A0A096M2B8_POEFO Loading...

Cytochrome P450, family 27, subfamily C, polypeptide 1

AlphaFold DB (A0A3B3UYS2), UniProt , Accession A0A096M2B8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 539 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	36.8	Very low	29.9	Very low	245 Å²	245	133.9 Å²	133.9	100%	1.207	72%	0.716	S	S	*	*				0	39	0	-89.9	177.8	175.3	0	0	113.3
2	A	25.4	Very low	30.8	Very low	84 Å²	84	136.8 Å²	136.8	69%	0.694	71%	0.71	S	S	*	*			trans	-130.2	-9.6	177	0	0	0	0	0	114.9
3	M	22.4	Very low	31.1	Very low	174 Å²	174	138.1 Å²	138.1	86%	0.857	71%	0.706	S	S	*	*	S	Bend	trans	-93	-15.3	177.9	-84.3	-171.9	-176.3	0	0	114.7	N5	M3-N5 VanDerWaalsContact C-N 3.33Å
4	L	28.8	Very low	31.3	Very low	156 Å²	156	134 Å²	134	82%	0.817	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-15.8	176.7	-83.5	152.2	0	0	0	113.3
5	N	29.8	Very low	31.8	Very low	126 Å²	126	130.7 Å²	130.7	67%	0.674	68%	0.684	S	S	*	*	H	α-helix	trans	-84.4	-12.1	-175.5	-125.2	2.9	0	0	0	114.5	M3 S8	M3-N5 VanDerWaalsContact C-N 3.33Å; N5-S8 PolarHBondContact O-OG 3.44Å
6	R	28.9	Very low	32.4	Very low	219 Å²	219	126 Å²	126	83%	0.826	67%	0.666	S	S	*	*	H	α-helix	trans	-95.2	-23.3	179.2	-77.9	-171.3	177.5	-161.3	-0.1	114
7	F	27.7	Very low	32.7	Very low	177 Å²	177	122.5 Å²	122.5	78%	0.776	66%	0.659	S	S	*	*	H	α-helix	trans	-81.7	-24.4	178.1	-87.4	-83.7	0	0	0	113.3
8	S	35.6	Very low	32.7	Very low	54 Å²	54	118.8 Å²	118.8	38%	0.378	66%	0.655	S	S	.	*	H	α-helix	trans	-70.2	-39.5	176.3	55.2	0	0	0	0	113	N5 A10 W12	N5-S8 PolarHBondContact O-OG 3.44Å; S8-A10 PolarHBondContact O-N 3.45Å; S8-W12 PolarHBondContact O-N 3.45Å
9	V	33.3	Very low	32.9	Very low	89 Å²	89	118.1 Å²	118.1	54%	0.539	65%	0.649	S	S	.	*	H	α-helix	trans	-70.8	-30.9	-178.1	-178.6	0	0	0	0	112.6
10	A	29	Very low	33.1	Very low	68 Å²	68	117.2 Å²	117.2	56%	0.562	64%	0.643	S	S	*	*	H	α-helix	trans	-73.7	-37.2	179.2	0	0	0	0	0	112.4	S8 W12 K13	S8-A10 PolarHBondContact O-N 3.45Å; A10-W12 VanDerWaalsContact C-N 3.33Å; A10-K13 PolarHBondContact O-N 2.65Å
11	C	31.8	Very low	33.2	Very low	81 Å²	81	117.2 Å²	117.2	55%	0.547	64%	0.642	S	S	.	*	H	α-helix	trans	-72.5	-27.9	176.8	-152.2	0	0	0	0	112	K13 S14	C11-K13 PolarHBondContact O-N 3.09Å; C11-S14 PolarHBondContact O-OG 2.96Å
12	W	40.4	Very low	33.1	Very low	168 Å²	168	113.1 Å²	113.1	64%	0.636	62%	0.62	S	S	*	*	H	α-helix	trans	-62.6	-36.1	173.9	-97.3	43.5	0	0	0	114	S8 A10 S16 M329	S8-W12 PolarHBondContact O-N 3.45Å; A10-W12 VanDerWaalsContact C-N 3.33Å; W12-S16 PolarHBondContact O-N 3.35Å; W12-M329 HydrophobicContact CH2-SD 3.9Å
13	K	35	Very low	33.5	Very low	154 Å²	154	115.5 Å²	115.5	67%	0.67	62%	0.617	S	S	*	*	H	α-helix	trans	-73.9	-34.4	-178.9	-76.1	-173.1	176.2	-176.7	0	113.1	A10 C11 S16 A17	A10-K13 PolarHBondContact O-N 2.65Å; C11-K13 PolarHBondContact O-N 3.09Å; K13-S16 PolarHBondContact O-OG 2.99Å; K13-A17 PolarHBondContact O-N 2.96Å
14	S	32.9	Very low	34.1	Very low	81 Å²	81	112.6 Å²	112.6	57%	0.566	60%	0.604	S	S	*	*	H	α-helix	trans	-74.4	-33.8	-176.9	68.3	0	0	0	0	113	C11	C11-S14 PolarHBondContact O-OG 2.96Å
15	V	39.1	Very low	34.2	Very low	84 Å²	84	111 Å²	111	51%	0.509	60%	0.596	S	S	.	*	H	α-helix	trans	-73.1	-33.1	176.3	-178	0	0	0	0	111.3	A17	V15-A17 PolarHBondContact O-N 2.97Å
16	S	41.3	Very low	34.3	Very low	56 Å²	56	111.9 Å²	111.9	39%	0.392	60%	0.6	S	S	.	*	H	α-helix	trans	-65	-34.9	177.9	76.4	0	0	0	0	113.7	W12 K13 G18 L20	W12-S16 PolarHBondContact O-N 3.35Å; K13-S16 PolarHBondContact O-OG 2.99Å; S16-G18 VanDerWaalsContact C-N 3.34Å; S16-G18 PolarHBondContact O-N 3.19Å; S16-L20 WeakPolarHBondContact O-CB 3.2Å; S16-L20 WeakPolarHBondContact O-CD1 3.29Å; S16-L20 PolarHBondContact O-N 3.47Å
17	A	37.2	Very low	34.5	Very low	66 Å²	66	111.6 Å²	111.6	55%	0.545	60%	0.599	S	S	.	*	H	α-helix	trans	-71.4	-26.9	-174.8	0	0	0	0	0	113.4	K13 V15	K13-A17 PolarHBondContact O-N 2.96Å; V15-A17 PolarHBondContact O-N 2.97Å
18	G	33.7	Very low	34.6	Very low	57 Å²	57	107 Å²	107	59%	0.588	59%	0.593	S	S	*	*	H	α-helix	trans	-78.8	-34.9	179.9	0	0	0	0	0	114.1	S16	S16-G18 VanDerWaalsContact C-N 3.34Å; S16-G18 PolarHBondContact O-N 3.19Å
19	L	36.5	Very low	34.4	Very low	105 Å²	105	111.6 Å²	111.6	55%	0.55	61%	0.613	S	S	.	*	H	α-helix	trans	-87.5	-26.6	-177.9	-94.7	125.7	0	0	0	114	N21	L19-N21 VanDerWaalsContact C-N 3.34Å; L19-N21 PolarHBondContact O-N 3.49Å
20	L	36.1	Very low	34.2	Very low	99 Å²	99	115.8 Å²	115.8	52%	0.518	63%	0.626	S	S	.	*	H	α-helix	trans	-69.8	-28.9	179.7	-93.5	153.2	0	0	0	112.9	S16 L24	S16-L20 WeakPolarHBondContact O-CB 3.2Å; S16-L20 WeakPolarHBondContact O-CD1 3.29Å; S16-L20 PolarHBondContact O-N 3.47Å; L20-L24 HydrophobicContact CD2-CD1 3.76Å; L20-L24 WeakPolarHBondContact O-CB 3.24Å; L20-L24 WeakPolarHBondContact O-CD1 3.31Å; L20-L24 PolarHBondContact O-N 3.28Å
21	N	35.6	Very low	34.2	Very low	119 Å²	119	122 Å²	122	64%	0.636	64%	0.641	S	S	*	*	H	α-helix	trans	-80	-28.1	-170.7	-124.4	9.7	0	0	0	114.2	L19	L19-N21 VanDerWaalsContact C-N 3.34Å; L19-N21 PolarHBondContact O-N 3.49Å
22	E	34.7	Very low	34.2	Very low	158 Å²	158	123.9 Å²	123.9	74%	0.738	66%	0.655	S	S	*	*	H	α-helix	trans	-86.8	-30	178.9	-74.5	-167.1	156.3	0	0	113.5
23	Q	34.4	Very low	33.6	Very low	135 Å²	135	120.7 Å²	120.7	63%	0.631	66%	0.664	S	S	*	*	H	α-helix	trans	-83	-26.2	-179.5	-75.4	-174.5	-7.2	0	0	114	R27	Q23-R27 PolarHBondContact O-N 3.41Å
24	L	34.5	Very low	33.2	Very low	112 Å²	112	118.5 Å²	118.5	59%	0.586	67%	0.674	S	S	*	*	H	α-helix	trans	-72.4	-31.6	176.6	-93.3	154.6	0	0	0	112.6	L20 A28	L20-L24 HydrophobicContact CD2-CD1 3.76Å; L20-L24 WeakPolarHBondContact O-CB 3.24Å; L20-L24 WeakPolarHBondContact O-CD1 3.31Å; L20-L24 PolarHBondContact O-N 3.28Å; L24-A28 PolarHBondContact O-N 3.26Å
25	L	31.4	Very low	32.8	Very low	124 Å²	124	120.1 Å²	120.1	65%	0.649	69%	0.686	S	S	*	*	H	α-helix	trans	-72.4	-29.9	177.9	-103.1	136.7	0	0	0	113.3
26	L	32	Very low	32.1	Very low	144 Å²	144	125.2 Å²	125.2	75%	0.754	70%	0.704	S	S	*	*	H	α-helix	trans	-84.1	-20.9	178.4	-92.5	149.2	0	0	0	114.2
27	R	32	Very low	31.3	Very low	213 Å²	213	126.8 Å²	126.8	80%	0.804	72%	0.72	S	S	*	*	H	α-helix	trans	-89.4	-16.4	176.2	-85.9	-178.8	172.2	177.7	-0.8	114.4	Q23 L29	Q23-R27 PolarHBondContact O-N 3.41Å; R27-L29 VanDerWaalsContact C-N 3.35Å
28	A	29.7	Very low	30.7	Very low	79 Å²	79	130.6 Å²	130.6	65%	0.653	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-12.1	180	0	0	0	0	0	114.3	L24	L24-A28 PolarHBondContact O-N 3.26Å
29	L	31	Very low	30.2	Very low	151 Å²	151	137.1 Å²	137.1	79%	0.791	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	5.5	-175.7	-79.6	165.2	0	0	0	115.5	R27	R27-L29 VanDerWaalsContact C-N 3.35Å
30	H	29.5	Very low	29.7	Very low	178 Å²	178	139 Å²	139	82%	0.824	76%	0.755	S	S	*	*	S	Bend	trans	-122.8	13.5	179.8	-100.6	-63.7	0	0	0	115.9
31	K	30.3	Very low	29.2	Very low	199 Å²	199	139 Å²	139	87%	0.865	76%	0.763	S	S	*	*			trans	-121.6	71.3	171.9	-79.6	-172.9	175.2	-177.1	0	111.4
32	S	32.1	Very low	28.7	Very low	120 Å²	120	137.7 Å²	137.7	84%	0.839	77%	0.769	S	S	*	*			trans	-163.6	72	159.9	-179.3	0	0	0	0	109.9
33	A	27.1	Very low	28.2	Very low	100 Å²	100	136.9 Å²	136.9	83%	0.826	78%	0.775	S	S	*	*	S	Bend	trans	-165.8	136.3	155.9	0	0	0	0	0	108.7
34	A	25.7	Very low	27.7	Very low	108 Å²	108	134.1 Å²	134.1	89%	0.893	78%	0.783	S	S	*	*			trans	83	66.1	175.4	0	0	0	0	0	117
35	S	25.4	Very low	27.4	Very low	116 Å²	116	138.2 Å²	138.2	81%	0.811	80%	0.799	S	S	*	*			trans	-125	97.8	138.7	170.6	0	0	0	0	106.6
36	E	25	Very low	27.1	Very low	191 Å²	191	141.7 Å²	141.7	89%	0.893	81%	0.812	S	S	*	*			trans	175.8	156.4	148.6	-102.9	168.3	-170.4	0	0	110.8
37	A	23.5	Very low	26.8	Very low	88 Å²	88	139.5 Å²	139.5	73%	0.727	82%	0.815	S	S	*	*			trans	86.4	97	176	0	0	0	0	0	116.9
38	L	24.5	Very low	26.5	Very low	147 Å²	147	137.8 Å²	137.8	77%	0.77	82%	0.818	S	S	*	*				178	100.3	96.4	-92.5	150.9	0	0	0	110.9	I40	L38-I40 HydrophobicContact CD2-CD1 4.07Å; L38-I40 HydrophobicContact CD2-CG1 3.97Å
39	E	23.6	Very low	26.4	Very low	194 Å²	194	139.4 Å²	139.4	91%	0.907	82%	0.821	S	S	*	*			trans	-65.8	129.8	147.8	-71.6	178.7	148.4	0	0	108.1
40	I	26.6	Very low	26.5	Very low	144 Å²	144	136.2 Å²	136.2	74%	0.738	83%	0.825	S	S	*	*			trans	-133.7	134.9	161.4	-62.7	-176.8	0	0	0	109.4	L38	L38-I40 HydrophobicContact CD2-CD1 4.07Å; L38-I40 HydrophobicContact CD2-CG1 3.97Å
41	S	24.3	Very low	26.4	Very low	98 Å²	98	138.9 Å²	138.9	69%	0.685	83%	0.828	S	S	*	*			trans	-60.7	150.5	-167	58	0	0	0	0	117.3
42	A	25.9	Very low	26.3	Very low	92 Å²	92	137.9 Å²	137.9	76%	0.76	83%	0.831	S	S	*	*			trans	-61.9	133	153.2	0	0	0	0	0	111.5
43	T	23.8	Very low	26.3	Very low	142 Å²	142	139.6 Å²	139.6	87%	0.871	83%	0.829	S	S	*	*			trans	173.9	133.9	142.1	27.4	0	0	0	0	108.8
44	G	24.9	Very low	26.4	Very low	77 Å²	77	143 Å²	143	79%	0.794	83%	0.828	S	S	*	*			trans	149.6	64.8	175.1	0	0	0	0	0	113.2
45	E	26.6	Very low	26.7	Very low	198 Å²	198	144 Å²	144	93%	0.925	83%	0.826	S	S	*	*			trans	-66.7	120.2	161.6	-76.2	175.3	136.5	0	0	109.4
46	E	26.3	Very low	27.2	Very low	197 Å²	197	142.9 Å²	142.9	92%	0.921	82%	0.823	S	S	*	*			trans	-130.5	114.2	152.5	-82.8	-168.9	160.6	0	0	109
47	A	25.5	Very low	27.7	Very low	98 Å²	98	140.1 Å²	140.1	81%	0.81	82%	0.819	S	S	*	*			trans	-80.2	136.1	179.2	0	0	0	0	0	111
48	M	26.1	Very low	28.3	Very low	177 Å²	177	142.3 Å²	142.3	87%	0.872	82%	0.823	S	S	*	*			trans	-131.4	147.9	164.7	-78.9	-64.9	-80.8	0	0	110.3
49	P	27.6	Very low	29.1	Very low	112 Å²	112	146.5 Å²	146.5	73%	0.727	83%	0.829	S	S	*	*			trans	-81.7	141.7	-143.4	30.1	-34.6	0	0	0	114.1	R51	P49-R51 PolarHBondContact O-N 3.19Å
50	G	31.6	Very low	30	Very low	84 Å²	84	146 Å²	146	87%	0.866	83%	0.826	S	S	*	*			trans	-61.9	116	176.3	0	0	0	0	0	112.9
51	R	27.5	Very low	30.9	Very low	234 Å²	234	144 Å²	144	88%	0.883	83%	0.831	S	S	*	*			trans	-95.5	111.9	148.9	-87.9	-177.1	176.2	-179.7	-1	107.5	P49 I53	P49-R51 PolarHBondContact O-N 3.19Å; R51-I53 PolarHBondContact O-N 3.44Å
52	L	29.5	Very low	32.9	Very low	178 Å²	178	143.9 Å²	143.9	93%	0.932	83%	0.831	S	S	*	*			trans	-55.4	105.7	163.4	-78	151.8	0	0	0	107.9	E54	L52-E54 PolarHBondContact O-N 2.87Å
53	I	31.1	Very low	35.7	Very low	157 Å²	157	148 Å²	148	81%	0.805	83%	0.832	S	S	*	*			trans	-77.5	110.9	164.8	-63.4	173.4	0	0	0	105.2	R51	R51-I53 PolarHBondContact O-N 3.44Å
54	E	30.4	Very low	39	Very low	170 Å²	170	145.8 Å²	145.8	79%	0.794	81%	0.813	S	S	*	*			trans	-53.5	142.1	167.4	-72.1	-176	154.1	0	0	109.6	L52 A56	L52-E54 PolarHBondContact O-N 2.87Å; E54-A56 PolarHBondContact O-N 3.18Å
55	P	32	Very low	42.3	Very low	130 Å²	130	146.7 Å²	146.7	84%	0.844	80%	0.796	S	S	*	*			trans	-64.2	107.4	179.8	-9.2	23	0	0	0	108.6	V57	P55-V57 PolarHBondContact O-N 3.26Å; P55-V57 VanDerWaalsContact O-N 3.17Å
56	A	35.2	Very low	45.5	Very low	93 Å²	93	139.5 Å²	139.5	77%	0.769	77%	0.767	S	S	*	*			trans	-53.4	123.1	167.8	0	0	0	0	0	108.4	E54 V58	E54-A56 PolarHBondContact O-N 3.18Å; A56-V58 PolarHBondContact O-N 3.04Å
57	V	35.8	Very low	48.7	Very low	133 Å²	133	131.4 Å²	131.4	81%	0.806	73%	0.73	S	S	*	*			trans	5.4	107.2	161.4	-174.2	0	0	0	0	113.5	P55 R59	P55-V57 PolarHBondContact O-N 3.26Å; P55-V57 VanDerWaalsContact O-N 3.17Å; V57-R59 PolarHBondContact O-N 2.98Å
58	V	35.8	Very low	51.8	Low	133 Å²	133	135.7 Å²	135.7	81%	0.806	73%	0.73	S	S	*	*			trans	-40.6	106.4	164.9	177.2	0	0	0	0	108.6	A56 E60	A56-V58 PolarHBondContact O-N 3.04Å; V58-E60 PolarHBondContact O-N 3.38Å; V58-E60 VanDerWaalsContact O-N 3.13Å
59	R	40.9	Very low	55	Low	235 Å²	235	132.4 Å²	132.4	89%	0.887	71%	0.713	S	S	*	*			trans	-55.4	119.2	164.9	-74.8	-179.2	175.2	-177	-1.4	106	V57 A61	V57-R59 PolarHBondContact O-N 2.98Å; R59-A61 PolarHBondContact O-N 3.49Å; R59-A61 VanDerWaalsContact O-N 3.14Å
60	E	42.6	Very low	58.2	Low	183 Å²	183	127.2 Å²	127.2	86%	0.855	68%	0.679	S	S	*	*			trans	-44.3	125.8	168.9	-78	179.7	142.1	0	0	108.3	V58 S62	V58-E60 PolarHBondContact O-N 3.38Å; V58-E60 VanDerWaalsContact O-N 3.13Å; E60-S62 PolarHBondContact O-N 3.23Å
61	A	46.5	Very low	61.3	Low	102 Å²	102	125.3 Å²	125.3	84%	0.843	65%	0.651	S	S	*	*			trans	-62.5	92.1	174.6	0	0	0	0	0	107.6	R59 K63	R59-A61 PolarHBondContact O-N 3.49Å; R59-A61 VanDerWaalsContact O-N 3.14Å; A61-K63 PolarHBondContact O-N 3.16Å
62	S	64.8	Low	64.5	Low	97 Å²	97	115.3 Å²	115.3	68%	0.678	62%	0.621	S	S	*	*			trans	-59.4	111.1	177.8	62.4	0	0	0	0	107.1	E60 I64	E60-S62 PolarHBondContact O-N 3.23Å; S62-I64 PolarHBondContact O-N 3.18Å
63	K	85.8	Confident	67.5	Low	178 Å²	178	107.5 Å²	107.5	77%	0.774	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-52.8	117.2	177.8	-176.9	179.9	178.2	-177.3	0	108.6	A61 K65	A61-K63 PolarHBondContact O-N 3.16Å; K63-K65 PolarHBondContact O-N 3.22Å
64	I	92.1	Very high	70.3	Confident	95 Å²	95	103.6 Å²	103.6	49%	0.487	57%	0.567	S	S	.	*	P	Polyproline II helix	trans	-61.4	124	177.9	-60.6	170.8	0	0	0	107.9	S62 V423 F428	S62-I64 PolarHBondContact O-N 3.18Å; I64-V423 HydrophobicContact CD1-CG2 4.21Å; I64-V423 HydrophobicContact CG1-CG1 4.46Å; I64-V423 HydrophobicContact CG2-CG1 4.2Å; I64-V423 HydrophobicContact CG2-CG2 4.36Å; I64-F428 HydrophobicContact CG2-CB 3.81Å
65	K	95.3	Very high	72.9	Confident	97 Å²	97	98.7 Å²	98.7	42%	0.422	55%	0.549	S	S	.	.	B	Isolated β-bridge	trans	-86.1	149.1	-177.1	-65.5	175.9	-174.8	172	0	110.6	K63 E69 G426 Y427 F428	K63-K65 PolarHBondContact O-N 3.22Å; K65-E69 HydrophobicContact CB-CB 4.34Å; K65-G426 PolarHBondContact N-O 2.86Å; K65-Y427 HydrophobicContact CB-CD1 3.49Å; K65-Y427 VanDerWaalsContact CB-CD1 3.49Å; K65-Y427 HydrophobicContact CB-CE1 3.49Å; K65-Y427 VanDerWaalsContact CB-CE1 3.49Å; K65-Y427 HydrophobicContact CB-CG 4.29Å; K65-Y427 HydrophobicContact CD-CD1 4.48Å; K65-Y427 HydrophobicContact CD-CE1 3.76Å; K65-Y427 HydrophobicContact CG-CE1 4.28Å; K65-Y427 WeakPolarHBondContact O-CA 3.42Å; K65-F428 PolarHBondContact O-N 2.95Å
66	S	94.1	Very high	75.5	Confident	46 Å²	46	98.2 Å²	98.2	32%	0.322	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-82.8	160.9	174.4	68.6	0	0	0	0	112.1	K68 E69 M70	S66-K68 PolarHBondContact O-N 3.17Å; S66-K68 VanDerWaalsContact O-N 3.07Å; S66-K68 PolarHBondContact OG-N 3.08Å; S66-E69 WeakPolarHBondContact CB-OE2 3.16Å; S66-E69 PolarHBondContact N-OE2 3Å; S66-E69 PolarHBondContact O-N 3.08Å; S66-E69 PolarHBondContact OG-OE2 3.14Å; S66-M70 PolarHBondContact O-N 3.05Å
67	L	92.6	Very high	77.9	Confident	28 Å²	28	96 Å²	96	15%	0.147	52%	0.518	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-23.3	170.9	-69	-176.8	0	0	0	113.3	E69 M70 K107 L114 V116 F428 I429 P430	L67-E69 VanDerWaalsContact C-N 3.29Å; L67-E69 PolarHBondContact O-N 2.81Å; L67-M70 HydrophobicContact CD2-CE 3.68Å; L67-M70 HydrophobicContact CD2-SD 4.33Å; L67-M70 WeakPolarHBondContact O-CB 3.44Å; L67-M70 PolarHBondContact O-N 2.86Å; L67-K107 WeakPolarHBondContact O-CD 3.36Å; L67-K107 PolarHBondContact O-NZ 3.37Å; L67-L114 HydrophobicContact CD1-CD2 3.86Å; L67-V116 HydrophobicContact CD2-CG2 4Å; L67-F428 WeakPolarHBondContact CG-O 3.39Å; L67-I429 HydrophobicContact CD2-CG1 4.23Å; L67-P430 VanDerWaalsContact CD1-CD 3.48Å; L67-P430 HydrophobicContact CD1-CG 4.21Å
68	K	90.2	Very high	80.3	Confident	188 Å²	188	89.8 Å²	89.8	82%	0.817	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-35.8	176.1	-69.4	-177.7	179.9	176.7	0	111.5	S66 M70 K107	S66-K68 PolarHBondContact O-N 3.17Å; S66-K68 VanDerWaalsContact O-N 3.07Å; S66-K68 PolarHBondContact OG-N 3.08Å; K68-M70 VanDerWaalsContact C-N 3.34Å; K68-K107 PolarHBondContact O-NZ 3.26Å
69	E	93.7	Very high	82.5	Confident	107 Å²	107	86.9 Å²	86.9	50%	0.5	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-8.9	-179.9	-64	161.6	92.5	0	0	113.4	K65 S66 L67 Y427	K65-E69 HydrophobicContact CB-CB 4.34Å; S66-E69 WeakPolarHBondContact CB-OE2 3.16Å; S66-E69 PolarHBondContact N-OE2 3Å; S66-E69 PolarHBondContact O-N 3.08Å; S66-E69 PolarHBondContact OG-OE2 3.14Å; L67-E69 VanDerWaalsContact C-N 3.29Å; L67-E69 PolarHBondContact O-N 2.81Å; E69-Y427 HydrophobicContact CB-CE1 4.4Å
70	M	95.4	Very high	84.6	Confident	4 Å²	4	78.2 Å²	78.2	2%	0.02	43%	0.43	C	S	.	.	S	Bend	trans	-68.9	132.2	176.4	-172.8	-179.6	-73.7	0	0	110.4	S66 L67 K68 I105 F106 K107 V116 Y427	S66-M70 PolarHBondContact O-N 3.05Å; L67-M70 HydrophobicContact CD2-CE 3.68Å; L67-M70 HydrophobicContact CD2-SD 4.33Å; L67-M70 WeakPolarHBondContact O-CB 3.44Å; L67-M70 PolarHBondContact O-N 2.86Å; K68-M70 VanDerWaalsContact C-N 3.34Å; M70-I105 HydrophobicContact CE-CD1 3.83Å; M70-I105 HydrophobicContact CE-CG1 3.94Å; M70-I105 HydrophobicContact SD-CG1 4.26Å; M70-F106 VanDerWaalsContact SD-C 3.59Å; M70-K107 HydrophobicContact CB-CD 4.24Å; M70-K107 HydrophobicContact CB-CG 4.5Å; M70-K107 HydrophobicContact CG-CB 4.3Å; M70-K107 HydrophobicContact CG-CG 4.49Å; M70-K107 WeakPolarHBondContact O-CE 3.37Å; M70-K107 PolarHBondContact O-NZ 3.44Å; M70-K107 HydrophobicContact SD-CB 3.78Å; M70-V116 HydrophobicContact CE-CG1 3.91Å; M70-V116 HydrophobicContact CE-CG2 4.35Å; M70-V116 HydrophobicContact SD-CG1 3.86Å; M70-V116 HydrophobicContact SD-CG2 4.06Å; M70-Y427 VanDerWaalsContact CA-CE1 3.48Å; M70-Y427 HydrophobicContact CB-CD1 3.96Å; M70-Y427 HydrophobicContact CB-CE1 3.79Å; M70-Y427 HydrophobicContact CE-CD1 4.04Å; M70-Y427 HydrophobicContact CE-CD2 4.07Å; M70-Y427 HydrophobicContact CE-CG 3.66Å; M70-Y427 HydrophobicContact CG-CD1 4.5Å; M70-Y427 HydrophobicContact CG-CE1 4.37Å
71	P	96.2	Very high	86.8	Confident	44 Å²	44	70.2 Å²	70.2	29%	0.286	39%	0.393	S	S	.	.			trans	-69	163.2	178.7	31.2	-36.5	0	0	0	111.2	Y102 F106 K107	P71-Y102 HydrophobicContact CB-CD1 4.27Å; P71-Y102 VanDerWaalsContact CG-O 3.22Å; P71-Y102 WeakPolarHBondContact CG-O 3.46Å; P71-F106 CarbonylContact O-C 3.28Å; P71-F106 VanDerWaalsContact O-CA 3.29Å; P71-F106 WeakPolarHBondContact O-CA 3.49Å; P71-F106 WeakPolarHBondContact O-CB 3.44Å; P71-K107 PolarHBondContact O-N 2.84Å
