; Q547-P559 HydrophobicContact CG-CG 4.49Å; Q547-S566 PolarHBondContact OE1-OG 3.32Å
548	V	95.8	Very high	95.6	Very high	2 Å²	2	65.4 Å²	65.4	1%	0.012	31%	0.312	C	S	.	.	H	α-helix	trans	-60.8	-44.3	174.3	173.5	0	0	0	0	111	A544 F545 A551 Q552 P558 L567 V570 F605	A544-V548 WeakPolarHBondContact O-CG2 3.4Å; A544-V548 PolarHBondContact O-N 3.47Å; F545-V548 PolarHBondContact O-N 3.23Å; V548-A551 PolarHBondContact O-N 2.82Å; V548-Q552 WeakPolarHBondContact O-CG 3.45Å; V548-Q552 PolarHBondContact O-N 2.82Å; V548-P558 HydrophobicContact CG2-CB 4.18Å; V548-P558 HydrophobicContact CG2-CG 4.32Å; V548-L567 HydrophobicContact CG1-CD1 4.48Å; V548-L567 HydrophobicContact CG2-CB 4.3Å; V548-L567 HydrophobicContact CG2-CD1 4.33Å; V548-V570 HydrophobicContact CG2-CG2 4.08Å; V548-F605 HydrophobicContact CG1-CE2 4.19Å; V548-F605 HydrophobicContact CG1-CZ 4.13Å
549	Q	95.5	Very high	95.3	Very high	47 Å²	47	67.9 Å²	67.9	22%	0.22	33%	0.328	C	S	.	.	H	α-helix	trans	-66.8	-39.3	179.9	-170.1	-179.6	58.5	0	0	112.3	F545 Q546 Q547 Q552 R553	F545-Q549 WeakPolarHBondContact O-CB 3.34Å; F545-Q549 PolarHBondContact O-N 3.36Å; Q546-Q549 PolarHBondContact O-N 3.29Å; Q547-Q549 PolarHBondContact O-N 2.89Å; Q549-Q552 PolarHBondContact O-N 3.17Å; Q549-R553 VanDerWaalsContact CD-NH2 3.28Å; Q549-R553 WeakPolarHBondContact O-CG 3.3Å; Q549-R553 PolarHBondContact O-N 3.34Å
550	Q	95.6	Very high	95.2	Very high	125 Å²	125	70.3 Å²	70.3	58%	0.584	35%	0.345	S	S	*	.	H	α-helix	trans	-62.1	-44.3	174.5	-75.2	170.3	13.9	0	0	111.1	Q546 Q547 R553 A554	Q546-Q550 WeakPolarHBondContact O-CB 3.27Å; Q546-Q550 WeakPolarHBondContact O-CG 3.39Å; Q546-Q550 PolarHBondContact O-N 2.88Å; Q547-Q550 PolarHBondContact O-N 3.44Å; Q550-R553 PolarHBondContact O-N 3.08Å; Q550-A554 WeakPolarHBondContact O-CB 3.27Å; Q550-A554 PolarHBondContact O-N 3.45Å
551	A	94.7	Very high	95	Very high	6 Å²	6	73.1 Å²	73.1	5%	0.05	36%	0.36	C	S	.	.	H	α-helix	trans	-62.2	-45.3	175.7	0	0	0	0	0	112.1	Q547 V548 R553 A554 K555 T556 E557	Q547-A551 WeakPolarHBondContact O-CB 3.43Å; Q547-A551 PolarHBondContact O-N 3.27Å; V548-A551 PolarHBondContact O-N 2.82Å; A551-R553 PolarHBondContact O-N 2.66Å; A551-A554 CarbonylContact O-C 3.57Å; A551-A554 PolarHBondContact O-N 3.42Å; A551-K555 PolarHBondContact O-N 3.32Å; A551-T556 CarbonylContact C-O 3.35Å; A551-T556 PolarHBondContact O-N 2.92Å; A551-T556 PolarHBondContact O-OG1 3.37Å; A551-E557 WeakPolarHBondContact CB-O 3.39Å
552	Q	93.3	Very high	94.6	Very high	103 Å²	103	77.5 Å²	77.5	48%	0.481	38%	0.383	S	S	.	.	H	α-helix	trans	-58.6	-44.2	175.3	-74.9	175.2	-16.3	0	0	112.4	V548 Q549 A554 K555	V548-Q552 WeakPolarHBondContact O-CG 3.45Å; V548-Q552 PolarHBondContact O-N 2.82Å; Q549-Q552 PolarHBondContact O-N 3.17Å; Q552-A554 VanDerWaalsContact C-N 3.34Å; Q552-A554 PolarHBondContact O-N 3.38Å; Q552-K555 PolarHBondContact O-N 3.49Å; Q552-K555 VanDerWaalsContact O-N 3.08Å
553	R	94.4	Very high	94.3	Very high	181 Å²	181	79 Å²	79	68%	0.683	41%	0.407	S	S	*	.	H	α-helix	trans	-65	-37.9	176.6	-72.6	175.8	-176.5	170.9	5.6	112.3	Q549 Q550 A551 K555	Q549-R553 VanDerWaalsContact CD-NH2 3.28Å; Q549-R553 WeakPolarHBondContact O-CG 3.3Å; Q549-R553 PolarHBondContact O-N 3.34Å; Q550-R553 PolarHBondContact O-N 3.08Å; A551-R553 PolarHBondContact O-N 2.66Å; R553-K555 PolarHBondContact O-N 3.02Å
554	A	94.8	Very high	94.2	Very high	64 Å²	64	73.5 Å²	73.5	53%	0.529	39%	0.388	S	S	.	.	H	α-helix	trans	-75.6	-6.7	174.4	0	0	0	0	0	113.3	Q550 A551 Q552 T556	Q550-A554 WeakPolarHBondContact O-CB 3.27Å; Q550-A554 PolarHBondContact O-N 3.45Å; A551-A554 CarbonylContact O-C 3.57Å; A551-A554 PolarHBondContact O-N 3.42Å; Q552-A554 VanDerWaalsContact C-N 3.34Å; Q552-A554 PolarHBondContact O-N 3.38Å; A554-T556 HydrophobicContact CB-CG2 4.13Å; A554-T556 PolarHBondContact O-N 3.46Å
555	K	93.5	Very high	94.2	Very high	197 Å²	197	74.4 Å²	74.4	86%	0.857	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	38.6	-171.1	-57	179.9	-180	179.4	0	112.6	A551 Q552 R553	A551-K555 PolarHBondContact O-N 3.32Å; Q552-K555 PolarHBondContact O-N 3.49Å; Q552-K555 VanDerWaalsContact O-N 3.08Å; R553-K555 PolarHBondContact O-N 3.02Å
556	T	94.7	Very high	94	Very high	85 Å²	85	74.1 Å²	74.1	52%	0.521	39%	0.392	S	S	.	.	S	Bend	trans	-116.4	167.4	175.6	62.4	0	0	0	0	110.5	A551 A554	A551-T556 CarbonylContact C-O 3.35Å; A551-T556 PolarHBondContact O-N 2.92Å; A551-T556 PolarHBondContact O-OG1 3.37Å; A554-T556 HydrophobicContact CB-CG2 4.13Å; A554-T556 PolarHBondContact O-N 3.46Å
557	E	92.2	Very high	93.9	Very high	171 Å²	171	71.6 Å²	71.6	80%	0.799	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-69.3	149.7	171.4	-67.1	-177.1	175.5	0	0	111.5	A551	A551-E557 WeakPolarHBondContact CB-O 3.39Å
558	P	92	Very high	93.8	Very high	33 Å²	33	71.3 Å²	71.3	21%	0.214	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-55.8	143.9	171.3	-23.5	34	0	0	0	111.4	V548 V560 L567	V548-P558 HydrophobicContact CG2-CB 4.18Å; V548-P558 HydrophobicContact CG2-CG 4.32Å; P558-V560 PolarHBondContact O-N 2.66Å; P558-L567 HydrophobicContact CG-CB 4.47Å
559	P	92.2	Very high	93.9	Very high	52 Å²	52	71.3 Å²	71.3	34%	0.338	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-65.9	137	-177.6	22.8	-27.6	0	0	0	111.2	Q547 S566	Q547-P559 HydrophobicContact CB-CG 4.01Å; Q547-P559 HydrophobicContact CG-CG 4.49Å; P559-S566 WeakPolarHBondContact CG-OG 3.24Å; P559-S566 PolarHBondContact O-N 3.33Å; P559-S566 PolarHBondContact O-OG 2.85Å
560	V	95.2	Very high	94	Very high	92 Å²	92	69.1 Å²	69.1	56%	0.558	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.2	116.1	172.1	-179.1	0	0	0	0	108.2	P558 G563 V564	P558-V560 PolarHBondContact O-N 2.66Å; V560-G563 VanDerWaalsContact CG1-C 3.5Å; V560-V564 WeakPolarHBondContact CA-O 3.45Å
561	I	91.4	Very high	94	Very high	69 Å²	69	65 Å²	65	35%	0.354	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	125.9	-179	-59.4	165.8	0	0	0	107.4	L505 G563 V564	L505-I561 HydrophobicContact CD1-CB 3.82Å; L505-I561 HydrophobicContact CD1-CD1 4.22Å; L505-I561 HydrophobicContact CD1-CG2 4.29Å; I561-G563 PolarHBondContact O-N 2.67Å; I561-V564 PolarHBondContact N-O 3.13Å; I561-V564 PolarHBondContact O-N 3.43Å
562	D	90	Very high	94	Very high	91 Å²	91	65.7 Å²	65.7	49%	0.487	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	50	38.8	-174.5	-61	-17.2	0	0	0	112.8	P506 V564	P506-D562 HydrophobicContact CG-CB 3.92Å; P506-D562 WeakPolarHBondContact CG-O 3.22Å; D562-V564 VanDerWaalsContact C-N 3.26Å; D562-V564 PolarHBondContact O-N 3.23Å
563	G	91.9	Very high	94.2	Very high	67 Å²	67	60.8 Å²	60.8	69%	0.691	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	1	-178.7	0	0	0	0	0	115.4	V560 I561	V560-G563 VanDerWaalsContact CG1-C 3.5Å; I561-G563 PolarHBondContact O-N 2.67Å
564	V	94.5	Very high	94.4	Very high	11 Å²	11	52.1 Å²	52.1	7%	0.067	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	122.7	179.2	-179.7	0	0	0	0	110.8	L505 P506 K509 V560 I561 D562 D568 I569	L505-V564 HydrophobicContact CB-CB 4.09Å; L505-V564 HydrophobicContact CB-CG1 4.32Å; L505-V564 HydrophobicContact CB-CG2 4.48Å; P506-V564 HydrophobicContact CB-CG2 4.22Å; P506-V564 HydrophobicContact CG-CG2 3.79Å; K509-V564 HydrophobicContact CD-CG1 3.88Å; K509-V564 HydrophobicContact CD-CG2 4.43Å; V560-V564 WeakPolarHBondContact CA-O 3.45Å; I561-V564 PolarHBondContact N-O 3.13Å; I561-V564 PolarHBondContact O-N 3.43Å; D562-V564 VanDerWaalsContact C-N 3.26Å; D562-V564 PolarHBondContact O-N 3.23Å; V564-D568 HydrophobicContact CG1-CB 4.21Å; V564-I569 HydrophobicContact CG1-CD1 3.76Å; V564-I569 HydrophobicContact CG1-CG1 3.95Å
565	S	95	Very high	94.5	Very high	22 Å²	22	49.4 Å²	49.4	15%	0.154	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	142.9	173.7	176.9	0	0	0	0	111.1	L567 D568 I569	S565-L567 PolarHBondContact O-N 2.91Å; S565-L567 PolarHBondContact OG-N 3.26Å; S565-D568 WeakPolarHBondContact O-CB 3.3Å; S565-D568 PolarHBondContact O-N 3.26Å; S565-I569 PolarHBondContact O-N 2.97Å
566	S	94.5	Very high	94.7	Very high	0 Å²	0	40 Å²	40	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59.1	-29.2	171.5	-57.6	0	0	0	0	112.1	Q547 P559 I569 V570	Q547-S566 PolarHBondContact OE1-OG 3.32Å; P559-S566 WeakPolarHBondContact CG-OG 3.24Å; P559-S566 PolarHBondContact O-N 3.33Å; P559-S566 PolarHBondContact O-OG 2.85Å; S566-I569 PolarHBondContact O-N 3.46Å; S566-V570 WeakPolarHBondContact O-CG2 3.39Å; S566-V570 PolarHBondContact O-N 3.35Å
567	L	94.9	Very high	94.9	Very high	42 Å²	42	36 Å²	36	22%	0.22	21%	0.212	C	C	.	.	H	α-helix	trans	-65	-39.2	175.2	-173.5	61.7	0	0	0	111.8	V548 P558 S565 I569 V570 E571 F605 I610	V548-L567 HydrophobicContact CG1-CD1 4.48Å; V548-L567 HydrophobicContact CG2-CB 4.3Å; V548-L567 HydrophobicContact CG2-CD1 4.33Å; P558-L567 HydrophobicContact CG-CB 4.47Å; S565-L567 PolarHBondContact O-N 2.91Å; S565-L567 PolarHBondContact OG-N 3.26Å; L567-I569 VanDerWaalsContact C-N 3.26Å; L567-I569 PolarHBondContact O-N 2.87Å; L567-V570 WeakPolarHBondContact O-CB 3.49Å; L567-V570 PolarHBondContact O-N 2.92Å; L567-V570 VanDerWaalsContact O-N 3.16Å; L567-E571 PolarHBondContact O-N 3.29Å; L567-F605 HydrophobicContact CD1-CD2 4.26Å; L567-F605 HydrophobicContact CD1-CE2 3.88Å; L567-I610 HydrophobicContact CD1-CD1 3.61Å; L567-I610 HydrophobicContact CG-CD1 4.12Å
568	D	94.8	Very high	95.2	Very high	37 Å²	37	28.5 Å²	28.5	20%	0.198	18%	0.177	C	C	.	.	H	α-helix	trans	-62.3	-35.9	175.7	-62.9	4	0	0	0	111.8	K509 V564 S565 C572	K509-D568 HydrophobicContact CD-CB 4.28Å; K509-D568 IonicContact NZ-OD2 3.64Å; K509-D568 PolarHBondContact NZ-OD2 3.29Å; V564-D568 HydrophobicContact CG1-CB 4.21Å; S565-D568 WeakPolarHBondContact O-CB 3.3Å; S565-D568 PolarHBondContact O-N 3.26Å; D568-C572 WeakPolarHBondContact O-CB 3.39Å; D568-C572 PolarHBondContact O-N 3.03Å
569	I	96.5	Very high	95.4	Very high	3 Å²	3	27.3 Å²	27.3	2%	0.015	17%	0.17	C	C	.	.	H	α-helix	trans	-69.4	-41.3	176	-60.1	-60.7	0	0	0	110.2	L505 K509 Y540 A544 V564 S565 S566 L567 E571 C572 S573	L505-I569 HydrophobicContact CB-CD1 4.44Å; L505-I569 HydrophobicContact CD1-CG1 4.31Å; L505-I569 HydrophobicContact CD2-CD1 4.42Å; L505-I569 HydrophobicContact CD2-CG1 4.42Å; K509-I569 HydrophobicContact CB-CD1 3.88Å; K509-I569 HydrophobicContact CG-CD1 4.42Å; Y540-I569 HydrophobicContact CD1-CG2 4.22Å; A544-I569 HydrophobicContact CB-CB 3.8Å; A544-I569 HydrophobicContact CB-CG2 3.57Å; V564-I569 HydrophobicContact CG1-CD1 3.76Å; V564-I569 HydrophobicContact CG1-CG1 3.95Å; S565-I569 PolarHBondContact O-N 2.97Å; S566-I569 PolarHBondContact O-N 3.46Å; L567-I569 VanDerWaalsContact C-N 3.26Å; L567-I569 PolarHBondContact O-N 2.87Å; I569-E571 VanDerWaalsContact C-N 3.33Å; I569-E571 PolarHBondContact O-N 3.43Å; I569-C572 PolarHBondContact O-N 3.29Å; I569-S573 VanDerWaalsContact O-CB 3.23Å; I569-S573 WeakPolarHBondContact O-CB 3.47Å; I569-S573 PolarHBondContact O-N 3.3Å; I569-S573 PolarHBondContact O-OG 3.39Å
570	V	97.2	Very high	95.6	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-57.1	-49.2	173.4	171.9	0	0	0	0	110.3	F541 A544 F545 V548 S566 L567 S573 A574 L602	F541-V570 HydrophobicContact CD2-CG1 4.32Å; F541-V570 HydrophobicContact CE2-CG1 3.88Å; A544-V570 HydrophobicContact CB-CG2 3.68Å; F545-V570 HydrophobicContact CB-CG2 4.08Å; V548-V570 HydrophobicContact CG2-CG2 4.08Å; S566-V570 WeakPolarHBondContact O-CG2 3.39Å; S566-V570 PolarHBondContact O-N 3.35Å; L567-V570 WeakPolarHBondContact O-CB 3.49Å; L567-V570 PolarHBondContact O-N 2.92Å; L567-V570 VanDerWaalsContact O-N 3.16Å; V570-S573 PolarHBondContact O-OG 2.85Å; V570-A574 WeakPolarHBondContact O-CB 3.44Å; V570-A574 PolarHBondContact O-N 3.36Å; V570-L602 HydrophobicContact CG1-CD1 3.85Å; V570-L602 HydrophobicContact CG1-CD2 3.89Å
571	E	95.6	Very high	95.7	Very high	39 Å²	39	20.4 Å²	20.4	18%	0.182	13%	0.128	C	C	.	.	H	α-helix	trans	-61.4	-51.3	179.6	-175.5	-176.8	153.9	0	0	112.1	L567 I569 A574 A575 H609 I610	L567-E571 PolarHBondContact O-N 3.29Å; I569-E571 VanDerWaalsContact C-N 3.33Å; I569-E571 PolarHBondContact O-N 3.43Å; E571-A574 PolarHBondContact O-N 3.13Å; E571-A575 WeakPolarHBondContact O-CB 3.41Å; E571-A575 PolarHBondContact O-N 3.4Å; E571-H609 VanDerWaalsContact CD-ND1 3.25Å; E571-H609 VanDerWaalsContact CG-ND1 3.26Å; E571-H609 WeakPolarHBondContact CG-ND1 3.37Å; E571-H609 IonicContact OE1-CE1 2.93Å; E571-H609 PolarHBondContact OE1-CE1 3.3Å; E571-H609 VanDerWaalsContact OE1-CE1 3.27Å; E571-H609 IonicContact OE1-CG 3.18Å; E571-H609 IonicContact OE1-ND1 2.81Å; E571-H609 PolarHBondContact OE1-ND1 3.32Å; E571-I610 HydrophobicContact CB-CD1 4.46Å; E571-I610 HydrophobicContact CB-CG1 4.14Å; E571-I610 HydrophobicContact CG-CG1 4.1Å
572	C	95.8	Very high	95.8	Very high	20 Å²	20	21.5 Å²	21.5	14%	0.135	13%	0.13	C	C	.	.	H	α-helix	trans	-65.8	-41.9	-177.6	-168.6	0	0	0	0	112	K509 L512 D568 I569 A575 T576	K509-C572 HydrophobicContact CG-CB 4.45Å; L512-C572 VanDerWaalsContact CB-SG 3.51Å; D568-C572 WeakPolarHBondContact O-CB 3.39Å; D568-C572 PolarHBondContact O-N 3.03Å; I569-C572 PolarHBondContact O-N 3.29Å; C572-A575 PolarHBondContact O-N 3.27Å; C572-T576 WeakPolarHBondContact O-CB 3.42Å; C572-T576 PolarHBondContact O-N 2.94Å; C572-T576 PolarHBondContact O-OG1 3.49Å
573	S	98	Very high	96	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-69.6	-39.3	176.9	58.9	0	0	0	0	112	F541 I569 V570 T576 L577	F541-S573 WeakPolarHBondContact CA-OG 3.37Å; F541-S573 WeakPolarHBondContact CB-OG 3.39Å; F541-S573 WeakPolarHBondContact CD2-OG 3.21Å; I569-S573 VanDerWaalsContact O-CB 3.23Å; I569-S573 WeakPolarHBondContact O-CB 3.47Å; I569-S573 PolarHBondContact O-N 3.3Å; I569-S573 PolarHBondContact O-OG 3.39Å; V570-S573 PolarHBondContact O-OG 2.85Å; S573-T576 WeakPolarHBondContact O-CB 3.47Å; S573-T576 PolarHBondContact O-N 2.9Å; S573-L577 VanDerWaalsContact O-CG 3.25Å; S573-L577 WeakPolarHBondContact O-CG 3.44Å; S573-L577 PolarHBondContact O-N 2.85Å
574	A	98	Very high	96.1	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-61.4	-44.2	172.9	0	0	0	0	0	112.1	F541 V570 E571 T576 L577 H578 V613	F541-A574 HydrophobicContact CD2-CB 4.25Å; F541-A574 HydrophobicContact CE2-CB 3.78Å; V570-A574 WeakPolarHBondContact O-CB 3.44Å; V570-A574 PolarHBondContact O-N 3.36Å; E571-A574 PolarHBondContact O-N 3.13Å; A574-T576 VanDerWaalsContact C-N 3.28Å; A574-T576 PolarHBondContact O-N 3.04Å; A574-L577 PolarHBondContact O-N 3.41Å; A574-H578 PolarHBondContact O-N 3.18Å; A574-V613 HydrophobicContact CB-CB 4.39Å; A574-V613 HydrophobicContact CB-CG2 3.62Å