72	G	94.6	Very high	88.5	Confident	23 Å²	23	66.1 Å²	66.1	24%	0.237	36%	0.356	C	S	.	.			trans	163.2	168	178.2	0	0	0	0	0	113.1	K107	G72-K107 VanDerWaalsContact CA-O 3.27Å; G72-K107 WeakPolarHBondContact CA-O 3.23Å
73	P	92.9	Very high	89.2	Confident	14 Å²	14	67.1 Å²	67.1	9%	0.091	35%	0.348	C	S	.	.			trans	-61.7	147.3	174.8	28	-36.3	0	0	0	111.5	N78 Y102 K107	P73-N78 HydrophobicContact CB-CB 4.44Å; P73-N78 HydrophobicContact CG-CB 4.39Å; P73-Y102 WeakPolarHBondContact CA-OH 3.25Å; P73-Y102 HydrophobicContact CB-CE2 4.34Å; P73-Y102 HydrophobicContact CG-CE2 4.44Å; P73-K107 WeakPolarHBondContact CD-O 3.35Å
74	S	89.2	Confident	89	Confident	75 Å²	75	68.7 Å²	68.7	52%	0.524	35%	0.35	S	S	.	.			trans	-64.1	152.6	167.4	70.5	0	0	0	0	110	L76 S77 N78	S74-L76 PolarHBondContact O-N 2.74Å; S74-S77 PolarHBondContact O-N 2.78Å; S74-S77 VanDerWaalsContact O-N 3.13Å; S74-S77 WeakPolarHBondContact OG-CB 3.19Å; S74-S77 PolarHBondContact OG-N 2.78Å; S74-N78 PolarHBondContact O-N 3.32Å
75	T	85.3	Confident	88.7	Confident	67 Å²	67	69.6 Å²	69.6	41%	0.411	35%	0.35	S	S	.	.	H	α-helix	trans	-56.1	-40.1	179.6	-56.1	0	0	0	0	112.1	N78 L79	T75-N78 PolarHBondContact O-N 2.93Å; T75-L79 HydrophobicContact CG2-CD1 4.34Å; T75-L79 VanDerWaalsContact O-CG 3.31Å; T75-L79 WeakPolarHBondContact O-CG 3.43Å; T75-L79 PolarHBondContact O-N 3.01Å
76	L	85.9	Confident	88.2	Confident	121 Å²	121	68.1 Å²	68.1	63%	0.634	35%	0.347	S	S	*	.	H	α-helix	trans	-66.1	-44.9	177.3	-178	63	0	0	0	112.1	S74 N78 L79 I80	S74-L76 PolarHBondContact O-N 2.74Å; L76-N78 VanDerWaalsContact C-N 3.27Å; L76-N78 PolarHBondContact O-N 3.46Å; L76-L79 PolarHBondContact O-N 3.49Å; L76-I80 HydrophobicContact CD1-CD1 4.35Å; L76-I80 HydrophobicContact CG-CD1 4.11Å; L76-I80 WeakPolarHBondContact O-CG1 3.49Å; L76-I80 PolarHBondContact O-N 3.14Å
77	S	86.8	Confident	87.8	Confident	47 Å²	47	65.9 Å²	65.9	33%	0.329	33%	0.331	S	S	.	.	H	α-helix	trans	-61.3	-39.9	176.8	-175	0	0	0	0	111.2	S74 I80 E81	S74-S77 PolarHBondContact O-N 2.78Å; S74-S77 VanDerWaalsContact O-N 3.13Å; S74-S77 WeakPolarHBondContact OG-CB 3.19Å; S74-S77 PolarHBondContact OG-N 2.78Å; S77-I80 PolarHBondContact O-N 2.73Å; S77-E81 WeakPolarHBondContact O-CB 3.38Å; S77-E81 PolarHBondContact O-N 3.46Å
78	N	84.9	Confident	87.3	Confident	2 Å²	2	66.2 Å²	66.2	1%	0.011	33%	0.331	C	S	.	.	H	α-helix	trans	-65.4	-43.1	177.8	-153	52.7	0	0	0	111	P73 S74 T75 L76 I80 E81 F82 R109	P73-N78 HydrophobicContact CB-CB 4.44Å; P73-N78 HydrophobicContact CG-CB 4.39Å; S74-N78 PolarHBondContact O-N 3.32Å; T75-N78 PolarHBondContact O-N 2.93Å; L76-N78 VanDerWaalsContact C-N 3.27Å; L76-N78 PolarHBondContact O-N 3.46Å; N78-I80 PolarHBondContact O-N 3.38Å; N78-E81 PolarHBondContact O-N 2.98Å; N78-F82 VanDerWaalsContact O-CD2 3.27Å; N78-F82 WeakPolarHBondContact O-CD2 3.3Å; N78-F82 PolarHBondContact O-N 3.27Å; N78-F82 VanDerWaalsContact O-N 3.08Å; N78-F82 VanDerWaalsContact OD1-CE2 3.3Å; N78-F82 WeakPolarHBondContact OD1-CE2 3.49Å; N78-R109 PolarHBondContact ND2-O 3.14Å
79	L	82.9	Confident	87.2	Confident	72 Å²	72	57.3 Å²	57.3	38%	0.377	29%	0.293	S	S	.	.	H	α-helix	trans	-60.5	-45.9	175.3	-71.9	171	0	0	0	112	T75 L76 E81 F82 F83	T75-L79 HydrophobicContact CG2-CD1 4.34Å; T75-L79 VanDerWaalsContact O-CG 3.31Å; T75-L79 WeakPolarHBondContact O-CG 3.43Å; T75-L79 PolarHBondContact O-N 3.01Å; L76-L79 PolarHBondContact O-N 3.49Å; L79-E81 VanDerWaalsContact C-N 3.32Å; L79-E81 PolarHBondContact O-N 3.46Å; L79-F82 PolarHBondContact O-N 2.71Å; L79-F83 HydrophobicContact CD2-CD2 3.96Å; L79-F83 HydrophobicContact CD2-CE2 3.67Å; L79-F83 WeakPolarHBondContact O-CB 3.33Å; L79-F83 WeakPolarHBondContact O-CD2 3.3Å; L79-F83 PolarHBondContact O-N 2.94Å
80	I	85.9	Confident	87.1	Confident	53 Å²	53	54.9 Å²	54.9	27%	0.272	28%	0.279	S	S	.	.	H	α-helix	trans	-60.1	-44.5	177	-68.6	169.7	0	0	0	111	L76 S77 N78 F82 W84 K85	L76-I80 HydrophobicContact CD1-CD1 4.35Å; L76-I80 HydrophobicContact CG-CD1 4.11Å; L76-I80 WeakPolarHBondContact O-CG1 3.49Å; L76-I80 PolarHBondContact O-N 3.14Å; S77-I80 PolarHBondContact O-N 2.73Å; N78-I80 PolarHBondContact O-N 3.38Å; I80-F82 PolarHBondContact O-N 3.22Å; I80-W84 HydrophobicContact CB-CE3 4.24Å; I80-W84 HydrophobicContact CD1-CE3 4.45Å; I80-W84 HydrophobicContact CD1-CZ3 4.18Å; I80-W84 HydrophobicContact CG1-CE3 3.76Å; I80-W84 HydrophobicContact CG1-CZ3 3.83Å; I80-W84 HydrophobicContact CG2-CB 4.44Å; I80-W84 HydrophobicContact CG2-CE3 3.87Å; I80-W84 WeakPolarHBondContact O-CA 3.24Å; I80-W84 WeakPolarHBondContact O-CB 3.1Å; I80-W84 PolarHBondContact O-N 2.94Å; I80-K85 PolarHBondContact O-N 2.86Å
81	E	86.9	Confident	86.8	Confident	15 Å²	15	57.3 Å²	57.3	7%	0.07	29%	0.292	C	S	.	.	H	α-helix	trans	-59.8	-48.1	-178.5	-165.1	59.7	-138.6	0	0	111.7	S77 N78 L79 K85 G87 R90 I94	S77-E81 WeakPolarHBondContact O-CB 3.38Å; S77-E81 PolarHBondContact O-N 3.46Å; N78-E81 PolarHBondContact O-N 2.98Å; L79-E81 VanDerWaalsContact C-N 3.32Å; L79-E81 PolarHBondContact O-N 3.46Å; E81-K85 CarbonylContact O-C 3.5Å; E81-K85 PolarHBondContact O-N 3.47Å; E81-K85 VanDerWaalsContact OE2-CD 3.27Å; E81-K85 WeakPolarHBondContact OE2-CD 3.12Å; E81-K85 IonicContact OE2-NZ 2.93Å; E81-K85 PolarHBondContact OE2-NZ 3.44Å; E81-G87 WeakPolarHBondContact O-CA 3.43Å; E81-G87 PolarHBondContact O-N 3.09Å; E81-R90 IonicContact OE1-CZ 3.74Å; E81-R90 IonicContact OE1-NH2 2.69Å; E81-R90 PolarHBondContact OE1-NH2 3.45Å; E81-I94 HydrophobicContact CG-CD1 3.81Å; E81-I94 HydrophobicContact CG-CG1 4.37Å
82	F	82.2	Confident	86.7	Confident	16 Å²	16	55.5 Å²	55.5	7%	0.07	28%	0.28	C	S	.	.	H	α-helix	trans	-81.9	-31.7	-174.7	-76.9	-77.6	0	0	0	114	N78 L79 I80 F88 I91 I94 F110	N78-F82 VanDerWaalsContact O-CD2 3.27Å; N78-F82 WeakPolarHBondContact O-CD2 3.3Å; N78-F82 PolarHBondContact O-N 3.27Å; N78-F82 VanDerWaalsContact O-N 3.08Å; N78-F82 VanDerWaalsContact OD1-CE2 3.3Å; N78-F82 WeakPolarHBondContact OD1-CE2 3.49Å; L79-F82 PolarHBondContact O-N 2.71Å; I80-F82 PolarHBondContact O-N 3.22Å; F82-F88 HydrophobicContact CB-CD2 4.16Å; F82-F88 HydrophobicContact CB-CE2 3.72Å; F82-F88 HydrophobicContact CB-CZ 4.41Å; F82-F88 HydrophobicContact CD1-CD1 4.16Å; F82-F88 AromaticContact CD1-CD2 3.71Å; F82-F88 HydrophobicContact CD1-CD2 3.71Å; F82-F88 HydrophobicContact CD1-CE1 4.11Å; F82-F88 AromaticContact CD1-CE2 3.65Å; F82-F88 HydrophobicContact CD1-CE2 3.65Å; F82-F88 AromaticContact CD1-CG 3.97Å; F82-F88 HydrophobicContact CD1-CG 3.97Å; F82-F88 AromaticContact CD1-CZ 3.86Å; F82-F88 HydrophobicContact CD1-CZ 3.86Å; F82-F88 HydrophobicContact CE1-CD1 4.45Å; F82-F88 HydrophobicContact CE1-CE1 4.47Å; F82-F88 HydrophobicContact CG-CD2 4.42Å; F82-F88 HydrophobicContact CG-CE2 4.06Å; F82-F88 HydrophobicContact CG-CZ 4.38Å; F82-I91 HydrophobicContact CE1-CG1 4.32Å; F82-I94 HydrophobicContact CE1-CD1 4.09Å; F82-I94 HydrophobicContact CE2-CD1 4.48Å; F82-I94 HydrophobicContact CZ-CD1 3.9Å; F82-F110 HydrophobicContact CD1-CE1 4.17Å; F82-F110 HydrophobicContact CD2-CD1 4.33Å; F82-F110 AromaticContact CD2-CE1 3.46Å; F82-F110 HydrophobicContact CD2-CE1 3.46Å; F82-F110 VanDerWaalsContact CD2-CE1 3.46Å; F82-F110 HydrophobicContact CD2-CZ 4.21Å; F82-F110 AromaticContact CE1-CE1 3.99Å; F82-F110 HydrophobicContact CE1-CE1 3.99Å; F82-F110 HydrophobicContact CE1-CZ 4.41Å; F82-F110 HydrophobicContact CE2-CD1 4.47Å; F82-F110 AromaticContact CE2-CE1 3.27Å; F82-F110 HydrophobicContact CE2-CE1 3.27Å; F82-F110 AromaticContact CE2-CZ 3.55Å; F82-F110 HydrophobicContact CE2-CZ 3.55Å; F82-F110 AromaticContact CG-CE1 3.94Å; F82-F110 HydrophobicContact CG-CE1 3.94Å; F82-F110 AromaticContact CZ-CE1 3.56Å; F82-F110 HydrophobicContact CZ-CE1 3.56Å; F82-F110 AromaticContact CZ-CZ 3.67Å; F82-F110 HydrophobicContact CZ-CZ 3.67Å
83	F	79.9	Confident	86.8	Confident	118 Å²	118	57.7 Å²	57.7	52%	0.518	28%	0.283	S	S	.	.	H	α-helix	trans	-98	-30.3	-176.7	-71.5	-83.4	0	0	0	114.7	L79 Y266	L79-F83 HydrophobicContact CD2-CD2 3.96Å; L79-F83 HydrophobicContact CD2-CE2 3.67Å; L79-F83 WeakPolarHBondContact O-CB 3.33Å; L79-F83 WeakPolarHBondContact O-CD2 3.3Å; L79-F83 PolarHBondContact O-N 2.94Å; F83-Y266 HydrophobicContact CD1-CE1 4.35Å; F83-Y266 HydrophobicContact CE1-CD1 4.15Å; F83-Y266 AromaticContact CE1-CE1 3.38Å; F83-Y266 HydrophobicContact CE1-CE1 3.38Å; F83-Y266 AromaticContact CE1-CZ 3.65Å; F83-Y266 HydrophobicContact CZ-CD1 4.25Å; F83-Y266 AromaticContact CZ-CE1 3.5Å; F83-Y266 HydrophobicContact CZ-CE1 3.5Å
84	W	82	Confident	86.8	Confident	211 Å²	211	57.4 Å²	57.4	80%	0.799	28%	0.281	S	S	*	.	H	α-helix	trans	-106.9	-25.5	-177.8	-68.4	-16	0	0	0	114.2	I80	I80-W84 HydrophobicContact CB-CE3 4.24Å; I80-W84 HydrophobicContact CD1-CE3 4.45Å; I80-W84 HydrophobicContact CD1-CZ3 4.18Å; I80-W84 HydrophobicContact CG1-CE3 3.76Å; I80-W84 HydrophobicContact CG1-CZ3 3.83Å; I80-W84 HydrophobicContact CG2-CB 4.44Å; I80-W84 HydrophobicContact CG2-CE3 3.87Å; I80-W84 WeakPolarHBondContact O-CA 3.24Å; I80-W84 WeakPolarHBondContact O-CB 3.1Å; I80-W84 PolarHBondContact O-N 2.94Å
85	K	85.8	Confident	87.1	Confident	113 Å²	113	54.6 Å²	54.6	49%	0.491	26%	0.26	S	S	.	.	S	Bend	trans	-110.4	20.2	-178.1	-60.3	178.3	-178.6	173.7	0	114.4	I80 E81 G87 R90	I80-K85 PolarHBondContact O-N 2.86Å; E81-K85 CarbonylContact O-C 3.5Å; E81-K85 PolarHBondContact O-N 3.47Å; E81-K85 VanDerWaalsContact OE2-CD 3.27Å; E81-K85 WeakPolarHBondContact OE2-CD 3.12Å; E81-K85 IonicContact OE2-NZ 2.93Å; E81-K85 PolarHBondContact OE2-NZ 3.44Å; K85-G87 VanDerWaalsContact C-N 3.27Å; K85-G87 PolarHBondContact O-N 3.42Å; K85-R90 PolarHBondContact O-NE 2.98Å; K85-R90 PolarHBondContact O-NH2 3.44Å
86	D	85.1	Confident	87.5	Confident	66 Å²	66	53.5 Å²	53.5	35%	0.353	25%	0.251	S	S	.	.			trans	49.7	43.4	-176.8	-164.5	30.6	0	0	0	113.7	F88 G89 K262	D86-F88 PolarHBondContact O-N 3.47Å; D86-F88 VanDerWaalsContact O-N 3.11Å; D86-G89 WeakPolarHBondContact O-CA 3.49Å; D86-G89 PolarHBondContact O-N 3.26Å; D86-K262 IonicContact OD1-NZ 2.64Å; D86-K262 PolarHBondContact OD1-NZ 3.42Å; D86-K262 IonicContact OD2-NZ 2.92Å; D86-K262 PolarHBondContact OD2-NZ 3.29Å
87	G	84.4	Confident	88	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-57.3	-28.4	-175.8	0	0	0	0	0	114.3	E81 K85 G89 R90 I91 I94	E81-G87 WeakPolarHBondContact O-CA 3.43Å; E81-G87 PolarHBondContact O-N 3.09Å; K85-G87 VanDerWaalsContact C-N 3.27Å; K85-G87 PolarHBondContact O-N 3.42Å; G87-G89 VanDerWaalsContact C-N 3.27Å; G87-G89 PolarHBondContact O-N 3.31Å; G87-R90 CarbonylContact O-C 3.45Å; G87-R90 VanDerWaalsContact O-C 3.28Å; G87-R90 PolarHBondContact O-N 3Å; G87-I91 PolarHBondContact O-N 2.98Å; G87-I94 WeakPolarHBondContact O-CD1 3.41Å
88	F	82.9	Confident	88.4	Confident	34 Å²	34	50.9 Å²	50.9	15%	0.149	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-63.9	-32.3	172.4	-72.6	-77.6	0	0	0	113	F82 D86 R90 I91 M265 Y266 T520	F82-F88 HydrophobicContact CB-CD2 4.16Å; F82-F88 HydrophobicContact CB-CE2 3.72Å; F82-F88 HydrophobicContact CB-CZ 4.41Å; F82-F88 HydrophobicContact CD1-CD1 4.16Å; F82-F88 AromaticContact CD1-CD2 3.71Å; F82-F88 HydrophobicContact CD1-CD2 3.71Å; F82-F88 HydrophobicContact CD1-CE1 4.11Å; F82-F88 AromaticContact CD1-CE2 3.65Å; F82-F88 HydrophobicContact CD1-CE2 3.65Å; F82-F88 AromaticContact CD1-CG 3.97Å; F82-F88 HydrophobicContact CD1-CG 3.97Å; F82-F88 AromaticContact CD1-CZ 3.86Å; F82-F88 HydrophobicContact CD1-CZ 3.86Å; F82-F88 HydrophobicContact CE1-CD1 4.45Å; F82-F88 HydrophobicContact CE1-CE1 4.47Å; F82-F88 HydrophobicContact CG-CD2 4.42Å; F82-F88 HydrophobicContact CG-CE2 4.06Å; F82-F88 HydrophobicContact CG-CZ 4.38Å; D86-F88 PolarHBondContact O-N 3.47Å; D86-F88 VanDerWaalsContact O-N 3.11Å; F88-R90 PolarHBondContact O-N 3.49Å; F88-I91 HydrophobicContact CD1-CD1 4.18Å; F88-M265 HydrophobicContact CE1-CE 4.23Å; F88-M265 HydrophobicContact CE1-SD 4.4Å; F88-Y266 VanDerWaalsContact CD2-OH 3.29Å; F88-Y266 WeakPolarHBondContact CD2-OH 3.16Å; F88-Y266 AromaticContact CE2-CE1 3.87Å; F88-Y266 HydrophobicContact CE2-CE1 3.87Å; F88-Y266 AromaticContact CE2-CZ 3.61Å; F88-Y266 WeakPolarHBondContact CE2-OH 3.45Å; F88-Y266 HydrophobicContact CZ-CE1 4.23Å; F88-T520 WeakPolarHBondContact O-CB 3.29Å
89	G	87.4	Confident	88.9	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.01	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-65.9	-20.4	171.4	0	0	0	0	0	113.9	D86 G87 T520	D86-G89 WeakPolarHBondContact O-CA 3.49Å; D86-G89 PolarHBondContact O-N 3.26Å; G87-G89 VanDerWaalsContact C-N 3.27Å; G87-G89 PolarHBondContact O-N 3.31Å; G89-T520 VanDerWaalsContact CA-O 3.27Å; G89-T520 WeakPolarHBondContact CA-O 3.33Å; G89-T520 PolarHBondContact O-N 3.08Å
90	R	91.6	Very high	89.4	Confident	57 Å²	57	56.9 Å²	56.9	22%	0.215	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-132.8	27.2	-165.6	-60.7	-176.5	-50.8	95.8	3.5	112.4	E81 K85 G87 F88 H92 E93 I94	E81-R90 IonicContact OE1-CZ 3.74Å; E81-R90 IonicContact OE1-NH2 2.69Å; E81-R90 PolarHBondContact OE1-NH2 3.45Å; K85-R90 PolarHBondContact O-NE 2.98Å; K85-R90 PolarHBondContact O-NH2 3.44Å; G87-R90 CarbonylContact O-C 3.45Å; G87-R90 VanDerWaalsContact O-C 3.28Å; G87-R90 PolarHBondContact O-N 3Å; F88-R90 PolarHBondContact O-N 3.49Å; R90-H92 PolarHBondContact O-N 3.25Å; R90-E93 HydrophobicContact CB-CB 4.32Å; R90-E93 HydrophobicContact CB-CG 4.3Å; R90-E93 WeakPolarHBondContact CB-OE2 3.42Å; R90-E93 WeakPolarHBondContact CD-OE2 3.37Å; R90-E93 WeakPolarHBondContact CG-OE2 3.37Å; R90-E93 IonicContact CZ-OE2 3.81Å; R90-E93 IonicContact NE-OE2 2.82Å; R90-E93 IonicContact NH1-OE2 2.91Å; R90-E93 PolarHBondContact NH1-OE2 3.35Å; R90-E93 WeakPolarHBondContact O-CB 3.4Å; R90-E93 PolarHBondContact O-N 2.99Å; R90-I94 WeakPolarHBondContact O-CG1 3.32Å; R90-I94 PolarHBondContact O-N 3.27Å
91	I	90.9	Very high	89.9	Confident	55 Å²	55	61.3 Å²	61.3	28%	0.282	27%	0.273	S	S	.	.	H	α-helix	trans	-53.7	-41.8	-178.5	-71.1	174.1	0	0	0	111.2	F82 G87 F88 I94 Q95 T520	F82-I91 HydrophobicContact CE1-CG1 4.32Å; G87-I91 PolarHBondContact O-N 2.98Å; F88-I91 HydrophobicContact CD1-CD1 4.18Å; I91-I94 PolarHBondContact O-N 2.68Å; I91-Q95 WeakPolarHBondContact O-CG 3.44Å; I91-Q95 PolarHBondContact O-N 2.9Å; I91-T520 HydrophobicContact CB-CG2 4.28Å; I91-T520 HydrophobicContact CD1-CG2 4.17Å; I91-T520 HydrophobicContact CG1-CG2 4.49Å
92	H	94.1	Very high	90.3	Very high	6 Å²	6	62.5 Å²	62.5	3%	0.028	28%	0.277	C	S	.	.	H	α-helix	trans	-62.6	-41.6	179	61.8	-79.5	0	0	0	112.5	R90 Q95 P412 Y440 A518 T520 L524	R90-H92 PolarHBondContact O-N 3.25Å; H92-Q95 PolarHBondContact O-N 2.95Å; H92-P412 HydrophobicContact CB-CB 4.02Å; H92-P412 HydrophobicContact CB-CG 4.13Å; H92-Y440 HydrophobicContact CB-CD1 3.66Å; H92-Y440 HydrophobicContact CB-CD2 3.96Å; H92-Y440 HydrophobicContact CB-CE1 3.89Å; H92-Y440 HydrophobicContact CB-CE2 4.23Å; H92-Y440 HydrophobicContact CB-CG 3.68Å; H92-Y440 AromaticContact CD2-CE1 3.86Å; H92-Y440 AromaticContact CD2-CZ 3.84Å; H92-Y440 WeakPolarHBondContact O-CD1 3.45Å; H92-A518 PolarHBondContact NE2-O 3.3Å; H92-T520 PolarHBondContact ND1-OG1 3.3Å; H92-L524 HydrophobicContact CB-CD1 3.97Å; H92-L524 WeakPolarHBondContact ND1-CD1 3.41Å
93	E	94.8	Very high	90.9	Very high	68 Å²	68	63.2 Å²	63.2	32%	0.318	29%	0.288	S	S	.	.	H	α-helix	trans	-65.4	-44.5	173.9	-56	177.6	172.4	0	0	111.4	R90 Q95 I96 E97	R90-E93 HydrophobicContact CB-CB 4.32Å; R90-E93 HydrophobicContact CB-CG 4.3Å; R90-E93 WeakPolarHBondContact CB-OE2 3.42Å; R90-E93 WeakPolarHBondContact CD-OE2 3.37Å; R90-E93 WeakPolarHBondContact CG-OE2 3.37Å; R90-E93 IonicContact CZ-OE2 3.81Å; R90-E93 IonicContact NE-OE2 2.82Å; R90-E93 IonicContact NH1-OE2 2.91Å; R90-E93 PolarHBondContact NH1-OE2 3.35Å; R90-E93 WeakPolarHBondContact O-CB 3.4Å; R90-E93 PolarHBondContact O-N 2.99Å; E93-Q95 PolarHBondContact O-N 3Å; E93-I96 WeakPolarHBondContact O-CB 3.41Å; E93-I96 PolarHBondContact O-N 2.88Å; E93-E97 PolarHBondContact O-N 2.92Å
94	I	93.6	Very high	91.7	Very high	9 Å²	9	61.3 Å²	61.3	5%	0.046	28%	0.28	C	S	.	.	H	α-helix	trans	-58.9	-36	179.1	-69	170.1	0	0	0	111	E81 F82 G87 R90 I91 I96 E97 H98	E81-I94 HydrophobicContact CG-CD1 3.81Å; E81-I94 HydrophobicContact CG-CG1 4.37Å; F82-I94 HydrophobicContact CE1-CD1 4.09Å; F82-I94 HydrophobicContact CE2-CD1 4.48Å; F82-I94 HydrophobicContact CZ-CD1 3.9Å; G87-I94 WeakPolarHBondContact O-CD1 3.41Å; R90-I94 WeakPolarHBondContact O-CG1 3.32Å; R90-I94 PolarHBondContact O-N 3.27Å; I91-I94 PolarHBondContact O-N 2.68Å; I94-I96 VanDerWaalsContact C-N 3.32Å; I94-I96 PolarHBondContact O-N 3.07Å; I94-E97 PolarHBondContact O-N 3.17Å; I94-H98 VanDerWaalsContact CG2-CE1 3.47Å; I94-H98 WeakPolarHBondContact CG2-CE1 3.17Å; I94-H98 WeakPolarHBondContact O-CB 3.36Å; I94-H98 PolarHBondContact O-N 2.91Å
95	Q	95.3	Very high	92.3	Very high	15 Å²	15	52 Å²	52	7%	0.07	25%	0.245	C	C	.	.	H	α-helix	trans	-58.8	-45	174.3	-69.3	-179	21.4	0	0	111.6	I91 H92 E93 T99 P412 C438	I91-Q95 WeakPolarHBondContact O-CG 3.44Å; I91-Q95 PolarHBondContact O-N 2.9Å; H92-Q95 PolarHBondContact O-N 2.95Å; E93-Q95 PolarHBondContact O-N 3Å; Q95-T99 VanDerWaalsContact O-CB 3.27Å; Q95-T99 WeakPolarHBondContact O-CB 3.42Å; Q95-T99 PolarHBondContact O-N 2.73Å; Q95-T99 PolarHBondContact O-OG1 2.95Å; Q95-P412 PolarHBondContact NE2-O 3.35Å; Q95-P412 PolarHBondContact OE1-O 3.44Å; Q95-P412 VanDerWaalsContact OE1-O 3.12Å; Q95-C438 HydrophobicContact CB-CB 4.26Å; Q95-C438 HydrophobicContact CG-CB 3.98Å; Q95-C438 VanDerWaalsContact OE1-CB 3.29Å; Q95-C438 PolarHBondContact OE1-O 3.22Å
96	I	94.8	Very high	92.9	Very high	45 Å²	45	46.7 Å²	46.7	23%	0.231	22%	0.222	C	C	.	.	H	α-helix	trans	-65.9	-48.3	178.8	-60.9	175.9	0	0	0	110.2	E93 I94 H98 T99 K100 Y440 L444	E93-I96 WeakPolarHBondContact O-CB 3.41Å; E93-I96 PolarHBondContact O-N 2.88Å; I94-I96 VanDerWaalsContact C-N 3.32Å; I94-I96 PolarHBondContact O-N 3.07Å; I96-H98 PolarHBondContact O-N 2.85Å; I96-T99 PolarHBondContact O-N 3.43Å; I96-K100 HydrophobicContact CG2-CD 4.12Å; I96-K100 WeakPolarHBondContact O-CG 3.45Å; I96-K100 PolarHBondContact O-N 3.21Å; I96-Y440 HydrophobicContact CD1-CD1 3.91Å; I96-Y440 HydrophobicContact CD1-CE1 3.63Å; I96-Y440 HydrophobicContact CG1-CD1 4.15Å; I96-Y440 HydrophobicContact CG1-CE1 4.37Å; I96-L444 HydrophobicContact CD1-CD1 4.04Å
97	E	95.1	Very high	93.3	Very high	94 Å²	94	45.9 Å²	45.9	44%	0.439	22%	0.215	S	C	.	.	H	α-helix	trans	-60.2	-46.7	-179.4	-68.8	-179.7	-179.1	0	0	112	E93 I94 K100 K101	E93-E97 PolarHBondContact O-N 2.92Å; I94-E97 PolarHBondContact O-N 3.17Å; E97-K100 PolarHBondContact O-N 2.99Å; E97-K101 WeakPolarHBondContact O-CB 3.38Å; E97-K101 PolarHBondContact O-N 2.58Å
98	H	95.3	Very high	93.7	Very high	19 Å²	19	46.1 Å²	46.1	9%	0.088	22%	0.217	C	C	.	.	H	α-helix	trans	-69.1	-37.5	179.6	-75.7	-173.9	0	0	0	112.4	I94 I96 K100 K101 Y102 F106	I94-H98 VanDerWaalsContact CG2-CE1 3.47Å; I94-H98 WeakPolarHBondContact CG2-CE1 3.17Å; I94-H98 WeakPolarHBondContact O-CB 3.36Å; I94-H98 PolarHBondContact O-N 2.91Å; I96-H98 PolarHBondContact O-N 2.85Å; H98-K100 VanDerWaalsContact C-N 3.34Å; H98-K100 PolarHBondContact O-N 3.06Å; H98-K101 PolarHBondContact O-N 2.97Å; H98-Y102 HydrophobicContact CB-CD2 3.91Å; H98-Y102 HydrophobicContact CB-CE2 4.29Å; H98-Y102 AromaticContact CD2-CE2 3.64Å; H98-Y102 AromaticContact CG-CE2 3.9Å; H98-Y102 WeakPolarHBondContact O-CB 3.25Å; H98-Y102 WeakPolarHBondContact O-CD2 3.18Å; H98-Y102 PolarHBondContact O-N 2.83Å; H98-F106 HydrophobicContact CB-CD1 4.47Å; H98-F106 HydrophobicContact CB-CD2 4.21Å; H98-F106 HydrophobicContact CB-CE1 3.9Å; H98-F106 HydrophobicContact CB-CE2 3.59Å; H98-F106 HydrophobicContact CB-CZ 3.42Å; H98-F106 VanDerWaalsContact CB-CZ 3.42Å; H98-F106 AromaticContact CG-CE2 4Å; H98-F106 AromaticContact ND1-CE2 3.59Å
99	T	95.3	Very high	93.8	Very high	23 Å²	23	50 Å²	50	14%	0.141	23%	0.231	C	C	.	.	H	α-helix	trans	-63	-42.9	175.9	-57.8	0	0	0	0	110.8	Q95 I96 K101 G103 A119 S441	Q95-T99 VanDerWaalsContact O-CB 3.27Å; Q95-T99 WeakPolarHBondContact O-CB 3.42Å; Q95-T99 PolarHBondContact O-N 2.73Å; Q95-T99 PolarHBondContact O-OG1 2.95Å; I96-T99 PolarHBondContact O-N 3.43Å; T99-K101 VanDerWaalsContact C-N 3.34Å; T99-K101 PolarHBondContact O-N 2.82Å; T99-G103 CarbonylContact O-C 3.41Å; T99-G103 WeakPolarHBondContact O-CA 3.48Å; T99-G103 PolarHBondContact O-N 3.39Å; T99-A119 HydrophobicContact CG2-CB 3.83Å; T99-A119 WeakPolarHBondContact OG1-CB 3.26Å; T99-S441 PolarHBondContact OG1-OG 3.01Å
100	K	94.8	Very high	93.3	Very high	177 Å²	177	53.1 Å²	53.1	77%	0.77	24%	0.244	S	C	*	.	H	α-helix	trans	-63.3	-37.6	174.8	-71.9	175.5	-179.7	178.2	0	112.8	I96 E97 H98	I96-K100 HydrophobicContact CG2-CD 4.12Å; I96-K100 WeakPolarHBondContact O-CG 3.45Å; I96-K100 PolarHBondContact O-N 3.21Å; E97-K100 PolarHBondContact O-N 2.99Å; H98-K100 VanDerWaalsContact C-N 3.34Å; H98-K100 PolarHBondContact O-N 3.06Å
101	K	95.9	Very high	92.4	Very high	146 Å²	146	52.7 Å²	52.7	64%	0.635	26%	0.258	S	S	*	.	H	α-helix	trans	-86.4	-39.4	-173.4	-172.9	174.7	178.3	-172.5	0	114.3	E97 H98 T99	E97-K101 WeakPolarHBondContact O-CB 3.38Å; E97-K101 PolarHBondContact O-N 2.58Å; H98-K101 PolarHBondContact O-N 2.97Å; T99-K101 VanDerWaalsContact C-N 3.34Å; T99-K101 PolarHBondContact O-N 2.82Å
102	Y	95.9	Very high	91.7	Very high	40 Å²	40	56.2 Å²	56.2	16%	0.157	29%	0.285	C	S	.	.	H	α-helix	trans	-113	-9	-171.8	-54.2	-60.5	0	0	0	113	P71 P73 H98 F106	P71-Y102 HydrophobicContact CB-CD1 4.27Å; P71-Y102 VanDerWaalsContact CG-O 3.22Å; P71-Y102 WeakPolarHBondContact CG-O 3.46Å; P73-Y102 WeakPolarHBondContact CA-OH 3.25Å; P73-Y102 HydrophobicContact CB-CE2 4.34Å; P73-Y102 HydrophobicContact CG-CE2 4.44Å; H98-Y102 HydrophobicContact CB-CD2 3.91Å; H98-Y102 HydrophobicContact CB-CE2 4.29Å; H98-Y102 AromaticContact CD2-CE2 3.64Å; H98-Y102 AromaticContact CG-CE2 3.9Å; H98-Y102 WeakPolarHBondContact O-CB 3.25Å; H98-Y102 WeakPolarHBondContact O-CD2 3.18Å; H98-Y102 PolarHBondContact O-N 2.83Å; Y102-F106 HydrophobicContact CG-CB 4.37Å
103	G	95.1	Very high	91.1	Very high	30 Å²	30	60.3 Å²	60.3	31%	0.309	30%	0.304	S	S	.	.			trans	90.4	-165.8	-179.8	0	0	0	0	0	113.6	T99 I105	T99-G103 CarbonylContact O-C 3.41Å; T99-G103 WeakPolarHBondContact O-CA 3.48Å; T99-G103 PolarHBondContact O-N 3.39Å; G103-I105 VanDerWaalsContact C-N 3.29Å; G103-I105 PolarHBondContact O-N 2.84Å
104	K	94.8	Very high	90.8	Very high	79 Å²	79	59 Å²	59	34%	0.343	30%	0.298	S	S	.	.	S	Bend	trans	-68.5	-18.8	-170.3	-72.8	179.7	167.4	-153.9	0	115.3	A119 D120 E447	K104-A119 PolarHBondContact O-N 2.92Å; K104-D120 HydrophobicContact CB-CB 3.8Å; K104-D120 HydrophobicContact CD-CB 3.87Å; K104-D120 VanDerWaalsContact CD-OD2 3.28Å; K104-D120 WeakPolarHBondContact CD-OD2 3.4Å; K104-D120 WeakPolarHBondContact CE-OD2 3.33Å; K104-D120 HydrophobicContact CG-CB 3.93Å; K104-D120 IonicContact NZ-OD2 2.75Å; K104-D120 PolarHBondContact NZ-OD2 3.17Å; K104-E447 IonicContact NZ-OE1 2.78Å; K104-E447 IonicContact NZ-OE2 2.75Å; K104-E447 PolarHBondContact NZ-OE2 3.49Å
105	I	96.6	Very high	90.8	Very high	14 Å²	14	59.2 Å²	59.2	7%	0.072	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	129.8	176.6	-171.4	170.3	0	0	0	109.8	M70 G103 V116 S117 I118 L123 V424 Y427 I429	M70-I105 HydrophobicContact CE-CD1 3.83Å; M70-I105 HydrophobicContact CE-CG1 3.94Å; M70-I105 HydrophobicContact SD-CG1 4.26Å; G103-I105 VanDerWaalsContact C-N 3.29Å; G103-I105 PolarHBondContact O-N 2.84Å; I105-V116 HydrophobicContact CD1-CG1 4.04Å; I105-V116 HydrophobicContact CG1-CG1 3.94Å; I105-S117 WeakPolarHBondContact CA-O 3.25Å; I105-I118 HydrophobicContact CD1-CG1 4.36Å; I105-I118 HydrophobicContact CG1-CG1 4.34Å; I105-L123 HydrophobicContact CB-CD1 4.26Å; I105-V424 HydrophobicContact CD1-CG1 4.34Å; I105-Y427 HydrophobicContact CG2-CD2 3.92Å; I105-Y427 HydrophobicContact CG2-CE2 3.87Å; I105-I429 HydrophobicContact CD1-CD1 4.4Å
106	F	96.5	Very high	90.8	Very high	3 Å²	3	58.5 Å²	58.5	1%	0.013	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	157.2	-177.1	58.9	-90.2	0	0	0	111.5	M70 P71 H98 Y102 S117 A119	M70-F106 VanDerWaalsContact SD-C 3.59Å; P71-F106 CarbonylContact O-C 3.28Å; P71-F106 VanDerWaalsContact O-CA 3.29Å; P71-F106 WeakPolarHBondContact O-CA 3.49Å; P71-F106 WeakPolarHBondContact O-CB 3.44Å; H98-F106 HydrophobicContact CB-CD1 4.47Å; H98-F106 HydrophobicContact CB-CD2 4.21Å; H98-F106 HydrophobicContact CB-CE1 3.9Å; H98-F106 HydrophobicContact CB-CE2 3.59Å; H98-F106 HydrophobicContact CB-CZ 3.42Å; H98-F106 VanDerWaalsContact CB-CZ 3.42Å; H98-F106 AromaticContact CG-CE2 4Å; H98-F106 AromaticContact ND1-CE2 3.59Å; Y102-F106 HydrophobicContact CG-CB 4.37Å; F106-S117 WeakPolarHBondContact CE2-OG 3.28Å; F106-S117 PolarHBondContact N-O 2.97Å; F106-S117 PolarHBondContact O-N 3.28Å; F106-A119 HydrophobicContact CE1-CB 4.49Å
107	K	95.1	Very high	90.9	Very high	48 Å²	48	56.9 Å²	56.9	21%	0.209	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	150.8	176.3	70.7	-175	173.5	-158	0	111.6	L67 K68 M70 P71 G72 P73 L114 V115	L67-K107 WeakPolarHBondContact O-CD 3.36Å; L67-K107 PolarHBondContact O-NZ 3.37Å; K68-K107 PolarHBondContact O-NZ 3.26Å; M70-K107 HydrophobicContact CB-CD 4.24Å; M70-K107 HydrophobicContact CB-CG 4.5Å; M70-K107 HydrophobicContact CG-CB 4.3Å; M70-K107 HydrophobicContact CG-CG 4.49Å; M70-K107 WeakPolarHBondContact O-CE 3.37Å; M70-K107 PolarHBondContact O-NZ 3.44Å; M70-K107 HydrophobicContact SD-CB 3.78Å; P71-K107 PolarHBondContact O-N 2.84Å; G72-K107 VanDerWaalsContact CA-O 3.27Å; G72-K107 WeakPolarHBondContact CA-O 3.23Å; P73-K107 WeakPolarHBondContact CD-O 3.35Å; K107-L114 HydrophobicContact CB-CD1 4.13Å; K107-L114 HydrophobicContact CD-CD1 4.3Å; K107-V115 CarbonylContact C-O 3.59Å; K107-V115 WeakPolarHBondContact CA-O 3.35Å
108	S	91.7	Very high	91	Very high	6 Å²	6	52.4 Å²	52.4	4%	0.042	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	154.5	169.4	53.9	0	0	0	0	110.1	F110 V115	S108-F110 VanDerWaalsContact OG-CE2 3.31Å; S108-F110 WeakPolarHBondContact OG-CE2 3.47Å; S108-V115 PolarHBondContact N-O 2.97Å; S108-V115 PolarHBondContact O-N 3.38Å
109	R	85.3	Confident	91	Very high	116 Å²	116	51.5 Å²	51.5	44%	0.438	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	125.8	179.7	-81.7	-173.5	174.1	-93.4	1.1	110.8	N78 Q113 L114	N78-R109 PolarHBondContact ND2-O 3.14Å; R109-Q113 WeakPolarHBondContact CA-O 3.3Å; R109-L114 HydrophobicContact CG-CD1 3.75Å
110	F	76.3	Confident	91	Very high	65 Å²	65	51.1 Å²	51.1	29%	0.285	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	94.4	176.2	-63.4	-86	0	0	0	108.5	F82 S108 Q113 V115	F82-F110 HydrophobicContact CD1-CE1 4.17Å; F82-F110 HydrophobicContact CD2-CD1 4.33Å; F82-F110 AromaticContact CD2-CE1 3.46Å; F82-F110 HydrophobicContact CD2-CE1 3.46Å; F82-F110 VanDerWaalsContact CD2-CE1 3.46Å; F82-F110 HydrophobicContact CD2-CZ 4.21Å; F82-F110 AromaticContact CE1-CE1 3.99Å; F82-F110 HydrophobicContact CE1-CE1 3.99Å; F82-F110 HydrophobicContact CE1-CZ 4.41Å; F82-F110 HydrophobicContact CE2-CD1 4.47Å; F82-F110 AromaticContact CE2-CE1 3.27Å; F82-F110 HydrophobicContact CE2-CE1 3.27Å; F82-F110 AromaticContact CE2-CZ 3.55Å; F82-F110 HydrophobicContact CE2-CZ 3.55Å; F82-F110 AromaticContact CG-CE1 3.94Å; F82-F110 HydrophobicContact CG-CE1 3.94Å; F82-F110 AromaticContact CZ-CE1 3.56Å; F82-F110 HydrophobicContact CZ-CE1 3.56Å; F82-F110 AromaticContact CZ-CZ 3.67Å; F82-F110 HydrophobicContact CZ-CZ 3.67Å; S108-F110 VanDerWaalsContact OG-CE2 3.31Å; S108-F110 WeakPolarHBondContact OG-CE2 3.47Å; F110-Q113 PolarHBondContact N-O 3.33Å; F110-Q113 PolarHBondContact O-N 3.45Å; F110-V115 HydrophobicContact CD2-CB 4.41Å; F110-V115 HydrophobicContact CD2-CG2 3.87Å; F110-V115 HydrophobicContact CE2-CB 4.35Å; F110-V115 HydrophobicContact CE2-CG2 4.18Å
111	G	74.1	Confident	90.9	Very high	49 Å²	49	46.6 Å²	46.6	51%	0.505	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	-122.8	-169.4	0	0	0	0	0	111	Q113	G111-Q113 VanDerWaalsContact C-N 3.31Å
112	P	76.2	Confident	90.7	Very high	129 Å²	129	44.2 Å²	44.2	84%	0.838	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-19.7	178.1	31.9	-34.6	0	0	0	113.4
113	Q	80.6	Confident	90.7	Very high	92 Å²	92	43.4 Å²	43.4	43%	0.43	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	131.1	-170.6	-156.4	173.6	16.8	0	0	111.4	R109 F110 G111	R109-Q113 WeakPolarHBondContact CA-O 3.3Å; F110-Q113 PolarHBondContact N-O 3.33Å; F110-Q113 PolarHBondContact O-N 3.45Å; G111-Q113 VanDerWaalsContact C-N 3.31Å
114	L	89.2	Confident	90.6	Very high	39 Å²	39	42 Å²	42	20%	0.204	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	130	171.9	-177.9	72.5	0	0	0	108.8	L67 K107 R109	L67-L114 HydrophobicContact CD1-CD2 3.86Å; K107-L114 HydrophobicContact CB-CD1 4.13Å; K107-L114 HydrophobicContact CD-CD1 4.3Å; R109-L114 HydrophobicContact CG-CD1 3.75Å
115	V	92.4	Very high	90.5	Very high	15 Å²	15	38.2 Å²	38.2	9%	0.091	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	129.1	176.8	-178.6	0	0	0	0	108.9	K107 S108 F110 Q434 A436	K107-V115 CarbonylContact C-O 3.59Å; K107-V115 WeakPolarHBondContact CA-O 3.35Å; S108-V115 PolarHBondContact N-O 2.97Å; S108-V115 PolarHBondContact O-N 3.38Å; F110-V115 HydrophobicContact CD2-CB 4.41Å; F110-V115 HydrophobicContact CD2-CG2 3.87Å; F110-V115 HydrophobicContact CE2-CB 4.35Å; F110-V115 HydrophobicContact CE2-CG2 4.18Å; V115-Q434 CarbonylContact C-O 3.58Å; V115-Q434 WeakPolarHBondContact CA-O 3.36Å; V115-Q434 HydrophobicContact CG1-CG 4.31Å; V115-Q434 HydrophobicContact CG2-CB 4.28Å; V115-Q434 HydrophobicContact CG2-CG 3.99Å; V115-A436 HydrophobicContact CG1-CB 3.67Å
116	V	96.1	Very high	90.3	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	115.4	170.5	175	0	0	0	0	108.3	L67 M70 I105 I118 I429 T433 Q434 L435 A436	L67-V116 HydrophobicContact CD2-CG2 4Å; M70-V116 HydrophobicContact CE-CG1 3.91Å; M70-V116 HydrophobicContact CE-CG2 4.35Å; M70-V116 HydrophobicContact SD-CG1 3.86Å; M70-V116 HydrophobicContact SD-CG2 4.06Å; I105-V116 HydrophobicContact CD1-CG1 4.04Å; I105-V116 HydrophobicContact CG1-CG1 3.94Å; V116-I118 HydrophobicContact CG1-CG1 4.34Å; V116-I429 HydrophobicContact CG1-CD1 4.1Å; V116-T433 HydrophobicContact CB-CG2 4.41Å; V116-T433 HydrophobicContact CG2-CG2 3.79Å; V116-Q434 PolarHBondContact N-O 3.38Å; V116-L435 HydrophobicContact CB-CD2 3.8Å; V116-L435 HydrophobicContact CG1-CD2 4.21Å; V116-L435 CarbonylContact O-C 3.52Å; V116-L435 VanDerWaalsContact O-CA 3.24Å; V116-L435 WeakPolarHBondContact O-CA 3.36Å; V116-A436 PolarHBondContact O-N 2.87Å
117	S	96.7	Very high	90.1	Very high	11 Å²	11	41.7 Å²	41.7	8%	0.077	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	134.3	178.1	-62.5	0	0	0	0	110.5	I105 F106 A436	I105-S117 WeakPolarHBondContact CA-O 3.25Å; F106-S117 WeakPolarHBondContact CE2-OG 3.28Å; F106-S117 PolarHBondContact N-O 2.97Å; F106-S117 PolarHBondContact O-N 3.28Å; S117-A436 CarbonylContact C-O 3.52Å; S117-A436 VanDerWaalsContact CA-O 3.28Å; S117-A436 WeakPolarHBondContact CA-O 3.25Å
118	I	96.5	Very high	90	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	116.6	-177.2	-54	176.3	0	0	0	107.9	I105 V116 L123 V124 V127 V424 L435 A436 L437 C438	I105-I118 HydrophobicContact CD1-CG1 4.36Å; I105-I118 HydrophobicContact CG1-CG1 4.34Å; V116-I118 HydrophobicContact CG1-CG1 4.34Å; I118-L123 HydrophobicContact CG2-CB 3.44Å; I118-L123 VanDerWaalsContact CG2-CB 3.44Å; I118-L123 HydrophobicContact CG2-CD1 4.37Å; I118-V124 HydrophobicContact CB-CG2 4.47Å; I118-V124 HydrophobicContact CG2-CG2 3.95Å; I118-V127 HydrophobicContact CD1-CG2 3.56Å; I118-V424 HydrophobicContact CD1-CG1 4.36Å; I118-L435 HydrophobicContact CD1-CD1 4.34Å; I118-A436 PolarHBondContact N-O 2.63Å; I118-L437 HydrophobicContact CB-CD2 4.34Å; I118-L437 HydrophobicContact CD1-CD2 4.2Å; I118-C438 WeakPolarHBondContact O-CB 3.35Å; I118-C438 PolarHBondContact O-N 2.94Å
119	A	95.7	Very high	89.9	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.232	C	C	.	.			trans	-122.8	31.7	-172.6	0	0	0	0	0	112.4	T99 K104 F106 C438	T99-A119 HydrophobicContact CG2-CB 3.83Å; T99-A119 WeakPolarHBondContact OG1-CB 3.26Å; K104-A119 PolarHBondContact O-N 2.92Å; F106-A119 HydrophobicContact CE1-CB 4.49Å; A119-C438 HydrophobicContact CB-CB 3.8Å
120	D	94.7	Very high	90.2	Very high	14 Å²	14	44 Å²	44	8%	0.075	23%	0.233	C	C	.	.			trans	-130.9	139	176	172.7	-87.2	0	0	0	110.5	K104 E122 L123 V124	K104-D120 HydrophobicContact CB-CB 3.8Å; K104-D120 HydrophobicContact CD-CB 3.87Å; K104-D120 VanDerWaalsContact CD-OD2 3.28Å; K104-D120 WeakPolarHBondContact CD-OD2 3.4Å; K104-D120 WeakPolarHBondContact CE-OD2 3.33Å; K104-D120 HydrophobicContact CG-CB 3.93Å; K104-D120 IonicContact NZ-OD2 2.75Å; K104-D120 PolarHBondContact NZ-OD2 3.17Å; D120-E122 VanDerWaalsContact C-N 3.34Å; D120-E122 PolarHBondContact O-N 3.47Å; D120-E122 WeakPolarHBondContact OD1-CA 3.49Å; D120-E122 WeakPolarHBondContact OD1-CB 3.45Å; D120-E122 PolarHBondContact OD1-N 3.34Å; D120-L123 HydrophobicContact CB-CB 4.24Å; D120-L123 HydrophobicContact CB-CD1 4.12Å; D120-L123 HydrophobicContact CB-CG 4.06Å; D120-L123 PolarHBondContact O-N 3.07Å; D120-L123 PolarHBondContact OD1-N 3.39Å; D120-V124 WeakPolarHBondContact O-CB 3.27Å; D120-V124 WeakPolarHBondContact O-CG2 3.44Å; D120-V124 PolarHBondContact O-N 3.14Å
121	R	92.9	Very high	90.7	Very high	83 Å²	83	43 Å²	43	31%	0.313	23%	0.229	S	C	.	.	H	α-helix	trans	-63.1	-37.1	-174	66.1	154	-166	-141.9	6.6	113.4	A125 N448 N471 F472	R121-A125 WeakPolarHBondContact O-CB 3.37Å; R121-A125 PolarHBondContact O-N 3.46Å; R121-N448 WeakPolarHBondContact CD-OD1 3.32Å; R121-N448 VanDerWaalsContact CG-OD1 3.31Å; R121-N448 WeakPolarHBondContact CG-OD1 3.41Å; R121-N471 WeakPolarHBondContact CD-OD1 3.24Å; R121-F472 HydrophobicContact CB-CB 4.19Å; R121-F472 WeakPolarHBondContact O-CB 2.94Å
122	E	92.9	Very high	91.4	Very high	95 Å²	95	42.4 Å²	42.4	44%	0.444	22%	0.222	S	C	.	.	H	α-helix	trans	-77.9	-40.4	-175.3	-60.5	-57.9	162	0	0	109.6	D120 V124 A125 E126	D120-E122 VanDerWaalsContact C-N 3.34Å; D120-E122 PolarHBondContact O-N 3.47Å; D120-E122 WeakPolarHBondContact OD1-CA 3.49Å; D120-E122 WeakPolarHBondContact OD1-CB 3.45Å; D120-E122 PolarHBondContact OD1-N 3.34Å; E122-V124 VanDerWaalsContact C-N 3.34Å; E122-A125 WeakPolarHBondContact O-CB 3.5Å; E122-A125 PolarHBondContact O-N 2.86Å; E122-E126 WeakPolarHBondContact O-CB 3.41Å; E122-E126 PolarHBondContact O-N 3.35Å
123	L	94.6	Very high	91.9	Very high	24 Å²	24	40 Å²	40	13%	0.126	21%	0.213	C	C	.	.	H	α-helix	trans	-65.1	-38.6	173.9	-59.8	-173.7	0	0	0	111.9	I105 I118 D120 A125 E126 V127 V424	I105-L123 HydrophobicContact CB-CD1 4.26Å; I118-L123 HydrophobicContact CG2-CB 3.44Å; I118-L123 VanDerWaalsContact CG2-CB 3.44Å; I118-L123 HydrophobicContact CG2-CD1 4.37Å; D120-L123 HydrophobicContact CB-CB 4.24Å; D120-L123 HydrophobicContact CB-CD1 4.12Å; D120-L123 HydrophobicContact CB-CG 4.06Å; D120-L123 PolarHBondContact O-N 3.07Å; D120-L123 PolarHBondContact OD1-N 3.39Å; L123-A125 VanDerWaalsContact C-N 3.34Å; L123-E126 PolarHBondContact O-N 3.15Å; L123-V127 WeakPolarHBondContact O-CG2 3.34Å; L123-V127 PolarHBondContact O-N 3.31Å; L123-V424 HydrophobicContact CB-CG1 4.05Å; L123-V424 HydrophobicContact CD2-CG1 4.01Å; L123-V424 HydrophobicContact CG-CG1 4.44Å