575	A	97.2	Very high	96.1	Very high	6 Å²	6	20.1 Å²	20.1	5%	0.05	12%	0.116	C	C	.	.	H	α-helix	trans	-60.9	-39	174.5	0	0	0	0	0	111.9	E571 C572 H578 A579 V613	E571-A575 WeakPolarHBondContact O-CB 3.41Å; E571-A575 PolarHBondContact O-N 3.4Å; C572-A575 PolarHBondContact O-N 3.27Å; A575-H578 PolarHBondContact O-N 2.98Å; A575-A579 PolarHBondContact O-N 3.11Å; A575-A579 VanDerWaalsContact O-N 3.17Å; A575-V613 HydrophobicContact CB-CB 4.47Å; A575-V613 HydrophobicContact CB-CG1 3.84Å
576	T	98.1	Very high	96.2	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-67.6	-41.6	176	-53.2	0	0	0	0	111.4	L512 I515 R516 V537 C572 S573 A574 H578 A579 L580	L512-T576 HydrophobicContact CD2-CG2 4.19Å; L512-T576 PolarHBondContact O-OG1 3.14Å; I515-T576 HydrophobicContact CB-CG2 4.3Å; I515-T576 HydrophobicContact CG2-CG2 3.79Å; R516-T576 HydrophobicContact CB-CG2 4.35Å; V537-T576 HydrophobicContact CG1-CG2 4.07Å; V537-T576 HydrophobicContact CG2-CG2 3.99Å; C572-T576 WeakPolarHBondContact O-CB 3.42Å; C572-T576 PolarHBondContact O-N 2.94Å; C572-T576 PolarHBondContact O-OG1 3.49Å; S573-T576 WeakPolarHBondContact O-CB 3.47Å; S573-T576 PolarHBondContact O-N 2.9Å; A574-T576 VanDerWaalsContact C-N 3.28Å; A574-T576 PolarHBondContact O-N 3.04Å; T576-H578 VanDerWaalsContact C-N 3.35Å; T576-A579 PolarHBondContact O-N 3.24Å; T576-L580 HydrophobicContact CG2-CD1 4.1Å; T576-L580 HydrophobicContact CG2-CG 4.49Å; T576-L580 VanDerWaalsContact O-CG 3.31Å; T576-L580 WeakPolarHBondContact O-CG 3.43Å; T576-L580 PolarHBondContact O-N 3.35Å
577	L	98.3	Very high	96.3	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-62.8	-41.2	175.4	-69.8	167.5	0	0	0	111.4	V537 C538 F541 S573 A574 A579 L580 S581 M590 I595 T617	V537-L577 HydrophobicContact CB-CD2 4.04Å; V537-L577 HydrophobicContact CG1-CD1 4.4Å; V537-L577 HydrophobicContact CG1-CD2 3.7Å; V537-L577 HydrophobicContact CG1-CG 3.65Å; C538-L577 VanDerWaalsContact SG-CD2 3.59Å; F541-L577 HydrophobicContact CB-CD1 3.87Å; F541-L577 HydrophobicContact CD1-CD1 3.79Å; F541-L577 HydrophobicContact CD2-CD1 4.33Å; F541-L577 HydrophobicContact CE1-CD1 4.39Å; F541-L577 HydrophobicContact CG-CD1 3.75Å; S573-L577 VanDerWaalsContact O-CG 3.25Å; S573-L577 WeakPolarHBondContact O-CG 3.44Å; S573-L577 PolarHBondContact O-N 2.85Å; A574-L577 PolarHBondContact O-N 3.41Å; L577-A579 VanDerWaalsContact C-N 3.33Å; L577-A579 PolarHBondContact O-N 3.03Å; L577-L580 CarbonylContact O-C 3.43Å; L577-L580 PolarHBondContact O-N 3.1Å; L577-S581 WeakPolarHBondContact O-CB 3.49Å; L577-S581 PolarHBondContact O-N 3.1Å; L577-S581 PolarHBondContact O-OG 3.33Å; L577-M590 HydrophobicContact CB-CE 4.02Å; L577-M590 HydrophobicContact CD2-CE 3.69Å; L577-M590 HydrophobicContact CD2-CG 4.17Å; L577-M590 HydrophobicContact CD2-SD 4.39Å; L577-M590 HydrophobicContact CG-CE 4.48Å; L577-M590 WeakPolarHBondContact O-CE 3.25Å; L577-I595 HydrophobicContact CD1-CD1 3.79Å; L577-T617 HydrophobicContact CB-CG2 4.41Å
578	H	97.7	Very high	96.5	Very high	14 Å²	14	20.9 Å²	20.9	7%	0.065	12%	0.118	C	C	.	.	H	α-helix	trans	-57.9	-44.9	174	-176.3	-155.3	0	0	0	111.9	A574 A575 T576 S581 G616 T617 Y654	A574-H578 PolarHBondContact O-N 3.18Å; A575-H578 PolarHBondContact O-N 2.98Å; T576-H578 VanDerWaalsContact C-N 3.35Å; H578-S581 WeakPolarHBondContact CA-OG 3.27Å; H578-S581 PolarHBondContact O-N 3.46Å; H578-S581 PolarHBondContact O-OG 3.45Å; H578-G616 WeakPolarHBondContact NE2-CA 3.37Å; H578-T617 WeakPolarHBondContact CA-OG1 3.4Å; H578-T617 VanDerWaalsContact CB-OG1 3.28Å; H578-T617 WeakPolarHBondContact CB-OG1 3.19Å; H578-T617 PolarHBondContact CD2-N 2.96Å; H578-T617 PolarHBondContact N-OG1 3.43Å; H578-Y654 AromaticContact CE1-CZ 3.71Å; H578-Y654 PolarHBondContact CE1-OH 2.9Å; H578-Y654 AromaticContact NE2-CZ 3.89Å
579	A	96.3	Very high	96.6	Very high	8 Å²	8	21 Å²	21	7%	0.066	12%	0.119	C	C	.	.	H	α-helix	trans	-64.7	-42.1	177.1	0	0	0	0	0	111.9	R516 A519 A575 T576 L577 S581	R516-A579 HydrophobicContact CG-CB 3.83Å; A519-A579 HydrophobicContact CB-CB 3.99Å; A575-A579 PolarHBondContact O-N 3.11Å; A575-A579 VanDerWaalsContact O-N 3.17Å; T576-A579 PolarHBondContact O-N 3.24Å; L577-A579 VanDerWaalsContact C-N 3.33Å; L577-A579 PolarHBondContact O-N 3.03Å; A579-S581 VanDerWaalsContact C-N 3.35Å; A579-S581 PolarHBondContact O-N 2.97Å
580	L	97.5	Very high	96.7	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-69.2	-28.5	177.4	-67.6	171.9	0	0	0	112.8	A519 L525 F528 I533 V537 T576 L577 K582 D583 S586 M590	A519-L580 HydrophobicContact CB-CD2 3.98Å; L525-L580 HydrophobicContact CD2-CD2 4.45Å; F528-L580 HydrophobicContact CD2-CD2 3.91Å; F528-L580 HydrophobicContact CE2-CD2 4.46Å; I533-L580 HydrophobicContact CG2-CD1 4.02Å; I533-L580 HydrophobicContact CG2-CD2 3.96Å; V537-L580 HydrophobicContact CG2-CD1 4.15Å; T576-L580 HydrophobicContact CG2-CD1 4.1Å; T576-L580 HydrophobicContact CG2-CG 4.49Å; T576-L580 VanDerWaalsContact O-CG 3.31Å; T576-L580 WeakPolarHBondContact O-CG 3.43Å; T576-L580 PolarHBondContact O-N 3.35Å; L577-L580 CarbonylContact O-C 3.43Å; L577-L580 PolarHBondContact O-N 3.1Å; L580-K582 PolarHBondContact O-N 3.06Å; L580-K582 VanDerWaalsContact O-N 3.13Å; L580-D583 WeakPolarHBondContact O-CB 3.47Å; L580-D583 PolarHBondContact O-N 3.34Å; L580-S586 WeakPolarHBondContact O-CB 3.45Å; L580-M590 HydrophobicContact CB-CE 3.78Å
581	S	96.5	Very high	96.7	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-10.4	-176.3	54.5	0	0	0	0	114.1	L577 H578 A579 D583 R587 E620	L577-S581 WeakPolarHBondContact O-CB 3.49Å; L577-S581 PolarHBondContact O-N 3.1Å; L577-S581 PolarHBondContact O-OG 3.33Å; H578-S581 WeakPolarHBondContact CA-OG 3.27Å; H578-S581 PolarHBondContact O-N 3.46Å; H578-S581 PolarHBondContact O-OG 3.45Å; A579-S581 VanDerWaalsContact C-N 3.35Å; A579-S581 PolarHBondContact O-N 2.97Å; S581-D583 PolarHBondContact O-N 3.26Å; S581-R587 WeakPolarHBondContact O-CD 3.44Å; S581-R587 WeakPolarHBondContact O-CG 3.22Å; S581-R587 PolarHBondContact O-NH1 3.44Å; S581-R587 VanDerWaalsContact O-NH1 3.14Å; S581-E620 WeakPolarHBondContact OG-CB 3.42Å; S581-E620 WeakPolarHBondContact OG-CG 3.49Å
582	K	93.3	Very high	96.8	Very high	92 Å²	92	27.7 Å²	27.7	40%	0.4	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-28	167.3	-61.4	178.4	-177.6	179	0	111.5	N520 L580 R587	N520-K582 PolarHBondContact OD1-NZ 2.96Å; L580-K582 PolarHBondContact O-N 3.06Å; L580-K582 VanDerWaalsContact O-N 3.13Å; K582-R587 PolarHBondContact O-NH1 3.01Å
583	D	93.5	Very high	96.8	Very high	19 Å²	19	29 Å²	29	10%	0.102	15%	0.154	C	C	.	.	S	Bend	trans	-87.1	128	174.6	173.8	76.6	0	0	0	112.2	L525 R529 L580 S581 V585 S586 R587	L525-D583 HydrophobicContact CD1-CB 4.18Å; L525-D583 HydrophobicContact CD2-CB 4.37Å; R529-D583 IonicContact CZ-OD1 3.32Å; R529-D583 IonicContact NH1-OD1 2.89Å; R529-D583 PolarHBondContact NH1-OD1 2.98Å; L580-D583 WeakPolarHBondContact O-CB 3.47Å; L580-D583 PolarHBondContact O-N 3.34Å; S581-D583 PolarHBondContact O-N 3.26Å; D583-V585 VanDerWaalsContact C-N 3.32Å; D583-V585 PolarHBondContact O-N 3.39Å; D583-V585 WeakPolarHBondContact OD2-CB 3.48Å; D583-V585 PolarHBondContact OD2-N 3Å; D583-S586 WeakPolarHBondContact O-CB 3.45Å; D583-S586 PolarHBondContact O-N 3.39Å; D583-S586 WeakPolarHBondContact OD2-CB 3.46Å; D583-S586 PolarHBondContact OD2-N 3.38Å; D583-S586 PolarHBondContact OD2-OG 2.95Å; D583-R587 PolarHBondContact O-N 3.42Å
584	A	94.8	Very high	96.8	Very high	49 Å²	49	34.1 Å²	34.1	41%	0.405	18%	0.181	S	C	.	.	H	α-helix	trans	-64.1	-32.3	-176.3	0	0	0	0	0	114.1	R587 T588	A584-R587 PolarHBondContact O-N 3.2Å; A584-T588 PolarHBondContact O-N 2.89Å; A584-T588 VanDerWaalsContact O-N 3.15Å; A584-T588 PolarHBondContact O-OG1 3.35Å
585	V	95.2	Very high	96.8	Very high	72 Å²	72	34.1 Å²	34.1	44%	0.436	18%	0.181	S	C	.	.	H	α-helix	trans	-69.9	-42.5	177.4	-176.3	0	0	0	0	109.7	D583 R587 T588 I589	D583-V585 VanDerWaalsContact C-N 3.32Å; D583-V585 PolarHBondContact O-N 3.39Å; D583-V585 WeakPolarHBondContact OD2-CB 3.48Å; D583-V585 PolarHBondContact OD2-N 3Å; V585-R587 VanDerWaalsContact C-N 3.34Å; V585-R587 PolarHBondContact O-N 3.29Å; V585-T588 WeakPolarHBondContact O-CA 3.41Å; V585-T588 WeakPolarHBondContact O-CB 3.35Å; V585-T588 PolarHBondContact O-N 2.9Å; V585-T588 VanDerWaalsContact O-N 3.07Å; V585-I589 HydrophobicContact CG1-CD1 4.2Å; V585-I589 WeakPolarHBondContact O-CG1 3.41Å; V585-I589 PolarHBondContact O-N 3.14Å
586	S	96	Very high	96.8	Very high	4 Å²	4	34 Å²	34	3%	0.028	18%	0.179	C	C	.	.	H	α-helix	trans	-59.5	-42.1	174.9	-60.3	0	0	0	0	112	L580 D583 T588 I589 M590	L580-S586 WeakPolarHBondContact O-CB 3.45Å; D583-S586 WeakPolarHBondContact O-CB 3.45Å; D583-S586 PolarHBondContact O-N 3.39Å; D583-S586 WeakPolarHBondContact OD2-CB 3.46Å; D583-S586 PolarHBondContact OD2-N 3.38Å; D583-S586 PolarHBondContact OD2-OG 2.95Å; S586-T588 VanDerWaalsContact C-N 3.3Å; S586-T588 PolarHBondContact O-N 3.48Å; S586-I589 PolarHBondContact O-N 3.43Å; S586-M590 VanDerWaalsContact O-CG 3.25Å; S586-M590 WeakPolarHBondContact O-CG 3.44Å; S586-M590 PolarHBondContact O-N 3.04Å
587	R	97.6	Very high	96.8	Very high	23 Å²	23	35.9 Å²	35.9	9%	0.087	19%	0.192	C	C	.	.	H	α-helix	trans	-59.4	-39.4	172.3	-64.5	-164	-59.5	-94.1	8.3	113	S581 K582 D583 A584 V585 M590 R591 E620 L621 D624	S581-R587 WeakPolarHBondContact O-CD 3.44Å; S581-R587 WeakPolarHBondContact O-CG 3.22Å; S581-R587 PolarHBondContact O-NH1 3.44Å; S581-R587 VanDerWaalsContact O-NH1 3.14Å; K582-R587 PolarHBondContact O-NH1 3.01Å; D583-R587 PolarHBondContact O-N 3.42Å; A584-R587 PolarHBondContact O-N 3.2Å; V585-R587 VanDerWaalsContact C-N 3.34Å; V585-R587 PolarHBondContact O-N 3.29Å; R587-M590 PolarHBondContact O-N 3.04Å; R587-R591 WeakPolarHBondContact O-CG 3.3Å; R587-R591 PolarHBondContact O-N 2.9Å; R587-R591 VanDerWaalsContact O-N 3.08Å; R587-R591 PolarHBondContact O-NE 3.3Å; R587-E620 WeakPolarHBondContact CD-O 3.25Å; R587-L621 HydrophobicContact CB-CD2 3.84Å; R587-L621 HydrophobicContact CG-CD2 4.01Å; R587-D624 IonicContact CZ-OD1 2.8Å; R587-D624 IonicContact CZ-OD2 3.92Å; R587-D624 IonicContact NE-OD1 3.69Å; R587-D624 IonicContact NE-OD2 3.59Å; R587-D624 PolarHBondContact NE-OD2 3.23Å; R587-D624 IonicContact NH2-OD1 2.73Å; R587-D624 PolarHBondContact NH2-OD1 3.13Å; R587-D624 IonicContact NH2-OD2 3.7Å
588	T	97.8	Very high	96.8	Very high	52 Å²	52	36.8 Å²	36.8	32%	0.319	20%	0.196	S	C	.	.	H	α-helix	trans	-63.8	-44.6	176.2	-57	0	0	0	0	111.4	A584 V585 S586 R591 Q592	A584-T588 PolarHBondContact O-N 2.89Å; A584-T588 VanDerWaalsContact O-N 3.15Å; A584-T588 PolarHBondContact O-OG1 3.35Å; V585-T588 WeakPolarHBondContact O-CA 3.41Å; V585-T588 WeakPolarHBondContact O-CB 3.35Å; V585-T588 PolarHBondContact O-N 2.9Å; V585-T588 VanDerWaalsContact O-N 3.07Å; S586-T588 VanDerWaalsContact C-N 3.3Å; S586-T588 PolarHBondContact O-N 3.48Å; T588-R591 PolarHBondContact O-N 3.48Å; T588-R591 PolarHBondContact OG1-NH2 3.13Å; T588-Q592 WeakPolarHBondContact O-CG 3.38Å; T588-Q592 PolarHBondContact O-N 3.46Å
589	I	97.3	Very high	96.9	Very high	39 Å²	39	36.1 Å²	36.1	20%	0.2	19%	0.193	C	C	.	.	H	α-helix	trans	-63	-44.3	176.5	-65.5	166.3	0	0	0	111	A534 N535 V585 S586 R591 Q592 M593	A534-I589 HydrophobicContact CB-CB 4.25Å; A534-I589 HydrophobicContact CB-CD1 4.04Å; A534-I589 HydrophobicContact CB-CG2 4.01Å; N535-I589 HydrophobicContact CB-CG2 4.31Å; V585-I589 HydrophobicContact CG1-CD1 4.2Å; V585-I589 WeakPolarHBondContact O-CG1 3.41Å; V585-I589 PolarHBondContact O-N 3.14Å; S586-I589 PolarHBondContact O-N 3.43Å; I589-R591 VanDerWaalsContact C-N 3.33Å; I589-R591 PolarHBondContact O-N 2.98Å; I589-Q592 PolarHBondContact O-N 2.9Å; I589-M593 HydrophobicContact CG2-CG 4.17Å; I589-M593 WeakPolarHBondContact O-CB 3.49Å; I589-M593 VanDerWaalsContact O-CG 3.29Å; I589-M593 WeakPolarHBondContact O-CG 3.36Å; I589-M593 PolarHBondContact O-N 3.42Å
590	M	98.2	Very high	96.9	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-58.9	-42.8	177.8	-72.3	169.8	-163.7	0	0	112.2	L577 L580 S586 R587 M593 N594 I595 T617 L621	L577-M590 HydrophobicContact CB-CE 4.02Å; L577-M590 HydrophobicContact CD2-CE 3.69Å; L577-M590 HydrophobicContact CD2-CG 4.17Å; L577-M590 HydrophobicContact CD2-SD 4.39Å; L577-M590 HydrophobicContact CG-CE 4.48Å; L577-M590 WeakPolarHBondContact O-CE 3.25Å; L580-M590 HydrophobicContact CB-CE 3.78Å; S586-M590 VanDerWaalsContact O-CG 3.25Å; S586-M590 WeakPolarHBondContact O-CG 3.44Å; S586-M590 PolarHBondContact O-N 3.04Å; R587-M590 PolarHBondContact O-N 3.04Å; M590-M593 PolarHBondContact O-N 2.85Å; M590-N594 PolarHBondContact O-N 3.46Å; M590-I595 HydrophobicContact CB-CD1 3.78Å; M590-I595 HydrophobicContact CB-CG1 4.02Å; M590-I595 HydrophobicContact CG-CD1 3.79Å; M590-I595 WeakPolarHBondContact O-CG1 3.46Å; M590-I595 PolarHBondContact O-N 3.27Å; M590-I595 HydrophobicContact SD-CD1 4.38Å; M590-T617 HydrophobicContact SD-CG2 4.42Å; M590-L621 HydrophobicContact CB-CD2 3.99Å; M590-L621 HydrophobicContact SD-CD2 4.12Å
591	R	97.7	Very high	96.9	Very high	32 Å²	32	39.8 Å²	39.8	12%	0.121	21%	0.209	C	C	.	.	H	α-helix	trans	-62.2	-45.9	174.3	-71.5	177	-68.5	174.7	2.2	111.5	R587 T588 I589 M593 N594 I596 L621 D624 D626 L630	R587-R591 WeakPolarHBondContact O-CG 3.3Å; R587-R591 PolarHBondContact O-N 2.9Å; R587-R591 VanDerWaalsContact O-N 3.08Å; R587-R591 PolarHBondContact O-NE 3.3Å; T588-R591 PolarHBondContact O-N 3.48Å; T588-R591 PolarHBondContact OG1-NH2 3.13Å; I589-R591 VanDerWaalsContact C-N 3.33Å; I589-R591 PolarHBondContact O-N 2.98Å; R591-M593 VanDerWaalsContact C-N 3.3Å; R591-M593 PolarHBondContact O-N 2.92Å; R591-N594 PolarHBondContact O-N 2.83Å; R591-I596 HydrophobicContact CG-CD1 4.09Å; R591-L621 HydrophobicContact CG-CD2 4.4Å; R591-D624 IonicContact CZ-OD2 2.83Å; R591-D624 VanDerWaalsContact NH1-CB 3.27Å; R591-D624 IonicContact NH1-OD2 3.25Å; R591-D624 IonicContact NH2-OD2 2.85Å; R591-D624 PolarHBondContact NH2-OD2 3.26Å; R591-D626 IonicContact NH1-OD2 3.66Å; R591-D626 PolarHBondContact NH1-OD2 3.16Å; R591-L630 HydrophobicContact CB-CD1 4.06Å; R591-L630 HydrophobicContact CG-CD1 4Å