124	V	94.3	Very high	92.4	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-61.2	-45.3	172	165.6	0	0	0	0	110.2	I118 D120 E122 V127 L128 L437 F472 I475	I118-V124 HydrophobicContact CB-CG2 4.47Å; I118-V124 HydrophobicContact CG2-CG2 3.95Å; D120-V124 WeakPolarHBondContact O-CB 3.27Å; D120-V124 WeakPolarHBondContact O-CG2 3.44Å; D120-V124 PolarHBondContact O-N 3.14Å; E122-V124 VanDerWaalsContact C-N 3.34Å; V124-V127 PolarHBondContact O-N 3.46Å; V124-L128 HydrophobicContact CG1-CD1 3.54Å; V124-L128 HydrophobicContact CG1-CG 4.39Å; V124-L128 WeakPolarHBondContact O-CB 3.37Å; V124-L128 WeakPolarHBondContact O-CD1 3.4Å; V124-L128 VanDerWaalsContact O-CG 3.24Å; V124-L128 WeakPolarHBondContact O-CG 3.44Å; V124-L128 PolarHBondContact O-N 3.46Å; V124-L437 HydrophobicContact CG1-CD1 4.45Å; V124-L437 HydrophobicContact CG2-CB 4.37Å; V124-L437 HydrophobicContact CG2-CD2 4.27Å; V124-F472 HydrophobicContact CG1-CD1 4.24Å; V124-I475 HydrophobicContact CG1-CD1 4.07Å
125	A	92.4	Very high	92.6	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.8	-42.4	177.7	0	0	0	0	0	112.3	R121 E122 L123 L128 R129 F472	R121-A125 WeakPolarHBondContact O-CB 3.37Å; R121-A125 PolarHBondContact O-N 3.46Å; E122-A125 WeakPolarHBondContact O-CB 3.5Å; E122-A125 PolarHBondContact O-N 2.86Å; L123-A125 VanDerWaalsContact C-N 3.34Å; A125-L128 PolarHBondContact O-N 3.31Å; A125-R129 VanDerWaalsContact O-CB 3.3Å; A125-R129 WeakPolarHBondContact O-CB 3.47Å; A125-R129 WeakPolarHBondContact O-CD 3.34Å; A125-R129 WeakPolarHBondContact O-CG 3.23Å; A125-R129 PolarHBondContact O-N 3Å; A125-F472 HydrophobicContact CB-CB 4.18Å; A125-F472 HydrophobicContact CB-CD1 3.81Å; A125-F472 HydrophobicContact CB-CD2 3.47Å; A125-F472 VanDerWaalsContact CB-CD2 3.47Å; A125-F472 HydrophobicContact CB-CE1 3.96Å; A125-F472 HydrophobicContact CB-CE2 3.66Å; A125-F472 HydrophobicContact CB-CG 3.55Å; A125-F472 HydrophobicContact CB-CZ 3.88Å
126	E	92.5	Very high	92.5	Very high	84 Å²	84	37.1 Å²	37.1	39%	0.393	20%	0.203	S	C	.	.	H	α-helix	trans	-57.1	-52	176.1	-177.8	177.8	-170.5	0	0	111.2	E122 L123 L128 R129 A130 V423	E122-E126 WeakPolarHBondContact O-CB 3.41Å; E122-E126 PolarHBondContact O-N 3.35Å; L123-E126 PolarHBondContact O-N 3.15Å; E126-L128 PolarHBondContact O-N 2.85Å; E126-R129 PolarHBondContact O-N 3.07Å; E126-A130 WeakPolarHBondContact O-CB 3.36Å; E126-A130 PolarHBondContact O-N 2.74Å; E126-A130 VanDerWaalsContact O-N 3.08Å; E126-V423 VanDerWaalsContact OE1-O 3.11Å
127	V	92.9	Very high	92.1	Very high	6 Å²	6	40 Å²	40	4%	0.036	21%	0.213	C	C	.	.	H	α-helix	trans	-60.5	-46.2	178.4	166.9	0	0	0	0	112.1	I118 L123 V124 R129 A130 V424 L435 L437	I118-V127 HydrophobicContact CD1-CG2 3.56Å; L123-V127 WeakPolarHBondContact O-CG2 3.34Å; L123-V127 PolarHBondContact O-N 3.31Å; V124-V127 PolarHBondContact O-N 3.46Å; V127-R129 VanDerWaalsContact C-N 3.33Å; V127-R129 PolarHBondContact O-N 2.63Å; V127-A130 PolarHBondContact O-N 2.94Å; V127-V424 HydrophobicContact CG2-CG1 4.06Å; V127-V424 HydrophobicContact CG2-CG2 3.8Å; V127-L435 HydrophobicContact CB-CD1 4.44Å; V127-L435 HydrophobicContact CG1-CD1 3.46Å; V127-L435 VanDerWaalsContact CG1-CD1 3.46Å; V127-L435 HydrophobicContact CG2-CD1 4.06Å; V127-L437 HydrophobicContact CG1-CD2 4.26Å
128	L	92.4	Very high	91.1	Very high	6 Å²	6	41.4 Å²	41.4	3%	0.031	23%	0.226	C	C	.	.	H	α-helix	trans	-70.1	-30.3	-176.5	-71.2	168.7	0	0	0	112.6	V124 A125 E126 E131 L437 F472 I475 Y479	V124-L128 HydrophobicContact CG1-CD1 3.54Å; V124-L128 HydrophobicContact CG1-CG 4.39Å; V124-L128 WeakPolarHBondContact O-CB 3.37Å; V124-L128 WeakPolarHBondContact O-CD1 3.4Å; V124-L128 VanDerWaalsContact O-CG 3.24Å; V124-L128 WeakPolarHBondContact O-CG 3.44Å; V124-L128 PolarHBondContact O-N 3.46Å; A125-L128 PolarHBondContact O-N 3.31Å; E126-L128 PolarHBondContact O-N 2.85Å; L128-E131 WeakPolarHBondContact CD2-OE1 3.34Å; L128-E131 WeakPolarHBondContact O-CG 3.4Å; L128-L437 HydrophobicContact CD1-CD1 4.17Å; L128-L437 HydrophobicContact CD2-CD1 3.71Å; L128-L437 HydrophobicContact CG-CD1 3.99Å; L128-F472 HydrophobicContact CB-CE1 4.33Å; L128-F472 HydrophobicContact CD1-CD1 3.93Å; L128-F472 HydrophobicContact CD1-CE1 3.81Å; L128-I475 HydrophobicContact CD1-CD1 3.63Å; L128-Y479 HydrophobicContact CB-CD1 3.9Å; L128-Y479 HydrophobicContact CD1-CD1 4.48Å; L128-Y479 HydrophobicContact CD1-CG 4.39Å
129	R	90.2	Very high	89.9	Confident	158 Å²	158	46.3 Å²	46.3	60%	0.596	25%	0.252	S	S	*	.	H	α-helix	trans	-76.7	-25.9	175.1	-72.4	170.7	-174.5	145.3	-0.2	112.6	A125 E126 V127 E131	A125-R129 VanDerWaalsContact O-CB 3.3Å; A125-R129 WeakPolarHBondContact O-CB 3.47Å; A125-R129 WeakPolarHBondContact O-CD 3.34Å; A125-R129 WeakPolarHBondContact O-CG 3.23Å; A125-R129 PolarHBondContact O-N 3Å; E126-R129 PolarHBondContact O-N 3.07Å; V127-R129 VanDerWaalsContact C-N 3.33Å; V127-R129 PolarHBondContact O-N 2.63Å; R129-E131 PolarHBondContact O-N 3.33Å
130	A	89.6	Confident	89.1	Confident	54 Å²	54	48.6 Å²	48.6	45%	0.446	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	0.6	176	0	0	0	0	0	113.6	E126 V127 L422	E126-A130 WeakPolarHBondContact O-CB 3.36Å; E126-A130 PolarHBondContact O-N 2.74Å; E126-A130 VanDerWaalsContact O-N 3.08Å; V127-A130 PolarHBondContact O-N 2.94Å; A130-L422 HydrophobicContact CB-CD2 4.07Å
131	E	88.5	Confident	88.5	Confident	45 Å²	45	52.3 Å²	52.3	21%	0.21	28%	0.28	C	S	.	.			trans	-65.4	137.9	-179.1	-72.2	-175.8	169.9	0	0	113.1	L128 R129 P135 R416	L128-E131 WeakPolarHBondContact CD2-OE1 3.34Å; L128-E131 WeakPolarHBondContact O-CG 3.4Å; R129-E131 PolarHBondContact O-N 3.33Å; E131-P135 HydrophobicContact CB-CB 4.42Å; E131-P135 HydrophobicContact CB-CG 4.13Å; E131-P135 HydrophobicContact CG-CB 4.32Å; E131-P135 HydrophobicContact CG-CG 4.49Å; E131-P135 WeakPolarHBondContact OE2-CB 3.32Å; E131-P135 VanDerWaalsContact OE2-CG 3.31Å; E131-P135 WeakPolarHBondContact OE2-CG 3.22Å; E131-R416 VanDerWaalsContact OE1-CD 3.22Å; E131-R416 WeakPolarHBondContact OE1-CD 3.4Å; E131-R416 WeakPolarHBondContact OE1-CG 3.27Å; E131-R416 IonicContact OE1-CZ 3.98Å; E131-R416 IonicContact OE1-NE 3.33Å; E131-R416 PolarHBondContact OE1-NE 3.33Å; E131-R416 IonicContact OE1-NH2 3.78Å; E131-R416 PolarHBondContact OE1-NH2 2.94Å; E131-R416 IonicContact OE2-NE 3.49Å
132	G	87.2	Confident	88.1	Confident	35 Å²	35	49 Å²	49	36%	0.361	27%	0.27	S	S	.	.			trans	-75	-176.1	171.2	0	0	0	0	0	113.7	A134 P135	G132-A134 PolarHBondContact O-N 2.85Å; G132-P135 WeakPolarHBondContact O-CD 3.48Å
133	A	88.1	Confident	87.8	Confident	78 Å²	78	46.9 Å²	46.9	65%	0.645	26%	0.258	S	S	*	.	S	Bend	trans	-66.7	-18.3	-175.4	0	0	0	0	0	115.2	I481	A133-I481 WeakPolarHBondContact O-CD1 3.5Å
134	A	90.9	Very high	87.5	Confident	26 Å²	26	48.2 Å²	48.2	22%	0.215	26%	0.264	C	S	.	.	S	Bend	trans	-133.8	78.7	175.3	0	0	0	0	0	110.1	G132 Q136 W164	G132-A134 PolarHBondContact O-N 2.85Å; A134-Q136 PolarHBondContact O-N 3.25Å; A134-W164 HydrophobicContact CB-CE3 4.49Å
135	P	92.2	Very high	87.3	Confident	3 Å²	3	49.7 Å²	49.7	2%	0.019	27%	0.27	C	S	.	.			trans	-60.9	137.7	-179.2	-18.1	29.1	0	0	0	109.7	E131 G132 I481 R482	E131-P135 HydrophobicContact CB-CB 4.42Å; E131-P135 HydrophobicContact CB-CG 4.13Å; E131-P135 HydrophobicContact CG-CB 4.32Å; E131-P135 HydrophobicContact CG-CG 4.49Å; E131-P135 WeakPolarHBondContact OE2-CB 3.32Å; E131-P135 VanDerWaalsContact OE2-CG 3.31Å; E131-P135 WeakPolarHBondContact OE2-CG 3.22Å; G132-P135 WeakPolarHBondContact O-CD 3.48Å; P135-I481 HydrophobicContact CG-CD1 3.92Å; P135-I481 HydrophobicContact CG-CG1 3.73Å; P135-R482 HydrophobicContact CB-CB 4.37Å; P135-R482 HydrophobicContact CG-CB 4.33Å; P135-R482 WeakPolarHBondContact O-CD 3.44Å; P135-R482 PolarHBondContact O-NH1 3.5Å
136	Q	91.1	Very high	87.2	Confident	58 Å²	58	49.7 Å²	49.7	27%	0.271	27%	0.271	S	S	.	.	B	Isolated β-bridge	trans	-104.1	142.7	-179.4	-63.9	-179	-5.8	0	0	111.9	A134 E160 R416 I417 R482	A134-Q136 PolarHBondContact O-N 3.25Å; Q136-E160 WeakPolarHBondContact CA-OE2 3.31Å; Q136-E160 WeakPolarHBondContact CB-OE2 3.41Å; Q136-E160 WeakPolarHBondContact CG-OE2 3.4Å; Q136-R416 CarbonylContact O-C 3.44Å; Q136-R416 WeakPolarHBondContact O-CA 3.48Å; Q136-R416 VanDerWaalsContact O-CD 3.32Å; Q136-R416 WeakPolarHBondContact O-CD 3.33Å; Q136-I417 HydrophobicContact CB-CB 4.12Å; Q136-I417 PolarHBondContact O-N 3.17Å; Q136-R482 VanDerWaalsContact CA-NH1 3.33Å
137	R	87.1	Confident	87.2	Confident	59 Å²	59	45.8 Å²	45.8	22%	0.223	25%	0.252	C	S	.	.			trans	-99.9	-170.3	174.1	-69.4	-174.3	178.9	-175.7	1.3	110.1	E160 I417 R482	R137-E160 PolarHBondContact N-OE1 2.78Å; R137-I417 WeakPolarHBondContact O-CD1 3.39Å; R137-I417 VanDerWaalsContact O-CG1 3.31Å; R137-I417 WeakPolarHBondContact O-CG1 3.39Å; R137-R482 PolarHBondContact NH2-O 2.96Å
138	A	76.6	Confident	87.2	Confident	41 Å²	41	51.6 Å²	51.6	34%	0.339	28%	0.283	S	S	.	.	S	Bend	trans	-62.6	149.8	179.4	0	0	0	0	0	112.1	M140	A138-M140 PolarHBondContact O-N 3.4Å
139	N	71.7	Confident	87.2	Confident	103 Å²	103	56 Å²	56	55%	0.551	31%	0.305	S	S	*	.			trans	-58.3	119.5	177.6	-177.6	7.6	0	0	0	111.2	E141	N139-E141 WeakPolarHBondContact OD1-CB 3.27Å; N139-E141 PolarHBondContact OD1-N 3.33Å
140	M	79.3	Confident	87.4	Confident	49 Å²	49	53.3 Å²	53.3	24%	0.241	30%	0.295	C	S	.	.			trans	-104.4	39.8	176	-63.5	-166	177	0	0	112.1	A138 S142 W143 H144 I157	A138-M140 PolarHBondContact O-N 3.4Å; M140-S142 VanDerWaalsContact C-N 3.25Å; M140-S142 PolarHBondContact O-N 2.91Å; M140-S142 VanDerWaalsContact O-N 3.11Å; M140-W143 HydrophobicContact CB-CB 4.25Å; M140-W143 HydrophobicContact CB-CG 4.31Å; M140-W143 WeakPolarHBondContact O-CB 3.47Å; M140-W143 PolarHBondContact O-N 3.41Å; M140-W143 HydrophobicContact SD-CD2 4.3Å; M140-W143 HydrophobicContact SD-CE3 4.31Å; M140-H144 PolarHBondContact O-CD2 2.95Å; M140-H144 PolarHBondContact O-N 3.44Å; M140-I157 HydrophobicContact CE-CG2 4.03Å; M140-I157 HydrophobicContact SD-CG2 4.38Å
141	E	81.6	Confident	87.6	Confident	91 Å²	91	53.7 Å²	53.7	43%	0.425	30%	0.304	S	S	.	.	H	α-helix	trans	-49.3	-41.8	-174.6	-170.8	177.7	168.3	0	0	113.7	N139 W143 H144 E145	N139-E141 WeakPolarHBondContact OD1-CB 3.27Å; N139-E141 PolarHBondContact OD1-N 3.33Å; E141-W143 VanDerWaalsContact C-N 3.26Å; E141-W143 PolarHBondContact O-N 3.43Å; E141-H144 PolarHBondContact O-N 3.14Å; E141-E145 WeakPolarHBondContact O-CB 3.31Å; E141-E145 PolarHBondContact O-N 2.91Å
142	S	83.3	Confident	87.9	Confident	15 Å²	15	54.5 Å²	54.5	11%	0.105	31%	0.305	C	S	.	.	H	α-helix	trans	-60.3	-35.7	177.8	-58.8	0	0	0	0	113.1	M140 Y146 G268 F285	M140-S142 VanDerWaalsContact C-N 3.25Å; M140-S142 PolarHBondContact O-N 2.91Å; M140-S142 VanDerWaalsContact O-N 3.11Å; S142-Y146 PolarHBondContact O-N 3.09Å; S142-Y146 VanDerWaalsContact O-N 3.12Å; S142-G268 WeakPolarHBondContact OG-CA 3.3Å; S142-G268 PolarHBondContact OG-N 2.98Å; S142-F285 VanDerWaalsContact O-CE1 3.32Å; S142-F285 WeakPolarHBondContact O-CE1 3.3Å
143	W	88	Confident	88.2	Confident	49 Å²	49	54.3 Å²	54.3	19%	0.186	30%	0.298	C	S	.	.	H	α-helix	trans	-71.7	-47.4	179	-66.9	40.1	0	0	0	109.4	M140 E141 E145 Y146 R147 I157 F285 W289 L345	M140-W143 HydrophobicContact CB-CB 4.25Å; M140-W143 HydrophobicContact CB-CG 4.31Å; M140-W143 WeakPolarHBondContact O-CB 3.47Å; M140-W143 PolarHBondContact O-N 3.41Å; M140-W143 HydrophobicContact SD-CD2 4.3Å; M140-W143 HydrophobicContact SD-CE3 4.31Å; E141-W143 VanDerWaalsContact C-N 3.26Å; E141-W143 PolarHBondContact O-N 3.43Å; W143-E145 VanDerWaalsContact C-N 3.33Å; W143-E145 PolarHBondContact O-N 3Å; W143-Y146 WeakPolarHBondContact O-CB 3.39Å; W143-Y146 PolarHBondContact O-N 3.28Å; W143-R147 WeakPolarHBondContact O-CG 3.41Å; W143-R147 PolarHBondContact O-N 2.78Å; W143-I157 HydrophobicContact CZ3-CG2 4.42Å; W143-F285 AromaticContact CD1-CZ 3.61Å; W143-F285 HydrophobicContact CG-CZ 4.19Å; W143-F285 AromaticContact NE1-CE2 3.96Å; W143-W289 HydrophobicContact CD2-CH2 4.21Å; W143-W289 AromaticContact CD2-CZ2 3.52Å; W143-W289 HydrophobicContact CD2-CZ2 3.52Å; W143-W289 AromaticContact CE2-CZ2 3.63Å; W143-W289 AromaticContact CE3-CH2 3.54Å; W143-W289 HydrophobicContact CE3-CH2 3.54Å; W143-W289 AromaticContact CE3-CZ2 3.34Å; W143-W289 HydrophobicContact CE3-CZ2 3.34Å; W143-W289 HydrophobicContact CG-CZ2 4.4Å; W143-W289 AromaticContact CH2-CH2 3.69Å; W143-W289 HydrophobicContact CH2-CH2 3.69Å; W143-W289 AromaticContact CH2-CZ2 3.44Å; W143-W289 HydrophobicContact CH2-CZ2 3.44Å; W143-W289 VanDerWaalsContact CH2-CZ2 3.44Å; W143-W289 HydrophobicContact CZ2-CH2 4.33Å; W143-W289 AromaticContact CZ2-CZ2 3.6Å; W143-W289 HydrophobicContact CZ2-CZ2 3.6Å; W143-W289 AromaticContact CZ3-CH2 3.26Å; W143-W289 HydrophobicContact CZ3-CH2 3.26Å; W143-W289 AromaticContact CZ3-CZ2 3.32Å; W143-W289 HydrophobicContact CZ3-CZ2 3.32Å; W143-L345 HydrophobicContact CH2-CD2 3.9Å; W143-L345 HydrophobicContact CZ3-CD2 4.38Å
144	H	88.6	Confident	88.5	Confident	53 Å²	53	51.1 Å²	51.1	25%	0.245	27%	0.271	C	S	.	.	H	α-helix	trans	-56.9	-46	174.7	-70	-73.6	0	0	0	112	M140 E141 Y146 R147 D148 S158	M140-H144 PolarHBondContact O-CD2 2.95Å; M140-H144 PolarHBondContact O-N 3.44Å; E141-H144 PolarHBondContact O-N 3.14Å; H144-Y146 VanDerWaalsContact C-N 3.32Å; H144-Y146 PolarHBondContact O-N 3.26Å; H144-R147 WeakPolarHBondContact O-CA 3.32Å; H144-R147 WeakPolarHBondContact O-CB 3.31Å; H144-R147 PolarHBondContact O-N 3.48Å; H144-D148 PolarHBondContact O-N 2.67Å; H144-S158 PolarHBondContact CE1-O 3.41Å; H144-S158 PolarHBondContact NE2-O 3.12Å; H144-S158 VanDerWaalsContact NE2-O 3.13Å
145	E	88.9	Confident	88.6	Confident	30 Å²	30	49.9 Å²	49.9	14%	0.14	26%	0.26	C	S	.	.	H	α-helix	trans	-60.2	-41.6	178.3	-179.9	170.9	-147.6	0	0	111.9	E141 W143 M149 K272 R275 W282	E141-E145 WeakPolarHBondContact O-CB 3.31Å; E141-E145 PolarHBondContact O-N 2.91Å; W143-E145 VanDerWaalsContact C-N 3.33Å; W143-E145 PolarHBondContact O-N 3Å; E145-M149 HydrophobicContact CG-SD 4.13Å; E145-M149 WeakPolarHBondContact O-CB 3.4Å; E145-M149 WeakPolarHBondContact O-CG 3.41Å; E145-M149 PolarHBondContact O-N 2.79Å; E145-K272 WeakPolarHBondContact OE1-CE 3.34Å; E145-K272 IonicContact OE1-NZ 3.75Å; E145-K272 PolarHBondContact OE1-NZ 3.1Å; E145-K272 IonicContact OE2-NZ 3.71Å; E145-R275 IonicContact OE1-CZ 3.45Å; E145-R275 IonicContact OE1-NH1 3.34Å; E145-R275 PolarHBondContact OE1-NH1 3.44Å; E145-R275 IonicContact OE1-NH2 3.46Å; E145-R275 IonicContact OE2-CZ 3.91Å; E145-R275 VanDerWaalsContact OE2-CZ 3.28Å; E145-R275 IonicContact OE2-NH1 2.75Å; E145-R275 PolarHBondContact OE2-NH1 3.29Å; E145-R275 IonicContact OE2-NH2 2.78Å; E145-R275 PolarHBondContact OE2-NH2 3.08Å; E145-W282 HydrophobicContact CB-CH2 3.99Å; E145-W282 HydrophobicContact CG-CH2 3.79Å; E145-W282 HydrophobicContact CG-CZ2 3.89Å
146	Y	90.6	Very high	88.5	Confident	1 Å²	1	50.3 Å²	50.3	0%	0.004	26%	0.263	C	S	.	.	H	α-helix	trans	-61.3	-43.4	172.4	165.6	-91.4	0	0	0	112	S142 W143 H144 M149 R150 F285 C286 W289 D290 F293	S142-Y146 PolarHBondContact O-N 3.09Å; S142-Y146 VanDerWaalsContact O-N 3.12Å; W143-Y146 WeakPolarHBondContact O-CB 3.39Å; W143-Y146 PolarHBondContact O-N 3.28Å; H144-Y146 VanDerWaalsContact C-N 3.32Å; H144-Y146 PolarHBondContact O-N 3.26Å; Y146-M149 PolarHBondContact O-N 3.48Å; Y146-R150 HydrophobicContact CD2-CG 4.07Å; Y146-R150 HydrophobicContact CE1-CG 4.41Å; Y146-R150 HydrophobicContact CE2-CG 3.58Å; Y146-R150 WeakPolarHBondContact O-CB 3.46Å; Y146-R150 WeakPolarHBondContact O-CG 3.45Å; Y146-R150 PolarHBondContact O-N 3.5Å; Y146-F285 HydrophobicContact CG-CE1 4.46Å; Y146-C286 HydrophobicContact CD2-CB 4.21Å; Y146-C286 HydrophobicContact CE2-CB 4.39Å; Y146-W289 HydrophobicContact CD1-CB 3.98Å; Y146-W289 HydrophobicContact CD1-CG 4.1Å; Y146-W289 HydrophobicContact CD2-CB 4.02Å; Y146-W289 HydrophobicContact CE1-CB 3.52Å; Y146-W289 HydrophobicContact CE1-CD2 4.45Å; Y146-W289 HydrophobicContact CE1-CG 4.05Å; Y146-W289 HydrophobicContact CE2-CB 3.53Å; Y146-W289 HydrophobicContact CE2-CG 4.48Å; Y146-W289 HydrophobicContact CG-CB 4.23Å; Y146-W289 HydrophobicContact CG-CG 4.4Å; Y146-D290 VanDerWaalsContact CE2-OD1 3.28Å; Y146-D290 WeakPolarHBondContact CE2-OD1 3.37Å; Y146-D290 PolarHBondContact OH-N 2.97Å; Y146-D290 PolarHBondContact OH-OD1 2.85Å; Y146-F293 AromaticContact CE1-CD2 3.94Å; Y146-F293 HydrophobicContact CE1-CD2 3.94Å; Y146-F293 AromaticContact CE1-CE2 3.84Å; Y146-F293 HydrophobicContact CE1-CE2 3.84Å
147	R	92.4	Very high	88.5	Confident	1 Å²	1	49.6 Å²	49.6	0%	0.004	26%	0.26	C	S	.	.	H	α-helix	trans	-61.9	-47.5	179.1	-63.4	-46.8	164.2	87	2.7	111.4	W143 H144 M149 R150 G151 R152 S153 F293 E342	W143-R147 WeakPolarHBondContact O-CG 3.41Å; W143-R147 PolarHBondContact O-N 2.78Å; H144-R147 WeakPolarHBondContact O-CA 3.32Å; H144-R147 WeakPolarHBondContact O-CB 3.31Å; H144-R147 PolarHBondContact O-N 3.48Å; R147-M149 PolarHBondContact O-N 3.3Å; R147-R150 CarbonylContact O-C 3.54Å; R147-R150 PolarHBondContact O-N 3.05Å; R147-G151 PolarHBondContact O-N 3.03Å; R147-R152 HydrophobicContact CB-CB 4.29Å; R147-R152 WeakPolarHBondContact CB-O 3.46Å; R147-R152 PolarHBondContact O-N 3.26Å; R147-S153 WeakPolarHBondContact CD-O 2.88Å; R147-S153 PolarHBondContact NH1-O 3.19Å; R147-F293 VanDerWaalsContact CZ-CE2 3.48Å; R147-E342 IonicContact CZ-OE1 3.85Å; R147-E342 VanDerWaalsContact CZ-OE1 3.29Å; R147-E342 IonicContact NH1-OE1 2.96Å; R147-E342 PolarHBondContact NH1-OE1 2.82Å; R147-E342 IonicContact NH2-OE1 2.84Å; R147-E342 PolarHBondContact NH2-OE1 2.63Å
148	D	92.3	Very high	88.6	Confident	129 Å²	129	46.8 Å²	46.8	69%	0.69	25%	0.25	S	C	*	.	H	α-helix	trans	-60.3	-46	176.9	-67.6	-19.4	0	0	0	111.4	H144 R150 G151	H144-D148 PolarHBondContact O-N 2.67Å; D148-R150 VanDerWaalsContact C-N 3.25Å; D148-R150 PolarHBondContact O-N 3.3Å; D148-G151 PolarHBondContact O-N 3.14Å
149	M	92.9	Very high	89.3	Confident	98 Å²	98	44.9 Å²	44.9	48%	0.483	23%	0.234	S	C	.	.	H	α-helix	trans	-62.7	-29.8	179.2	-77.7	179.6	59.7	0	0	113.7	E145 Y146 R147 W282	E145-M149 HydrophobicContact CG-SD 4.13Å; E145-M149 WeakPolarHBondContact O-CB 3.4Å; E145-M149 WeakPolarHBondContact O-CG 3.41Å; E145-M149 PolarHBondContact O-N 2.79Å; Y146-M149 PolarHBondContact O-N 3.48Å; R147-M149 PolarHBondContact O-N 3.3Å; M149-W282 HydrophobicContact SD-CZ2 3.72Å
150	R	94.4	Very high	90.2	Very high	102 Å²	102	42.2 Å²	42.2	39%	0.385	22%	0.218	S	C	.	.	H	α-helix	trans	-101.3	-1.7	-178.8	-66.3	-64.1	-169.1	-105	2.1	113.4	Y146 R147 D148 R152 D290	Y146-R150 HydrophobicContact CD2-CG 4.07Å; Y146-R150 HydrophobicContact CE1-CG 4.41Å; Y146-R150 HydrophobicContact CE2-CG 3.58Å; Y146-R150 WeakPolarHBondContact O-CB 3.46Å; Y146-R150 WeakPolarHBondContact O-CG 3.45Å; Y146-R150 PolarHBondContact O-N 3.5Å; R147-R150 CarbonylContact O-C 3.54Å; R147-R150 PolarHBondContact O-N 3.05Å; D148-R150 VanDerWaalsContact C-N 3.25Å; D148-R150 PolarHBondContact O-N 3.3Å; R150-R152 VanDerWaalsContact C-N 3.32Å; R150-R152 HydrophobicContact CB-CG 3.71Å; R150-D290 IonicContact CZ-OD1 3.44Å; R150-D290 IonicContact CZ-OD2 3.53Å; R150-D290 IonicContact NE-OD1 2.82Å; R150-D290 PolarHBondContact NE-OD1 3.29Å; R150-D290 IonicContact NE-OD2 3.52Å; R150-D290 PolarHBondContact NE-OD2 3.42Å; R150-D290 IonicContact NH2-OD1 3.9Å; R150-D290 IonicContact NH2-OD2 3.28Å; R150-D290 PolarHBondContact NH2-OD2 3.39Å
151	G	94.1	Very high	90.8	Very high	62 Å²	62	40.8 Å²	40.8	64%	0.639	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.7	39.1	-174.3	0	0	0	0	0	112.8	R147 D148	R147-G151 PolarHBondContact O-N 3.03Å; D148-G151 PolarHBondContact O-N 3.14Å
152	R	94.5	Very high	91.2	Very high	61 Å²	61	44.1 Å²	44.1	23%	0.23	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-102.5	150.8	-179.1	-61.3	-58.9	-173.5	175.7	3.2	111.2	R147 R150 F293 M297 E334	R147-R152 HydrophobicContact CB-CB 4.29Å; R147-R152 WeakPolarHBondContact CB-O 3.46Å; R147-R152 PolarHBondContact O-N 3.26Å; R150-R152 VanDerWaalsContact C-N 3.32Å; R150-R152 HydrophobicContact CB-CG 3.71Å; R152-F293 HydrophobicContact CB-CE1 4.49Å; R152-F293 HydrophobicContact CB-CZ 4.39Å; R152-F293 HydrophobicContact CG-CE1 4.45Å; R152-M297 PolarHBondContact NH1-SD 3.16Å; R152-M297 PolarHBondContact NH2-SD 3.36Å; R152-E334 WeakPolarHBondContact CD-OE2 3.38Å; R152-E334 IonicContact CZ-OE2 3.94Å; R152-E334 IonicContact NH1-OE1 2.84Å; R152-E334 PolarHBondContact NH1-OE1 2.88Å; R152-E334 IonicContact NH1-OE2 3.76Å; R152-E334 PolarHBondContact NH1-OE2 2.78Å
153	S	94.4	Very high	91.6	Very high	31 Å²	31	47.3 Å²	47.3	22%	0.217	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-72.5	159.2	168.3	-60.1	0	0	0	0	111.6	R147 E334 A338	R147-S153 WeakPolarHBondContact CD-O 2.88Å; R147-S153 PolarHBondContact NH1-O 3.19Å; S153-E334 WeakPolarHBondContact OG-CB 3.32Å; S153-A338 WeakPolarHBondContact O-CB 3.42Å
154	T	93.3	Very high	91.9	Very high	12 Å²	12	45.1 Å²	45.1	7%	0.074	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-74.7	155.4	163.9	75.4	0	0	0	0	109.8	S158 A159 E163 M167 A338	T154-S158 WeakPolarHBondContact CB-OG 2.94Å; T154-A159 WeakPolarHBondContact OG1-CB 3.45Å; T154-E163 PolarHBondContact OG1-OE1 3.04Å; T154-M167 WeakPolarHBondContact O-CE 3.49Å; T154-A338 VanDerWaalsContact O-CB 3.31Å; T154-A338 WeakPolarHBondContact O-CB 3.1Å
155	G	92.4	Very high	92.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.239	C	C	.	.			trans	-106.8	176.7	168.7	0	0	0	0	0	110	I157 S158 A159 E342	G155-I157 PolarHBondContact O-N 3Å; G155-S158 PolarHBondContact N-OG 3.28Å; G155-S158 VanDerWaalsContact N-OG 3.15Å; G155-S158 PolarHBondContact O-N 3.45Å; G155-S158 VanDerWaalsContact O-N 3.08Å; G155-S158 PolarHBondContact O-OG 3Å; G155-A159 VanDerWaalsContact O-CB 3.28Å; G155-A159 WeakPolarHBondContact O-CB 3.47Å; G155-A159 PolarHBondContact O-N 3.12Å; G155-E342 VanDerWaalsContact CA-CD 3.42Å; G155-E342 WeakPolarHBondContact CA-OE1 3.42Å; G155-E342 WeakPolarHBondContact CA-OE2 3.44Å; G155-E342 PolarHBondContact N-OE1 3.45Å; G155-E342 VanDerWaalsContact N-OE1 3.15Å
156	L	91.6	Very high	92.2	Very high	12 Å²	12	49 Å²	49	6%	0.063	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-29.8	-175.8	-172.3	73.1	0	0	0	115.1	W164 M167 R168 L171 N339 E342 I485	L156-W164 VanDerWaalsContact O-CD1 3.26Å; L156-M167 HydrophobicContact CD1-CB 4Å; L156-R168 HydrophobicContact CD1-CB 3.86Å; L156-L171 HydrophobicContact CB-CD1 4.26Å; L156-L171 HydrophobicContact CD1-CD1 4.38Å; L156-L171 HydrophobicContact CD2-CD1 4.09Å; L156-L171 HydrophobicContact CG-CD1 4.48Å; L156-N339 VanDerWaalsContact CB-OD1 3.31Å; L156-N339 WeakPolarHBondContact CB-OD1 3.46Å; L156-N339 PolarHBondContact N-OD1 3.47Å; L156-E342 PolarHBondContact N-OE2 2.77Å; L156-I485 HydrophobicContact CD2-CB 3.88Å; L156-I485 HydrophobicContact CD2-CD1 3.34Å; L156-I485 HydrophobicContact CD2-CG1 4.15Å; L156-I485 HydrophobicContact CD2-CG2 3.8Å
157	I	89.8	Confident	92.2	Very high	42 Å²	42	49 Å²	49	22%	0.215	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-41.4	-178.6	-57.3	179.9	0	0	0	110.2	M140 W143 G155 E342 A346	M140-I157 HydrophobicContact CE-CG2 4.03Å; M140-I157 HydrophobicContact SD-CG2 4.38Å; W143-I157 HydrophobicContact CZ3-CG2 4.42Å; G155-I157 PolarHBondContact O-N 3Å; I157-E342 WeakPolarHBondContact CA-OE2 3.46Å; I157-E342 HydrophobicContact CB-CB 4.45Å; I157-E342 WeakPolarHBondContact CB-OE2 3.4Å; I157-E342 HydrophobicContact CD1-CB 3.93Å; I157-E342 WeakPolarHBondContact CD1-O 3.03Å; I157-E342 HydrophobicContact CG1-CB 4.12Å; I157-E342 PolarHBondContact N-OE2 2.6Å; I157-A346 HydrophobicContact CD1-CB 3.68Å
158	S	89.6	Confident	92.3	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.007	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-20	-177.6	56.2	0	0	0	0	114.3	H144 T154 G155 E342	H144-S158 PolarHBondContact CE1-O 3.41Å; H144-S158 PolarHBondContact NE2-O 3.12Å; H144-S158 VanDerWaalsContact NE2-O 3.13Å; T154-S158 WeakPolarHBondContact CB-OG 2.94Å; G155-S158 PolarHBondContact N-OG 3.28Å; G155-S158 VanDerWaalsContact N-OG 3.15Å; G155-S158 PolarHBondContact O-N 3.45Å; G155-S158 VanDerWaalsContact O-N 3.08Å; G155-S158 PolarHBondContact O-OG 3Å; S158-E342 PolarHBondContact N-OE2 2.97Å; S158-E342 PolarHBondContact OG-OE1 3.06Å
159	A	91.7	Very high	92.2	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.24	C	C	.	.			trans	-67.5	148.3	176.7	0	0	0	0	0	111.9	T154 G155 E163 W164 M167 R482	T154-A159 WeakPolarHBondContact OG1-CB 3.45Å; G155-A159 VanDerWaalsContact O-CB 3.28Å; G155-A159 WeakPolarHBondContact O-CB 3.47Å; G155-A159 PolarHBondContact O-N 3.12Å; A159-E163 HydrophobicContact CB-CG 4.23Å; A159-W164 HydrophobicContact CB-CB 3.88Å; A159-M167 HydrophobicContact CB-SD 4.1Å; A159-R482 PolarHBondContact O-NH2 3.1Å
160	E	91	Very high	92	Very high	47 Å²	47	41.5 Å²	41.5	22%	0.22	22%	0.224	C	C	.	.			trans	-132.2	165.8	175.6	-71.4	-64.5	156.1	0	0	111	Q136 R137 W164 R482	Q136-E160 WeakPolarHBondContact CA-OE2 3.31Å; Q136-E160 WeakPolarHBondContact CB-OE2 3.41Å; Q136-E160 WeakPolarHBondContact CG-OE2 3.4Å; R137-E160 PolarHBondContact N-OE1 2.78Å; E160-W164 PolarHBondContact O-N 3.22Å; E160-R482 VanDerWaalsContact CD-NH2 3.3Å; E160-R482 IonicContact OE1-CZ 3.16Å; E160-R482 IonicContact OE1-NH1 3.03Å; E160-R482 PolarHBondContact OE1-NH1 2.82Å; E160-R482 IonicContact OE1-NH2 2.66Å; E160-R482 PolarHBondContact OE1-NH2 2.75Å; E160-R482 IonicContact OE2-CZ 3.94Å; E160-R482 IonicContact OE2-NH1 3.24Å; E160-R482 PolarHBondContact OE2-NH1 3.44Å; E160-R482 IonicContact OE2-NH2 3.01Å
161	G	90.6	Very high	91.7	Very high	20 Å²	20	36.7 Å²	36.7	21%	0.206	21%	0.206	C	C	.	.	H	α-helix	trans	60.3	-136.9	173.6	0	0	0	0	0	114.9	L165	G161-L165 PolarHBondContact O-N 3.37Å; G161-L165 VanDerWaalsContact O-N 3.1Å
162	E	90.7	Very high	91.3	Very high	160 Å²	160	39.5 Å²	39.5	75%	0.748	20%	0.197	S	C	*	.	H	α-helix	trans	-68.4	-36.4	-177.8	-68	-173.2	170.2	0	0	113	W164 L165 N166	E162-W164 VanDerWaalsContact C-N 3.33Å; E162-W164 PolarHBondContact O-N 3.22Å; E162-L165 PolarHBondContact O-N 3.03Å; E162-L165 VanDerWaalsContact O-N 3.14Å; E162-N166 WeakPolarHBondContact O-CB 3.48Å; E162-N166 VanDerWaalsContact O-CG 3.29Å; E162-N166 PolarHBondContact O-N 2.87Å; E162-N166 PolarHBondContact O-ND2 3.35Å
163	E	91	Very high	90.6	Very high	82 Å²	82	40.8 Å²	40.8	38%	0.383	21%	0.206	S	C	.	.	H	α-helix	trans	-57.7	-49.3	175.7	-178.1	-178	-172.9	0	0	110.1	T154 A159 L165 N166 M167	T154-E163 PolarHBondContact OG1-OE1 3.04Å; A159-E163 HydrophobicContact CB-CG 4.23Å; E163-L165 PolarHBondContact O-N 3.43Å; E163-N166 PolarHBondContact O-N 2.96Å; E163-M167 HydrophobicContact CG-CE 3.72Å; E163-M167 WeakPolarHBondContact O-CG 3.45Å; E163-M167 PolarHBondContact O-N 3.42Å; E163-M167 VanDerWaalsContact O-N 3.1Å
164	W	94.2	Very high	89.9	Confident	4 Å²	4	40.6 Å²	40.6	2%	0.015	20%	0.202	C	C	.	.	H	α-helix	trans	-58.7	-45.4	173.9	173.2	79	0	0	0	112.4	A134 L156 A159 E160 E162 N166 M167 R168 I481 R482	A134-W164 HydrophobicContact CB-CE3 4.49Å; L156-W164 VanDerWaalsContact O-CD1 3.26Å; A159-W164 HydrophobicContact CB-CB 3.88Å; E160-W164 PolarHBondContact O-N 3.22Å; E162-W164 VanDerWaalsContact C-N 3.33Å; E162-W164 PolarHBondContact O-N 3.22Å; W164-N166 VanDerWaalsContact C-N 3.32Å; W164-N166 PolarHBondContact O-N 3.39Å; W164-M167 PolarHBondContact O-N 3.43Å; W164-R168 HydrophobicContact CD2-CB 4.43Å; W164-R168 HydrophobicContact CH2-CB 4.42Å; W164-R168 HydrophobicContact CH2-CG 4.01Å; W164-R168 HydrophobicContact CZ2-CB 4.02Å; W164-R168 HydrophobicContact CZ2-CG 3.68Å; W164-R168 WeakPolarHBondContact O-CB 3.44Å; W164-R168 PolarHBondContact O-N 2.79Å; W164-I481 HydrophobicContact CH2-CB 4.44Å; W164-I481 HydrophobicContact CH2-CD1 3.96Å; W164-I481 HydrophobicContact CH2-CG1 4.08Å; W164-I481 HydrophobicContact CZ3-CD1 4.04Å; W164-R482 VanDerWaalsContact CE2-CD 3.45Å; W164-R482 VanDerWaalsContact CE2-NE 3.33Å; W164-R482 HydrophobicContact CH2-CB 3.84Å; W164-R482 HydrophobicContact CH2-CG 4.06Å; W164-R482 HydrophobicContact CZ2-CB 3.59Å; W164-R482 VanDerWaalsContact CZ2-CD 3.45Å; W164-R482 HydrophobicContact CZ2-CG 3.36Å; W164-R482 VanDerWaalsContact NE1-NE 3.17Å
165	L	92.9	Very high	89.4	Confident	58 Å²	58	40 Å²	40	30%	0.304	20%	0.199	S	C	.	.	H	α-helix	trans	-64.2	-38.3	-176.7	-175.1	63.2	0	0	0	111.9	G161 E162 E163 S169	G161-L165 PolarHBondContact O-N 3.37Å; G161-L165 VanDerWaalsContact O-N 3.1Å; E162-L165 PolarHBondContact O-N 3.03Å; E162-L165 VanDerWaalsContact O-N 3.14Å; E163-L165 PolarHBondContact O-N 3.43Å; L165-S169 VanDerWaalsContact O-CB 3.25Å; L165-S169 WeakPolarHBondContact O-CB 3.29Å; L165-S169 PolarHBondContact O-N 3.45Å; L165-S169 PolarHBondContact O-OG 2.99Å
166	N	91.3	Very high	88.8	Confident	106 Å²	106	42.7 Å²	42.7	57%	0.567	21%	0.212	S	C	*	.	H	α-helix	trans	-64.6	-54.2	175.9	-71.3	-20.5	0	0	0	110.8	E162 E163 W164 R168 S169 V170	E162-N166 WeakPolarHBondContact O-CB 3.48Å; E162-N166 VanDerWaalsContact O-CG 3.29Å; E162-N166 PolarHBondContact O-N 2.87Å; E162-N166 PolarHBondContact O-ND2 3.35Å; E163-N166 PolarHBondContact O-N 2.96Å; W164-N166 VanDerWaalsContact C-N 3.32Å; W164-N166 PolarHBondContact O-N 3.39Å; N166-R168 VanDerWaalsContact C-N 3.3Å; N166-R168 PolarHBondContact O-N 3.05Å; N166-S169 PolarHBondContact O-N 3.06Å; N166-S169 VanDerWaalsContact O-N 3.1Å; N166-V170 PolarHBondContact O-N 2.81Å
167	M	92	Very high	88.4	Confident	2 Å²	2	47 Å²	47	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-57.1	-44.8	176.8	-67.4	-177.7	-171.5	0	0	111.6	T154 L156 A159 E163 W164 S169 V170 L171 L331 E335	T154-M167 WeakPolarHBondContact O-CE 3.49Å; L156-M167 HydrophobicContact CD1-CB 4Å; A159-M167 HydrophobicContact CB-SD 4.1Å; E163-M167 HydrophobicContact CG-CE 3.72Å; E163-M167 WeakPolarHBondContact O-CG 3.45Å; E163-M167 PolarHBondContact O-N 3.42Å; E163-M167 VanDerWaalsContact O-N 3.1Å; W164-M167 PolarHBondContact O-N 3.43Å; M167-S169 VanDerWaalsContact C-N 3.3Å; M167-S169 PolarHBondContact O-N 3.23Å; M167-V170 PolarHBondContact O-N 3.21Å; M167-L171 WeakPolarHBondContact O-CB 3.29Å; M167-L171 WeakPolarHBondContact O-CG 3.33Å; M167-L171 PolarHBondContact O-N 3.25Å; M167-L331 HydrophobicContact CG-CD2 4.3Å; M167-E335 HydrophobicContact CE-CG 3.93Å
168	R	93.1	Very high	88	Confident	12 Å²	12	49.4 Å²	49.4	5%	0.045	25%	0.246	C	C	.	.	H	α-helix	trans	-61	-39.5	178.3	-177.9	61.5	171.9	-163.2	-0.9	111.8	L156 W164 N166 R172 I481 S483 I485	L156-R168 HydrophobicContact CD1-CB 3.86Å; W164-R168 HydrophobicContact CD2-CB 4.43Å; W164-R168 HydrophobicContact CH2-CB 4.42Å; W164-R168 HydrophobicContact CH2-CG 4.01Å; W164-R168 HydrophobicContact CZ2-CB 4.02Å; W164-R168 HydrophobicContact CZ2-CG 3.68Å; W164-R168 WeakPolarHBondContact O-CB 3.44Å; W164-R168 PolarHBondContact O-N 2.79Å; N166-R168 VanDerWaalsContact C-N 3.3Å; N166-R168 PolarHBondContact O-N 3.05Å; R168-R172 WeakPolarHBondContact O-CB 3.47Å; R168-R172 VanDerWaalsContact O-CG 3.29Å; R168-R172 WeakPolarHBondContact O-CG 3.28Å; R168-R172 PolarHBondContact O-N 2.84Å; R168-I481 PolarHBondContact NE-O 3.17Å; R168-I481 PolarHBondContact NH2-O 3.04Å; R168-S483 PolarHBondContact NH1-O 3.43Å; R168-S483 VanDerWaalsContact NH1-O 3.14Å; R168-S483 PolarHBondContact NH2-O 3.25Å; R168-I485 VanDerWaalsContact NH1-CG1 3.27Å
169	S	90.4	Very high	87.7	Confident	34 Å²	34	57.3 Å²	57.3	24%	0.238	28%	0.275	C	S	.	.	H	α-helix	trans	-70.1	-32	-177.3	-67.4	0	0	0	0	113.2	L165 N166 M167 R172 Q173	L165-S169 VanDerWaalsContact O-CB 3.25Å; L165-S169 WeakPolarHBondContact O-CB 3.29Å; L165-S169 PolarHBondContact O-N 3.45Å; L165-S169 PolarHBondContact O-OG 2.99Å; N166-S169 PolarHBondContact O-N 3.06Å; N166-S169 VanDerWaalsContact O-N 3.1Å; M167-S169 VanDerWaalsContact C-N 3.3Å; M167-S169 PolarHBondContact O-N 3.23Å; S169-R172 WeakPolarHBondContact O-CG 3.34Å; S169-Q173 WeakPolarHBondContact O-CG 3.39Å; S169-Q173 PolarHBondContact O-NE2 3.15Å; S169-Q173 VanDerWaalsContact O-NE2 3.16Å
170	V	88.2	Confident	87.2	Confident	23 Å²	23	58.9 Å²	58.9	14%	0.139	28%	0.284	C	S	.	.	H	α-helix	trans	-72.1	-60.8	171.5	174.8	0	0	0	0	109.6	N166 M167 R172 Q173 E330 L331	N166-V170 PolarHBondContact O-N 2.81Å; M167-V170 PolarHBondContact O-N 3.21Å; V170-R172 VanDerWaalsContact C-N 3.32Å; V170-R172 PolarHBondContact O-N 2.82Å; V170-Q173 WeakPolarHBondContact O-CB 3.25Å; V170-Q173 PolarHBondContact O-N 3.1Å; V170-Q173 VanDerWaalsContact O-N 3.1Å; V170-E330 HydrophobicContact CG1-CB 4.25Å; V170-E330 WeakPolarHBondContact CG1-OE2 3.25Å; V170-E330 HydrophobicContact CG2-CB 4.13Å; V170-L331 HydrophobicContact CG1-CD1 4.35Å; V170-L331 HydrophobicContact CG1-CG 4.32Å
171	L	87.9	Confident	86.8	Confident	1 Å²	1	57 Å²	57	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-63.1	-34	-171.6	-65.6	174.2	0	0	0	113.3	L156 M167 Q173 L174 I175 M325 L331 N339 M343 I485	L156-L171 HydrophobicContact CB-CD1 4.26Å; L156-L171 HydrophobicContact CD1-CD1 4.38Å; L156-L171 HydrophobicContact CD2-CD1 4.09Å; L156-L171 HydrophobicContact CG-CD1 4.48Å; M167-L171 WeakPolarHBondContact O-CB 3.29Å; M167-L171 WeakPolarHBondContact O-CG 3.33Å; M167-L171 PolarHBondContact O-N 3.25Å; L171-Q173 PolarHBondContact O-N 2.95Å; L171-Q173 VanDerWaalsContact O-N 3.12Å; L171-L174 PolarHBondContact O-N 2.8Å; L171-I175 WeakPolarHBondContact O-CG1 3.33Å; L171-I175 PolarHBondContact O-N 3.01Å; L171-M325 HydrophobicContact CD2-SD 3.64Å; L171-L331 HydrophobicContact CD2-CD1 4.4Å; L171-N339 HydrophobicContact CD1-CB 4.48Å; L171-N339 WeakPolarHBondContact CD1-OD1 3.35Å; L171-M343 HydrophobicContact CD1-SD 4.44Å; L171-I485 HydrophobicContact CB-CD1 3.46Å; L171-I485 VanDerWaalsContact CB-CD1 3.46Å; L171-I485 HydrophobicContact CD1-CD1 4.28Å
172	R	86.9	Confident	86.6	Confident	122 Å²	122	57.5 Å²	57.5	46%	0.46	28%	0.278	S	S	.	.	H	α-helix	trans	-59.6	-27.4	178.9	73.7	-176.4	-177.9	179.4	-0.2	113.2	R168 S169 V170 L174 M176	R168-R172 WeakPolarHBondContact O-CB 3.47Å; R168-R172 VanDerWaalsContact O-CG 3.29Å; R168-R172 WeakPolarHBondContact O-CG 3.28Å; R168-R172 PolarHBondContact O-N 2.84Å; S169-R172 WeakPolarHBondContact O-CG 3.34Å; V170-R172 VanDerWaalsContact C-N 3.32Å; V170-R172 PolarHBondContact O-N 2.82Å; R172-L174 PolarHBondContact O-N 2.77Å; R172-M176 HydrophobicContact CB-CB 4.48Å; R172-M176 HydrophobicContact CB-CG 4.28Å; R172-M176 WeakPolarHBondContact O-CB 3.37Å; R172-M176 PolarHBondContact O-N 2.88Å
173	Q	80.3	Confident	86.5	Confident	88 Å²	88	54.5 Å²	54.5	41%	0.411	27%	0.27	S	S	.	.	H	α-helix	trans	-74.6	-13.3	-178.5	-59.2	-173.7	38.6	0	0	112.4	S169 V170 L171 D180	S169-Q173 WeakPolarHBondContact O-CG 3.39Å; S169-Q173 PolarHBondContact O-NE2 3.15Å; S169-Q173 VanDerWaalsContact O-NE2 3.16Å; V170-Q173 WeakPolarHBondContact O-CB 3.25Å; V170-Q173 PolarHBondContact O-N 3.1Å; V170-Q173 VanDerWaalsContact O-N 3.1Å; L171-Q173 PolarHBondContact O-N 2.95Å; L171-Q173 VanDerWaalsContact O-N 3.12Å; Q173-D180 VanDerWaalsContact O-OD2 3.06Å
174	L	78.3	Confident	86.5	Confident	26 Å²	26	51.4 Å²	51.4	14%	0.136	26%	0.255	C	S	.	.	H	α-helix	trans	-105.7	-32	-173.1	-50.7	177.8	0	0	0	112.6	L171 R172 L321 H324 M325	L171-L174 PolarHBondContact O-N 2.8Å; R172-L174 PolarHBondContact O-N 2.77Å; L174-L321 HydrophobicContact CB-CD1 3.46Å; L174-L321 VanDerWaalsContact CB-CD1 3.46Å; L174-L321 HydrophobicContact CD1-CD1 3.58Å; L174-L321 HydrophobicContact CG-CD1 4.12Å; L174-H324 WeakPolarHBondContact CD2-CD2 3.22Å; L174-H324 WeakPolarHBondContact CD2-NE2 3.44Å; L174-M325 HydrophobicContact CD1-CG 4.14Å