592	Q	97.4	Very high	97	Very high	151 Å²	151	39.8 Å²	39.8	71%	0.706	21%	0.209	S	C	*	.	H	α-helix	trans	-63.8	-34.7	178.2	-71.4	171.5	-7	0	0	112.9	T588 I589 N594	T588-Q592 WeakPolarHBondContact O-CG 3.38Å; T588-Q592 PolarHBondContact O-N 3.46Å; I589-Q592 PolarHBondContact O-N 2.9Å; Q592-N594 PolarHBondContact O-N 3.05Å
593	M	97.5	Very high	97.1	Very high	49 Å²	49	35.4 Å²	35.4	24%	0.241	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-1.5	175.5	-70	-64.7	-75.8	0	0	113.5	N535 C538 M539 I542 I589 M590 R591 I595	N535-M593 WeakPolarHBondContact OD1-CE 3.31Å; N535-M593 PolarHBondContact OD1-SD 3.3Å; C538-M593 HydrophobicContact CB-CB 3.93Å; C538-M593 HydrophobicContact CB-CE 3.84Å; C538-M593 HydrophobicContact CB-CG 3.92Å; M539-M593 HydrophobicContact CE-CE 4.45Å; M539-M593 HydrophobicContact CG-CE 3.76Å; I542-M593 HydrophobicContact CD1-CE 4.16Å; I589-M593 HydrophobicContact CG2-CG 4.17Å; I589-M593 WeakPolarHBondContact O-CB 3.49Å; I589-M593 VanDerWaalsContact O-CG 3.29Å; I589-M593 WeakPolarHBondContact O-CG 3.36Å; I589-M593 PolarHBondContact O-N 3.42Å; M590-M593 PolarHBondContact O-N 2.85Å; R591-M593 VanDerWaalsContact C-N 3.3Å; R591-M593 PolarHBondContact O-N 2.92Å; M593-I595 VanDerWaalsContact C-N 3.35Å; M593-I595 HydrophobicContact CB-CG2 4.12Å; M593-I595 PolarHBondContact O-N 3.46Å
594	N	96.8	Very high	97.2	Very high	106 Å²	106	40.2 Å²	40.2	57%	0.567	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.8	44	176.1	-166.7	31.5	0	0	0	113.7	M590 R591 Q592 P597	M590-N594 PolarHBondContact O-N 3.46Å; R591-N594 PolarHBondContact O-N 2.83Å; Q592-N594 PolarHBondContact O-N 3.05Å; N594-P597 WeakPolarHBondContact O-CD 3.2Å
595	I	98	Very high	97.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.195	C	C	.	.			trans	-84.4	-14.6	179.8	67.2	160.4	0	0	0	113.9	C538 F541 I542 L577 M590 M593 I598 L599	C538-I595 HydrophobicContact CB-CG2 4.13Å; F541-I595 HydrophobicContact CD1-CB 4.12Å; F541-I595 HydrophobicContact CD1-CG2 4.09Å; F541-I595 HydrophobicContact CE1-CB 4.06Å; I542-I595 HydrophobicContact CD1-CG2 4.01Å; I542-I595 HydrophobicContact CG1-CG2 4.05Å; L577-I595 HydrophobicContact CD1-CD1 3.79Å; M590-I595 HydrophobicContact CB-CD1 3.78Å; M590-I595 HydrophobicContact CB-CG1 4.02Å; M590-I595 HydrophobicContact CG-CD1 3.79Å; M590-I595 WeakPolarHBondContact O-CG1 3.46Å; M590-I595 PolarHBondContact O-N 3.27Å; M590-I595 HydrophobicContact SD-CD1 4.38Å; M593-I595 VanDerWaalsContact C-N 3.35Å; M593-I595 HydrophobicContact CB-CG2 4.12Å; M593-I595 PolarHBondContact O-N 3.46Å; I595-I598 WeakPolarHBondContact O-CA 2.94Å; I595-I598 WeakPolarHBondContact O-CB 3.07Å; I595-I598 PolarHBondContact O-N 3.41Å; I595-L599 HydrophobicContact CD1-CD1 3.92Å; I595-L599 HydrophobicContact CD1-CG 4.48Å; I595-L599 HydrophobicContact CG1-CD1 4.14Å; I595-L599 PolarHBondContact O-N 3.45Å
596	I	98.2	Very high	96.8	Very high	4 Å²	4	45.1 Å²	45.1	2%	0.021	22%	0.217	C	C	.	.	H	α-helix	trans	-56.5	-45	-176.9	-67	171	0	0	0	112.6	R591 I598 L599 V600 L618 L621 L630 V631 C634	R591-I596 HydrophobicContact CG-CD1 4.09Å; I596-I598 PolarHBondContact O-N 2.76Å; I596-L599 PolarHBondContact O-N 3.2Å; I596-L599 VanDerWaalsContact O-N 3.15Å; I596-V600 HydrophobicContact CG2-CG2 4.32Å; I596-V600 WeakPolarHBondContact O-CG2 3.39Å; I596-V600 PolarHBondContact O-N 3.33Å; I596-L618 HydrophobicContact CG2-CD2 4.08Å; I596-L621 HydrophobicContact CD1-CD1 4.23Å; I596-L621 HydrophobicContact CG1-CD1 3.78Å; I596-L630 HydrophobicContact CD1-CB 3.59Å; I596-L630 HydrophobicContact CD1-CD1 4.05Å; I596-L630 HydrophobicContact CD1-CG 4.48Å; I596-V631 HydrophobicContact CD1-CG2 4.21Å; I596-V631 HydrophobicContact CG2-CB 4.49Å; I596-V631 HydrophobicContact CG2-CG2 3.88Å; I596-C634 HydrophobicContact CG2-CB 4.09Å
597	P	98.1	Very high	96.5	Very high	40 Å²	40	48 Å²	48	26%	0.26	23%	0.234	S	C	.	.	H	α-helix	trans	-59.2	-30.2	176	-23.2	32.3	0	0	0	113.9	N594 Q601	N594-P597 WeakPolarHBondContact O-CD 3.2Å; P597-Q601 WeakPolarHBondContact O-CG 3.46Å; P597-Q601 PolarHBondContact O-N 2.95Å; P597-Q601 PolarHBondContact O-NE2 2.98Å; P597-Q601 VanDerWaalsContact O-NE2 3.08Å
598	I	98.2	Very high	96.2	Very high	19 Å²	19	51.4 Å²	51.4	10%	0.097	25%	0.251	C	S	.	.	H	α-helix	trans	-73.8	-48.2	176.2	-58.4	176.3	0	0	0	109.4	F541 I542 F545 I595 I596 V600 Q601 L602	F541-I598 HydrophobicContact CD1-CG2 4.38Å; F541-I598 HydrophobicContact CE1-CB 3.77Å; F541-I598 HydrophobicContact CE1-CD1 4.37Å; F541-I598 HydrophobicContact CE1-CG2 3.47Å; F541-I598 VanDerWaalsContact CE1-CG2 3.47Å; F541-I598 HydrophobicContact CE2-CG2 4.25Å; F541-I598 HydrophobicContact CZ-CB 4.12Å; F541-I598 HydrophobicContact CZ-CG2 3.4Å; I542-I598 HydrophobicContact CB-CD1 4.32Å; I542-I598 HydrophobicContact CG1-CD1 3.82Å; I542-I598 HydrophobicContact CG2-CD1 4.48Å; F545-I598 HydrophobicContact CB-CG2 3.9Å; F545-I598 HydrophobicContact CD1-CB 4.27Å; F545-I598 HydrophobicContact CD1-CD1 4.09Å; F545-I598 HydrophobicContact CD1-CG1 3.9Å; F545-I598 HydrophobicContact CD1-CG2 3.52Å; F545-I598 HydrophobicContact CD2-CG2 3.58Å; F545-I598 HydrophobicContact CE1-CB 4.42Å; F545-I598 HydrophobicContact CE1-CG1 4.18Å; F545-I598 HydrophobicContact CE1-CG2 3.86Å; F545-I598 HydrophobicContact CE2-CG2 3.92Å; F545-I598 HydrophobicContact CG-CG2 3.36Å; F545-I598 HydrophobicContact CZ-CG2 4.04Å; I595-I598 WeakPolarHBondContact O-CA 2.94Å; I595-I598 WeakPolarHBondContact O-CB 3.07Å; I595-I598 PolarHBondContact O-N 3.41Å; I596-I598 PolarHBondContact O-N 2.76Å; I598-V600 VanDerWaalsContact C-N 3.27Å; I598-V600 PolarHBondContact O-N 3.28Å; I598-Q601 WeakPolarHBondContact O-CB 3.41Å; I598-Q601 PolarHBondContact O-N 3.26Å; I598-L602 HydrophobicContact CG2-CG 4.5Å; I598-L602 WeakPolarHBondContact O-CG 3.1Å; I598-L602 PolarHBondContact O-N 3.21Å
599	L	98.3	Very high	95.9	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-56.7	-41.2	177	-66.4	170.3	0	0	0	111.9	F541 I595 I596 Q601 L602 L603 A614 T617 L618 L621	F541-L599 HydrophobicContact CE1-CD2 4.16Å; F541-L599 HydrophobicContact CE1-CG 4.32Å; F541-L599 HydrophobicContact CZ-CD2 3.8Å; F541-L599 HydrophobicContact CZ-CG 4.32Å; I595-L599 HydrophobicContact CD1-CD1 3.92Å; I595-L599 HydrophobicContact CD1-CG 4.48Å; I595-L599 HydrophobicContact CG1-CD1 4.14Å; I595-L599 PolarHBondContact O-N 3.45Å; I596-L599 PolarHBondContact O-N 3.2Å; I596-L599 VanDerWaalsContact O-N 3.15Å; L599-Q601 PolarHBondContact O-N 3.12Å; L599-L602 PolarHBondContact O-N 3Å; L599-L603 PolarHBondContact O-N 3.47Å; L599-A614 HydrophobicContact CD2-CB 4.46Å; L599-T617 HydrophobicContact CD1-CG2 3.67Å; L599-T617 HydrophobicContact CD2-CG2 4.27Å; L599-L618 HydrophobicContact CB-CD1 4.27Å; L599-L618 HydrophobicContact CB-CD2 3.86Å; L599-L618 HydrophobicContact CB-CG 3.96Å; L599-L618 HydrophobicContact CD1-CD2 4.1Å; L599-L618 HydrophobicContact CD1-CG 4.39Å; L599-L621 HydrophobicContact CD1-CD1 3.85Å
600	V	98	Very high	95.8	Very high	9 Å²	9	49.1 Å²	49.1	6%	0.055	24%	0.236	C	C	.	.	H	α-helix	trans	-63.4	-40.6	175.4	174.5	0	0	0	0	111.6	I596 I598 L602 L603 Y604 L618 C634 A636	I596-V600 HydrophobicContact CG2-CG2 4.32Å; I596-V600 WeakPolarHBondContact O-CG2 3.39Å; I596-V600 PolarHBondContact O-N 3.33Å; I598-V600 VanDerWaalsContact C-N 3.27Å; I598-V600 PolarHBondContact O-N 3.28Å; V600-L602 VanDerWaalsContact C-N 3.32Å; V600-L602 PolarHBondContact O-N 2.97Å; V600-L603 WeakPolarHBondContact O-CB 3.4Å; V600-L603 PolarHBondContact O-N 2.69Å; V600-Y604 HydrophobicContact CG1-CE2 4.48Å; V600-Y604 VanDerWaalsContact O-CD2 3.31Å; V600-Y604 WeakPolarHBondContact O-CD2 3.48Å; V600-L618 HydrophobicContact CG2-CD1 4.26Å; V600-L618 HydrophobicContact CG2-CD2 4.35Å; V600-C634 HydrophobicContact CG2-CB 3.95Å; V600-A636 HydrophobicContact CG1-CB 4.31Å; V600-A636 HydrophobicContact CG2-CB 3.73Å
601	Q	97.1	Very high	95.6	Very high	75 Å²	75	50 Å²	50	35%	0.35	24%	0.24	S	C	.	.	H	α-helix	trans	-63.6	-36.9	174.2	-77.5	170.5	71.9	0	0	112.3	F545 P597 I598 L599 L603 Y604	F545-Q601 HydrophobicContact CZ-CB 3.91Å; P597-Q601 WeakPolarHBondContact O-CG 3.46Å; P597-Q601 PolarHBondContact O-N 2.95Å; P597-Q601 PolarHBondContact O-NE2 2.98Å; P597-Q601 VanDerWaalsContact O-NE2 3.08Å; I598-Q601 WeakPolarHBondContact O-CB 3.41Å; I598-Q601 PolarHBondContact O-N 3.26Å; L599-Q601 PolarHBondContact O-N 3.12Å; Q601-L603 PolarHBondContact O-N 3.34Å; Q601-Y604 WeakPolarHBondContact O-CB 2.99Å; Q601-Y604 PolarHBondContact O-N 3.4Å
602	L	97.2	Very high	95.5	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-65.2	-24.8	177.9	-67.3	-175.6	0	0	0	113.4	F541 F545 V570 I598 L599 V600 Y604 F605 I610 A614	F541-L602 HydrophobicContact CE2-CD1 3.57Å; F541-L602 HydrophobicContact CZ-CD1 3.55Å; F545-L602 HydrophobicContact CD2-CD2 3.92Å; F545-L602 HydrophobicContact CE2-CD2 3.69Å; F545-L602 HydrophobicContact CE2-CG 4.38Å; V570-L602 HydrophobicContact CG1-CD1 3.85Å; V570-L602 HydrophobicContact CG1-CD2 3.89Å; I598-L602 HydrophobicContact CG2-CG 4.5Å; I598-L602 WeakPolarHBondContact O-CG 3.1Å; I598-L602 PolarHBondContact O-N 3.21Å; L599-L602 PolarHBondContact O-N 3Å; V600-L602 VanDerWaalsContact C-N 3.32Å; V600-L602 PolarHBondContact O-N 2.97Å; L602-Y604 PolarHBondContact O-N 3.23Å; L602-Y604 VanDerWaalsContact O-N 3.15Å; L602-F605 HydrophobicContact CD2-CD1 4.18Å; L602-F605 HydrophobicContact CD2-CD2 3.98Å; L602-F605 HydrophobicContact CD2-CE1 3.96Å; L602-F605 HydrophobicContact CD2-CE2 3.75Å; L602-F605 HydrophobicContact CD2-CG 4.2Å; L602-F605 HydrophobicContact CD2-CZ 3.75Å; L602-F605 WeakPolarHBondContact O-CB 3.27Å; L602-F605 PolarHBondContact O-N 2.95Å; L602-F605 VanDerWaalsContact O-N 3.1Å; L602-I610 HydrophobicContact CB-CG2 3.78Å; L602-I610 HydrophobicContact CD1-CG2 4.15Å; L602-I610 HydrophobicContact CD2-CG2 3.85Å; L602-I610 HydrophobicContact CG-CG2 4.12Å; L602-A614 HydrophobicContact CB-CB 3.79Å
603	L	96.9	Very high	95.4	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-21.3	172.3	-60.5	179.5	0	0	0	113	L599 V600 Q601 Q611 A614 A615 L618 R639 L640 L643	L599-L603 PolarHBondContact O-N 3.47Å; V600-L603 WeakPolarHBondContact O-CB 3.4Å; V600-L603 PolarHBondContact O-N 2.69Å; Q601-L603 PolarHBondContact O-N 3.34Å; L603-Q611 PolarHBondContact O-NE2 2.86Å; L603-A614 HydrophobicContact CD2-CB 3.93Å; L603-A615 HydrophobicContact CD2-CB 3.94Å; L603-L618 HydrophobicContact CD1-CD1 3.72Å; L603-L618 HydrophobicContact CD2-CD1 4.21Å; L603-L618 HydrophobicContact CG-CD1 4.09Å; L603-R639 HydrophobicContact CB-CB 4.48Å; L603-R639 HydrophobicContact CB-CG 3.6Å; L603-R639 HydrophobicContact CD1-CG 4.4Å; L603-R639 PolarHBondContact O-NE 2.91Å; L603-R639 PolarHBondContact O-NH2 3.34Å; L603-L640 HydrophobicContact CD1-CD2 3.83Å; L603-L640 HydrophobicContact CD1-CG 4.08Å; L603-L643 HydrophobicContact CB-CD1 4.23Å; L603-L643 HydrophobicContact CD2-CD1 3.93Å
604	Y	95.4	Very high	95.5	Very high	121 Å²	121	39.5 Å²	39.5	48%	0.475	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-5.9	178.6	-66.6	-91	0	0	0	113.6	V600 Q601 L602 R639	V600-Y604 HydrophobicContact CG1-CE2 4.48Å; V600-Y604 VanDerWaalsContact O-CD2 3.31Å; V600-Y604 WeakPolarHBondContact O-CD2 3.48Å; Q601-Y604 WeakPolarHBondContact O-CB 2.99Å; Q601-Y604 PolarHBondContact O-N 3.4Å; L602-Y604 PolarHBondContact O-N 3.23Å; L602-Y604 VanDerWaalsContact O-N 3.15Å; Y604-R639 HydrophobicContact CD1-CG 4.25Å; Y604-R639 HydrophobicContact CD2-CG 4.23Å; Y604-R639 HydrophobicContact CE1-CB 4.06Å; Y604-R639 HydrophobicContact CE1-CG 4.03Å; Y604-R639 HydrophobicContact CE2-CB 3.9Å; Y604-R639 HydrophobicContact CE2-CG 4.01Å; Y604-R639 HydrophobicContact CG-CG 4.36Å
605	F	92.8	Very high	95.5	Very high	29 Å²	29	34.5 Å²	34.5	13%	0.127	17%	0.166	C	C	.	.	S	Bend	trans	-70.6	149.8	177.8	-80.3	35	0	0	0	110.1	F545 V548 L567 L602 V607 I610 Q611	F545-F605 HydrophobicContact CE2-CE1 4.27Å; F545-F605 AromaticContact CE2-CZ 3.91Å; F545-F605 HydrophobicContact CE2-CZ 3.91Å; V548-F605 HydrophobicContact CG1-CE2 4.19Å; V548-F605 HydrophobicContact CG1-CZ 4.13Å; L567-F605 HydrophobicContact CD1-CD2 4.26Å; L567-F605 HydrophobicContact CD1-CE2 3.88Å; L602-F605 HydrophobicContact CD2-CD1 4.18Å; L602-F605 HydrophobicContact CD2-CD2 3.98Å; L602-F605 HydrophobicContact CD2-CE1 3.96Å; L602-F605 HydrophobicContact CD2-CE2 3.75Å; L602-F605 HydrophobicContact CD2-CG 4.2Å; L602-F605 HydrophobicContact CD2-CZ 3.75Å; L602-F605 WeakPolarHBondContact O-CB 3.27Å; L602-F605 PolarHBondContact O-N 2.95Å; L602-F605 VanDerWaalsContact O-N 3.1Å; F605-V607 VanDerWaalsContact C-N 3.29Å; F605-I610 HydrophobicContact CB-CG2 4.17Å; F605-I610 HydrophobicContact CD2-CD1 4.08Å; F605-I610 HydrophobicContact CD2-CG2 4.18Å; F605-I610 HydrophobicContact CG-CG2 4.36Å; F605-Q611 VanDerWaalsContact O-CD 3.32Å; F605-Q611 WeakPolarHBondContact O-CG 3.45Å; F605-Q611 PolarHBondContact O-NE2 3.45Å
606	E	88.6	Confident	95.5	Very high	195 Å²	195	34.5 Å²	34.5	91%	0.911	17%	0.166	S	C	*	.	S	Bend	trans	-75.5	-20.2	179.1	-64	-177.5	173.9	0	0	112.9	E608	E606-E608 PolarHBondContact O-N 2.86Å
607	V	89.8	Confident	95.5	Very high	63 Å²	63	34.3 Å²	34.3	38%	0.382	17%	0.165	S	C	.	.			trans	-73.9	108.3	-179.3	-175.7	0	0	0	0	109.8	F605 H609 I610 Q611	F605-V607 VanDerWaalsContact C-N 3.29Å; V607-H609 VanDerWaalsContact C-N 3.31Å; V607-H609 PolarHBondContact O-N 3.12Å; V607-I610 HydrophobicContact CB-CB 4.17Å; V607-I610 HydrophobicContact CB-CD1 3.96Å; V607-I610 HydrophobicContact CB-CG1 4.07Å; V607-I610 HydrophobicContact CG1-CB 4.36Å; V607-I610 HydrophobicContact CG1-CD1 4.14Å; V607-I610 HydrophobicContact CG1-CG1 3.94Å; V607-I610 HydrophobicContact CG2-CD1 4.33Å; V607-I610 WeakPolarHBondContact O-CB 3.31Å; V607-I610 PolarHBondContact O-N 3.4Å; V607-Q611 PolarHBondContact O-N 3.49Å; V607-Q611 VanDerWaalsContact O-N 3.16Å
608	E	92	Very high	95.5	Very high	95 Å²	95	32.4 Å²	32.4	44%	0.444	15%	0.152	S	C	.	.	H	α-helix	trans	-56.3	-39.7	-175.4	-170.8	179.9	154.7	0	0	113.3	E606 I610 Q611 L612 N648 I651	E606-E608 PolarHBondContact O-N 2.86Å; E608-I610 PolarHBondContact O-N 2.94Å; E608-Q611 WeakPolarHBondContact O-CB 3.47Å; E608-Q611 PolarHBondContact O-N 3.34Å; E608-L612 PolarHBondContact O-N 3.09Å; E608-N648 WeakPolarHBondContact OE1-CB 3.46Å; E608-N648 PolarHBondContact OE1-ND2 3.41Å; E608-I651 HydrophobicContact CG-CD1 3.68Å
609	H	90	Very high	95.5	Very high	43 Å²	43	31.6 Å²	31.6	20%	0.199	15%	0.149	C	C	.	.	H	α-helix	trans	-64.7	-38.3	177.7	-179.7	-109.3	0	0	0	112.4	E571 V607 Q611 L612 V613	E571-H609 VanDerWaalsContact CD-ND1 3.25Å; E571-H609 VanDerWaalsContact CG-ND1 3.26Å; E571-H609 WeakPolarHBondContact CG-ND1 3.37Å; E571-H609 IonicContact OE1-CE1 2.93Å; E571-H609 PolarHBondContact OE1-CE1 3.3Å; E571-H609 VanDerWaalsContact OE1-CE1 3.27Å; E571-H609 IonicContact OE1-CG 3.18Å; E571-H609 IonicContact OE1-ND1 2.81Å; E571-H609 PolarHBondContact OE1-ND1 3.32Å; V607-H609 VanDerWaalsContact C-N 3.31Å; V607-H609 PolarHBondContact O-N 3.12Å; H609-Q611 VanDerWaalsContact C-N 3.34Å; H609-L612 PolarHBondContact O-N 3.26Å; H609-V613 WeakPolarHBondContact O-CG2 3.47Å; H609-V613 PolarHBondContact O-N 3.36Å
610	I	94.7	Very high	95.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-63.2	-42.5	174.7	-69.3	-178.9	0	0	0	110.3	L567 E571 L602 F605 V607 E608 L612 V613 A614	L567-I610 HydrophobicContact CD1-CD1 3.61Å; L567-I610 HydrophobicContact CG-CD1 4.12Å; E571-I610 HydrophobicContact CB-CD1 4.46Å; E571-I610 HydrophobicContact CB-CG1 4.14Å; E571-I610 HydrophobicContact CG-CG1 4.1Å; L602-I610 HydrophobicContact CB-CG2 3.78Å; L602-I610 HydrophobicContact CD1-CG2 4.15Å; L602-I610 HydrophobicContact CD2-CG2 3.85Å; L602-I610 HydrophobicContact CG-CG2 4.12Å; F605-I610 HydrophobicContact CB-CG2 4.17Å; F605-I610 HydrophobicContact CD2-CD1 4.08Å; F605-I610 HydrophobicContact CD2-CG2 4.18Å; F605-I610 HydrophobicContact CG-CG2 4.36Å; V607-I610 HydrophobicContact CB-CB 4.17Å; V607-I610 HydrophobicContact CB-CD1 3.96Å; V607-I610 HydrophobicContact CB-CG1 4.07Å; V607-I610 HydrophobicContact CG1-CB 4.36Å; V607-I610 HydrophobicContact CG1-CD1 4.14Å; V607-I610 HydrophobicContact CG1-CG1 3.94Å; V607-I610 HydrophobicContact CG2-CD1 4.33Å; V607-I610 WeakPolarHBondContact O-CB 3.31Å; V607-I610 PolarHBondContact O-N 3.4Å; E608-I610 PolarHBondContact O-N 2.94Å; I610-L612 VanDerWaalsContact C-N 3.34Å; I610-L612 PolarHBondContact O-N 3.5Å; I610-V613 WeakPolarHBondContact O-CG2 3.29Å; I610-A614 VanDerWaalsContact O-CB 3.23Å; I610-A614 WeakPolarHBondContact O-CB 3.34Å; I610-A614 PolarHBondContact O-N 3.48Å
611	Q	95.5	Very high	95.4	Very high	18 Å²	18	33 Å²	33	8%	0.084	15%	0.154	C	C	.	.	H	α-helix	trans	-61.7	-42.6	174.7	-64.8	179.4	-22.5	0	0	111.7	L603 F605 V607 E608 H609 A614 A615 R639 I651	L603-Q611 PolarHBondContact O-NE2 2.86Å; F605-Q611 VanDerWaalsContact O-CD 3.32Å; F605-Q611 WeakPolarHBondContact O-CG 3.45Å; F605-Q611 PolarHBondContact O-NE2 3.45Å; V607-Q611 PolarHBondContact O-N 3.49Å; V607-Q611 VanDerWaalsContact O-N 3.16Å; E608-Q611 WeakPolarHBondContact O-CB 3.47Å; E608-Q611 PolarHBondContact O-N 3.34Å; H609-Q611 VanDerWaalsContact C-N 3.34Å; Q611-A614 PolarHBondContact O-N 3.09Å; Q611-A615 VanDerWaalsContact O-CB 3.24Å; Q611-A615 WeakPolarHBondContact O-CB 3.47Å; Q611-A615 PolarHBondContact O-N 3.08Å; Q611-R639 VanDerWaalsContact NE2-NH2 3.17Å; Q611-I651 HydrophobicContact CB-CD1 4.15Å
612	L	95.7	Very high	95.5	Very high	9 Å²	9	29.4 Å²	29.4	5%	0.047	14%	0.138	C	C	.	.	H	α-helix	trans	-60.4	-50.9	179.4	-175.4	152.5	0	0	0	111.9	E608 H609 I610 A614 A615 G616 T650 I651 V703	E608-L612 PolarHBondContact O-N 3.09Å; H609-L612 PolarHBondContact O-N 3.26Å; I610-L612 VanDerWaalsContact C-N 3.34Å; I610-L612 PolarHBondContact O-N 3.5Å; L612-A614 VanDerWaalsContact C-N 3.34Å; L612-A614 PolarHBondContact O-N 2.96Å; L612-A615 PolarHBondContact O-N 3.09Å; L612-G616 PolarHBondContact O-N 3.23Å; L612-T650 HydrophobicContact CD1-CG2 4.04Å; L612-T650 HydrophobicContact CG-CG2 4.33Å; L612-I651 HydrophobicContact CB-CD1 4.04Å; L612-I651 HydrophobicContact CB-CG1 3.77Å; L612-I651 HydrophobicContact CD1-CG1 4.24Å; L612-I651 HydrophobicContact CG-CG1 4.14Å; L612-V703 HydrophobicContact CD2-CG1 4.06Å
613	V	95.8	Very high	95.4	Very high	4 Å²	4	32.9 Å²	32.9	2%	0.024	16%	0.156	C	C	.	.	H	α-helix	trans	-69.9	-33	-179	-60.7	0	0	0	0	111.9	A574 A575 H609 I610 T617	A574-V613 HydrophobicContact CB-CB 4.39Å; A574-V613 HydrophobicContact CB-CG2 3.62Å; A575-V613 HydrophobicContact CB-CB 4.47Å; A575-V613 HydrophobicContact CB-CG1 3.84Å; H609-V613 WeakPolarHBondContact O-CG2 3.47Å; H609-V613 PolarHBondContact O-N 3.36Å; I610-V613 WeakPolarHBondContact O-CG2 3.29Å; V613-T617 WeakPolarHBondContact O-CB 3.28Å; V613-T617 PolarHBondContact O-N 2.99Å; V613-T617 PolarHBondContact O-OG1 3.36Å
614	A	97.8	Very high	95.3	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-67	-48.5	174.3	0	0	0	0	0	111.8	L599 L602 L603 I610 Q611 L612 T617 L618	L599-A614 HydrophobicContact CD2-CB 4.46Å; L602-A614 HydrophobicContact CB-CB 3.79Å; L603-A614 HydrophobicContact CD2-CB 3.93Å; I610-A614 VanDerWaalsContact O-CB 3.23Å; I610-A614 WeakPolarHBondContact O-CB 3.34Å; I610-A614 PolarHBondContact O-N 3.48Å; Q611-A614 PolarHBondContact O-N 3.09Å; L612-A614 VanDerWaalsContact C-N 3.34Å; L612-A614 PolarHBondContact O-N 2.96Å; A614-T617 PolarHBondContact O-N 3.46Å; A614-L618 WeakPolarHBondContact O-CB 3.41Å; A614-L618 VanDerWaalsContact O-CG 3.28Å; A614-L618 WeakPolarHBondContact O-CG 3.41Å; A614-L618 PolarHBondContact O-N 2.92Å
615	A	97.7	Very high	95.2	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63	-42.6	177.3	0	0	0	0	0	111.7	L603 Q611 L612 L618 S619	L603-A615 HydrophobicContact CD2-CB 3.94Å; Q611-A615 VanDerWaalsContact O-CB 3.24Å; Q611-A615 WeakPolarHBondContact O-CB 3.47Å; Q611-A615 PolarHBondContact O-N 3.08Å; L612-A615 PolarHBondContact O-N 3.09Å; A615-L618 PolarHBondContact O-N 3.37Å; A615-S619 WeakPolarHBondContact O-CB 3.41Å; A615-S619 PolarHBondContact O-N 3.37Å
616	G	97.6	Very high	95.3	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.6	-48.8	175.3	0	0	0	0	0	112.4	H578 L612 L618 S619 E620	H578-G616 WeakPolarHBondContact NE2-CA 3.37Å; L612-G616 PolarHBondContact O-N 3.23Å; G616-L618 PolarHBondContact O-N 3.3Å; G616-S619 WeakPolarHBondContact O-CB 3.42Å; G616-S619 PolarHBondContact O-N 3.32Å; G616-E620 PolarHBondContact O-N 3.39Å
617	T	98.1	Very high	95.6	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-60.8	-43.9	177	-50	0	0	0	0	111.6	L577 H578 M590 L599 V613 A614 S619 E620 L621	L577-T617 HydrophobicContact CB-CG2 4.41Å; H578-T617 WeakPolarHBondContact CA-OG1 3.4Å; H578-T617 VanDerWaalsContact CB-OG1 3.28Å; H578-T617 WeakPolarHBondContact CB-OG1 3.19Å; H578-T617 PolarHBondContact CD2-N 2.96Å; H578-T617 PolarHBondContact N-OG1 3.43Å; M590-T617 HydrophobicContact SD-CG2 4.42Å; L599-T617 HydrophobicContact CD1-CG2 3.67Å; L599-T617 HydrophobicContact CD2-CG2 4.27Å; V613-T617 WeakPolarHBondContact O-CB 3.28Å; V613-T617 PolarHBondContact O-N 2.99Å; V613-T617 PolarHBondContact O-OG1 3.36Å; A614-T617 PolarHBondContact O-N 3.46Å; T617-S619 VanDerWaalsContact C-N 3.33Å; T617-S619 PolarHBondContact O-N 3.4Å; T617-E620 PolarHBondContact O-N 2.92Å; T617-L621 HydrophobicContact CG2-CD1 4.22Å; T617-L621 HydrophobicContact CG2-CG 4.48Å; T617-L621 VanDerWaalsContact O-CG 3.26Å; T617-L621 WeakPolarHBondContact O-CG 3.47Å; T617-L621 PolarHBondContact O-N 3.34Å
618	L	98.3	Very high	95.9	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-62.2	-41.3	176.2	-71	170.1	0	0	0	111.6	I596 L599 V600 L603 A614 A615 G616 E620 L621 T622 V631	I596-L618 HydrophobicContact CG2-CD2 4.08Å; L599-L618 HydrophobicContact CB-CD1 4.27Å; L599-L618 HydrophobicContact CB-CD2 3.86Å; L599-L618 HydrophobicContact CB-CG 3.96Å; L599-L618 HydrophobicContact CD1-CD2 4.1Å; L599-L618 HydrophobicContact CD1-CG 4.39Å; V600-L618 HydrophobicContact CG2-CD1 4.26Å; V600-L618 HydrophobicContact CG2-CD2 4.35Å; L603-L618 HydrophobicContact CD1-CD1 3.72Å; L603-L618 HydrophobicContact CD2-CD1 4.21Å; L603-L618 HydrophobicContact CG-CD1 4.09Å; A614-L618 WeakPolarHBondContact O-CB 3.41Å; A614-L618 VanDerWaalsContact O-CG 3.28Å; A614-L618 WeakPolarHBondContact O-CG 3.41Å; A614-L618 PolarHBondContact O-N 2.92Å; A615-L618 PolarHBondContact O-N 3.37Å; G616-L618 PolarHBondContact O-N 3.3Å; L618-E620 VanDerWaalsContact C-N 3.34Å; L618-E620 PolarHBondContact O-N 3.18Å; L618-L621 PolarHBondContact O-N 3.31Å; L618-T622 WeakPolarHBondContact O-CG2 3.35Å; L618-T622 PolarHBondContact O-N 2.96Å; L618-T622 PolarHBondContact O-OG1 2.94Å; L618-V631 HydrophobicContact CD2-CG1 4.31Å; L618-V631 HydrophobicContact CD2-CG2 3.75Å
619	S	97.8	Very high	96.1	Very high	3 Å²	3	25.4 Å²	25.4	2%	0.021	14%	0.139	C	C	.	.	H	α-helix	trans	-57.9	-47.8	175.8	-160.3	0	0	0	0	111.1	A615 G616 T617 L621 T622 T658 R661	A615-S619 WeakPolarHBondContact O-CB 3.41Å; A615-S619 PolarHBondContact O-N 3.37Å; G616-S619 WeakPolarHBondContact O-CB 3.42Å; G616-S619 PolarHBondContact O-N 3.32Å; T617-S619 VanDerWaalsContact C-N 3.33Å; T617-S619 PolarHBondContact O-N 3.4Å; S619-L621 PolarHBondContact O-N 3.26Å; S619-T622 PolarHBondContact O-N 3.23Å; S619-T622 PolarHBondContact O-OG1 3.07Å; S619-T658 WeakPolarHBondContact CA-OG1 3.39Å; S619-T658 WeakPolarHBondContact CB-OG1 3.44Å; S619-T658 PolarHBondContact N-OG1 2.98Å; S619-T658 PolarHBondContact OG-OG1 2.93Å; S619-R661 PolarHBondContact O-NH1 3.27Å; S619-R661 PolarHBondContact OG-NH1 3.46Å
620	E	97.7	Very high	96.4	Very high	37 Å²	37	26 Å²	26	17%	0.173	14%	0.143	C	C	.	.	H	α-helix	trans	-62	-42.9	176.1	-71.8	-58.7	150.3	0	0	112.3	S581 R587 G616 T617 L618 T622 N623	S581-E620 WeakPolarHBondContact OG-CB 3.42Å; S581-E620 WeakPolarHBondContact OG-CG 3.49Å; R587-E620 WeakPolarHBondContact CD-O 3.25Å; G616-E620 PolarHBondContact O-N 3.39Å; T617-E620 PolarHBondContact O-N 2.92Å; L618-E620 VanDerWaalsContact C-N 3.34Å; L618-E620 PolarHBondContact O-N 3.18Å; E620-T622 VanDerWaalsContact C-N 3.26Å; E620-T622 PolarHBondContact O-N 3.12Å; E620-N623 VanDerWaalsContact O-CB 3.28Å; E620-N623 WeakPolarHBondContact O-CB 3.39Å; E620-N623 PolarHBondContact O-N 3.42Å; E620-N623 VanDerWaalsContact O-N 3.1Å; E620-N623 PolarHBondContact O-ND2 3.08Å; E620-N623 PolarHBondContact OE2-ND2 3.27Å
621	L	98	Very high	96.5	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.3	-31.9	177.5	-68.9	174.1	0	0	0	112.9	R587 M590 R591 I596 L599 T617 L618 S619 N623 D624 G627	R587-L621 HydrophobicContact CB-CD2 3.84Å; R587-L621 HydrophobicContact CG-CD2 4.01Å; M590-L621 HydrophobicContact CB-CD2 3.99Å; M590-L621 HydrophobicContact SD-CD2 4.12Å; R591-L621 HydrophobicContact CG-CD2 4.4Å; I596-L621 HydrophobicContact CD1-CD1 4.23Å; I596-L621 HydrophobicContact CG1-CD1 3.78Å; L599-L621 HydrophobicContact CD1-CD1 3.85Å; T617-L621 HydrophobicContact CG2-CD1 4.22Å; T617-L621 HydrophobicContact CG2-CG 4.48Å; T617-L621 VanDerWaalsContact O-CG 3.26Å; T617-L621 WeakPolarHBondContact O-CG 3.47Å; T617-L621 PolarHBondContact O-N 3.34Å; L618-L621 PolarHBondContact O-N 3.31Å; S619-L621 PolarHBondContact O-N 3.26Å; L621-N623 PolarHBondContact O-N 2.84Å; L621-D624 PolarHBondContact O-N 3.38Å; L621-G627 WeakPolarHBondContact O-CA 3.38Å
622	T	97.5	Very high	96.4	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.006	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	1.1	176.1	60	0	0	0	0	114.9	L618 S619 E620 D624 I628 V631 T658 R661 M662	L618-T622 WeakPolarHBondContact O-CG2 3.35Å; L618-T622 PolarHBondContact O-N 2.96Å; L618-T622 PolarHBondContact O-OG1 2.94Å; S619-T622 PolarHBondContact O-N 3.23Å; S619-T622 PolarHBondContact O-OG1 3.07Å; E620-T622 VanDerWaalsContact C-N 3.26Å; E620-T622 PolarHBondContact O-N 3.12Å; T622-D624 PolarHBondContact O-N 2.88Å; T622-I628 HydrophobicContact CG2-CG1 4.25Å; T622-I628 WeakPolarHBondContact O-CG1 3.23Å; T622-V631 HydrophobicContact CG2-CB 4.19Å; T622-V631 HydrophobicContact CG2-CG1 4.37Å; T622-V631 HydrophobicContact CG2-CG2 4.02Å; T622-T658 HydrophobicContact CG2-CG2 3.69Å; T622-R661 WeakPolarHBondContact O-CD 3.48Å; T622-R661 PolarHBondContact OG1-NH1 2.81Å; T622-M662 HydrophobicContact CG2-CG 4.4Å
623	N	96.1	Very high	96.4	Very high	72 Å²	72	35 Å²	35	39%	0.385	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-17.5	168.2	-72.4	-38.5	0	0	0	112.6	E620 L621 R661	E620-N623 VanDerWaalsContact O-CB 3.28Å; E620-N623 WeakPolarHBondContact O-CB 3.39Å; E620-N623 PolarHBondContact O-N 3.42Å; E620-N623 VanDerWaalsContact O-N 3.1Å; E620-N623 PolarHBondContact O-ND2 3.08Å; E620-N623 PolarHBondContact OE2-ND2 3.27Å; L621-N623 PolarHBondContact O-N 2.84Å; N623-R661 VanDerWaalsContact OD1-CZ 3.28Å; N623-R661 PolarHBondContact OD1-NE 3.36Å; N623-R661 VanDerWaalsContact OD1-NE 3.12Å; N623-R661 PolarHBondContact OD1-NH2 3.17Å
624	D	94.7	Very high	96.4	Very high	35 Å²	35	37 Å²	37	19%	0.187	20%	0.198	C	C	.	.	S	Bend	trans	-110.9	141.8	176.3	-48.6	-54.3	0	0	0	110.8	R587 R591 L621 T622 D626 G627 I628	R587-D624 IonicContact CZ-OD1 2.8Å; R587-D624 IonicContact CZ-OD2 3.92Å; R587-D624 IonicContact NE-OD1 3.69Å; R587-D624 IonicContact NE-OD2 3.59Å; R587-D624 PolarHBondContact NE-OD2 3.23Å; R587-D624 IonicContact NH2-OD1 2.73Å; R587-D624 PolarHBondContact NH2-OD1 3.13Å; R587-D624 IonicContact NH2-OD2 3.7Å; R591-D624 IonicContact CZ-OD2 2.83Å; R591-D624 VanDerWaalsContact NH1-CB 3.27Å; R591-D624 IonicContact NH1-OD2 3.25Å; R591-D624 IonicContact NH2-OD2 2.85Å; R591-D624 PolarHBondContact NH2-OD2 3.26Å; L621-D624 PolarHBondContact O-N 3.38Å; T622-D624 PolarHBondContact O-N 2.88Å; D624-D626 VanDerWaalsContact C-N 3.34Å; D624-D626 PolarHBondContact O-N 3.07Å; D624-G627 WeakPolarHBondContact O-CA 3.48Å; D624-G627 PolarHBondContact O-N 3.34Å; D624-I628 PolarHBondContact O-N 3.19Å; D624-I628 VanDerWaalsContact O-N 3.1Å
625	S	93.5	Very high	96.2	Very high	89 Å²	89	38.7 Å²	38.7	62%	0.622	22%	0.216	S	C	*	.	H	α-helix	trans	-57.6	-40.5	-178	-55	0	0	0	0	113.7	G627 I628 I629	S625-G627 PolarHBondContact O-N 3.11Å; S625-I628 WeakPolarHBondContact O-CB 3.48Å; S625-I628 PolarHBondContact O-N 3.47Å; S625-I629 WeakPolarHBondContact O-CG1 3.16Å; S625-I629 PolarHBondContact O-N 3.4Å; S625-I629 VanDerWaalsContact O-N 3.14Å
626	D	94.6	Very high	96.1	Very high	99 Å²	99	38.7 Å²	38.7	53%	0.529	22%	0.216	S	C	.	.	H	α-helix	trans	-66.3	-30.6	176.8	-38.4	-55.5	0	0	0	111.4	R591 D624 I629 L630	R591-D626 IonicContact NH1-OD2 3.66Å; R591-D626 PolarHBondContact NH1-OD2 3.16Å; D624-D626 VanDerWaalsContact C-N 3.34Å; D624-D626 PolarHBondContact O-N 3.07Å; D626-I629 PolarHBondContact O-N 3.31Å; D626-L630 WeakPolarHBondContact O-CB 3.47Å; D626-L630 VanDerWaalsContact O-CG 3.25Å; D626-L630 WeakPolarHBondContact O-CG 3.27Å; D626-L630 PolarHBondContact O-N 2.88Å