175	I	82.9	Confident	86.4	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-132.6	0.7	-167.8	61.7	171.8	0	0	0	116.1	L171 V181 L321 M343 I485 I489	L171-I175 WeakPolarHBondContact O-CG1 3.33Å; L171-I175 PolarHBondContact O-N 3.01Å; I175-V181 VanDerWaalsContact O-CG2 3.29Å; I175-V181 WeakPolarHBondContact O-CG2 3.33Å; I175-L321 HydrophobicContact CG2-CD1 3.79Å; I175-L321 HydrophobicContact CG2-CD2 3.74Å; I175-L321 HydrophobicContact CG2-CG 4.39Å; I175-M343 HydrophobicContact CD1-CE 3.57Å; I175-I485 HydrophobicContact CD1-CB 4.3Å; I175-I485 HydrophobicContact CD1-CD1 3.86Å; I175-I485 HydrophobicContact CD1-CG1 3.64Å; I175-I485 HydrophobicContact CD1-CG2 3.94Å; I175-I485 HydrophobicContact CG1-CD1 4.22Å; I175-I485 HydrophobicContact CG1-CG1 3.95Å; I175-I489 HydrophobicContact CB-CD1 3.92Å; I175-I489 HydrophobicContact CG2-CD1 3.88Å
176	M	81.4	Confident	86.5	Confident	56 Å²	56	53.8 Å²	53.8	28%	0.276	27%	0.269	S	S	.	.	S	Bend	trans	-106.9	-17.5	-176.6	-71.5	-114.1	-64.3	0	0	115.3	R172 I485 R488	R172-M176 HydrophobicContact CB-CB 4.48Å; R172-M176 HydrophobicContact CB-CG 4.28Å; R172-M176 WeakPolarHBondContact O-CB 3.37Å; R172-M176 PolarHBondContact O-N 2.88Å; M176-I485 HydrophobicContact CG-CG1 4Å; M176-I485 HydrophobicContact SD-CG1 4.29Å; M176-R488 WeakPolarHBondContact O-CG 3.28Å
177	R	82.9	Confident	86.6	Confident	102 Å²	102	51.7 Å²	51.7	39%	0.385	26%	0.258	S	S	.	.	S	Bend	trans	-87.9	140.9	177.8	-47.3	-174.9	-178.9	122.8	-7.9	110.2	R179 D180 V181	R177-R179 VanDerWaalsContact C-N 3.29Å; R177-R179 HydrophobicContact CB-CG 4.37Å; R177-R179 PolarHBondContact O-N 3.36Å; R177-D180 HydrophobicContact CB-CB 4.32Å; R177-D180 WeakPolarHBondContact CB-OD2 3.37Å; R177-D180 VanDerWaalsContact CD-OD2 3.25Å; R177-D180 WeakPolarHBondContact CD-OD2 3.42Å; R177-D180 WeakPolarHBondContact CG-OD2 3.28Å; R177-D180 IonicContact NH1-OD2 3.53Å; R177-D180 PolarHBondContact O-N 3.35Å; R177-V181 PolarHBondContact O-N 3.44Å
178	P	81.5	Confident	86.8	Confident	92 Å²	92	51.6 Å²	51.6	60%	0.597	26%	0.258	S	S	*	.	H	α-helix	trans	-53.3	-43.7	-179.8	-28.4	35.4	0	0	0	113.8	D180 V181 A182	P178-D180 VanDerWaalsContact C-N 3.28Å; P178-D180 PolarHBondContact O-N 3.42Å; P178-V181 PolarHBondContact O-N 3.33Å; P178-A182 PolarHBondContact O-N 3.3Å
179	R	82.8	Confident	87	Confident	168 Å²	168	51.5 Å²	51.5	63%	0.634	26%	0.258	S	S	*	.	H	α-helix	trans	-62.4	-34	178.2	76.5	-173.5	-177.5	-176.5	-2.4	113.2	R177 V181	R177-R179 VanDerWaalsContact C-N 3.29Å; R177-R179 HydrophobicContact CB-CG 4.37Å; R177-R179 PolarHBondContact O-N 3.36Å; R179-V181 VanDerWaalsContact C-N 3.26Å; R179-V181 PolarHBondContact O-N 3.22Å
180	D	80.1	Confident	87.3	Confident	33 Å²	33	54.8 Å²	54.8	18%	0.176	27%	0.268	C	S	.	.	H	α-helix	trans	-77.4	-20.6	-176.4	-55.1	-21.2	0	0	0	110.2	Q173 R177 P178 V183 F184	Q173-D180 VanDerWaalsContact O-OD2 3.06Å; R177-D180 HydrophobicContact CB-CB 4.32Å; R177-D180 WeakPolarHBondContact CB-OD2 3.37Å; R177-D180 VanDerWaalsContact CD-OD2 3.25Å; R177-D180 WeakPolarHBondContact CD-OD2 3.42Å; R177-D180 WeakPolarHBondContact CG-OD2 3.28Å; R177-D180 IonicContact NH1-OD2 3.53Å; R177-D180 PolarHBondContact O-N 3.35Å; P178-D180 VanDerWaalsContact C-N 3.28Å; P178-D180 PolarHBondContact O-N 3.42Å; D180-V183 VanDerWaalsContact O-CG2 3.25Å; D180-V183 WeakPolarHBondContact O-CG2 3.29Å; D180-F184 WeakPolarHBondContact O-CE2 3.27Å
181	V	83.1	Confident	87.8	Confident	6 Å²	6	53.7 Å²	53.7	4%	0.036	26%	0.261	C	S	.	.	H	α-helix	trans	-97.1	-27.2	177.6	173.8	0	0	0	0	112.7	I175 R177 P178 R179 V183 F184 R488 I489 L492	I175-V181 VanDerWaalsContact O-CG2 3.29Å; I175-V181 WeakPolarHBondContact O-CG2 3.33Å; R177-V181 PolarHBondContact O-N 3.44Å; P178-V181 PolarHBondContact O-N 3.33Å; R179-V181 VanDerWaalsContact C-N 3.26Å; R179-V181 PolarHBondContact O-N 3.22Å; V181-V183 PolarHBondContact O-N 2.94Å; V181-V183 VanDerWaalsContact O-N 3.16Å; V181-F184 HydrophobicContact CB-CD2 4.36Å; V181-F184 HydrophobicContact CG1-CD2 4.28Å; V181-F184 HydrophobicContact CG2-CE2 4.45Å; V181-F184 WeakPolarHBondContact O-CB 3.27Å; V181-F184 WeakPolarHBondContact O-CD2 3.32Å; V181-F184 PolarHBondContact O-N 3.5Å; V181-R488 HydrophobicContact CB-CB 4.21Å; V181-R488 HydrophobicContact CG1-CB 4.2Å; V181-R488 HydrophobicContact CG2-CB 3.71Å; V181-I489 HydrophobicContact CG1-CG1 4.31Å; V181-I489 HydrophobicContact CG2-CG1 4.22Å; V181-L492 HydrophobicContact CG1-CB 4.1Å; V181-L492 HydrophobicContact CG1-CD2 3.74Å; V181-L492 WeakPolarHBondContact O-CD2 3.45Å
182	A	87.1	Confident	88.3	Confident	31 Å²	31	53.7 Å²	53.7	26%	0.256	26%	0.261	S	S	.	.	H	α-helix	trans	-57.5	-29.8	176.6	0	0	0	0	0	113	P178 F184 S185 A388	P178-A182 PolarHBondContact O-N 3.3Å; A182-F184 PolarHBondContact O-N 3.49Å; A182-S185 WeakPolarHBondContact O-CB 3.22Å; A182-S185 PolarHBondContact O-N 2.78Å; A182-S185 VanDerWaalsContact O-N 3.08Å; A182-A388 HydrophobicContact CB-CB 3.81Å
183	V	88.6	Confident	88.9	Confident	98 Å²	98	50.6 Å²	50.6	59%	0.594	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-21.8	176.3	-54	0	0	0	0	113.5	D180 V181 S185	D180-V183 VanDerWaalsContact O-CG2 3.25Å; D180-V183 WeakPolarHBondContact O-CG2 3.29Å; V181-V183 PolarHBondContact O-N 2.94Å; V181-V183 VanDerWaalsContact O-N 3.16Å; V183-S185 VanDerWaalsContact C-N 3.3Å
184	F	90.4	Very high	89.7	Confident	16 Å²	16	48.1 Å²	48.1	7%	0.07	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-4.1	177.6	-54.1	-52	0	0	0	112.9	D180 V181 A182 D186 D187 V188 I230 L492	D180-F184 WeakPolarHBondContact O-CE2 3.27Å; V181-F184 HydrophobicContact CB-CD2 4.36Å; V181-F184 HydrophobicContact CG1-CD2 4.28Å; V181-F184 HydrophobicContact CG2-CE2 4.45Å; V181-F184 WeakPolarHBondContact O-CB 3.27Å; V181-F184 WeakPolarHBondContact O-CD2 3.32Å; V181-F184 PolarHBondContact O-N 3.5Å; A182-F184 PolarHBondContact O-N 3.49Å; F184-D186 VanDerWaalsContact C-N 3.29Å; F184-D186 PolarHBondContact O-N 3.46Å; F184-D187 PolarHBondContact O-N 3.44Å; F184-V188 WeakPolarHBondContact O-CG2 3.19Å; F184-V188 PolarHBondContact O-N 2.85Å; F184-I230 HydrophobicContact CB-CD1 3.96Å; F184-I230 HydrophobicContact CB-CG1 4.04Å; F184-I230 HydrophobicContact CD1-CG1 4.19Å; F184-I230 HydrophobicContact CD1-CG2 4.02Å; F184-I230 HydrophobicContact CD2-CD1 4.33Å; F184-I230 HydrophobicContact CD2-CG2 4.02Å; F184-I230 HydrophobicContact CE1-CG2 3.92Å; F184-I230 HydrophobicContact CE2-CG2 3.93Å; F184-I230 HydrophobicContact CG-CD1 4.13Å; F184-I230 HydrophobicContact CG-CG1 4Å; F184-I230 HydrophobicContact CG-CG2 4.09Å; F184-I230 HydrophobicContact CZ-CG2 3.88Å; F184-L492 HydrophobicContact CB-CD2 4.26Å
185	S	93.4	Very high	90.7	Very high	5 Å²	5	46.9 Å²	46.9	4%	0.035	24%	0.237	C	C	.	.	H	α-helix	trans	-55.6	-42.4	-174.9	-167.9	0	0	0	0	112.6	A182 V183 N189 T387 A388	A182-S185 WeakPolarHBondContact O-CB 3.22Å; A182-S185 PolarHBondContact O-N 2.78Å; A182-S185 VanDerWaalsContact O-N 3.08Å; V183-S185 VanDerWaalsContact C-N 3.3Å; S185-N189 WeakPolarHBondContact O-CB 3.33Å; S185-N189 PolarHBondContact O-N 3.24Å; S185-N189 PolarHBondContact O-ND2 2.95Å; S185-N189 VanDerWaalsContact O-ND2 3.14Å; S185-T387 WeakPolarHBondContact OG-CA 3.4Å; S185-A388 PolarHBondContact OG-N 3.16Å; S185-A388 VanDerWaalsContact OG-N 3.08Å
186	D	93.6	Very high	91.4	Very high	107 Å²	107	47.5 Å²	47.5	57%	0.572	24%	0.24	S	C	*	.	H	α-helix	trans	-68.6	-40.9	-179.3	-70.5	-12.2	0	0	0	111.9	F184 N189 K190	F184-D186 VanDerWaalsContact C-N 3.29Å; F184-D186 PolarHBondContact O-N 3.46Å; D186-N189 PolarHBondContact O-N 2.89Å; D186-K190 WeakPolarHBondContact O-CG 3.35Å; D186-K190 PolarHBondContact O-N 3.05Å
187	D	94	Very high	92.2	Very high	62 Å²	62	51 Å²	51	33%	0.332	25%	0.254	S	S	.	.	H	α-helix	trans	-69.5	-41.1	179.5	-66.8	-33.1	0	0	0	111.3	F184 N189 K190 V191	F184-D187 PolarHBondContact O-N 3.44Å; D187-N189 VanDerWaalsContact C-N 3.34Å; D187-N189 PolarHBondContact O-N 3.36Å; D187-K190 PolarHBondContact O-N 3.23Å; D187-K190 IonicContact OD1-NZ 2.81Å; D187-K190 PolarHBondContact OD1-NZ 3.28Å; D187-V191 WeakPolarHBondContact O-CG2 3.38Å; D187-V191 PolarHBondContact O-N 3.29Å; D187-V191 VanDerWaalsContact O-N 3.14Å
188	V	96.3	Very high	92.9	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.006	24%	0.243	C	C	.	.	H	α-helix	trans	-60.5	-44.4	171.7	174.8	0	0	0	0	110.5	F184 K190 V191 V192 I230 L492 E493 L496	F184-V188 WeakPolarHBondContact O-CG2 3.19Å; F184-V188 PolarHBondContact O-N 2.85Å; V188-K190 VanDerWaalsContact C-N 3.34Å; V188-K190 PolarHBondContact O-N 3.11Å; V188-V191 CarbonylContact O-C 3.6Å; V188-V191 WeakPolarHBondContact O-CA 3.35Å; V188-V191 WeakPolarHBondContact O-CB 3.46Å; V188-V191 PolarHBondContact O-N 3.44Å; V188-V192 HydrophobicContact CG1-CG2 4.36Å; V188-V192 WeakPolarHBondContact O-CG2 3.2Å; V188-V192 PolarHBondContact O-N 2.97Å; V188-I230 HydrophobicContact CG2-CD1 3.96Å; V188-L492 HydrophobicContact CG2-CD2 4.14Å; V188-E493 HydrophobicContact CG1-CG 4.26Å; V188-E493 HydrophobicContact CG2-CG 4.2Å; V188-L496 HydrophobicContact CB-CD1 4.04Å; V188-L496 HydrophobicContact CG1-CB 4.19Å; V188-L496 HydrophobicContact CG1-CD1 3.74Å; V188-L496 HydrophobicContact CG1-CG 4.5Å
189	N	97.3	Very high	93.7	Very high	9 Å²	9	43.8 Å²	43.8	5%	0.048	22%	0.215	C	C	.	.	H	α-helix	trans	-63.1	-36.8	178.7	-87.1	-44.8	0	0	0	113.4	S185 D186 D187 V191 V192 D193 V385 P386 R500	S185-N189 WeakPolarHBondContact O-CB 3.33Å; S185-N189 PolarHBondContact O-N 3.24Å; S185-N189 PolarHBondContact O-ND2 2.95Å; S185-N189 VanDerWaalsContact O-ND2 3.14Å; D186-N189 PolarHBondContact O-N 2.89Å; D187-N189 VanDerWaalsContact C-N 3.34Å; D187-N189 PolarHBondContact O-N 3.36Å; N189-V191 VanDerWaalsContact C-N 3.29Å; N189-V191 PolarHBondContact O-N 3.38Å; N189-V192 CarbonylContact O-C 3.59Å; N189-V192 PolarHBondContact O-N 3.36Å; N189-V192 VanDerWaalsContact O-N 3.17Å; N189-D193 PolarHBondContact O-N 3.21Å; N189-V385 HydrophobicContact CB-CG1 4.09Å; N189-P386 PolarHBondContact ND2-O 3.04Å; N189-R500 PolarHBondContact O-NH1 2.84Å; N189-R500 WeakPolarHBondContact OD1-CD 3.23Å
190	K	97.4	Very high	94.5	Very high	103 Å²	103	39.4 Å²	39.4	45%	0.448	20%	0.199	S	C	.	.	H	α-helix	trans	-61.8	-39.1	172.1	-68.3	166.3	-159.8	158.1	0	111.5	D186 D187 V188 V192 D193 D194	D186-K190 WeakPolarHBondContact O-CG 3.35Å; D186-K190 PolarHBondContact O-N 3.05Å; D187-K190 PolarHBondContact O-N 3.23Å; D187-K190 IonicContact OD1-NZ 2.81Å; D187-K190 PolarHBondContact OD1-NZ 3.28Å; V188-K190 VanDerWaalsContact C-N 3.34Å; V188-K190 PolarHBondContact O-N 3.11Å; K190-V192 VanDerWaalsContact C-N 3.34Å; K190-D193 WeakPolarHBondContact O-CB 3.38Å; K190-D193 PolarHBondContact O-N 3.19Å; K190-D194 PolarHBondContact O-N 3.24Å
191	V	98.3	Very high	95.3	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.006	20%	0.203	C	C	.	.	H	α-helix	trans	-68.1	-36.7	174.9	-179.8	0	0	0	0	110.8	D187 V188 N189 D193 D194 L195 Y222 E225 A229 L239	D187-V191 WeakPolarHBondContact O-CG2 3.38Å; D187-V191 PolarHBondContact O-N 3.29Å; D187-V191 VanDerWaalsContact O-N 3.14Å; V188-V191 CarbonylContact O-C 3.6Å; V188-V191 WeakPolarHBondContact O-CA 3.35Å; V188-V191 WeakPolarHBondContact O-CB 3.46Å; V188-V191 PolarHBondContact O-N 3.44Å; N189-V191 VanDerWaalsContact C-N 3.29Å; N189-V191 PolarHBondContact O-N 3.38Å; V191-D193 VanDerWaalsContact C-N 3.34Å; V191-D193 PolarHBondContact O-N 3.06Å; V191-D194 PolarHBondContact O-N 3.35Å; V191-L195 PolarHBondContact O-N 2.93Å; V191-Y222 HydrophobicContact CB-CE2 4.35Å; V191-Y222 HydrophobicContact CG1-CD2 3.66Å; V191-Y222 HydrophobicContact CG1-CE2 3.71Å; V191-E225 HydrophobicContact CG1-CB 3.8Å; V191-E225 HydrophobicContact CG1-CG 3.7Å; V191-E225 HydrophobicContact CG2-CG 4.04Å; V191-A229 HydrophobicContact CG2-CB 4.12Å; V191-L239 HydrophobicContact CG1-CD1 4.05Å
192	V	98.3	Very high	96	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-66.3	-33.8	173.3	-179.5	0	0	0	0	112.1	V188 N189 K190 D194 L195 I196 Y222 A497 R500	V188-V192 HydrophobicContact CG1-CG2 4.36Å; V188-V192 WeakPolarHBondContact O-CG2 3.2Å; V188-V192 PolarHBondContact O-N 2.97Å; N189-V192 CarbonylContact O-C 3.59Å; N189-V192 PolarHBondContact O-N 3.36Å; N189-V192 VanDerWaalsContact O-N 3.17Å; K190-V192 VanDerWaalsContact C-N 3.34Å; V192-D194 VanDerWaalsContact C-N 3.27Å; V192-D194 PolarHBondContact O-N 2.76Å; V192-L195 WeakPolarHBondContact O-CB 3.48Å; V192-L195 PolarHBondContact O-N 2.82Å; V192-I196 HydrophobicContact CG1-CD1 4.07Å; V192-I196 HydrophobicContact CG1-CG1 4.44Å; V192-I196 WeakPolarHBondContact O-CG1 3.44Å; V192-I196 PolarHBondContact O-N 3.33Å; V192-Y222 HydrophobicContact CB-CE2 4.48Å; V192-Y222 HydrophobicContact CG2-CE2 3.67Å; V192-Y222 VanDerWaalsContact CG2-OH 3.32Å; V192-Y222 WeakPolarHBondContact CG2-OH 3.46Å; V192-A497 HydrophobicContact CG2-CB 4.24Å; V192-R500 HydrophobicContact CG1-CB 3.75Å; V192-R500 HydrophobicContact CG1-CG 4.18Å
193	D	98.1	Very high	96.4	Very high	58 Å²	58	41 Å²	41	31%	0.31	20%	0.203	S	C	.	.	H	α-helix	trans	-58.2	-44.8	171.6	-69.5	-33.8	0	0	0	110.7	N189 K190 V191 I196 K197 R500	N189-D193 PolarHBondContact O-N 3.21Å; K190-D193 WeakPolarHBondContact O-CB 3.38Å; K190-D193 PolarHBondContact O-N 3.19Å; V191-D193 VanDerWaalsContact C-N 3.34Å; V191-D193 PolarHBondContact O-N 3.06Å; D193-I196 PolarHBondContact O-N 3Å; D193-K197 WeakPolarHBondContact O-CG 3.32Å; D193-K197 PolarHBondContact O-N 2.78Å; D193-R500 IonicContact OD1-CZ 3.17Å; D193-R500 IonicContact OD1-NH1 2.91Å; D193-R500 PolarHBondContact OD1-NH1 3.11Å; D193-R500 IonicContact OD1-NH2 3.4Å; D193-R500 PolarHBondContact OD1-NH2 2.88Å
194	D	98.3	Very high	96.8	Very high	36 Å²	36	39.6 Å²	39.6	19%	0.193	20%	0.202	C	C	.	.	H	α-helix	trans	-71.7	-32.2	179.9	-63	-28.3	0	0	0	111.8	K190 V191 V192 K197 R198 R235 L239	K190-D194 PolarHBondContact O-N 3.24Å; V191-D194 PolarHBondContact O-N 3.35Å; V192-D194 VanDerWaalsContact C-N 3.27Å; V192-D194 PolarHBondContact O-N 2.76Å; D194-K197 PolarHBondContact O-N 2.75Å; D194-K197 IonicContact OD1-NZ 3.06Å; D194-K197 PolarHBondContact OD1-NZ 3.49Å; D194-R198 VanDerWaalsContact O-CB 3.27Å; D194-R198 WeakPolarHBondContact O-CB 3.43Å; D194-R198 PolarHBondContact O-N 2.86Å; D194-R235 IonicContact OD2-CZ 3.09Å; D194-R235 IonicContact OD2-NH1 3.42Å; D194-R235 PolarHBondContact OD2-NH1 3.14Å; D194-R235 IonicContact OD2-NH2 3.66Å; D194-R235 PolarHBondContact OD2-NH2 3.46Å; D194-L239 HydrophobicContact CB-CB 4.34Å; D194-L239 HydrophobicContact CB-CD1 3.9Å
195	L	98.6	Very high	97.1	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-60.4	-47.9	170	170.1	61.3	0	0	0	110.9	V191 V192 R198 V199 L218 F219 Y222 L239 A497 L501	V191-L195 PolarHBondContact O-N 2.93Å; V192-L195 WeakPolarHBondContact O-CB 3.48Å; V192-L195 PolarHBondContact O-N 2.82Å; L195-R198 WeakPolarHBondContact O-CB 3.49Å; L195-R198 PolarHBondContact O-N 2.93Å; L195-R198 VanDerWaalsContact O-N 3.14Å; L195-V199 HydrophobicContact CD1-CG2 4.45Å; L195-V199 WeakPolarHBondContact O-CG2 3.5Å; L195-V199 PolarHBondContact O-N 3.37Å; L195-L218 HydrophobicContact CD1-CD1 3.63Å; L195-L218 HydrophobicContact CD1-CD2 3.95Å; L195-L218 HydrophobicContact CD1-CG 3.66Å; L195-F219 HydrophobicContact CD2-CE1 4.4Å; L195-Y222 HydrophobicContact CB-CD2 3.81Å; L195-Y222 HydrophobicContact CB-CE2 4.41Å; L195-Y222 HydrophobicContact CD2-CD1 4.37Å; L195-Y222 HydrophobicContact CD2-CD2 3.7Å; L195-Y222 HydrophobicContact CD2-CE2 4.05Å; L195-Y222 HydrophobicContact CD2-CG 3.88Å; L195-Y222 HydrophobicContact CG-CD2 4.23Å; L195-L239 HydrophobicContact CB-CD1 4.39Å; L195-A497 HydrophobicContact CD2-CB 4.39Å; L195-L501 HydrophobicContact CD2-CD1 4.24Å; L195-L501 HydrophobicContact CD2-CD2 4.48Å
196	I	98.4	Very high	97.3	Very high	14 Å²	14	46.4 Å²	46.4	7%	0.072	23%	0.233	C	C	.	.	H	α-helix	trans	-62.8	-45.6	178.8	-70	165.3	0	0	0	110.3	V192 D193 R198 V199 Y200 R500 L501 K504 F505	V192-I196 HydrophobicContact CG1-CD1 4.07Å; V192-I196 HydrophobicContact CG1-CG1 4.44Å; V192-I196 WeakPolarHBondContact O-CG1 3.44Å; V192-I196 PolarHBondContact O-N 3.33Å; D193-I196 PolarHBondContact O-N 3Å; I196-R198 PolarHBondContact O-N 3.26Å; I196-V199 WeakPolarHBondContact O-CB 3.2Å; I196-V199 PolarHBondContact O-N 3.03Å; I196-Y200 HydrophobicContact CG2-CD2 3.9Å; I196-Y200 HydrophobicContact CG2-CE2 3.6Å; I196-Y200 WeakPolarHBondContact O-CD2 3.44Å; I196-Y200 PolarHBondContact O-N 2.66Å; I196-Y200 VanDerWaalsContact O-N 3.08Å; I196-R500 HydrophobicContact CD1-CB 4.17Å; I196-L501 HydrophobicContact CG1-CD2 4.44Å; I196-K504 HydrophobicContact CD1-CG 4.27Å; I196-F505 HydrophobicContact CG2-CE2 4.23Å; I196-F505 HydrophobicContact CG2-CZ 4.27Å
197	K	98	Very high	97.4	Very high	128 Å²	128	47.6 Å²	47.6	56%	0.557	25%	0.247	S	C	*	.	H	α-helix	trans	-57.7	-40	173.6	-69.2	171.3	-159.2	157.5	0	111.6	D193 D194 Y200 S201	D193-K197 WeakPolarHBondContact O-CG 3.32Å; D193-K197 PolarHBondContact O-N 2.78Å; D194-K197 PolarHBondContact O-N 2.75Å; D194-K197 IonicContact OD1-NZ 3.06Å; D194-K197 PolarHBondContact OD1-NZ 3.49Å; K197-Y200 WeakPolarHBondContact O-CB 3.44Å; K197-Y200 PolarHBondContact O-N 3.3Å; K197-S201 PolarHBondContact O-N 2.95Å
198	R	98.1	Very high	97.5	Very high	44 Å²	44	47.5 Å²	47.5	17%	0.166	25%	0.246	C	C	.	.	H	α-helix	trans	-66.5	-39.9	178.2	-173.2	54	169.3	172	-3.9	111.8	D194 L195 I196 S201 L202 L218 L239 N241	D194-R198 VanDerWaalsContact O-CB 3.27Å; D194-R198 WeakPolarHBondContact O-CB 3.43Å; D194-R198 PolarHBondContact O-N 2.86Å; L195-R198 WeakPolarHBondContact O-CB 3.49Å; L195-R198 PolarHBondContact O-N 2.93Å; L195-R198 VanDerWaalsContact O-N 3.14Å; I196-R198 PolarHBondContact O-N 3.26Å; R198-S201 PolarHBondContact O-N 3.43Å; R198-L202 HydrophobicContact CG-CD1 3.98Å; R198-L202 HydrophobicContact CG-CG 4.31Å; R198-L202 WeakPolarHBondContact O-CB 3.44Å; R198-L202 VanDerWaalsContact O-CG 3.3Å; R198-L202 WeakPolarHBondContact O-CG 3.27Å; R198-L202 PolarHBondContact O-N 2.89Å; R198-L218 HydrophobicContact CB-CD1 4.09Å; R198-L218 HydrophobicContact CG-CD1 3.55Å; R198-L239 HydrophobicContact CB-CD2 4.35Å; R198-L239 WeakPolarHBondContact CD-O 3.49Å; R198-L239 HydrophobicContact CG-CD2 4.28Å; R198-N241 PolarHBondContact NH1-OD1 3.38Å
199	V	98.4	Very high	97.5	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-56.5	-50.2	172	169.6	0	0	0	0	110.7	L195 I196 S201 L202 R203 V212 L218 L501 F505 F534	L195-V199 HydrophobicContact CD1-CG2 4.45Å; L195-V199 WeakPolarHBondContact O-CG2 3.5Å; L195-V199 PolarHBondContact O-N 3.37Å; I196-V199 WeakPolarHBondContact O-CB 3.2Å; I196-V199 PolarHBondContact O-N 3.03Å; V199-S201 VanDerWaalsContact C-N 3.33Å; V199-S201 PolarHBondContact O-N 3.12Å; V199-L202 PolarHBondContact O-N 3.36Å; V199-R203 WeakPolarHBondContact O-CG 3.32Å; V199-R203 PolarHBondContact O-N 3.14Å; V199-V212 HydrophobicContact CG1-CG2 4.18Å; V199-L218 HydrophobicContact CG2-CD2 3.64Å; V199-L501 HydrophobicContact CG2-CD2 4.5Å; V199-F505 HydrophobicContact CB-CE2 4.46Å; V199-F505 HydrophobicContact CB-CZ 4.46Å; V199-F505 HydrophobicContact CG1-CE1 4.36Å; V199-F505 HydrophobicContact CG1-CE2 4Å; V199-F505 HydrophobicContact CG1-CZ 3.85Å; V199-F534 HydrophobicContact CG1-CB 3.67Å; V199-F534 HydrophobicContact CG1-CD1 3.84Å; V199-F534 HydrophobicContact CG1-CD2 4.08Å; V199-F534 HydrophobicContact CG1-CE1 4.5Å; V199-F534 HydrophobicContact CG1-CG 3.6Å; V199-F534 HydrophobicContact CG2-CE1 4.45Å
200	Y	97.9	Very high	97.5	Very high	75 Å²	75	56 Å²	56	29%	0.294	29%	0.287	S	S	.	.	H	α-helix	trans	-56.9	-45.2	175.8	-79.6	-69.2	0	0	0	112.5	I196 K197 L202 R203 A204 F505 E536	I196-Y200 HydrophobicContact CG2-CD2 3.9Å; I196-Y200 HydrophobicContact CG2-CE2 3.6Å; I196-Y200 WeakPolarHBondContact O-CD2 3.44Å; I196-Y200 PolarHBondContact O-N 2.66Å; I196-Y200 VanDerWaalsContact O-N 3.08Å; K197-Y200 WeakPolarHBondContact O-CB 3.44Å; K197-Y200 PolarHBondContact O-N 3.3Å; Y200-L202 PolarHBondContact O-N 3.27Å; Y200-R203 VanDerWaalsContact CD1-CZ 3.46Å; Y200-R203 VanDerWaalsContact CE1-NH2 3.32Å; Y200-R203 WeakPolarHBondContact O-CG 3.44Å; Y200-A204 WeakPolarHBondContact O-CB 3.16Å; Y200-A204 PolarHBondContact O-N 3.21Å; Y200-F505 HydrophobicContact CD2-CZ 4.34Å; Y200-F505 HydrophobicContact CE1-CE1 4.22Å; Y200-F505 HydrophobicContact CE1-CZ 4.41Å; Y200-F505 HydrophobicContact CE2-CE1 4.4Å; Y200-F505 AromaticContact CE2-CZ 3.85Å; Y200-F505 HydrophobicContact CE2-CZ 3.85Å; Y200-F505 AromaticContact CZ-CE1 3.97Å; Y200-F505 AromaticContact CZ-CZ 3.89Å; Y200-E536 HydrophobicContact CE1-CG 4.34Å; Y200-E536 VanDerWaalsContact CE1-OE1 3.29Å; Y200-E536 WeakPolarHBondContact CE1-OE1 3.29Å
201	S	97.6	Very high	97.6	Very high	37 Å²	37	51.2 Å²	51.2	26%	0.259	27%	0.267	S	S	.	.	H	α-helix	trans	-65.4	-37.8	179.6	179.9	0	0	0	0	113	K197 R198 V199 Q205 N241	K197-S201 PolarHBondContact O-N 2.95Å; R198-S201 PolarHBondContact O-N 3.43Å; V199-S201 VanDerWaalsContact C-N 3.33Å; V199-S201 PolarHBondContact O-N 3.12Å; S201-Q205 WeakPolarHBondContact O-CG 3.49Å; S201-Q205 PolarHBondContact O-NE2 3.3Å; S201-Q205 VanDerWaalsContact O-NE2 3.09Å; S201-N241 PolarHBondContact OG-OD1 3.01Å
202	L	97.6	Very high	97.6	Very high	32 Å²	32	51.2 Å²	51.2	17%	0.168	27%	0.266	C	S	.	.	H	α-helix	trans	-76.3	-41.6	-178.3	-71.7	174.3	0	0	0	111.6	R198 V199 Y200 A204 Q205 V212 L218	R198-L202 HydrophobicContact CG-CD1 3.98Å; R198-L202 HydrophobicContact CG-CG 4.31Å; R198-L202 WeakPolarHBondContact O-CB 3.44Å; R198-L202 VanDerWaalsContact O-CG 3.3Å; R198-L202 WeakPolarHBondContact O-CG 3.27Å; R198-L202 PolarHBondContact O-N 2.89Å; V199-L202 PolarHBondContact O-N 3.36Å; Y200-L202 PolarHBondContact O-N 3.27Å; L202-A204 VanDerWaalsContact C-N 3.33Å; L202-A204 PolarHBondContact O-N 2.79Å; L202-Q205 WeakPolarHBondContact O-CB 3.25Å; L202-Q205 PolarHBondContact O-N 3.34Å; L202-V212 HydrophobicContact CB-CG1 4.11Å; L202-V212 HydrophobicContact CB-CG2 4.09Å; L202-V212 HydrophobicContact CD1-CG1 3.84Å; L202-L218 HydrophobicContact CD1-CD1 3.94Å
203	R	96.7	Very high	97.6	Very high	35 Å²	35	54.7 Å²	54.7	13%	0.132	29%	0.285	C	S	.	.	H	α-helix	trans	-65.9	-36	178.7	76	176.6	-156.3	-174.7	1.2	112.5	V199 Y200 Q205 Q206 E209 T211 V212 F534 E536	V199-R203 WeakPolarHBondContact O-CG 3.32Å; V199-R203 PolarHBondContact O-N 3.14Å; Y200-R203 VanDerWaalsContact CD1-CZ 3.46Å; Y200-R203 VanDerWaalsContact CE1-NH2 3.32Å; Y200-R203 WeakPolarHBondContact O-CG 3.44Å; R203-Q205 PolarHBondContact O-N 2.84Å; R203-Q205 VanDerWaalsContact O-N 3.12Å; R203-Q206 PolarHBondContact O-N 2.96Å; R203-E209 WeakPolarHBondContact CD-O 3.38Å; R203-E209 VanDerWaalsContact CG-O 3.28Å; R203-E209 WeakPolarHBondContact CG-O 3.11Å; R203-E209 PolarHBondContact NE-O 3.36Å; R203-E209 CarbonylContact O-C 3.51Å; R203-E209 WeakPolarHBondContact O-CA 3.21Å; R203-T211 WeakPolarHBondContact CA-O 3.29Å; R203-V212 HydrophobicContact CB-CG2 4.19Å; R203-F534 PolarHBondContact NH1-O 2.96Å; R203-E536 IonicContact CZ-OE1 2.74Å; R203-E536 IonicContact NH1-OE1 3.02Å; R203-E536 PolarHBondContact NH1-OE1 3.25Å; R203-E536 IonicContact NH2-OE1 3.29Å; R203-E536 PolarHBondContact NH2-OE1 2.98Å
204	A	96.8	Very high	97.5	Very high	69 Å²	69	53.8 Å²	53.8	57%	0.57	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-13.3	177	0	0	0	0	0	113.6	Y200 L202 Q206	Y200-A204 WeakPolarHBondContact O-CB 3.16Å; Y200-A204 PolarHBondContact O-N 3.21Å; L202-A204 VanDerWaalsContact C-N 3.33Å; L202-A204 PolarHBondContact O-N 2.79Å; A204-Q206 VanDerWaalsContact C-N 3.34Å
205	Q	95.9	Very high	97.5	Very high	117 Å²	117	52 Å²	52	55%	0.547	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-9.5	174.2	-63.4	167.6	29.2	0	0	112.5	S201 L202 R203	S201-Q205 WeakPolarHBondContact O-CG 3.49Å; S201-Q205 PolarHBondContact O-NE2 3.3Å; S201-Q205 VanDerWaalsContact O-NE2 3.09Å; L202-Q205 WeakPolarHBondContact O-CB 3.25Å; L202-Q205 PolarHBondContact O-N 3.34Å; R203-Q205 PolarHBondContact O-N 2.84Å; R203-Q205 VanDerWaalsContact O-N 3.12Å
206	Q	97.2	Very high	97.4	Very high	46 Å²	46	52.9 Å²	52.9	22%	0.215	28%	0.275	C	S	.	.	S	Bend	trans	-99.1	149.3	-179.7	-59.2	-49.7	-58.5	0	0	111.5	R203 A204 D208 E209 T211	R203-Q206 PolarHBondContact O-N 2.96Å; A204-Q206 VanDerWaalsContact C-N 3.34Å; Q206-D208 PolarHBondContact O-N 3.44Å; Q206-E209 PolarHBondContact O-N 2.97Å; Q206-T211 HydrophobicContact CG-CG2 4.46Å; Q206-T211 WeakPolarHBondContact CG-O 3.49Å
207	P	95.9	Very high	97.3	Very high	132 Å²	132	56.3 Å²	56.3	86%	0.857	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-26.4	-178.7	-24.3	34.2	0	0	0	114.9	E209	P207-E209 VanDerWaalsContact C-N 3.35Å
208	D	96.3	Very high	97.3	Very high	61 Å²	61	50.5 Å²	50.5	33%	0.326	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-7.5	178.1	70.7	-9.4	0	0	0	112.9	Q206 L210 T211 Q533	Q206-D208 PolarHBondContact O-N 3.44Å; D208-L210 VanDerWaalsContact O-CG 3.3Å; D208-L210 WeakPolarHBondContact O-CG 3.49Å; D208-L210 PolarHBondContact O-N 3.19Å; D208-L210 PolarHBondContact OD1-N 3.08Å; D208-T211 WeakPolarHBondContact OD1-CB 3.47Å; D208-T211 PolarHBondContact OD1-N 3.34Å; D208-T211 PolarHBondContact OD1-OG1 2.88Å; D208-T211 WeakPolarHBondContact OD2-CB 3.3Å; D208-T211 PolarHBondContact OD2-OG1 3.06Å; D208-Q533 PolarHBondContact OD2-NE2 3.22Å; D208-Q533 VanDerWaalsContact OD2-NE2 3.07Å
209	E	97	Very high	97.3	Very high	133 Å²	133	48.4 Å²	48.4	62%	0.621	26%	0.261	S	S	*	.	S	Bend	trans	55.5	13.8	-174.4	-60.3	-175.8	-161.4	0	0	115	R203 Q206 P207	R203-E209 WeakPolarHBondContact CD-O 3.38Å; R203-E209 VanDerWaalsContact CG-O 3.28Å; R203-E209 WeakPolarHBondContact CG-O 3.11Å; R203-E209 PolarHBondContact NE-O 3.36Å; R203-E209 CarbonylContact O-C 3.51Å; R203-E209 WeakPolarHBondContact O-CA 3.21Å; Q206-E209 PolarHBondContact O-N 2.97Å; P207-E209 VanDerWaalsContact C-N 3.35Å
210	L	97.5	Very high	97.2	Very high	55 Å²	55	49.1 Å²	49.1	29%	0.288	26%	0.264	S	S	.	.			trans	-121.9	-35.1	-173.7	-66.5	174.7	0	0	0	112.1	D208 Q533 F534 I535	D208-L210 VanDerWaalsContact O-CG 3.3Å; D208-L210 WeakPolarHBondContact O-CG 3.49Å; D208-L210 PolarHBondContact O-N 3.19Å; D208-L210 PolarHBondContact OD1-N 3.08Å; L210-Q533 HydrophobicContact CB-CB 4.32Å; L210-Q533 HydrophobicContact CB-CG 4.24Å; L210-Q533 CarbonylContact O-C 3.55Å; L210-Q533 WeakPolarHBondContact O-CA 3.37Å; L210-F534 PolarHBondContact O-N 3.45Å; L210-I535 HydrophobicContact CD1-CG1 4.1Å; L210-I535 HydrophobicContact CD2-CB 4.45Å; L210-I535 HydrophobicContact CD2-CG1 3.9Å; L210-I535 HydrophobicContact CG-CG1 4.46Å
211	T	98.3	Very high	97.2	Very high	3 Å²	3	46.9 Å²	46.9	2%	0.018	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	131.7	-171.9	-69.2	0	0	0	0	112	R203 Q206 D208 L213 S510 L532 Q533	R203-T211 WeakPolarHBondContact CA-O 3.29Å; Q206-T211 HydrophobicContact CG-CG2 4.46Å; Q206-T211 WeakPolarHBondContact CG-O 3.49Å; D208-T211 WeakPolarHBondContact OD1-CB 3.47Å; D208-T211 PolarHBondContact OD1-N 3.34Å; D208-T211 PolarHBondContact OD1-OG1 2.88Å; D208-T211 WeakPolarHBondContact OD2-CB 3.3Å; D208-T211 PolarHBondContact OD2-OG1 3.06Å; T211-L213 HydrophobicContact CG2-CD2 3.77Å; T211-L213 HydrophobicContact CG2-CG 4.42Å; T211-S510 PolarHBondContact OG1-OG 3.25Å; T211-L532 CarbonylContact C-O 3.56Å; T211-L532 WeakPolarHBondContact CA-O 3.46Å; T211-Q533 WeakPolarHBondContact OG1-CG 3.31Å
212	V	98.5	Very high	97.2	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	119.4	160.5	177.6	0	0	0	0	108.2	V199 L202 R203 V215 L218 L532 F534	V199-V212 HydrophobicContact CG1-CG2 4.18Å; L202-V212 HydrophobicContact CB-CG1 4.11Å; L202-V212 HydrophobicContact CB-CG2 4.09Å; L202-V212 HydrophobicContact CD1-CG1 3.84Å; R203-V212 HydrophobicContact CB-CG2 4.19Å; V212-V215 HydrophobicContact CB-CG1 4.26Å; V212-V215 HydrophobicContact CG1-CG1 4.07Å; V212-L218 HydrophobicContact CG1-CD2 4.18Å; V212-L532 PolarHBondContact N-O 3.3Å; V212-L532 PolarHBondContact O-N 2.85Å; V212-L532 VanDerWaalsContact O-N 3.12Å; V212-F534 HydrophobicContact CB-CD2 3.95Å; V212-F534 HydrophobicContact CB-CE2 3.84Å; V212-F534 HydrophobicContact CG2-CD2 3.59Å; V212-F534 HydrophobicContact CG2-CE2 3.88Å
213	L	98	Very high	97.2	Very high	74 Å²	74	43.6 Å²	43.6	39%	0.387	24%	0.237	S	C	.	.	S	Bend	trans	-76.7	141.7	175.4	-59.5	179.3	0	0	0	110.5	T211 L512 N531	T211-L213 HydrophobicContact CG2-CD2 3.77Å; T211-L213 HydrophobicContact CG2-CG 4.42Å; L213-L512 HydrophobicContact CD2-CD1 3.66Å; L213-N531 WeakPolarHBondContact CA-OD1 3.15Å; L213-N531 HydrophobicContact CD2-CB 4.26Å
214	N	97	Very high	97.2	Very high	38 Å²	38	42 Å²	42	20%	0.203	23%	0.23	C	C	.	.			trans	45	67.9	177.3	-165.1	20.9	0	0	0	113.9	N216 D217 P529 I530 N531	N214-N216 PolarHBondContact O-N 2.75Å; N214-N216 WeakPolarHBondContact OD1-CB 3.47Å; N214-N216 PolarHBondContact OD1-OD1 3.23Å; N214-D217 PolarHBondContact ND2-OD1 3.49Å; N214-D217 PolarHBondContact ND2-OD2 3.13Å; N214-D217 PolarHBondContact O-N 3.31Å; N214-P529 HydrophobicContact CB-CB 4.19Å; N214-I530 CarbonylContact C-O 3.55Å; N214-I530 VanDerWaalsContact CA-O 3.3Å; N214-I530 WeakPolarHBondContact CA-O 3.22Å; N214-I530 PolarHBondContact N-O 3.42Å; N214-N531 PolarHBondContact N-OD1 3.46Å
215	V	98.1	Very high	97.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-59.9	-16.2	179.3	-56.4	0	0	0	0	112.9	V212 D217 L218 F219 I530 L532 F534	V212-V215 HydrophobicContact CB-CG1 4.26Å; V212-V215 HydrophobicContact CG1-CG1 4.07Å; V215-D217 VanDerWaalsContact C-N 3.34Å; V215-D217 PolarHBondContact O-N 2.95Å; V215-L218 WeakPolarHBondContact O-CB 3.35Å; V215-L218 PolarHBondContact O-N 2.9Å; V215-F219 HydrophobicContact CB-CD2 4.14Å; V215-F219 HydrophobicContact CB-CE2 3.9Å; V215-F219 HydrophobicContact CG2-CD2 4.22Å; V215-F219 HydrophobicContact CG2-CE2 3.97Å; V215-F219 WeakPolarHBondContact O-CD2 3.24Å; V215-F219 PolarHBondContact O-N 3.43Å; V215-I530 HydrophobicContact CG2-CB 3.87Å; V215-I530 HydrophobicContact CG2-CG2 3.73Å; V215-I530 WeakPolarHBondContact CG2-O 3.3Å; V215-I530 PolarHBondContact N-O 2.97Å; V215-L532 HydrophobicContact CG1-CB 4.02Å; V215-L532 HydrophobicContact CG1-CD1 4.13Å; V215-L532 HydrophobicContact CG1-CG 4.08Å; V215-L532 HydrophobicContact CG2-CD1 3.96Å; V215-L532 HydrophobicContact CG2-CG 4.32Å; V215-F534 HydrophobicContact CG1-CE2 3.97Å; V215-F534 HydrophobicContact CG1-CZ 4.34Å
216	N	96.3	Very high	97.2	Very high	18 Å²	18	33.1 Å²	33.1	10%	0.096	18%	0.178	C	C	.	.	H	α-helix	trans	-56.4	-46.2	170.6	-58.1	91	0	0	0	111.9	N214 L218 F219 F220 S356 P526 I530	N214-N216 PolarHBondContact O-N 2.75Å; N214-N216 WeakPolarHBondContact OD1-CB 3.47Å; N214-N216 PolarHBondContact OD1-OD1 3.23Å; N216-L218 VanDerWaalsContact C-N 3.34Å; N216-F219 PolarHBondContact O-N 3.39Å; N216-F220 VanDerWaalsContact O-CB 3.23Å; N216-F220 WeakPolarHBondContact O-CB 3.18Å; N216-F220 PolarHBondContact O-N 2.88Å; N216-S356 WeakPolarHBondContact ND2-CB 3.19Å; N216-S356 PolarHBondContact ND2-OG 3.35Å; N216-P526 VanDerWaalsContact ND2-CG 3.34Å; N216-P526 WeakPolarHBondContact ND2-CG 3.46Å; N216-I530 PolarHBondContact OD1-N 3.45Å; N216-I530 VanDerWaalsContact OD1-N 3.14Å
217	D	95.9	Very high	97.1	Very high	85 Å²	85	31.6 Å²	31.6	46%	0.455	17%	0.171	S	C	.	.	H	α-helix	trans	-69.5	-35.4	179.1	-66.6	-9.1	0	0	0	111.2	N214 V215 F220 N221	N214-D217 PolarHBondContact ND2-OD1 3.49Å; N214-D217 PolarHBondContact ND2-OD2 3.13Å; N214-D217 PolarHBondContact O-N 3.31Å; V215-D217 VanDerWaalsContact C-N 3.34Å; V215-D217 PolarHBondContact O-N 2.95Å; D217-F220 PolarHBondContact O-N 2.74Å; D217-N221 PolarHBondContact O-N 2.94Å; D217-N221 PolarHBondContact O-ND2 3.1Å
218	L	98	Very high	97.1	Very high	6 Å²	6	25.3 Å²	25.3	3%	0.031	13%	0.131	C	C	.	.	H	α-helix	trans	-60.6	-51.6	174.6	175.3	64.3	0	0	0	110.8	L195 R198 V199 L202 V212 V215 N216 F220 N221 Y222 L239	L195-L218 HydrophobicContact CD1-CD1 3.63Å; L195-L218 HydrophobicContact CD1-CD2 3.95Å; L195-L218 HydrophobicContact CD1-CG 3.66Å; R198-L218 HydrophobicContact CB-CD1 4.09Å; R198-L218 HydrophobicContact CG-CD1 3.55Å; V199-L218 HydrophobicContact CG2-CD2 3.64Å; L202-L218 HydrophobicContact CD1-CD1 3.94Å; V212-L218 HydrophobicContact CG1-CD2 4.18Å; V215-L218 WeakPolarHBondContact O-CB 3.35Å; V215-L218 PolarHBondContact O-N 2.9Å; N216-L218 VanDerWaalsContact C-N 3.34Å; L218-F220 VanDerWaalsContact C-N 3.33Å; L218-N221 PolarHBondContact O-N 3.38Å; L218-Y222 PolarHBondContact O-N 2.98Å; L218-L239 HydrophobicContact CD1-CD2 4.45Å
219	F	98.6	Very high	97.1	Very high	1 Å²	1	23 Å²	23	0%	0.004	12%	0.119	C	C	.	.	H	α-helix	trans	-72.1	-27.8	-178.9	-66.9	-51.2	0	0	0	112.8	L195 V215 N216 Y222 A223 S352 L355 C359 L501	L195-F219 HydrophobicContact CD2-CE1 4.4Å; V215-F219 HydrophobicContact CB-CD2 4.14Å; V215-F219 HydrophobicContact CB-CE2 3.9Å; V215-F219 HydrophobicContact CG2-CD2 4.22Å; V215-F219 HydrophobicContact CG2-CE2 3.97Å; V215-F219 WeakPolarHBondContact O-CD2 3.24Å; V215-F219 PolarHBondContact O-N 3.43Å; N216-F219 PolarHBondContact O-N 3.39Å; F219-Y222 PolarHBondContact O-N 2.82Å; F219-A223 WeakPolarHBondContact O-CB 3.04Å; F219-A223 PolarHBondContact O-N 3.1Å; F219-S352 VanDerWaalsContact C-CB 3.44Å; F219-S352 WeakPolarHBondContact O-CB 3.31Å; F219-L355 HydrophobicContact CB-CB 4.07Å; F219-L355 HydrophobicContact CB-CD1 4.41Å; F219-L355 HydrophobicContact CD1-CB 3.79Å; F219-L355 HydrophobicContact CD1-CD1 3.88Å; F219-L355 HydrophobicContact CD1-CG 4.41Å; F219-L355 HydrophobicContact CD2-CB 3.96Å; F219-L355 HydrophobicContact CE1-CB 4.21Å; F219-L355 HydrophobicContact CE2-CB 4.35Å; F219-L355 HydrophobicContact CG-CB 3.67Å; F219-L355 HydrophobicContact CG-CD1 4.33Å; F219-L355 HydrophobicContact CZ-CB 4.47Å; F219-C359 HydrophobicContact CE2-CB 4.14Å; F219-C359 HydrophobicContact CZ-CB 4.29Å; F219-C359 VanDerWaalsContact CZ-SG 3.51Å; F219-L501 HydrophobicContact CE1-CD1 3.9Å; F219-L501 HydrophobicContact CZ-CD1 4.18Å
220	F	97	Very high	96.9	Very high	14 Å²	14	16.8 Å²	16.8	6%	0.061	9%	0.091	C	C	.	.	H	α-helix	trans	-61.2	-49.9	170.3	175.7	-81.9	0	0	0	110.9	N216 D217 L218 Y222 A223 M224 I251 L254 V348 D349 S352	N216-F220 VanDerWaalsContact O-CB 3.23Å; N216-F220 WeakPolarHBondContact O-CB 3.18Å; N216-F220 PolarHBondContact O-N 2.88Å; D217-F220 PolarHBondContact O-N 2.74Å; L218-F220 VanDerWaalsContact C-N 3.33Å; F220-Y222 VanDerWaalsContact C-N 3.33Å; F220-Y222 PolarHBondContact O-N 3.33Å; F220-A223 PolarHBondContact O-N 3.43Å; F220-M224 HydrophobicContact CE1-SD 4.33Å; F220-M224 WeakPolarHBondContact O-CB 3.44Å; F220-M224 PolarHBondContact O-N 3.17Å; F220-I251 HydrophobicContact CE1-CD1 4.11Å; F220-I251 HydrophobicContact CE1-CG1 3.86Å; F220-I251 HydrophobicContact CE1-CG2 4.03Å; F220-I251 HydrophobicContact CZ-CG1 4.32Å; F220-I251 HydrophobicContact CZ-CG2 4.19Å; F220-L254 HydrophobicContact CE2-CD2 3.78Å; F220-L254 HydrophobicContact CZ-CD2 3.77Å; F220-V348 HydrophobicContact CD1-CG1 4.36Å; F220-V348 HydrophobicContact CD2-CG1 3.5Å; F220-V348 HydrophobicContact CE1-CG1 4.2Å; F220-V348 HydrophobicContact CE2-CG1 3.33Å; F220-V348 HydrophobicContact CG-CG1 4.03Å; F220-V348 HydrophobicContact CZ-CG1 3.72Å; F220-D349 WeakPolarHBondContact CD2-OD1 3.33Å; F220-D349 VanDerWaalsContact CE2-OD1 3.24Å; F220-D349 WeakPolarHBondContact CE2-OD1 3.36Å; F220-S352 VanDerWaalsContact CA-CB 3.48Å
221	N	96.9	Very high	96.7	Very high	29 Å²	29	14.4 Å²	14.4	16%	0.155	8%	0.078	C	C	.	.	H	α-helix	trans	-64.1	-38.6	177.7	-73.3	-47.9	0	0	0	112	D217 L218 E225 C238 L239	D217-N221 PolarHBondContact O-N 2.94Å; D217-N221 PolarHBondContact O-ND2 3.1Å; L218-N221 PolarHBondContact O-N 3.38Å; N221-E225 WeakPolarHBondContact O-CB 3.34Å; N221-E225 PolarHBondContact O-N 3.21Å; N221-C238 HydrophobicContact CB-CB 3.99Å; N221-L239 HydrophobicContact CB-CD2 3.95Å