627	G	95.8	Very high	95.9	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-65.7	-43.9	175.1	0	0	0	0	0	111.5	L621 D624 S625 I629 L630 V631	L621-G627 WeakPolarHBondContact O-CA 3.38Å; D624-G627 WeakPolarHBondContact O-CA 3.48Å; D624-G627 PolarHBondContact O-N 3.34Å; S625-G627 PolarHBondContact O-N 3.11Å; G627-I629 VanDerWaalsContact C-N 3.33Å; G627-I629 PolarHBondContact O-N 3.15Å; G627-L630 PolarHBondContact O-N 3.31Å; G627-V631 WeakPolarHBondContact O-CB 3.38Å; G627-V631 VanDerWaalsContact O-CG2 3.23Å; G627-V631 WeakPolarHBondContact O-CG2 3.36Å; G627-V631 PolarHBondContact O-N 2.79Å
628	I	95.9	Very high	95.7	Very high	37 Å²	37	43.6 Å²	43.6	19%	0.19	25%	0.247	C	C	.	.	H	α-helix	trans	-54.4	-50.3	173.3	-67.2	170.2	0	0	0	110.9	T622 D624 S625 L630 V631 E632 R661 M662	T622-I628 HydrophobicContact CG2-CG1 4.25Å; T622-I628 WeakPolarHBondContact O-CG1 3.23Å; D624-I628 PolarHBondContact O-N 3.19Å; D624-I628 VanDerWaalsContact O-N 3.1Å; S625-I628 WeakPolarHBondContact O-CB 3.48Å; S625-I628 PolarHBondContact O-N 3.47Å; I628-L630 PolarHBondContact O-N 3.13Å; I628-V631 PolarHBondContact O-N 2.79Å; I628-E632 WeakPolarHBondContact O-CB 3.42Å; I628-E632 PolarHBondContact O-N 3.18Å; I628-R661 HydrophobicContact CD1-CB 4.27Å; I628-M662 HydrophobicContact CG2-CB 4.35Å; I628-M662 HydrophobicContact CG2-CG 4.09Å
629	I	95.1	Very high	95.6	Very high	86 Å²	86	45.9 Å²	45.9	44%	0.441	26%	0.256	S	S	.	.	H	α-helix	trans	-60.2	-48.3	-179	-65.8	167.3	0	0	0	110.8	S625 D626 G627 E632 Q633	S625-I629 WeakPolarHBondContact O-CG1 3.16Å; S625-I629 PolarHBondContact O-N 3.4Å; S625-I629 VanDerWaalsContact O-N 3.14Å; D626-I629 PolarHBondContact O-N 3.31Å; G627-I629 VanDerWaalsContact C-N 3.33Å; G627-I629 PolarHBondContact O-N 3.15Å; I629-E632 PolarHBondContact O-N 3.43Å; I629-Q633 HydrophobicContact CG2-CG 4.39Å; I629-Q633 VanDerWaalsContact CG2-NE2 3.34Å; I629-Q633 WeakPolarHBondContact O-CB 3.32Å; I629-Q633 VanDerWaalsContact O-CG 3.23Å; I629-Q633 WeakPolarHBondContact O-CG 3.46Å; I629-Q633 PolarHBondContact O-N 3.35Å
630	L	96.8	Very high	95.4	Very high	56 Å²	56	45.7 Å²	45.7	29%	0.293	26%	0.255	S	S	.	.	H	α-helix	trans	-67.3	-41.4	-177.3	-70.8	170.9	0	0	0	112.5	R591 I596 D626 G627 I628 E632 Q633 C634	R591-L630 HydrophobicContact CB-CD1 4.06Å; R591-L630 HydrophobicContact CG-CD1 4Å; I596-L630 HydrophobicContact CD1-CB 3.59Å; I596-L630 HydrophobicContact CD1-CD1 4.05Å; I596-L630 HydrophobicContact CD1-CG 4.48Å; D626-L630 WeakPolarHBondContact O-CB 3.47Å; D626-L630 VanDerWaalsContact O-CG 3.25Å; D626-L630 WeakPolarHBondContact O-CG 3.27Å; D626-L630 PolarHBondContact O-N 2.88Å; G627-L630 PolarHBondContact O-N 3.31Å; I628-L630 PolarHBondContact O-N 3.13Å; L630-E632 VanDerWaalsContact C-N 3.34Å; L630-Q633 PolarHBondContact O-N 2.8Å; L630-C634 PolarHBondContact O-N 3.03Å; L630-C634 PolarHBondContact O-SG 3.39Å
631	V	96.5	Very high	95.2	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-64	-40.8	177	173.4	0	0	0	0	110.8	I596 L618 T622 G627 I628 C634 A636 T658 M662	I596-V631 HydrophobicContact CD1-CG2 4.21Å; I596-V631 HydrophobicContact CG2-CB 4.49Å; I596-V631 HydrophobicContact CG2-CG2 3.88Å; L618-V631 HydrophobicContact CD2-CG1 4.31Å; L618-V631 HydrophobicContact CD2-CG2 3.75Å; T622-V631 HydrophobicContact CG2-CB 4.19Å; T622-V631 HydrophobicContact CG2-CG1 4.37Å; T622-V631 HydrophobicContact CG2-CG2 4.02Å; G627-V631 WeakPolarHBondContact O-CB 3.38Å; G627-V631 VanDerWaalsContact O-CG2 3.23Å; G627-V631 WeakPolarHBondContact O-CG2 3.36Å; G627-V631 PolarHBondContact O-N 2.79Å; I628-V631 PolarHBondContact O-N 2.79Å; V631-C634 PolarHBondContact O-N 2.83Å; V631-A636 HydrophobicContact CG1-CB 3.6Å; V631-A636 PolarHBondContact O-N 3.25Å; V631-T658 HydrophobicContact CG1-CG2 4.4Å; V631-M662 HydrophobicContact CG1-CE 4.31Å; V631-M662 HydrophobicContact CG1-SD 3.91Å
632	E	93.7	Very high	95	Very high	71 Å²	71	50.7 Å²	50.7	33%	0.332	28%	0.281	S	S	.	.	H	α-helix	trans	-65.1	-46.3	175.2	-169	168.6	-165.9	0	0	112	I628 I629 L630 C634 G635 M662 K666	I628-E632 WeakPolarHBondContact O-CB 3.42Å; I628-E632 PolarHBondContact O-N 3.18Å; I629-E632 PolarHBondContact O-N 3.43Å; L630-E632 VanDerWaalsContact C-N 3.34Å; E632-C634 PolarHBondContact O-N 3.31Å; E632-G635 PolarHBondContact O-N 3.04Å; E632-M662 HydrophobicContact CB-CE 3.71Å; E632-M662 HydrophobicContact CG-CE 4.03Å; E632-K666 VanDerWaalsContact OE1-CE 3.26Å; E632-K666 WeakPolarHBondContact OE1-CE 3.09Å; E632-K666 IonicContact OE1-NZ 2.6Å; E632-K666 PolarHBondContact OE1-NZ 2.66Å; E632-K666 IonicContact OE2-NZ 2.95Å; E632-K666 PolarHBondContact OE2-NZ 3.19Å
633	Q	95.3	Very high	94.8	Very high	146 Å²	146	51.1 Å²	51.1	68%	0.682	28%	0.283	S	S	*	.	H	α-helix	trans	-61	-30.1	178.3	-75.8	174.3	-2	0	0	113.1	I629 L630 G635	I629-Q633 HydrophobicContact CG2-CG 4.39Å; I629-Q633 VanDerWaalsContact CG2-NE2 3.34Å; I629-Q633 WeakPolarHBondContact O-CB 3.32Å; I629-Q633 VanDerWaalsContact O-CG 3.23Å; I629-Q633 WeakPolarHBondContact O-CG 3.46Å; I629-Q633 PolarHBondContact O-N 3.35Å; L630-Q633 PolarHBondContact O-N 2.8Å; Q633-G635 PolarHBondContact O-N 2.98Å
634	C	95.8	Very high	94.7	Very high	44 Å²	44	48 Å²	48	30%	0.297	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-1.7	175.3	-66.1	0	0	0	0	113.7	I596 V600 L630 V631 E632	I596-C634 HydrophobicContact CG2-CB 4.09Å; V600-C634 HydrophobicContact CG2-CB 3.95Å; L630-C634 PolarHBondContact O-N 3.03Å; L630-C634 PolarHBondContact O-SG 3.39Å; V631-C634 PolarHBondContact O-N 2.83Å; E632-C634 PolarHBondContact O-N 3.31Å
635	G	94.3	Very high	94.5	Very high	36 Å²	36	50.7 Å²	50.7	37%	0.371	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	31.4	175.4	0	0	0	0	0	114.3	E632 Q633 T637 P638	E632-G635 PolarHBondContact O-N 3.04Å; Q633-G635 PolarHBondContact O-N 2.98Å; G635-T637 VanDerWaalsContact C-N 3.3Å; G635-T637 PolarHBondContact O-N 3.12Å; G635-P638 VanDerWaalsContact O-CD 3.27Å; G635-P638 WeakPolarHBondContact O-CD 3.45Å
636	A	95.2	Very high	94.3	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.258	C	S	.	.			trans	-68	-26.5	-179.2	0	0	0	0	0	113.9	V600 V631 R639 L640	V600-A636 HydrophobicContact CG1-CB 4.31Å; V600-A636 HydrophobicContact CG2-CB 3.73Å; V631-A636 HydrophobicContact CG1-CB 3.6Å; V631-A636 PolarHBondContact O-N 3.25Å; A636-R639 PolarHBondContact O-N 3.43Å; A636-L640 HydrophobicContact CB-CD1 3.73Å; A636-L640 HydrophobicContact CB-CG 4.3Å; A636-L640 WeakPolarHBondContact O-CG 3.4Å; A636-L640 PolarHBondContact O-N 3.12Å
637	T	93.4	Very high	94.1	Very high	29 Å²	29	55.3 Å²	55.3	18%	0.178	28%	0.278	C	S	.	.	H	α-helix	trans	-51.2	-51.1	-170.2	-49.1	0	0	0	0	114.4	G635 R639 L640 T641 L659 M662	G635-T637 VanDerWaalsContact C-N 3.3Å; G635-T637 PolarHBondContact O-N 3.12Å; T637-R639 PolarHBondContact O-N 3.48Å; T637-L640 PolarHBondContact O-N 3.33Å; T637-T641 PolarHBondContact O-N 2.99Å; T637-T641 PolarHBondContact O-OG1 3.35Å; T637-T641 VanDerWaalsContact O-OG1 3.07Å; T637-L659 HydrophobicContact CG2-CD2 3.91Å; T637-M662 WeakPolarHBondContact OG1-CE 3.42Å
638	P	93.8	Very high	93.8	Very high	75 Å²	75	56.4 Å²	56.4	49%	0.487	29%	0.285	S	S	.	.	H	α-helix	trans	-60.7	-44.6	-176.3	-22.1	34.9	0	0	0	112.4	G635 T641 E642	G635-P638 VanDerWaalsContact O-CD 3.27Å; G635-P638 WeakPolarHBondContact O-CD 3.45Å; P638-T641 PolarHBondContact O-N 3.19Å; P638-E642 PolarHBondContact O-N 3.43Å; P638-E642 VanDerWaalsContact O-N 3.1Å
639	R	95.4	Very high	93.7	Very high	47 Å²	47	62.2 Å²	62.2	18%	0.177	31%	0.311	C	S	.	.	H	α-helix	trans	-71.2	-38	-178.9	-171	55.7	176.8	-179.9	-0.1	112.1	L603 Y604 Q611 A636 T637 T641 E642 L643	L603-R639 HydrophobicContact CB-CB 4.48Å; L603-R639 HydrophobicContact CB-CG 3.6Å; L603-R639 HydrophobicContact CD1-CG 4.4Å; L603-R639 PolarHBondContact O-NE 2.91Å; L603-R639 PolarHBondContact O-NH2 3.34Å; Y604-R639 HydrophobicContact CD1-CG 4.25Å; Y604-R639 HydrophobicContact CD2-CG 4.23Å; Y604-R639 HydrophobicContact CE1-CB 4.06Å; Y604-R639 HydrophobicContact CE1-CG 4.03Å; Y604-R639 HydrophobicContact CE2-CB 3.9Å; Y604-R639 HydrophobicContact CE2-CG 4.01Å; Y604-R639 HydrophobicContact CG-CG 4.36Å; Q611-R639 VanDerWaalsContact NE2-NH2 3.17Å; A636-R639 PolarHBondContact O-N 3.43Å; T637-R639 PolarHBondContact O-N 3.48Å; R639-T641 VanDerWaalsContact C-N 3.31Å; R639-T641 PolarHBondContact O-N 3.32Å; R639-E642 WeakPolarHBondContact CD-OE2 3.49Å; R639-E642 IonicContact CZ-OE2 3.84Å; R639-E642 IonicContact NE-OE2 3.27Å; R639-E642 IonicContact NH1-OE2 2.81Å; R639-E642 PolarHBondContact NH1-OE2 3.19Å; R639-E642 PolarHBondContact O-N 2.98Å; R639-L643 HydrophobicContact CG-CD1 4.34Å; R639-L643 VanDerWaalsContact O-CG 3.3Å; R639-L643 WeakPolarHBondContact O-CG 3.35Å; R639-L643 PolarHBondContact O-N 3.42Å
640	L	95.4	Very high	93.6	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-62.5	-39	173.7	-69	170.6	0	0	0	111.4	L603 A636 T637 L643 L644 A655 T658 L659 M662	L603-L640 HydrophobicContact CD1-CD2 3.83Å; L603-L640 HydrophobicContact CD1-CG 4.08Å; A636-L640 HydrophobicContact CB-CD1 3.73Å; A636-L640 HydrophobicContact CB-CG 4.3Å; A636-L640 WeakPolarHBondContact O-CG 3.4Å; A636-L640 PolarHBondContact O-N 3.12Å; T637-L640 PolarHBondContact O-N 3.33Å; L640-L643 PolarHBondContact O-N 3.23Å; L640-L644 PolarHBondContact O-N 2.93Å; L640-L644 VanDerWaalsContact O-N 3.14Å; L640-A655 HydrophobicContact CD2-CB 4.15Å; L640-T658 HydrophobicContact CD1-CG2 3.68Å; L640-L659 HydrophobicContact CB-CD1 4.05Å; L640-L659 HydrophobicContact CB-CD2 3.92Å; L640-L659 HydrophobicContact CB-CG 3.87Å; L640-L659 HydrophobicContact CD1-CD2 4.41Å; L640-M662 HydrophobicContact CD1-SD 4.27Å
641	T	93.2	Very high	93.5	Very high	36 Å²	36	56.9 Å²	56.9	22%	0.221	29%	0.285	C	S	.	.	H	α-helix	trans	-62.6	-42.1	175	-61.8	0	0	0	0	111.5	T637 P638 R639 L643 L644	T637-T641 PolarHBondContact O-N 2.99Å; T637-T641 PolarHBondContact O-OG1 3.35Å; T637-T641 VanDerWaalsContact O-OG1 3.07Å; P638-T641 PolarHBondContact O-N 3.19Å; R639-T641 VanDerWaalsContact C-N 3.31Å; R639-T641 PolarHBondContact O-N 3.32Å; T641-L643 VanDerWaalsContact C-N 3.33Å; T641-L643 PolarHBondContact O-N 2.78Å; T641-L644 WeakPolarHBondContact O-CB 3.49Å; T641-L644 PolarHBondContact O-N 2.96Å
642	E	92.9	Very high	93.3	Very high	106 Å²	106	57.9 Å²	57.9	50%	0.495	29%	0.291	S	S	.	.	H	α-helix	trans	-61.3	-41.9	173.1	-69.5	171.6	-169	0	0	112	P638 R639 L644 H645	P638-E642 PolarHBondContact O-N 3.43Å; P638-E642 VanDerWaalsContact O-N 3.1Å; R639-E642 WeakPolarHBondContact CD-OE2 3.49Å; R639-E642 IonicContact CZ-OE2 3.84Å; R639-E642 IonicContact NE-OE2 3.27Å; R639-E642 IonicContact NH1-OE2 2.81Å; R639-E642 PolarHBondContact NH1-OE2 3.19Å; R639-E642 PolarHBondContact O-N 2.98Å; E642-L644 PolarHBondContact O-N 3.34Å; E642-H645 PolarHBondContact O-N 3.42Å; E642-H645 VanDerWaalsContact O-N 3.12Å
643	L	94.3	Very high	93.3	Very high	9 Å²	9	57.4 Å²	57.4	5%	0.047	29%	0.294	C	S	.	.	H	α-helix	trans	-70.6	-12.9	-178.8	-71	176.5	0	0	0	114.1	L603 R639 L640 T641 H645 S646 I651 A655	L603-L643 HydrophobicContact CB-CD1 4.23Å; L603-L643 HydrophobicContact CD2-CD1 3.93Å; R639-L643 HydrophobicContact CG-CD1 4.34Å; R639-L643 VanDerWaalsContact O-CG 3.3Å; R639-L643 WeakPolarHBondContact O-CG 3.35Å; R639-L643 PolarHBondContact O-N 3.42Å; L640-L643 PolarHBondContact O-N 3.23Å; T641-L643 VanDerWaalsContact C-N 3.33Å; T641-L643 PolarHBondContact O-N 2.78Å; L643-H645 PolarHBondContact O-N 2.98Å; L643-S646 WeakPolarHBondContact O-CB 3.13Å; L643-S646 PolarHBondContact O-N 3.3Å; L643-I651 HydrophobicContact CB-CG2 4.18Å; L643-I651 HydrophobicContact CD1-CG2 4.28Å; L643-I651 HydrophobicContact CD2-CG2 4.09Å; L643-I651 HydrophobicContact CG-CG2 4.41Å; L643-A655 HydrophobicContact CB-CB 4.05Å
644	L	92.4	Very high	93.4	Very high	6 Å²	6	51.3 Å²	51.3	3%	0.031	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-26.8	166.8	-67.7	177.3	0	0	0	112.2	L640 T641 E642 A655 C656 L659 L678 A681	L640-L644 PolarHBondContact O-N 2.93Å; L640-L644 VanDerWaalsContact O-N 3.14Å; T641-L644 WeakPolarHBondContact O-CB 3.49Å; T641-L644 PolarHBondContact O-N 2.96Å; E642-L644 PolarHBondContact O-N 3.34Å; L644-A655 HydrophobicContact CD2-CB 4.21Å; L644-C656 HydrophobicContact CD2-CB 3.79Å; L644-L659 HydrophobicContact CD1-CD1 3.78Å; L644-L659 HydrophobicContact CD2-CD1 4.06Å; L644-L659 HydrophobicContact CG-CD1 3.91Å; L644-L678 HydrophobicContact CD1-CD2 3.9Å; L644-L678 HydrophobicContact CD2-CD2 3.56Å; L644-L678 HydrophobicContact CG-CD2 4.4Å; L644-A681 HydrophobicContact CB-CB 4.15Å
645	H	90.6	Very high	93.4	Very high	92 Å²	92	49.2 Å²	49.2	43%	0.426	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	13.7	178.6	-55	-56.3	0	0	0	113	E642 L643	E642-H645 PolarHBondContact O-N 3.42Å; E642-H645 VanDerWaalsContact O-N 3.12Å; L643-H645 PolarHBondContact O-N 2.98Å
646	S	90.9	Very high	93.4	Very high	32 Å²	32	48.8 Å²	48.8	22%	0.224	24%	0.242	C	C	.	.			trans	-58.3	143.1	172.9	-175.1	0	0	0	0	110.4	L643 N648	L643-S646 WeakPolarHBondContact O-CB 3.13Å; L643-S646 PolarHBondContact O-N 3.3Å; S646-N648 PolarHBondContact O-N 3.41Å; S646-N648 PolarHBondContact OG-N 2.91Å
647	R	89.7	Confident	93.3	Very high	253 Å²	253	50.1 Å²	50.1	96%	0.955	25%	0.252	S	S	*	.	S	Bend	trans	-70.2	-17.5	172.2	-65.1	-177.5	-178.9	177.6	0	112.1
648	N	90.2	Very high	93.4	Very high	24 Å²	24	48.7 Å²	48.7	13%	0.128	24%	0.244	C	C	.	.			trans	-86.7	108.8	174.4	-168	-52.4	0	0	0	109.8	E608 S646 T650 I651 S652	E608-N648 WeakPolarHBondContact OE1-CB 3.46Å; E608-N648 PolarHBondContact OE1-ND2 3.41Å; S646-N648 PolarHBondContact O-N 3.41Å; S646-N648 PolarHBondContact OG-N 2.91Å; N648-T650 PolarHBondContact O-N 3.09Å; N648-T650 WeakPolarHBondContact OD1-CA 3.4Å; N648-T650 VanDerWaalsContact OD1-CB 3.27Å; N648-T650 WeakPolarHBondContact OD1-CB 3.47Å; N648-T650 PolarHBondContact OD1-N 2.96Å; N648-I651 HydrophobicContact CB-CB 4.07Å; N648-I651 HydrophobicContact CB-CD1 3.78Å; N648-I651 HydrophobicContact CB-CG1 3.77Å; N648-I651 PolarHBondContact O-N 2.94Å; N648-I651 VanDerWaalsContact O-N 3.1Å; N648-I651 PolarHBondContact OD1-N 2.91Å; N648-S652 PolarHBondContact O-N 3.29Å
649	E	91.8	Very high	93.5	Very high	158 Å²	158	45.2 Å²	45.2	74%	0.738	22%	0.221	S	C	*	.	H	α-helix	trans	-56.5	-36.1	-179.2	-66.5	179.3	-176.4	0	0	112.2	S652 T653	E649-S652 WeakPolarHBondContact CA-OG 3.33Å; E649-S652 PolarHBondContact O-N 2.92Å; E649-S652 PolarHBondContact O-OG 2.64Å; E649-T653 WeakPolarHBondContact O-CB 3.45Å; E649-T653 PolarHBondContact O-N 3.34Å; E649-T653 PolarHBondContact O-OG1 2.98Å
650	T	93.4	Very high	93.3	Very high	30 Å²	30	48.6 Å²	48.6	18%	0.184	24%	0.238	C	C	.	.	H	α-helix	trans	-66.8	-42.7	179.1	-56.4	0	0	0	0	111.3	L612 N648 T653 Y654	L612-T650 HydrophobicContact CD1-CG2 4.04Å; L612-T650 HydrophobicContact CG-CG2 4.33Å; N648-T650 PolarHBondContact O-N 3.09Å; N648-T650 WeakPolarHBondContact OD1-CA 3.4Å; N648-T650 VanDerWaalsContact OD1-CB 3.27Å; N648-T650 WeakPolarHBondContact OD1-CB 3.47Å; N648-T650 PolarHBondContact OD1-N 2.96Å; T650-T653 PolarHBondContact O-N 2.75Å; T650-Y654 HydrophobicContact CG2-CD2 3.88Å; T650-Y654 HydrophobicContact CG2-CE2 3.39Å; T650-Y654 VanDerWaalsContact O-CD2 3.24Å; T650-Y654 WeakPolarHBondContact O-CD2 3.45Å; T650-Y654 PolarHBondContact O-N 3.17Å
651	I	94.3	Very high	93.2	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.5	-47.5	175.3	-61.1	-177.8	0	0	0	110.3	E608 Q611 L612 L643 N648 T653 Y654 A655	E608-I651 HydrophobicContact CG-CD1 3.68Å; Q611-I651 HydrophobicContact CB-CD1 4.15Å; L612-I651 HydrophobicContact CB-CD1 4.04Å; L612-I651 HydrophobicContact CB-CG1 3.77Å; L612-I651 HydrophobicContact CD1-CG1 4.24Å; L612-I651 HydrophobicContact CG-CG1 4.14Å; L643-I651 HydrophobicContact CB-CG2 4.18Å; L643-I651 HydrophobicContact CD1-CG2 4.28Å; L643-I651 HydrophobicContact CD2-CG2 4.09Å; L643-I651 HydrophobicContact CG-CG2 4.41Å; N648-I651 HydrophobicContact CB-CB 4.07Å; N648-I651 HydrophobicContact CB-CD1 3.78Å; N648-I651 HydrophobicContact CB-CG1 3.77Å; N648-I651 PolarHBondContact O-N 2.94Å; N648-I651 VanDerWaalsContact O-N 3.1Å; N648-I651 PolarHBondContact OD1-N 2.91Å; I651-T653 VanDerWaalsContact C-N 3.26Å; I651-T653 PolarHBondContact O-N 3.28Å; I651-Y654 PolarHBondContact O-N 3.18Å; I651-A655 WeakPolarHBondContact O-CB 3.35Å; I651-A655 PolarHBondContact O-N 2.85Å
652	S	93.3	Very high	93.2	Very high	21 Å²	21	51 Å²	51	15%	0.147	24%	0.244	C	C	.	.	H	α-helix	trans	-61.5	-36.9	179.7	75.6	0	0	0	0	111.9	N648 E649 A655 C656	N648-S652 PolarHBondContact O-N 3.29Å; E649-S652 WeakPolarHBondContact CA-OG 3.33Å; E649-S652 PolarHBondContact O-N 2.92Å; E649-S652 PolarHBondContact O-OG 2.64Å; S652-A655 PolarHBondContact O-N 2.89Å; S652-C656 WeakPolarHBondContact O-CB 3.45Å; S652-C656 PolarHBondContact O-N 3.36Å
653	T	94.2	Very high	93.1	Very high	62 Å²	62	46.2 Å²	46.2	38%	0.38	22%	0.223	S	C	.	.	H	α-helix	trans	-65.9	-47	176.5	-60.7	0	0	0	0	111.2	E649 T650 I651 A655 C656 A657	E649-T653 WeakPolarHBondContact O-CB 3.45Å; E649-T653 PolarHBondContact O-N 3.34Å; E649-T653 PolarHBondContact O-OG1 2.98Å; T650-T653 PolarHBondContact O-N 2.75Å; I651-T653 VanDerWaalsContact C-N 3.26Å; I651-T653 PolarHBondContact O-N 3.28Å; T653-A655 PolarHBondContact O-N 2.91Å; T653-C656 PolarHBondContact O-N 3.4Å; T653-A657 WeakPolarHBondContact O-CB 3.32Å; T653-A657 PolarHBondContact O-N 2.96Å
654	Y	96.7	Very high	92.6	Very high	17 Å²	17	47.7 Å²	47.7	7%	0.067	24%	0.239	C	C	.	.	H	α-helix	trans	-63.3	-41.7	175.7	-72.7	-48.8	0	0	0	112.2	H578 T650 I651 A657 T658 V703	H578-Y654 AromaticContact CE1-CZ 3.71Å; H578-Y654 PolarHBondContact CE1-OH 2.9Å; H578-Y654 AromaticContact NE2-CZ 3.89Å; T650-Y654 HydrophobicContact CG2-CD2 3.88Å; T650-Y654 HydrophobicContact CG2-CE2 3.39Å; T650-Y654 VanDerWaalsContact O-CD2 3.24Å; T650-Y654 WeakPolarHBondContact O-CD2 3.45Å; T650-Y654 PolarHBondContact O-N 3.17Å; I651-Y654 PolarHBondContact O-N 3.18Å; Y654-A657 PolarHBondContact O-N 3.25Å; Y654-T658 WeakPolarHBondContact O-CB 3.41Å; Y654-T658 PolarHBondContact O-N 3.44Å; Y654-T658 PolarHBondContact O-OG1 3.23Å; Y654-V703 WeakPolarHBondContact OH-CG2 3.32Å
655	A	95.9	Very high	92.1	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-62.3	-45.9	176.3	0	0	0	0	0	111.7	L640 L643 L644 I651 S652 T653 T658 L659	L640-A655 HydrophobicContact CD2-CB 4.15Å; L643-A655 HydrophobicContact CB-CB 4.05Å; L644-A655 HydrophobicContact CD2-CB 4.21Å; I651-A655 WeakPolarHBondContact O-CB 3.35Å; I651-A655 PolarHBondContact O-N 2.85Å; S652-A655 PolarHBondContact O-N 2.89Å; T653-A655 PolarHBondContact O-N 2.91Å; A655-T658 PolarHBondContact O-N 2.95Å; A655-L659 WeakPolarHBondContact O-CB 3.21Å; A655-L659 WeakPolarHBondContact O-CG 3.32Å; A655-L659 PolarHBondContact O-N 3.44Å
656	C	93.6	Very high	91.9	Very high	28 Å²	28	53.7 Å²	53.7	19%	0.189	27%	0.272	C	S	.	.	H	α-helix	trans	-56.7	-53.7	174.6	171.8	0	0	0	0	111.8	L644 S652 T653 T658 L659 H660 L678	L644-C656 HydrophobicContact CD2-CB 3.79Å; S652-C656 WeakPolarHBondContact O-CB 3.45Å; S652-C656 PolarHBondContact O-N 3.36Å; T653-C656 PolarHBondContact O-N 3.4Å; C656-T658 VanDerWaalsContact C-N 3.3Å; C656-T658 PolarHBondContact O-N 2.92Å; C656-L659 PolarHBondContact O-N 2.9Å; C656-H660 VanDerWaalsContact O-CB 3.3Å; C656-H660 WeakPolarHBondContact O-CB 3.24Å; C656-H660 PolarHBondContact O-N 3.36Å; C656-L678 HydrophobicContact CB-CD2 3.79Å; C656-L678 WeakPolarHBondContact SG-CD2 3.34Å
657	A	93.8	Very high	91.5	Very high	27 Å²	27	56.6 Å²	56.6	22%	0.223	29%	0.29	C	S	.	.	H	α-helix	trans	-59.9	-41.9	-179.7	0	0	0	0	0	111.8	T653 Y654 R661	T653-A657 WeakPolarHBondContact O-CB 3.32Å; T653-A657 PolarHBondContact O-N 2.96Å; Y654-A657 PolarHBondContact O-N 3.25Å; A657-R661 WeakPolarHBondContact O-CG 3.4Å; A657-R661 PolarHBondContact O-N 2.94Å
658	T	96.3	Very high	91.2	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.6	-50.4	178.1	-51	0	0	0	0	111.1	S619 T622 V631 L640 Y654 A655 C656 H660 R661 M662	S619-T658 WeakPolarHBondContact CA-OG1 3.39Å; S619-T658 WeakPolarHBondContact CB-OG1 3.44Å; S619-T658 PolarHBondContact N-OG1 2.98Å; S619-T658 PolarHBondContact OG-OG1 2.93Å; T622-T658 HydrophobicContact CG2-CG2 3.69Å; V631-T658 HydrophobicContact CG1-CG2 4.4Å; L640-T658 HydrophobicContact CD1-CG2 3.68Å; Y654-T658 WeakPolarHBondContact O-CB 3.41Å; Y654-T658 PolarHBondContact O-N 3.44Å; Y654-T658 PolarHBondContact O-OG1 3.23Å; A655-T658 PolarHBondContact O-N 2.95Å; C656-T658 VanDerWaalsContact C-N 3.3Å; C656-T658 PolarHBondContact O-N 2.92Å; T658-H660 PolarHBondContact O-N 3.48Å; T658-R661 PolarHBondContact O-N 3.36Å; T658-M662 HydrophobicContact CG2-SD 3.89Å; T658-M662 VanDerWaalsContact O-CG 3.25Å; T658-M662 WeakPolarHBondContact O-CG 3.33Å; T658-M662 PolarHBondContact O-N 3.4Å
659	L	94.8	Very high	90.8	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-63.4	-40.1	178.5	-72.9	171.5	0	0	0	112.4	T637 L640 L644 A655 C656 M662 S663 L674	T637-L659 HydrophobicContact CG2-CD2 3.91Å; L640-L659 HydrophobicContact CB-CD1 4.05Å; L640-L659 HydrophobicContact CB-CD2 3.92Å; L640-L659 HydrophobicContact CB-CG 3.87Å; L640-L659 HydrophobicContact CD1-CD2 4.41Å; L644-L659 HydrophobicContact CD1-CD1 3.78Å; L644-L659 HydrophobicContact CD2-CD1 4.06Å; L644-L659 HydrophobicContact CG-CD1 3.91Å; A655-L659 WeakPolarHBondContact O-CB 3.21Å; A655-L659 WeakPolarHBondContact O-CG 3.32Å; A655-L659 PolarHBondContact O-N 3.44Å; C656-L659 PolarHBondContact O-N 2.9Å; L659-M662 PolarHBondContact O-N 3.02Å; L659-S663 WeakPolarHBondContact O-CB 3.22Å; L659-S663 PolarHBondContact O-N 3.17Å; L659-L674 HydrophobicContact CB-CD1 4.08Å; L659-L674 HydrophobicContact CB-CD2 4.29Å; L659-L674 HydrophobicContact CD1-CD1 4.27Å
660	H	91.8	Very high	90.3	Very high	118 Å²	118	49.5 Å²	49.5	55%	0.546	28%	0.279	S	S	.	.	H	α-helix	trans	-60.1	-48.7	177.3	-177	80.6	0	0	0	110.9	C656 T658 M662 S663	C656-H660 VanDerWaalsContact O-CB 3.3Å; C656-H660 WeakPolarHBondContact O-CB 3.24Å; C656-H660 PolarHBondContact O-N 3.36Å; T658-H660 PolarHBondContact O-N 3.48Å; H660-M662 PolarHBondContact O-N 2.69Å; H660-S663 WeakPolarHBondContact O-CB 3.37Å; H660-S663 PolarHBondContact O-N 3.45Å; H660-S663 VanDerWaalsContact O-N 3.12Å; H660-S663 PolarHBondContact O-OG 3.34Å
661	R	93.5	Very high	89.7	Confident	78 Å²	78	52.2 Å²	52.2	29%	0.294	29%	0.288	S	S	.	.	H	α-helix	trans	-61.2	-43.7	176.3	-68.7	-177.5	-162.8	109.7	-3.7	111.8	S619 T622 N623 I628 A657 T658 S663 G664	S619-R661 PolarHBondContact O-NH1 3.27Å; S619-R661 PolarHBondContact OG-NH1 3.46Å; T622-R661 WeakPolarHBondContact O-CD 3.48Å; T622-R661 PolarHBondContact OG1-NH1 2.81Å; N623-R661 VanDerWaalsContact OD1-CZ 3.28Å; N623-R661 PolarHBondContact OD1-NE 3.36Å; N623-R661 VanDerWaalsContact OD1-NE 3.12Å; N623-R661 PolarHBondContact OD1-NH2 3.17Å; I628-R661 HydrophobicContact CD1-CB 4.27Å; A657-R661 WeakPolarHBondContact O-CG 3.4Å; A657-R661 PolarHBondContact O-N 2.94Å; T658-R661 PolarHBondContact O-N 3.36Å; R661-S663 PolarHBondContact O-N 2.98Å; R661-G664 PolarHBondContact O-N 3.27Å
662	M	93	Very high	89.1	Confident	8 Å²	8	59.4 Å²	59.4	4%	0.039	32%	0.32	C	S	.	.	H	α-helix	trans	-64.4	-21.2	176.4	-67.5	168	67.6	0	0	113.7	T622 I628 V631 E632 T637 L640 T658 L659 H660 G664	T622-M662 HydrophobicContact CG2-CG 4.4Å; I628-M662 HydrophobicContact CG2-CB 4.35Å; I628-M662 HydrophobicContact CG2-CG 4.09Å; V631-M662 HydrophobicContact CG1-CE 4.31Å; V631-M662 HydrophobicContact CG1-SD 3.91Å; E632-M662 HydrophobicContact CB-CE 3.71Å; E632-M662 HydrophobicContact CG-CE 4.03Å; T637-M662 WeakPolarHBondContact OG1-CE 3.42Å; L640-M662 HydrophobicContact CD1-SD 4.27Å; T658-M662 HydrophobicContact CG2-SD 3.89Å; T658-M662 VanDerWaalsContact O-CG 3.25Å; T658-M662 WeakPolarHBondContact O-CG 3.33Å; T658-M662 PolarHBondContact O-N 3.4Å; L659-M662 PolarHBondContact O-N 3.02Å; H660-M662 PolarHBondContact O-N 2.69Å; M662-G664 VanDerWaalsContact C-N 3.3Å; M662-G664 PolarHBondContact O-N 2.83Å
663	S	90.7	Very high	88.6	Confident	7 Å²	7	65.5 Å²	65.5	5%	0.049	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-8.7	178.9	81.8	0	0	0	0	114.3	L659 H660 R661 D665 K666 K671	L659-S663 WeakPolarHBondContact O-CB 3.22Å; L659-S663 PolarHBondContact O-N 3.17Å; H660-S663 WeakPolarHBondContact O-CB 3.37Å; H660-S663 PolarHBondContact O-N 3.45Å; H660-S663 VanDerWaalsContact O-N 3.12Å; H660-S663 PolarHBondContact O-OG 3.34Å; R661-S663 PolarHBondContact O-N 2.98Å; S663-D665 VanDerWaalsContact C-N 3.3Å; S663-D665 PolarHBondContact O-N 3Å; S663-D665 VanDerWaalsContact O-N 3.15Å; S663-K666 WeakPolarHBondContact O-CB 3.3Å; S663-K666 PolarHBondContact O-N 3.41Å; S663-K671 WeakPolarHBondContact O-CE 3.47Å
664	G	83.9	Confident	88	Confident	39 Å²	39	62.9 Å²	62.9	40%	0.402	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.6	-42.9	-171.5	0	0	0	0	0	114.9	R661 M662 K671	R661-G664 PolarHBondContact O-N 3.27Å; M662-G664 VanDerWaalsContact C-N 3.3Å; M662-G664 PolarHBondContact O-N 2.83Å; G664-K671 WeakPolarHBondContact O-CE 3.11Å; G664-K671 PolarHBondContact O-NZ 2.68Å
665	D	82.2	Confident	87.3	Confident	167 Å²	167	65.2 Å²	65.2	89%	0.893	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	5.9	-178.1	-63.6	-25.6	0	0	0	113.6	S663	S663-D665 VanDerWaalsContact C-N 3.3Å; S663-D665 PolarHBondContact O-N 3Å; S663-D665 VanDerWaalsContact O-N 3.15Å
666	K	85.1	Confident	86.6	Confident	57 Å²	57	69.7 Å²	69.7	25%	0.248	37%	0.369	C	S	.	.	S	Bend	trans	-82.2	152.6	-177.6	-56.2	-61.4	-177.4	-167.3	0	111.7	E632 S663 Y670 K671	E632-K666 VanDerWaalsContact OE1-CE 3.26Å; E632-K666 WeakPolarHBondContact OE1-CE 3.09Å; E632-K666 IonicContact OE1-NZ 2.6Å; E632-K666 PolarHBondContact OE1-NZ 2.66Å; E632-K666 IonicContact OE2-NZ 2.95Å; E632-K666 PolarHBondContact OE2-NZ 3.19Å; S663-K666 WeakPolarHBondContact O-CB 3.3Å; S663-K666 PolarHBondContact O-N 3.41Å; K666-Y670 HydrophobicContact CB-CD1 3.39Å; K666-Y670 HydrophobicContact CB-CE1 4.11Å; K666-Y670 HydrophobicContact CB-CG 3.84Å; K666-Y670 HydrophobicContact CG-CD1 3.63Å; K666-Y670 HydrophobicContact CG-CE1 3.81Å; K666-Y670 HydrophobicContact CG-CG 4.25Å; K666-K671 VanDerWaalsContact O-CE 3.28Å; K666-K671 WeakPolarHBondContact O-CE 3.47Å
667	P	83.5	Confident	85.8	Confident	93 Å²	93	72 Å²	72	60%	0.604	38%	0.377	S	S	*	.			trans	-54.7	151.1	176	-25.2	33.8	0	0	0	112.7	E669 Y670 K671	P667-E669 PolarHBondContact O-N 3.34Å; P667-E669 VanDerWaalsContact O-N 3.1Å; P667-Y670 WeakPolarHBondContact O-CB 3.48Å; P667-Y670 PolarHBondContact O-N 3.02Å; P667-K671 PolarHBondContact O-N 2.59Å; P667-K671 VanDerWaalsContact O-N 3.15Å
668	A	83.8	Confident	85	Confident	82 Å²	82	71.5 Å²	71.5	68%	0.678	37%	0.37	S	S	*	.	H	α-helix	trans	-54.4	-34.3	-178.1	0	0	0	0	0	113.3	K671 K672	A668-K671 PolarHBondContact O-N 3.45Å; A668-K672 WeakPolarHBondContact O-CB 3.38Å; A668-K672 PolarHBondContact O-N 3.34Å
669	E	81.4	Confident	84.1	Confident	144 Å²	144	74.8 Å²	74.8	67%	0.673	39%	0.39	S	S	*	.	H	α-helix	trans	-65.3	-38.3	176.1	-171	177.6	-173.7	0	0	112.7	P667 K672 R673	P667-E669 PolarHBondContact O-N 3.34Å; P667-E669 VanDerWaalsContact O-N 3.1Å; E669-K672 PolarHBondContact O-N 3.26Å; E669-R673 WeakPolarHBondContact O-CG 3.31Å; E669-R673 PolarHBondContact O-N 3.21Å
670	Y	81.2	Confident	83.1	Confident	60 Å²	60	77.6 Å²	77.6	24%	0.235	41%	0.41	C	S	.	.	H	α-helix	trans	-65.6	-47.8	174.1	-179.8	-86.9	0	0	0	110.8	K666 P667 K672 R673 L674	K666-Y670 HydrophobicContact CB-CD1 3.39Å; K666-Y670 HydrophobicContact CB-CE1 4.11Å; K666-Y670 HydrophobicContact CB-CG 3.84Å; K666-Y670 HydrophobicContact CG-CD1 3.63Å; K666-Y670 HydrophobicContact CG-CE1 3.81Å; K666-Y670 HydrophobicContact CG-CG 4.25Å; P667-Y670 WeakPolarHBondContact O-CB 3.48Å; P667-Y670 PolarHBondContact O-N 3.02Å; Y670-K672 VanDerWaalsContact C-N 3.25Å; Y670-K672 PolarHBondContact O-N 3.16Å; Y670-R673 PolarHBondContact O-N 2.94Å; Y670-R673 VanDerWaalsContact O-N 3.15Å; Y670-L674 HydrophobicContact CE1-CD2 4.41Å; Y670-L674 PolarHBondContact O-N 3.33Å
671	K	81.7	Confident	82.1	Confident	87 Å²	87	73 Å²	73	38%	0.378	39%	0.393	S	S	.	.	H	α-helix	trans	-58.4	-38.7	176.3	-68	179.5	177	175.8	0	111.8	S663 G664 K666 P667 A668 S675	S663-K671 WeakPolarHBondContact O-CE 3.47Å; G664-K671 WeakPolarHBondContact O-CE 3.11Å; G664-K671 PolarHBondContact O-NZ 2.68Å; K666-K671 VanDerWaalsContact O-CE 3.28Å; K666-K671 WeakPolarHBondContact O-CE 3.47Å; P667-K671 PolarHBondContact O-N 2.59Å; P667-K671 VanDerWaalsContact O-N 3.15Å; A668-K671 PolarHBondContact O-N 3.45Å; K671-S675 VanDerWaalsContact O-CB 3.22Å; K671-S675 WeakPolarHBondContact O-CB 3.23Å; K671-S675 PolarHBondContact O-N 3.17Å
672	K	81.1	Confident	80.6	Confident	152 Å²	152	75.2 Å²	75.2	66%	0.661	41%	0.41	S	S	*	.	H	α-helix	trans	-64.8	-45	175.8	-170.2	177.3	-179.2	-179.4	0	111.9	A668 E669 Y670 S675 V676	A668-K672 WeakPolarHBondContact O-CB 3.38Å; A668-K672 PolarHBondContact O-N 3.34Å; E669-K672 PolarHBondContact O-N 3.26Å; Y670-K672 VanDerWaalsContact C-N 3.25Å; Y670-K672 PolarHBondContact O-N 3.16Å; K672-S675 PolarHBondContact O-N 3.19Å; K672-V676 WeakPolarHBondContact O-CG2 3.37Å; K672-V676 PolarHBondContact O-N 2.89Å
673	R	82.4	Confident	79.2	Confident	149 Å²	149	80.6 Å²	80.6	56%	0.562	44%	0.438	S	S	*	.	H	α-helix	trans	-61.4	-48.2	175.5	-73.3	-173.8	-63.8	-175	-0.1	111.8	E669 Y670 S675 V676 E677	E669-R673 WeakPolarHBondContact O-CG 3.31Å; E669-R673 PolarHBondContact O-N 3.21Å; Y670-R673 PolarHBondContact O-N 2.94Å; Y670-R673 VanDerWaalsContact O-N 3.15Å; R673-S675 VanDerWaalsContact C-N 3.34Å; R673-S675 PolarHBondContact O-N 3.45Å; R673-V676 WeakPolarHBondContact O-CB 3.28Å; R673-V676 PolarHBondContact O-N 3.16Å; R673-E677 PolarHBondContact O-N 3.01Å
674	L	82.1	Confident	77.5	Confident	7 Å²	7	89.6 Å²	89.6	4%	0.037	47%	0.471	C	S	.	.	H	α-helix	trans	-60.4	-45.1	176.5	-178.9	64.9	0	0	0	111	L659 Y670 V676 E677 L678	L659-L674 HydrophobicContact CB-CD1 4.08Å; L659-L674 HydrophobicContact CB-CD2 4.29Å; L659-L674 HydrophobicContact CD1-CD1 4.27Å; Y670-L674 HydrophobicContact CE1-CD2 4.41Å; Y670-L674 PolarHBondContact O-N 3.33Å; L674-V676 VanDerWaalsContact C-N 3.27Å; L674-V676 PolarHBondContact O-N 2.91Å; L674-E677 PolarHBondContact O-N 3.14Å; L674-E677 VanDerWaalsContact O-N 3.15Å; L674-L678 HydrophobicContact CD1-CD1 4.45Å; L674-L678 HydrophobicContact CD1-CD2 4.39Å; L674-L678 HydrophobicContact CD1-CG 4.14Å; L674-L678 HydrophobicContact CD2-CD1 4.47Å; L674-L678 HydrophobicContact CG-CD1 3.99Å; L674-L678 HydrophobicContact CG-CG 4.11Å; L674-L678 WeakPolarHBondContact O-CB 3.24Å; L674-L678 VanDerWaalsContact O-CG 3.25Å; L674-L678 WeakPolarHBondContact O-CG 3.46Å; L674-L678 PolarHBondContact O-N 2.73Å
675	S	81.3	Confident	75.6	Confident	65 Å²	65	94.8 Å²	94.8	46%	0.455	49%	0.49	S	S	.	.	H	α-helix	trans	-57.9	-38.6	176.6	-177.1	0	0	0	0	112.3	K671 K672 R673 T679	K671-S675 VanDerWaalsContact O-CB 3.22Å; K671-S675 WeakPolarHBondContact O-CB 3.23Å; K671-S675 PolarHBondContact O-N 3.17Å; K672-S675 PolarHBondContact O-N 3.19Å; R673-S675 VanDerWaalsContact C-N 3.34Å; R673-S675 PolarHBondContact O-N 3.45Å; S675-T679 VanDerWaalsContact O-CB 3.3Å; S675-T679 WeakPolarHBondContact O-CB 3.45Å; S675-T679 PolarHBondContact O-N 2.74Å; S675-T679 PolarHBondContact O-OG1 3.31Å
676	V	80.8	Confident	73.6	Confident	95 Å²	95	94.9 Å²	94.9	58%	0.576	49%	0.49	S	S	*	.	H	α-helix	trans	-65.9	-47	175.2	170.6	0	0	0	0	110.9	K672 R673 L674 T679 S680	K672-V676 WeakPolarHBondContact O-CG2 3.37Å; K672-V676 PolarHBondContact O-N 2.89Å; R673-V676 WeakPolarHBondContact O-CB 3.28Å; R673-V676 PolarHBondContact O-N 3.16Å; L674-V676 VanDerWaalsContact C-N 3.27Å; L674-V676 PolarHBondContact O-N 2.91Å; V676-T679 PolarHBondContact O-N 3.1Å; V676-S680 WeakPolarHBondContact O-CB 3.35Å; V676-S680 PolarHBondContact O-N 3.17Å
677	E	78.1	Confident	71.2	Confident	76 Å²	76	95.6 Å²	95.6	36%	0.355	51%	0.514	S	S	.	.	H	α-helix	trans	-58.9	-48.1	175.7	-74.7	179.6	-179.3	0	0	111.9	R673 L674 T679 S680 A681	R673-E677 PolarHBondContact O-N 3.01Å; L674-E677 PolarHBondContact O-N 3.14Å; L674-E677 VanDerWaalsContact O-N 3.15Å; E677-T679 PolarHBondContact O-N 3.4Å; E677-S680 PolarHBondContact O-N 3.41Å; E677-S680 PolarHBondContact O-OG 2.68Å; E677-A681 WeakPolarHBondContact O-CB 3.36Å; E677-A681 PolarHBondContact O-N 3.34Å
678	L	76.6	Confident	68.7	Low	17 Å²	17	96.7 Å²	96.7	9%	0.089	53%	0.531	C	S	.	.	H	α-helix	trans	-59.4	-44.7	177	-68.6	-179.2	0	0	0	111.9	L644 C656 L674 S680 A681 L682	L644-L678 HydrophobicContact CD1-CD2 3.9Å; L644-L678 HydrophobicContact CD2-CD2 3.56Å; L644-L678 HydrophobicContact CG-CD2 4.4Å; C656-L678 HydrophobicContact CB-CD2 3.79Å; C656-L678 WeakPolarHBondContact SG-CD2 3.34Å; L674-L678 HydrophobicContact CD1-CD1 4.45Å; L674-L678 HydrophobicContact CD1-CD2 4.39Å; L674-L678 HydrophobicContact CD1-CG 4.14Å; L674-L678 HydrophobicContact CD2-CD1 4.47Å; L674-L678 HydrophobicContact CG-CD1 3.99Å; L674-L678 HydrophobicContact CG-CG 4.11Å; L674-L678 WeakPolarHBondContact O-CB 3.24Å; L674-L678 VanDerWaalsContact O-CG 3.25Å; L674-L678 WeakPolarHBondContact O-CG 3.46Å; L674-L678 PolarHBondContact O-N 2.73Å; L678-S680 VanDerWaalsContact C-N 3.35Å; L678-S680 PolarHBondContact O-N 2.86Å; L678-A681 PolarHBondContact O-N 2.72Å; L678-L682 WeakPolarHBondContact O-CB 3.49Å; L678-L682 WeakPolarHBondContact O-CG 3.3Å; L678-L682 PolarHBondContact O-N 2.77Å
679	T	76.4	Confident	66.2	Low	68 Å²	68	95.4 Å²	95.4	42%	0.417	53%	0.526	S	S	.	.	H	α-helix	trans	-64.3	-41.5	177.8	-53.8	0	0	0	0	110.7	S675 V676 E677 A681 L682 L683	S675-T679 VanDerWaalsContact O-CB 3.3Å; S675-T679 WeakPolarHBondContact O-CB 3.45Å; S675-T679 PolarHBondContact O-N 2.74Å; S675-T679 PolarHBondContact O-OG1 3.31Å; V676-T679 PolarHBondContact O-N 3.1Å; E677-T679 PolarHBondContact O-N 3.4Å; T679-A681 VanDerWaalsContact C-N 3.31Å; T679-A681 PolarHBondContact O-N 2.92Å; T679-L682 PolarHBondContact O-N 3.44Å; T679-L683 HydrophobicContact CG2-CD1 3.49Å; T679-L683 VanDerWaalsContact CG2-CD1 3.49Å; T679-L683 HydrophobicContact CG2-CG 4.14Å; T679-L683 WeakPolarHBondContact O-CB 3.49Å; T679-L683 VanDerWaalsContact O-CG 3.24Å; T679-L683 WeakPolarHBondContact O-CG 3.42Å; T679-L683 PolarHBondContact O-N 3.45Å
680	S	75	Confident	63.6	Low	61 Å²	61	96 Å²	96	43%	0.427	53%	0.533	S	S	.	.	H	α-helix	trans	-65.9	-31.9	176.9	78.8	0	0	0	0	113.7	V676 E677 L678	V676-S680 WeakPolarHBondContact O-CB 3.35Å; V676-S680 PolarHBondContact O-N 3.17Å; E677-S680 PolarHBondContact O-N 3.41Å; E677-S680 PolarHBondContact O-OG 2.68Å; L678-S680 VanDerWaalsContact C-N 3.35Å; L678-S680 PolarHBondContact O-N 2.86Å
681	A	69.9	Low	61	Low	22 Å²	22	103.1 Å²	103.1	18%	0.182	56%	0.56	C	S	.	*	H	α-helix	trans	-74.2	-41.1	178.9	0	0	0	0	0	111	L644 E677 L678 T679	L644-A681 HydrophobicContact CB-CB 4.15Å; E677-A681 WeakPolarHBondContact O-CB 3.36Å; E677-A681 PolarHBondContact O-N 3.34Å; L678-A681 PolarHBondContact O-N 2.72Å; T679-A681 VanDerWaalsContact C-N 3.31Å; T679-A681 PolarHBondContact O-N 2.92Å
682	L	63	Low	58.5	Low	123 Å²	123	105.3 Å²	105.3	64%	0.644	58%	0.576	S	S	*	*	H	α-helix	trans	-75.6	-31.1	-179.8	-70	168.2	0	0	0	113.9	L678 T679 R684	L678-L682 WeakPolarHBondContact O-CB 3.49Å; L678-L682 WeakPolarHBondContact O-CG 3.3Å; L678-L682 PolarHBondContact O-N 2.77Å; T679-L682 PolarHBondContact O-N 3.44Å; L682-R684 PolarHBondContact O-N 3.38Å
683	L	62.3	Low	55.9	Low	122 Å²	122	106.8 Å²	106.8	64%	0.639	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	13.1	-176.6	-72.7	174.2	0	0	0	115	T679 D685	T679-L683 HydrophobicContact CG2-CD1 3.49Å; T679-L683 VanDerWaalsContact CG2-CD1 3.49Å; T679-L683 HydrophobicContact CG2-CG 4.14Å; T679-L683 WeakPolarHBondContact O-CB 3.49Å; T679-L683 VanDerWaalsContact O-CG 3.24Å; T679-L683 WeakPolarHBondContact O-CG 3.42Å; T679-L683 PolarHBondContact O-N 3.45Å; L683-D685 PolarHBondContact O-N 3.19Å
684	R	55.4	Low	53.2	Low	195 Å²	195	108.2 Å²	108.2	74%	0.736	60%	0.598	S	S	*	*			trans	-80.4	63.3	170.7	-74.3	-167.2	176.9	-177	2	111.5	L682	L682-R684 PolarHBondContact O-N 3.38Å
685	D	44.6	Very low	50.8	Low	149 Å²	149	113.8 Å²	113.8	80%	0.797	63%	0.634	S	S	*	*	S	Bend	trans	-163.5	145.1	141.8	-137.2	-5.9	0	0	0	110.8	L683 G687	L683-D685 PolarHBondContact O-N 3.19Å; D685-G687 PolarHBondContact O-N 2.97Å
686	D	39.9	Very low	48.2	Very low	168 Å²	168	117.9 Å²	117.9	90%	0.898	65%	0.648	S	S	*	*	S	Bend	trans	-61	117.6	-172.1	-71	-40.8	0	0	0	113.1
687	G	34.7	Very low	45.6	Very low	72 Å²	72	117.3 Å²	117.3	74%	0.742	65%	0.653	S	S	*	*	S	Bend	trans	140.4	107.2	161.8	0	0	0	0	0	115.3	D685 G689	D685-G687 PolarHBondContact O-N 2.97Å; G687-G689 PolarHBondContact O-N 2.97Å
688	A	30.9	Very low	43	Very low	117 Å²	117	120 Å²	120	97%	0.967	68%	0.675	S	S	*	*			trans	-43.1	114.5	176.6	0	0	0	0	0	114.9
689	G	31.5	Very low	40.5	Very low	55 Å²	55	126.1 Å²	126.1	57%	0.567	71%	0.708	S	S	*	*			trans	-128	111.4	166.5	0	0	0	0	0	109.9	G687 W691	G687-G689 PolarHBondContact O-N 2.97Å; G689-W691 PolarHBondContact O-N 3.49Å
690	N	26.7	Very low	38.1	Very low	157 Å²	157	128.5 Å²	128.5	84%	0.84	72%	0.722	S	S	*	*			trans	-71.7	117.5	-172.7	-142.4	13.6	0	0	0	110.7	D692	N690-D692 PolarHBondContact O-N 2.98Å
691	W	27.5	Very low	35.8	Very low	209 Å²	209	129.5 Å²	129.5	79%	0.792	73%	0.729	S	S	*	*			trans	-94.5	83.3	179	-71.8	83.7	0	0	0	110.7	G689 M696	G689-W691 PolarHBondContact O-N 3.49Å; W691-M696 HydrophobicContact CH2-CE 3.85Å; W691-M696 HydrophobicContact CZ3-CE 3.66Å
692	D	29.1	Very low	33.9	Very low	132 Å²	132	134.1 Å²	134.1	71%	0.706	75%	0.75	S	S	*	*			trans	-132	101.5	162.3	-83.4	-38.4	0	0	0	108	N690	N690-D692 PolarHBondContact O-N 2.98Å
693	Q	26.6	Very low	32.5	Very low	184 Å²	184	130.3 Å²	130.3	86%	0.86	73%	0.732	S	S	*	*	S	Bend	trans	147.9	127.2	141.1	-79.4	171.7	18.2	0	0	114.1
694	E	25.5	Very low	30.9	Very low	179 Å²	179	128 Å²	128	84%	0.836	72%	0.724	S	S	*	*			trans	74.6	141.3	155.9	-70.8	-172.1	171	0	0	120.9	M696	E694-M696 PolarHBondContact O-N 2.85Å
695	P	31.3	Very low	30.3	Very low	123 Å²	123	121.5 Å²	121.5	80%	0.799	70%	0.704	S	S	*	*			trans	-74.2	121.8	-163.4	30.3	-32.5	0	0	0	110.5	A697	P695-A697 PolarHBondContact O-N 3.33Å
696	M	26.8	Very low	29.8	Very low	152 Å²	152	120.1 Å²	120.1	75%	0.749	70%	0.697	S	S	*	*			trans	-26.7	104.4	172.3	-73.1	-71.5	-161.1	0	0	112	W691 E694	W691-M696 HydrophobicContact CH2-CE 3.85Å; W691-M696 HydrophobicContact CZ3-CE 3.66Å; E694-M696 PolarHBondContact O-N 2.85Å
697	A	25.2	Very low	30	Very low	82 Å²	82	117.1 Å²	117.1	68%	0.678	68%	0.676	S	S	*	*			trans	-54.1	139.4	161.8	0	0	0	0	0	107.8	P695 D699	P695-A697 PolarHBondContact O-N 3.33Å; A697-D699 PolarHBondContact O-N 3.36Å
698	T	24.8	Very low	30.3	Very low	133 Å²	133	115.1 Å²	115.1	82%	0.816	65%	0.65	S	S	*	*			trans	-66	73.5	179.5	50.4	0	0	0	0	110.6	T700	T698-T700 VanDerWaalsContact C-N 3.31Å; T698-T700 PolarHBondContact O-N 3.45Å; T698-T700 VanDerWaalsContact O-N 3.08Å
699	D	23.9	Very low	30.5	Very low	146 Å²	146	110 Å²	110	78%	0.781	61%	0.607	S	S	*	*			trans	-73.4	96.6	160.3	-85.2	-18.6	0	0	0	106.1	A697 C701	A697-D699 PolarHBondContact O-N 3.36Å; D699-C701 PolarHBondContact O-N 3.5Å
700	T	25.9	Very low	30.4	Very low	117 Å²	117	114.6 Å²	114.6	72%	0.718	62%	0.615	S	S	*	*			trans	-48.3	109.5	168.9	42.9	0	0	0	0	108	T698 N702	T698-T700 VanDerWaalsContact C-N 3.31Å; T698-T700 PolarHBondContact O-N 3.45Å; T698-T700 VanDerWaalsContact O-N 3.08Å; T700-N702 PolarHBondContact O-N 2.85Å
701	C	25.3	Very low	30.6	Very low	82 Å²	82	111 Å²	111	55%	0.554	60%	0.599	S	S	*	*			trans	-60.6	89.1	169.8	-63.4	0	0	0	0	107.8	D699 V703	D699-C701 PolarHBondContact O-N 3.5Å; C701-V703 PolarHBondContact O-N 2.99Å
702	N	31.1	Very low	30.8	Very low	120 Å²	120	105.8 Å²	105.8	64%	0.642	58%	0.58	S	S	*	*			trans	-60.8	109.6	160.3	-89.1	-19.3	0	0	0	105	T700 P704	T700-N702 PolarHBondContact O-N 2.85Å; N702-P704 WeakPolarHBondContact O-CD 3.25Å; N702-P704 VanDerWaalsContact O-N 3.11Å
703	V	34.4	Very low	30.6	Very low	43 Å²	43	109 Å²	109	26%	0.261	58%	0.582	S	S	.	*			trans	-43.7	124.1	168.2	178.7	0	0	0	0	106.2	L612 Y654 C701 D705	L612-V703 HydrophobicContact CD2-CG1 4.06Å; Y654-V703 WeakPolarHBondContact OH-CG2 3.32Å; C701-V703 PolarHBondContact O-N 2.99Å; V703-D705 PolarHBondContact O-N 3.11Å
704	P	28.4	Very low	30.6	Very low	72 Å²	72	102.1 Å²	102.1	47%	0.468	56%	0.56	S	S	.	*			trans	-57.9	99.4	165.6	-18.5	30.6	0	0	0	105.1	N702 D706	N702-P704 WeakPolarHBondContact O-CD 3.25Å; N702-P704 VanDerWaalsContact O-N 3.11Å; P704-D706 PolarHBondContact O-N 2.99Å
705	D	41.8	Very low	30.6	Very low	59 Å²	59	99.4 Å²	99.4	32%	0.316	56%	0.561	S	S	.	*			trans	-69.5	69.6	179.1	-126.5	-17.3	0	0	0	103.9	R471 V703 S708	R471-D705 HydrophobicContact CG-CB 4.41Å; R471-D705 PolarHBondContact NE-O 3.38Å; R471-D705 PolarHBondContact NH2-O 2.89Å; V703-D705 PolarHBondContact O-N 3.11Å; D705-S708 PolarHBondContact OD1-OG 2.97Å
706	D	33.7	Very low	30.4	Very low	121 Å²	121	101.5 Å²	101.5	65%	0.647	55%	0.554	S	S	*	*			trans	-93.6	-18.2	-178.8	-93.8	-21.3	0	0	0	111.4	R471 P704	R471-D706 VanDerWaalsContact NH2-CA 3.34Å; R471-D706 PolarHBondContact NH2-O 3.39Å; P704-D706 PolarHBondContact O-N 2.99Å
707	F	44.3	Very low	30.3	Very low	105 Å²	105	99.4 Å²	99.4	46%	0.461	55%	0.546	S	S	.	.	S	Bend	trans	-107	-6.5	-169.4	-58.3	-76.4	0	0	0	117.4	D709 M710	F707-D709 PolarHBondContact O-N 3.08Å; F707-M710 PolarHBondContact O-N 3.31Å
708	S	40.8	Very low	30.3	Very low	29 Å²	29	102.3 Å²	102.3	20%	0.203	55%	0.55	C	S	.	*	T	Hydrogen-bonded Turn	trans	-55.1	-25.1	-173.1	-77.5	0	0	0	0	116.1	R516 D705	R516-S708 PolarHBondContact NH1-OG 2.74Å; R516-S708 PolarHBondContact NH2-OG 3.21Å; D705-S708 PolarHBondContact OD1-OG 2.97Å
709	D	36.3	Very low	30.2	Very low	9 Å²	9	100.7 Å²	100.7	5%	0.048	55%	0.55	C	S	.	*	T	Hydrogen-bonded Turn	trans	-118.1	-1.2	-176.2	-65.9	-9.2	0	0	0	113.9	N427 R471 F707 V711 Y712	N427-D709 VanDerWaalsContact CG-CB 3.41Å; N427-D709 PolarHBondContact N-OD2 2.83Å; N427-D709 WeakPolarHBondContact ND2-CB 3.03Å; N427-D709 VanDerWaalsContact OD1-CB 3.23Å; N427-D709 WeakPolarHBondContact OD1-CB 3.2Å; N427-D709 PolarHBondContact OD1-OD2 3.33Å; R471-D709 IonicContact NH1-OD2 3.58Å; F707-D709 PolarHBondContact O-N 3.08Å; D709-V711 PolarHBondContact O-N 2.81Å; D709-Y712 PolarHBondContact O-N 2.82Å
710	M	28.9	Very low	30.2	Very low	153 Å²	153	98.6 Å²	98.6	75%	0.754	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-68.5	-21.2	-177.8	-127.5	-164.8	92.9	0	0	112.9	F707	F707-M710 PolarHBondContact O-N 3.31Å
711	V	31	Very low	30.1	Very low	80 Å²	80	97.6 Å²	97.6	49%	0.485	54%	0.54	S	S	.	.	G	3₁₀ helix	trans	-90.8	-6	-176.3	-170.9	0	0	0	0	112.8	D709 R713	D709-V711 PolarHBondContact O-N 2.81Å; V711-R713 PolarHBondContact O-N 3.41Å
712	Y	31.5	Very low	30	Very low	101 Å²	101	103 Å²	103	40%	0.396	55%	0.554	S	S	.	*	G	3₁₀ helix	trans	-78.9	2	178	-101.2	-81.9	0	0	0	115	C463 R466 D709 G714	C463-Y712 PolarHBondContact SG-OH 2.85Å; R466-Y712 PolarHBondContact NH1-OH 3.06Å; R466-Y712 VanDerWaalsContact NH2-CZ 3.32Å; R466-Y712 PolarHBondContact NH2-OH 3.31Å; R466-Y712 VanDerWaalsContact NH2-OH 3.11Å; D709-Y712 PolarHBondContact O-N 2.82Å; Y712-G714 PolarHBondContact O-N 2.94Å
713	R	26.1	Very low	29.8	Very low	200 Å²	200	103.7 Å²	103.7	76%	0.755	56%	0.558	S	S	*	*	S	Bend	trans	-76.7	66	152.6	-69.5	-156.8	-166.1	-148.8	3.1	108.8	V711 S715 D717	V711-R713 PolarHBondContact O-N 3.41Å; R713-S715 PolarHBondContact O-N 3.38Å; R713-D717 IonicContact CZ-OD2 3.6Å; R713-D717 IonicContact NH1-OD2 3.45Å; R713-D717 PolarHBondContact NH1-OD2 2.91Å
714	G	26.2	Very low	29.4	Very low	39 Å²	39	110.5 Å²	110.5	40%	0.402	59%	0.587	S	S	.	*			trans	-54.3	116.4	164	0	0	0	0	0	107.5	Y712 Y716	Y712-G714 PolarHBondContact O-N 2.94Å; G714-Y716 WeakPolarHBondContact O-CD2 3.46Å; G714-Y716 PolarHBondContact O-N 3.42Å
715	S	25.6	Very low	29.3	Very low	121 Å²	121	115.9 Å²	115.9	85%	0.846	61%	0.608	S	S	*	*	S	Bend	trans	20.8	22.5	160.7	-53.8	0	0	0	0	122.5	R713	R713-S715 PolarHBondContact O-N 3.38Å
716	Y	26.8	Very low	28.4	Very low	167 Å²	167	122 Å²	122	66%	0.655	63%	0.634	S	S	*	*			trans	-101.3	-4.3	-175.6	-71.8	-67.6	0	0	0	114.8	G714 W779	G714-Y716 WeakPolarHBondContact O-CD2 3.46Å; G714-Y716 PolarHBondContact O-N 3.42Å; Y716-W779 HydrophobicContact CE1-CZ2 4.41Å; Y716-W779 HydrophobicContact CE2-CZ2 4.29Å; Y716-W779 AromaticContact CZ-CZ2 3.78Å; Y716-W779 VanDerWaalsContact OH-CZ2 3.3Å; Y716-W779 WeakPolarHBondContact OH-CZ2 3.41Å; Y716-W779 PolarHBondContact OH-NE1 2.9Å; Y716-W779 VanDerWaalsContact OH-NE1 3.08Å
717	D	25.2	Very low	28.1	Very low	109 Å²	109	123 Å²	123	58%	0.583	65%	0.645	S	S	*	*	S	Bend	trans	-97.4	-5.3	-179.9	-94.6	-26.2	0	0	0	115.4	R713	R713-D717 IonicContact CZ-OD2 3.6Å; R713-D717 IonicContact NH1-OD2 3.45Å; R713-D717 PolarHBondContact NH1-OD2 2.91Å
718	N	23.4	Very low	27.1	Very low	143 Å²	143	125.1 Å²	125.1	77%	0.765	66%	0.661	S	S	*	*			trans	-108.8	50.1	178.8	-72.7	-16.1	0	0	0	112.8	V720	N718-V720 PolarHBondContact O-N 3.22Å
719	A	23.9	Very low	26.4	Very low	99 Å²	99	129.6 Å²	129.6	82%	0.818	69%	0.692	S	S	*	*			trans	-83.4	47.4	147.5	0	0	0	0	0	109.5	S721	A719-S721 PolarHBondContact O-N 2.89Å; A719-S721 VanDerWaalsContact O-N 3.11Å
720	V	23.9	Very low	26.4	Very low	102 Å²	102	135.1 Å²	135.1	62%	0.618	73%	0.729	S	S	*	*			trans	-77.1	98.1	166.3	-173.8	0	0	0	0	105.7	N718 F722	N718-V720 PolarHBondContact O-N 3.22Å; V720-F722 PolarHBondContact O-N 3.42Å
721	S	23.7	Very low	26.4	Very low	95 Å²	95	132.5 Å²	132.5	66%	0.664	73%	0.731	S	S	*	*			trans	5.3	86.5	159.1	-168.4	0	0	0	0	114.4	A719 D723	A719-S721 PolarHBondContact O-N 2.89Å; A719-S721 VanDerWaalsContact O-N 3.11Å; S721-D723 PolarHBondContact O-N 3.43Å
722	F	23.5	Very low	26.3	Very low	196 Å²	196	135.2 Å²	135.2	86%	0.86	75%	0.748	S	S	*	*			trans	-80.3	56	165.2	-98.6	-85.8	0	0	0	109.4	V720	V720-F722 PolarHBondContact O-N 3.42Å
723	D	26.9	Very low	26	Very low	135 Å²	135	136.8 Å²	136.8	72%	0.722	77%	0.768	S	S	*	*			trans	-100.3	123.4	155.6	-92.4	-32.1	0	0	0	106.3	S721	S721-D723 PolarHBondContact O-N 3.43Å
724	Q	26.5	Very low	26.1	Very low	185 Å²	185	133.1 Å²	133.1	86%	0.864	77%	0.77	S	S	*	*			trans	94.5	69.5	-179.8	-51.6	177.9	8.7	0	0	116.9
725	M	24.6	Very low	26.2	Very low	185 Å²	185	136.7 Å²	136.7	91%	0.911	79%	0.789	S	S	*	*			trans	-149.9	76.7	133.6	-73.7	-154.2	-158.2	0	0	110.5
726	H	22.9	Very low	26.5	Very low	187 Å²	187	134.4 Å²	134.4	87%	0.866	78%	0.784	S	S	*	*			trans	-84.1	104	156.7	-91.9	-69.8	0	0	0	108.6
727	V	27.4	Very low	26.3	Very low	144 Å²	144	138.7 Å²	138.7	87%	0.873	80%	0.799	S	S	*	*			trans	-145.5	120.5	149.9	-171	0	0	0	0	109.4
728	N	24.2	Very low	26.6	Very low	149 Å²	149	141.3 Å²	141.3	80%	0.797	81%	0.814	S	S	*	*			trans	-57	141.2	-179.2	-63	-55.2	0	0	0	113.8
729	S	26.2	Very low	26.9	Very low	122 Å²	122	138.4 Å²	138.4	85%	0.853	82%	0.817	S	S	*	*			trans	-147.3	119.4	144.3	-112.4	0	0	0	0	110.4
730	P	35.3	Very low	27.1	Very low	126 Å²	126	142.9 Å²	142.9	82%	0.818	82%	0.823	S	S	*	*			trans	-88.9	129.8	-179	33.9	-28.8	0	0	0	110
731	A	29.6	Very low	27.4	Very low	97 Å²	97	145.3 Å²	145.3	80%	0.802	83%	0.833	S	S	*	*			trans	-131	106.3	167.9	0	0	0	0	0	109.3
732	T	29	Very low	27.8	Very low	137 Å²	137	145.6 Å²	145.6	84%	0.84	84%	0.835	S	S	*	*			trans	-46.4	135.1	172.2	32.2	0	0	0	0	114	P734	T732-P734 WeakPolarHBondContact O-CD 3.45Å
733	V	24.5	Very low	28	Very low	135 Å²	135	142.3 Å²	142.3	82%	0.818	84%	0.836	S	S	*	*			trans	-76	130.6	167.9	179.9	0	0	0	0	109.9
734	P	29.9	Very low	28.2	Very low	122 Å²	122	140.3 Å²	140.3	79%	0.792	84%	0.839	S	S	*	*			trans	-111.6	114.5	152.5	7.7	13.7	0	0	0	109.7	T732	T732-P734 WeakPolarHBondContact O-CD 3.45Å
735	S	28.6	Very low	28.6	Very low	115 Å²	115	137.2 Å²	137.2	80%	0.804	84%	0.835	S	S	*	*			trans	-62.2	134.3	164.7	48.9	0	0	0	0	111.6
736	G	29.8	Very low	29.1	Very low	72 Å²	72	134.4 Å²	134.4	74%	0.742	83%	0.83	S	S	*	*			trans	-177.7	75.7	170.6	0	0	0	0	0	110.6
737	W	23.8	Very low	29.7	Very low	257 Å²	257	131.5 Å²	131.5	97%	0.973	83%	0.828	S	S	*	*			trans	-94.8	106.7	173.2	-78.4	45.5	0	0	0	107.8
738	D	30.3	Very low	29.9	Very low	165 Å²	165	128.2 Å²	128.2	88%	0.882	82%	0.823	S	S	*	*			trans	-122.3	111.7	161.7	-88.7	-37	0	0	0	108.1	M740	D738-M740 PolarHBondContact O-N 3.38Å
739	G	31.2	Very low	30.1	Very low	81 Å²	81	127.1 Å²	127.1	84%	0.835	83%	0.827	S	S	*	*			trans	-69.9	118.6	177.1	0	0	0	0	0	110.8
740	M	27	Very low	30.3	Very low	194 Å²	194	126.1 Å²	126.1	96%	0.956	83%	0.826	S	S	*	*			trans	-91.2	92.5	163.5	-84.5	177.3	165.9	0	0	108.3	D738	D738-M740 PolarHBondContact O-N 3.38Å
741	D	31.1	Very low	29.9	Very low	152 Å²	152	123.8 Å²	123.8	81%	0.813	83%	0.825	S	S	*	*			trans	-86.7	107.7	166.5	-114.1	-29.5	0	0	0	110.1
742	S	31.8	Very low	30	Very low	101 Å²	101	128.3 Å²	128.3	71%	0.706	83%	0.829	S	S	*	*				47.1	90.7	123	-46.2	0	0	0	0	117.4	A744	S742-A744 PolarHBondContact O-N 2.84Å
743	S	26.5	Very low	29.8	Very low	128 Å²	128	130.3 Å²	130.3	90%	0.895	83%	0.829	S	S	*	*			trans	-64.7	114.4	164.2	42.1	0	0	0	0	112.2
744	A	31.1	Very low	30.1	Very low	93 Å²	93	135.2 Å²	135.2	77%	0.769	84%	0.835	S	S	*	*			trans	-106.6	137	162.3	0	0	0	0	0	109.8	S742	S742-A744 PolarHBondContact O-N 2.84Å
745	P	36.2	Very low	30.1	Very low	120 Å²	120	133 Å²	133	78%	0.779	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-84.9	163.2	-168.6	35.4	-35.8	0	0	0	113.2
746	P	34.7	Very low	30.1	Very low	125 Å²	125	135.7 Å²	135.7	81%	0.812	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-92.4	140.4	-158.7	35.1	-31.8	0	0	0	112.8
747	P	36.4	Very low	30.3	Very low	126 Å²	126	139 Å²	139	82%	0.818	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-100.4	126.6	161.4	32.7	-23.1	0	0	0	111
748	G	31	Very low	30.8	Very low	75 Å²	75	132.1 Å²	132.1	77%	0.773	83%	0.833	S	S	*	*			trans	59.5	95.9	133.5	0	0	0	0	0	118.1	A750	G748-A750 PolarHBondContact O-N 3.48Å
749	S	27.3	Very low	30.7	Very low	126 Å²	126	128.3 Å²	128.3	88%	0.881	83%	0.825	S	S	*	*			trans	-51.1	118.3	161.9	51.8	0	0	0	0	113.8
750	A	32	Very low	30.5	Very low	101 Å²	101	129.9 Å²	129.9	84%	0.835	82%	0.822	S	S	*	*			trans	-146.7	97.5	150.7	0	0	0	0	0	107.4	G748	G748-A750 PolarHBondContact O-N 3.48Å
751	G	26.4	Very low	30.7	Very low	77 Å²	77	128.8 Å²	128.8	79%	0.794	82%	0.82	S	S	*	*			trans	-72.4	138.2	176.8	0	0	0	0	0	111.1
752	Q	30.7	Very low	30.8	Very low	192 Å²	192	127 Å²	127	90%	0.897	82%	0.816	S	S	*	*			trans	-154.6	113.6	142.7	-109.1	175.3	20	0	0	108.5
753	Q	25.8	Very low	30.9	Very low	180 Å²	180	127 Å²	127	84%	0.841	82%	0.822	S	S	*	*			trans	-57.5	138.2	168.5	-67.3	164.1	-42.2	0	0	110
754	Y	30.5	Very low	31.1	Very low	238 Å²	238	129.9 Å²	129.9	93%	0.933	82%	0.822	S	S	*	*			trans	-169.3	130.9	138.8	-91.9	-66.7	0	0	0	110.2
755	G	30.5	Very low	31.1	Very low	74 Å²	74	130 Å²	130	76%	0.763	82%	0.822	S	S	*	*			trans	101.5	81.4	143.7	0	0	0	0	0	118.5
756	N	27.3	Very low	30.9	Very low	173 Å²	173	128.5 Å²	128.5	93%	0.925	82%	0.821	S	S	*	*			trans	-55.7	125.7	154.1	-92.7	-22.6	0	0	0	111.6
757	V	35.1	Very low	30.8	Very low	142 Å²	142	126.4 Å²	126.4	86%	0.861	81%	0.813	S	S	*	*			trans	-146.1	140	154.1	-175.1	0	0	0	0	108.9
758	P	33.2	Very low	30.5	Very low	112 Å²	112	125.1 Å²	125.1	73%	0.727	81%	0.807	S	S	*	*			trans	-104.4	157.5	-145.7	39	-32.9	0	0	0	115.9
759	A	29.3	Very low	30.4	Very low	85 Å²	85	132.5 Å²	132.5	70%	0.702	81%	0.812	S	S	*	*			trans	54.3	99.2	134.8	0	0	0	0	0	119.6
760	S	27.6	Very low	30.5	Very low	113 Å²	113	136.4 Å²	136.4	79%	0.79	81%	0.809	S	S	*	*				54.6	103.8	121.5	64.3	0	0	0	0	118.8
761	L	29.8	Very low	30.5	Very low	171 Å²	171	136.5 Å²	136.5	90%	0.895	80%	0.801	S	S	*	*			trans	-120.6	138.7	146	-86.1	158.6	0	0	0	108.6	A763	L761-A763 PolarHBondContact O-N 3.26Å
762	P	34.8	Very low	30.7	Very low	115 Å²	115	138.7 Å²	138.7	75%	0.747	80%	0.801	S	S	*	*			trans	-79.3	123.8	-161.8	30.5	-32.2	0	0	0	111.5	Q764	P762-Q764 PolarHBondContact O-N 2.93Å; P762-Q764 VanDerWaalsContact O-N 3.12Å
763	A	32.9	Very low	30.6	Very low	100 Å²	100	138.8 Å²	138.8	83%	0.826	80%	0.802	S	S	*	*			trans	-69.3	106.4	170.1	0	0	0	0	0	109.1	L761 A765	L761-A763 PolarHBondContact O-N 3.26Å; A763-A765 PolarHBondContact O-N 3.36Å
764	Q	29.8	Very low	30.7	Very low	189 Å²	189	138.1 Å²	138.1	88%	0.883	80%	0.799	S	S	*	*			trans	-58.8	102.8	164.4	-77.9	174.6	-5.5	0	0	108.2	P762 A766	P762-Q764 PolarHBondContact O-N 2.93Å; P762-Q764 VanDerWaalsContact O-N 3.12Å; Q764-A766 VanDerWaalsContact C-N 3.28Å; Q764-A766 PolarHBondContact O-N 2.97Å
765	A	32.4	Very low	30.5	Very low	95 Å²	95	132.2 Å²	132.2	79%	0.785	79%	0.789	S	S	*	*			trans	-66.4	91.5	168.5	0	0	0	0	0	108.2	A763 A767	A763-A765 PolarHBondContact O-N 3.36Å; A765-A767 PolarHBondContact O-N 3.02Å
766	A	31.4	Very low	30.2	Very low	90 Å²	90	134.9 Å²	134.9	74%	0.744	79%	0.791	S	S	*	*			trans	-66.1	82.2	161.2	0	0	0	0	0	107.4	Q764 S768	Q764-A766 VanDerWaalsContact C-N 3.28Å; Q764-A766 PolarHBondContact O-N 2.97Å; A766-S768 PolarHBondContact O-N 2.91Å
767	A	32.4	Very low	30.2	Very low	80 Å²	80	133 Å²	133	66%	0.661	78%	0.78	S	S	*	*			trans	-66.9	90.6	169.5	0	0	0	0	0	107.6	A765 R769	A765-A767 PolarHBondContact O-N 3.02Å; A767-R769 PolarHBondContact O-N 2.94Å
768	S	30.1	Very low	29.7	Very low	99 Å²	99	130.3 Å²	130.3	69%	0.692	77%	0.768	S	S	*	*			trans	-60.7	81.6	161.4	24.8	0	0	0	0	108.1	A766 Y770	A766-S768 PolarHBondContact O-N 2.91Å; S768-Y770 PolarHBondContact O-N 3.35Å
769	R	30	Very low	29.3	Very low	231 Å²	231	133.9 Å²	133.9	87%	0.872	77%	0.767	S	S	*	*			trans	-64.5	85.3	165.4	-76.1	-178	175.8	178.5	-1.2	107.7	A767 P771	A767-R769 PolarHBondContact O-N 2.94Å; R769-P771 VanDerWaalsContact O-CD 3.32Å; R769-P771 WeakPolarHBondContact O-CD 3.33Å
770	Y	28.9	Very low	29.1	Very low	208 Å²	208	139.7 Å²	139.7	82%	0.816	77%	0.772	S	S	*	*			trans	-70.2	114.6	152.8	-77.8	-80.7	0	0	0	106.3	S768	S768-Y770 PolarHBondContact O-N 3.35Å
771	P	31.1	Very low	29	Very low	102 Å²	102	140 Å²	140	66%	0.662	77%	0.765	S	S	*	*			trans	-62.8	148.5	175.1	27.6	-32	0	0	0	108.8	R769 Q773	R769-P771 VanDerWaalsContact O-CD 3.32Å; R769-P771 WeakPolarHBondContact O-CD 3.33Å; P771-Q773 PolarHBondContact O-N 2.82Å; P771-Q773 VanDerWaalsContact O-N 3.15Å
772	P	30.6	Very low	28.9	Very low	123 Å²	123	137.3 Å²	137.3	80%	0.799	76%	0.756	S	S	*	*			trans	-57.8	123.8	-176.8	23.6	-31.7	0	0	0	109.1	Q774	P772-Q774 PolarHBondContact O-N 2.86Å
773	Q	28.8	Very low	28.7	Very low	194 Å²	194	134.1 Å²	134.1	91%	0.907	73%	0.733	S	S	*	*			trans	-57.7	105.5	170.5	-74.2	178.7	-14	0	0	107.3	P771	P771-Q773 PolarHBondContact O-N 2.82Å; P771-Q773 VanDerWaalsContact O-N 3.15Å
774	Q	27.6	Very low	28.5	Very low	167 Å²	167	139.7 Å²	139.7	78%	0.78	75%	0.747	S	S	*	*			trans	-58.8	140.2	165	-76.2	-177.6	-19.2	0	0	107.7	P772 V776	P772-Q774 PolarHBondContact O-N 2.86Å; Q774-V776 PolarHBondContact O-N 3.37Å
775	P	26.8	Very low	28.4	Very low	114 Å²	114	137.2 Å²	137.2	74%	0.74	74%	0.74	S	S	*	*			trans	-57.4	111.8	-179.8	22.6	-30.3	0	0	0	108.1	N777	P775-N777 PolarHBondContact O-N 2.86Å
776	V	24.3	Very low	28.2	Very low	130 Å²	130	139.4 Å²	139.4	79%	0.788	74%	0.738	S	S	*	*			trans	-69.1	91.7	173.6	-177.7	0	0	0	0	105	Q774 S778	Q774-V776 PolarHBondContact O-N 3.37Å; V776-S778 PolarHBondContact O-N 3.18Å
777	N	26.7	Very low	28.1	Very low	132 Å²	132	142.2 Å²	142.2	71%	0.706	74%	0.738	S	S	*	*			trans	-55	107.8	165	-74.9	-22.4	0	0	0	105.9	P775 W779	P775-N777 PolarHBondContact O-N 2.86Å; N777-W779 PolarHBondContact O-N 3.49Å
778	S	24.5	Very low	27.8	Very low	87 Å²	87	145.8 Å²	145.8	61%	0.608	74%	0.742	S	S	*	*			trans	-70	68.4	173.3	60.6	0	0	0	0	108.9	V776	V776-S778 PolarHBondContact O-N 3.18Å
779	W	25.7	Very low	27.7	Very low	186 Å²	186	148.8 Å²	148.8	71%	0.705	75%	0.745	S	S	*	*			trans	-125.7	87.6	159	-73.7	72.4	0	0	0	102.9	Y716 N777 D781	Y716-W779 HydrophobicContact CE1-CZ2 4.41Å; Y716-W779 HydrophobicContact CE2-CZ2 4.29Å; Y716-W779 AromaticContact CZ-CZ2 3.78Å; Y716-W779 VanDerWaalsContact OH-CZ2 3.3Å; Y716-W779 WeakPolarHBondContact OH-CZ2 3.41Å; Y716-W779 PolarHBondContact OH-NE1 2.9Å; Y716-W779 VanDerWaalsContact OH-NE1 3.08Å; N777-W779 PolarHBondContact O-N 3.49Å; W779-D781 PolarHBondContact O-N 3.17Å
780	Y	24.3	Very low	27.5	Very low	208 Å²	208	143.3 Å²	143.3	82%	0.816	74%	0.737	S	S	*	*			trans	-60.9	91.6	151.5	-79.7	-82.8	0	0	0	104.9	T782	Y780-T782 PolarHBondContact O-N 2.8Å
781	D	25.7	Very low	27.4	Very low	119 Å²	119	138.6 Å²	138.6	64%	0.636	73%	0.731	S	S	*	*			trans	-43	101.7	143.6	-143.6	1.7	0	0	0	103.7	W779 D783	W779-D781 PolarHBondContact O-N 3.17Å; D781-D783 PolarHBondContact O-N 3.16Å; D781-D783 WeakPolarHBondContact OD1-CB 3.47Å
782	T	28.8	Very low	27.1	Very low	115 Å²	115	141.5 Å²	141.5	71%	0.706	74%	0.737	S	S	*	*	S	Bend	trans	-72.3	26.7	171.3	31.3	0	0	0	0	110.2	Y780	Y780-T782 PolarHBondContact O-N 2.8Å
783	D	29.1	Very low	26.8	Very low	47 Å²	47	143 Å²	143	25%	0.251	73%	0.732	S	S	.	*			trans	-128.6	42.1	-172.7	-95.4	33.4	0	0	0	108.4	Y303 R304 D781	Y303-D783 WeakPolarHBondContact CE2-OD2 3.3Å; Y303-D783 PolarHBondContact OH-OD1 3.23Å; Y303-D783 PolarHBondContact OH-OD2 3.08Å; R304-D783 VanDerWaalsContact CZ-C 3.44Å; R304-D783 IonicContact CZ-OD2 3.82Å; R304-D783 IonicContact NE-OD2 3.5Å; R304-D783 PolarHBondContact NE-OD2 2.97Å; R304-D783 PolarHBondContact NH1-O 3Å; R304-D783 PolarHBondContact NH2-O 3.2Å; R304-D783 IonicContact NH2-OD2 3.23Å; D781-D783 PolarHBondContact O-N 3.16Å; D781-D783 WeakPolarHBondContact OD1-CB 3.47Å
784	L	29.9	Very low	26.7	Very low	217 Å²	217	138.4 Å²	138.4	100%	1.136	72%	0.716	S	S	*	*			trans	-126.1	0	143.1	-79.5	171.2	0	0	0	107.2

Retrieved 784 of 784 residues in 306.6 ms (Link to these results)

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