222	Y	98.2	Very high	96.5	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-61.9	-50.5	174.1	167.6	-102.8	0	0	0	112.5	V191 V192 L195 L218 F219 F220 M224 E225 G226 L355 E493 A497	V191-Y222 HydrophobicContact CB-CE2 4.35Å; V191-Y222 HydrophobicContact CG1-CD2 3.66Å; V191-Y222 HydrophobicContact CG1-CE2 3.71Å; V192-Y222 HydrophobicContact CB-CE2 4.48Å; V192-Y222 HydrophobicContact CG2-CE2 3.67Å; V192-Y222 VanDerWaalsContact CG2-OH 3.32Å; V192-Y222 WeakPolarHBondContact CG2-OH 3.46Å; L195-Y222 HydrophobicContact CB-CD2 3.81Å; L195-Y222 HydrophobicContact CB-CE2 4.41Å; L195-Y222 HydrophobicContact CD2-CD1 4.37Å; L195-Y222 HydrophobicContact CD2-CD2 3.7Å; L195-Y222 HydrophobicContact CD2-CE2 4.05Å; L195-Y222 HydrophobicContact CD2-CG 3.88Å; L195-Y222 HydrophobicContact CG-CD2 4.23Å; L218-Y222 PolarHBondContact O-N 2.98Å; F219-Y222 PolarHBondContact O-N 2.82Å; F220-Y222 VanDerWaalsContact C-N 3.33Å; F220-Y222 PolarHBondContact O-N 3.33Å; Y222-M224 VanDerWaalsContact C-N 3.31Å; Y222-M224 PolarHBondContact O-N 2.98Å; Y222-E225 PolarHBondContact O-N 2.83Å; Y222-G226 PolarHBondContact O-N 2.82Å; Y222-L355 HydrophobicContact CD1-CD1 3.54Å; Y222-L355 HydrophobicContact CE1-CD1 3.61Å; Y222-E493 PolarHBondContact OH-O 2.96Å; Y222-A497 HydrophobicContact CE1-CB 3.91Å
223	A	97.8	Very high	96.2	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-62.9	-39.9	-179.8	0	0	0	0	0	111.4	F219 F220 G226 V227 V348 T351	F219-A223 WeakPolarHBondContact O-CB 3.04Å; F219-A223 PolarHBondContact O-N 3.1Å; F220-A223 PolarHBondContact O-N 3.43Å; A223-G226 PolarHBondContact O-N 2.76Å; A223-V227 WeakPolarHBondContact O-CB 3.47Å; A223-V227 WeakPolarHBondContact O-CG2 3.14Å; A223-V227 PolarHBondContact O-N 3.07Å; A223-V348 VanDerWaalsContact CB-O 3.25Å; A223-V348 WeakPolarHBondContact CB-O 3.42Å; A223-T351 HydrophobicContact CB-CG2 4.19Å
224	M	96.1	Very high	96	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-62.3	-45.3	174.7	-173	175.7	173.6	0	0	112.3	F220 Y222 A228 L236 T247 Y250 I251 F295 V348	F220-M224 HydrophobicContact CE1-SD 4.33Å; F220-M224 WeakPolarHBondContact O-CB 3.44Å; F220-M224 PolarHBondContact O-N 3.17Å; Y222-M224 VanDerWaalsContact C-N 3.31Å; Y222-M224 PolarHBondContact O-N 2.98Å; M224-A228 WeakPolarHBondContact O-CB 3.31Å; M224-A228 PolarHBondContact O-N 3.21Å; M224-L236 HydrophobicContact CE-CD1 3.8Å; M224-L236 HydrophobicContact CG-CD1 4.03Å; M224-T247 HydrophobicContact CE-CG2 3.67Å; M224-T247 HydrophobicContact SD-CG2 4.26Å; M224-Y250 HydrophobicContact CE-CD1 3.16Å; M224-Y250 HydrophobicContact CE-CE1 3.78Å; M224-Y250 HydrophobicContact CE-CG 3.84Å; M224-Y250 HydrophobicContact SD-CD1 3.91Å; M224-Y250 HydrophobicContact SD-CE1 4.17Å; M224-I251 HydrophobicContact CE-CG1 4.28Å; M224-I251 HydrophobicContact SD-CD1 4.16Å; M224-I251 HydrophobicContact SD-CG1 3.79Å; M224-F295 HydrophobicContact CE-CZ 4.18Å; M224-V348 HydrophobicContact CB-CG1 4.13Å; M224-V348 HydrophobicContact CB-CG2 3.99Å; M224-V348 HydrophobicContact CG-CG2 4.15Å
225	E	97.3	Very high	95.9	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-64.3	-43.7	177.3	-168.2	73.9	-160.3	0	0	111.9	V191 N221 Y222 A228 A229 R235 L236 G237 C238 L239	V191-E225 HydrophobicContact CG1-CB 3.8Å; V191-E225 HydrophobicContact CG1-CG 3.7Å; V191-E225 HydrophobicContact CG2-CG 4.04Å; N221-E225 WeakPolarHBondContact O-CB 3.34Å; N221-E225 PolarHBondContact O-N 3.21Å; Y222-E225 PolarHBondContact O-N 2.83Å; E225-A228 PolarHBondContact O-N 3.47Å; E225-A229 WeakPolarHBondContact O-CB 3.5Å; E225-A229 PolarHBondContact O-N 3.34Å; E225-R235 VanDerWaalsContact OE1-CA 3.27Å; E225-R235 WeakPolarHBondContact OE1-CA 3.43Å; E225-R235 WeakPolarHBondContact OE1-CB 3.33Å; E225-R235 IonicContact OE1-CZ 3.42Å; E225-R235 IonicContact OE1-NE 2.67Å; E225-R235 PolarHBondContact OE1-NE 3.4Å; E225-R235 IonicContact OE1-NH2 2.78Å; E225-R235 PolarHBondContact OE1-NH2 2.95Å; E225-L236 PolarHBondContact OE1-N 3.49Å; E225-L236 WeakPolarHBondContact OE2-CB 3.45Å; E225-L236 PolarHBondContact OE2-N 3.05Å; E225-G237 PolarHBondContact OE1-N 2.79Å; E225-G237 PolarHBondContact OE2-N 2.82Å; E225-C238 HydrophobicContact CB-CB 4.37Å; E225-C238 WeakPolarHBondContact OE2-CB 3.21Å; E225-C238 PolarHBondContact OE2-N 2.91Å; E225-C238 PolarHBondContact OE2-SG 2.94Å; E225-L239 HydrophobicContact CB-CD1 4.3Å; E225-L239 HydrophobicContact CG-CD1 4.27Å
226	G	96.4	Very high	95.7	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.01	9%	0.09	C	C	.	.	H	α-helix	trans	-65.4	-50.5	-179.5	0	0	0	0	0	112.7	Y222 A223 A228 A229 I230 E493	Y222-G226 PolarHBondContact O-N 2.82Å; A223-G226 PolarHBondContact O-N 2.76Å; G226-A228 VanDerWaalsContact C-N 3.29Å; G226-A228 PolarHBondContact O-N 3.14Å; G226-A229 PolarHBondContact O-N 3.25Å; G226-I230 PolarHBondContact O-N 3.45Å; G226-E493 VanDerWaalsContact CA-OE1 3.29Å; G226-E493 WeakPolarHBondContact CA-OE1 3.36Å
227	V	94.9	Very high	95.6	Very high	14 Å²	14	17.5 Å²	17.5	9%	0.085	9%	0.088	C	C	.	.	H	α-helix	trans	-62.1	-40.8	177.7	174.8	0	0	0	0	110.2	A223 I230 L231 L344 E493	A223-V227 WeakPolarHBondContact O-CB 3.47Å; A223-V227 WeakPolarHBondContact O-CG2 3.14Å; A223-V227 PolarHBondContact O-N 3.07Å; V227-I230 PolarHBondContact O-N 3.43Å; V227-L231 HydrophobicContact CG1-CB 4.47Å; V227-L231 HydrophobicContact CG1-CD2 4.32Å; V227-L231 WeakPolarHBondContact O-CB 3.39Å; V227-L231 PolarHBondContact O-N 3.44Å; V227-L344 HydrophobicContact CB-CD1 4.17Å; V227-L344 HydrophobicContact CG1-CD1 3.79Å; V227-E493 PolarHBondContact N-OE1 2.78Å; V227-E493 VanDerWaalsContact N-OE1 3.14Å
228	A	95.5	Very high	95.5	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-70.3	-35	178.6	0	0	0	0	0	113.8	M224 E225 G226 I230 L231 Y232 E233 C234 L236 L344	M224-A228 WeakPolarHBondContact O-CB 3.31Å; M224-A228 PolarHBondContact O-N 3.21Å; E225-A228 PolarHBondContact O-N 3.47Å; G226-A228 VanDerWaalsContact C-N 3.29Å; G226-A228 PolarHBondContact O-N 3.14Å; A228-I230 PolarHBondContact O-N 2.95Å; A228-L231 PolarHBondContact O-N 3.01Å; A228-Y232 HydrophobicContact CB-CD2 3.95Å; A228-Y232 WeakPolarHBondContact O-CA 3.49Å; A228-Y232 WeakPolarHBondContact O-CB 3.35Å; A228-Y232 PolarHBondContact O-N 2.9Å; A228-E233 PolarHBondContact O-N 3.07Å; A228-C234 CarbonylContact C-O 3.57Å; A228-L236 HydrophobicContact CB-CD1 3.21Å; A228-L236 HydrophobicContact CB-CD2 4.12Å; A228-L236 HydrophobicContact CB-CG 3.43Å; A228-L236 VanDerWaalsContact CB-CG 3.43Å; A228-L344 HydrophobicContact CB-CD1 4.44Å
229	A	95.3	Very high	95.4	Very high	11 Å²	11	13.9 Å²	13.9	9%	0.091	7%	0.069	C	C	.	.	H	α-helix	trans	-59.3	-37.9	173.9	0	0	0	0	0	111.4	V191 E225 G226 E233 C234	V191-A229 HydrophobicContact CG2-CB 4.12Å; E225-A229 WeakPolarHBondContact O-CB 3.5Å; E225-A229 PolarHBondContact O-N 3.34Å; G226-A229 PolarHBondContact O-N 3.25Å; A229-E233 VanDerWaalsContact O-CA 3.25Å; A229-E233 WeakPolarHBondContact O-CA 3.22Å; A229-E233 PolarHBondContact O-N 2.83Å; A229-C234 VanDerWaalsContact CA-O 3.28Å; A229-C234 WeakPolarHBondContact CA-O 3.34Å; A229-C234 PolarHBondContact N-O 3.02Å
230	I	93.1	Very high	95.1	Very high	4 Å²	4	19.6 Å²	19.6	2%	0.021	10%	0.095	C	C	.	.	H	α-helix	trans	-81	-46.3	177.4	-62.8	170.8	0	0	0	111.4	F184 V188 G226 V227 A228 I489	F184-I230 HydrophobicContact CB-CD1 3.96Å; F184-I230 HydrophobicContact CB-CG1 4.04Å; F184-I230 HydrophobicContact CD1-CG1 4.19Å; F184-I230 HydrophobicContact CD1-CG2 4.02Å; F184-I230 HydrophobicContact CD2-CD1 4.33Å; F184-I230 HydrophobicContact CD2-CG2 4.02Å; F184-I230 HydrophobicContact CE1-CG2 3.92Å; F184-I230 HydrophobicContact CE2-CG2 3.93Å; F184-I230 HydrophobicContact CG-CD1 4.13Å; F184-I230 HydrophobicContact CG-CG1 4Å; F184-I230 HydrophobicContact CG-CG2 4.09Å; F184-I230 HydrophobicContact CZ-CG2 3.88Å; V188-I230 HydrophobicContact CG2-CD1 3.96Å; G226-I230 PolarHBondContact O-N 3.45Å; V227-I230 PolarHBondContact O-N 3.43Å; A228-I230 PolarHBondContact O-N 2.95Å; I230-I489 HydrophobicContact CD1-CG1 4.5Å; I230-I489 HydrophobicContact CD1-CG2 3.61Å; I230-I489 HydrophobicContact CG2-CD1 4.08Å
231	L	93.4	Very high	94.7	Very high	4 Å²	4	24.1 Å²	24.1	2%	0.021	12%	0.12	C	C	.	.	H	α-helix	trans	-81.6	-39.7	-168.2	-174	61.5	0	0	0	113.6	V227 A228 L321 L322 V340 M343 L344	V227-L231 HydrophobicContact CG1-CB 4.47Å; V227-L231 HydrophobicContact CG1-CD2 4.32Å; V227-L231 WeakPolarHBondContact O-CB 3.39Å; V227-L231 PolarHBondContact O-N 3.44Å; A228-L231 PolarHBondContact O-N 3.01Å; L231-L321 HydrophobicContact CD1-CD2 3.82Å; L231-L322 WeakPolarHBondContact O-CB 3.22Å; L231-V340 HydrophobicContact CD1-CB 4.13Å; L231-V340 HydrophobicContact CD1-CG1 3.82Å; L231-V340 HydrophobicContact CD2-CB 4.05Å; L231-V340 VanDerWaalsContact CD2-O 3.31Å; L231-V340 WeakPolarHBondContact CD2-O 3.45Å; L231-V340 HydrophobicContact CG-CB 4.02Å; L231-V340 HydrophobicContact CG-CG1 4.13Å; L231-M343 HydrophobicContact CD1-CB 4.21Å; L231-M343 HydrophobicContact CD1-CE 3.74Å; L231-M343 HydrophobicContact CD1-SD 4.04Å; L231-M343 HydrophobicContact CD2-CB 3.77Å; L231-L344 HydrophobicContact CD2-CB 3.98Å
232	Y	93.9	Very high	94.4	Very high	3 Å²	3	29.2 Å²	29.2	1%	0.012	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-4.7	179.2	-62.7	-70.6	0	0	0	112.8	A228 C234 F295 S296 H299 V300 L322 V340 L344	A228-Y232 HydrophobicContact CB-CD2 3.95Å; A228-Y232 WeakPolarHBondContact O-CA 3.49Å; A228-Y232 WeakPolarHBondContact O-CB 3.35Å; A228-Y232 PolarHBondContact O-N 2.9Å; Y232-C234 PolarHBondContact O-N 3.39Å; Y232-F295 HydrophobicContact CE2-CE1 4.24Å; Y232-S296 WeakPolarHBondContact OH-CB 3.41Å; Y232-S296 PolarHBondContact OH-OG 2.71Å; Y232-H299 HydrophobicContact CD1-CB 3.41Å; Y232-H299 VanDerWaalsContact CD1-CB 3.41Å; Y232-H299 HydrophobicContact CE1-CB 3.92Å; Y232-H299 HydrophobicContact CG-CB 3.82Å; Y232-V300 HydrophobicContact CD1-CG2 4.4Å; Y232-V300 HydrophobicContact CE1-CG2 4.21Å; Y232-L322 HydrophobicContact CD1-CD2 4.36Å; Y232-V340 HydrophobicContact CE1-CB 3.91Å; Y232-V340 HydrophobicContact CE1-CG2 3.61Å; Y232-V340 PolarHBondContact OH-O 3.2Å; Y232-L344 HydrophobicContact CE2-CB 4.18Å; Y232-L344 HydrophobicContact CE2-CD1 4.23Å; Y232-L344 HydrophobicContact CE2-CD2 3.81Å; Y232-L344 HydrophobicContact CE2-CG 4.27Å
233	E	93.7	Very high	94.2	Very high	48 Å²	48	30.6 Å²	30.6	22%	0.224	16%	0.156	C	C	.	.	S	Bend	trans	57.5	36.1	-176.1	-57.1	174.1	-152.7	0	0	111.9	A228 A229 R303 G319 G320 L321 L322 T323	A228-E233 PolarHBondContact O-N 3.07Å; A229-E233 VanDerWaalsContact O-CA 3.25Å; A229-E233 WeakPolarHBondContact O-CA 3.22Å; A229-E233 PolarHBondContact O-N 2.83Å; E233-R303 IonicContact OE2-CZ 3.52Å; E233-R303 IonicContact OE2-NE 2.68Å; E233-R303 PolarHBondContact OE2-NE 2.85Å; E233-R303 IonicContact OE2-NH2 3.43Å; E233-R303 PolarHBondContact OE2-NH2 2.84Å; E233-G319 VanDerWaalsContact OE2-CA 3.26Å; E233-G319 WeakPolarHBondContact OE2-CA 3.49Å; E233-G320 VanDerWaalsContact OE1-CA 3.28Å; E233-G320 WeakPolarHBondContact OE1-CA 3.49Å; E233-G320 PolarHBondContact OE1-N 3.42Å; E233-G320 PolarHBondContact OE2-N 2.96Å; E233-G320 VanDerWaalsContact OE2-N 3.07Å; E233-L321 PolarHBondContact OE1-N 3.48Å; E233-L322 PolarHBondContact OE1-N 3.32Å; E233-T323 WeakPolarHBondContact OE1-CB 3.31Å; E233-T323 PolarHBondContact OE1-N 3.04Å; E233-T323 PolarHBondContact OE1-OG1 2.92Å; E233-T323 PolarHBondContact OE2-OG1 3.19Å
234	C	92.9	Very high	94	Very high	28 Å²	28	32.9 Å²	32.9	19%	0.189	17%	0.171	C	C	.	.	S	Bend	trans	-145.8	156.6	-179.3	73.3	0	0	0	0	113.1	A228 A229 Y232 H299	A228-C234 CarbonylContact C-O 3.57Å; A229-C234 VanDerWaalsContact CA-O 3.28Å; A229-C234 WeakPolarHBondContact CA-O 3.34Å; A229-C234 PolarHBondContact N-O 3.02Å; Y232-C234 PolarHBondContact O-N 3.39Å; C234-H299 PolarHBondContact SG-ND1 2.84Å; C234-H299 VanDerWaalsContact SG-ND1 3.39Å
235	R	94.9	Very high	93.8	Very high	109 Å²	109	39.9 Å²	39.9	41%	0.411	20%	0.201	S	C	.	.			trans	-89.6	128	171.4	-59.3	-57.9	-53.1	-81.2	-14.9	108.7	D194 E225	D194-R235 IonicContact OD2-CZ 3.09Å; D194-R235 IonicContact OD2-NH1 3.42Å; D194-R235 PolarHBondContact OD2-NH1 3.14Å; D194-R235 IonicContact OD2-NH2 3.66Å; D194-R235 PolarHBondContact OD2-NH2 3.46Å; E225-R235 VanDerWaalsContact OE1-CA 3.27Å; E225-R235 WeakPolarHBondContact OE1-CA 3.43Å; E225-R235 WeakPolarHBondContact OE1-CB 3.33Å; E225-R235 IonicContact OE1-CZ 3.42Å; E225-R235 IonicContact OE1-NE 2.67Å; E225-R235 PolarHBondContact OE1-NE 3.4Å; E225-R235 IonicContact OE1-NH2 2.78Å; E225-R235 PolarHBondContact OE1-NH2 2.95Å
236	L	94.4	Very high	93.6	Very high	6 Å²	6	44.6 Å²	44.6	3%	0.031	22%	0.223	C	C	.	.			trans	-91	-16.2	-176.9	-64.6	-173.8	0	0	0	113	M224 E225 A228 C238 P244 T247 F295 H299	M224-L236 HydrophobicContact CE-CD1 3.8Å; M224-L236 HydrophobicContact CG-CD1 4.03Å; E225-L236 PolarHBondContact OE1-N 3.49Å; E225-L236 WeakPolarHBondContact OE2-CB 3.45Å; E225-L236 PolarHBondContact OE2-N 3.05Å; A228-L236 HydrophobicContact CB-CD1 3.21Å; A228-L236 HydrophobicContact CB-CD2 4.12Å; A228-L236 HydrophobicContact CB-CG 3.43Å; A228-L236 VanDerWaalsContact CB-CG 3.43Å; L236-C238 VanDerWaalsContact C-N 3.34Å; L236-C238 VanDerWaalsContact CB-SG 3.52Å; L236-P244 WeakPolarHBondContact O-CD 3.36Å; L236-P244 WeakPolarHBondContact O-CG 3.39Å; L236-T247 PolarHBondContact O-OG1 3.44Å; L236-F295 HydrophobicContact CD1-CE1 4.34Å; L236-F295 HydrophobicContact CD1-CZ 3.76Å; L236-F295 HydrophobicContact CD2-CZ 3.74Å; L236-F295 HydrophobicContact CG-CZ 4.41Å; L236-H299 WeakPolarHBondContact CD2-CE1 3.32Å
237	G	94.4	Very high	93.4	Very high	5 Å²	5	44.7 Å²	44.7	5%	0.052	22%	0.224	C	C	.	.			trans	74.2	22.2	-177.3	0	0	0	0	0	113.4	E225 L239 E240	E225-G237 PolarHBondContact OE1-N 2.79Å; E225-G237 PolarHBondContact OE2-N 2.82Å; G237-L239 PolarHBondContact O-N 3.33Å; G237-E240 WeakPolarHBondContact O-CB 3.37Å; G237-E240 PolarHBondContact O-N 2.91Å
238	C	92.5	Very high	93.3	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.007	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-24.6	-179.3	-56.3	0	0	0	0	112.9	N221 E225 L236 T247	N221-C238 HydrophobicContact CB-CB 3.99Å; E225-C238 HydrophobicContact CB-CB 4.37Å; E225-C238 WeakPolarHBondContact OE2-CB 3.21Å; E225-C238 PolarHBondContact OE2-N 2.91Å; E225-C238 PolarHBondContact OE2-SG 2.94Å; L236-C238 VanDerWaalsContact C-N 3.34Å; L236-C238 VanDerWaalsContact CB-SG 3.52Å; C238-T247 WeakPolarHBondContact SG-CG2 3.44Å
239	L	95.5	Very high	93.2	Very high	14 Å²	14	52.2 Å²	52.2	7%	0.073	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-0.2	-179.2	-65.2	170.6	0	0	0	113.1	V191 D194 L195 R198 L218 N221 E225 G237	V191-L239 HydrophobicContact CG1-CD1 4.05Å; D194-L239 HydrophobicContact CB-CB 4.34Å; D194-L239 HydrophobicContact CB-CD1 3.9Å; L195-L239 HydrophobicContact CB-CD1 4.39Å; R198-L239 HydrophobicContact CB-CD2 4.35Å; R198-L239 WeakPolarHBondContact CD-O 3.49Å; R198-L239 HydrophobicContact CG-CD2 4.28Å; L218-L239 HydrophobicContact CD1-CD2 4.45Å; N221-L239 HydrophobicContact CB-CD2 3.95Å; E225-L239 HydrophobicContact CB-CD1 4.3Å; E225-L239 HydrophobicContact CG-CD1 4.27Å; G237-L239 PolarHBondContact O-N 3.33Å
240	E	93.1	Very high	93.2	Very high	120 Å²	120	51.7 Å²	51.7	56%	0.561	26%	0.256	S	S	*	.	S	Bend	trans	-79.8	166.1	176.9	-62	-171.6	-168.9	0	0	111.9	G237 N242	G237-E240 WeakPolarHBondContact O-CB 3.37Å; G237-E240 PolarHBondContact O-N 2.91Å; E240-N242 VanDerWaalsContact C-N 3.27Å; E240-N242 PolarHBondContact O-N 3.35Å
241	N	88.9	Confident	93.1	Very high	109 Å²	109	52.8 Å²	52.8	58%	0.583	26%	0.261	S	S	*	.	S	Bend	trans	-66	-32.9	175	-73.7	-31.7	0	0	0	112.5	R198 S201	R198-N241 PolarHBondContact NH1-OD1 3.38Å; S201-N241 PolarHBondContact OG-OD1 3.01Å
242	N	91.1	Very high	93.1	Very high	137 Å²	137	56.2 Å²	56.2	73%	0.733	29%	0.286	S	S	*	.	S	Bend	trans	-119.3	92.5	-179	-66	-34.6	0	0	0	109.2	E240	E240-N242 VanDerWaalsContact C-N 3.27Å; E240-N242 PolarHBondContact O-N 3.35Å
243	V	92.3	Very high	93.1	Very high	29 Å²	29	56.5 Å²	56.5	18%	0.176	29%	0.289	C	S	.	.			trans	-65.4	132.3	179.5	-179	0	0	0	0	110	T247 Q248	V243-T247 HydrophobicContact CG1-CG2 3.45Å; V243-T247 VanDerWaalsContact CG1-CG2 3.45Å; V243-Q248 HydrophobicContact CB-CG 4.1Å; V243-Q248 HydrophobicContact CG1-CG 3.93Å; V243-Q248 PolarHBondContact O-NE2 2.97Å
244	P	93.8	Very high	92.9	Very high	48 Å²	48	54.2 Å²	54.2	31%	0.312	28%	0.278	S	S	.	.			trans	-57.2	150.8	177.5	-28.3	37.3	0	0	0	113.6	L236 E246 T247 Q248	L236-P244 WeakPolarHBondContact O-CD 3.36Å; L236-P244 WeakPolarHBondContact O-CG 3.39Å; P244-E246 VanDerWaalsContact C-N 3.34Å; P244-E246 PolarHBondContact O-N 3.36Å; P244-T247 WeakPolarHBondContact O-CB 3.26Å; P244-T247 PolarHBondContact O-N 3.25Å; P244-Q248 WeakPolarHBondContact O-CG 3.1Å; P244-Q248 PolarHBondContact O-N 2.9Å
245	K	93.4	Very high	92.7	Very high	147 Å²	147	57.6 Å²	57.6	64%	0.639	29%	0.291	S	S	*	.	H	α-helix	trans	-61.9	-41.3	-175.5	-176.6	173.9	179.7	177	0	112.2	T247 Q248 D249	K245-T247 VanDerWaalsContact C-N 3.26Å; K245-T247 PolarHBondContact O-N 2.98Å; K245-Q248 PolarHBondContact O-N 3.44Å; K245-D249 WeakPolarHBondContact O-CB 3.46Å; K245-D249 PolarHBondContact O-N 2.8Å
246	E	91.3	Very high	92.3	Very high	98 Å²	98	54.6 Å²	54.6	46%	0.458	28%	0.283	S	S	.	.	H	α-helix	trans	-59.9	-40.3	178.3	-63.5	80.7	-178.4	0	0	111.5	P244 D249 Y250 F295	P244-E246 VanDerWaalsContact C-N 3.34Å; P244-E246 PolarHBondContact O-N 3.36Å; E246-D249 PolarHBondContact O-N 2.86Å; E246-Y250 PolarHBondContact O-N 3.33Å; E246-Y250 VanDerWaalsContact O-N 3.1Å; E246-F295 WeakPolarHBondContact O-CD2 3.31Å
247	T	92.8	Very high	91.9	Very high	3 Å²	3	54.9 Å²	54.9	2%	0.018	28%	0.284	C	S	.	.	H	α-helix	trans	-66.1	-45.4	174.9	-57	0	0	0	0	110.8	M224 L236 C238 V243 P244 K245 D249 Y250 I251	M224-T247 HydrophobicContact CE-CG2 3.67Å; M224-T247 HydrophobicContact SD-CG2 4.26Å; L236-T247 PolarHBondContact O-OG1 3.44Å; C238-T247 WeakPolarHBondContact SG-CG2 3.44Å; V243-T247 HydrophobicContact CG1-CG2 3.45Å; V243-T247 VanDerWaalsContact CG1-CG2 3.45Å; P244-T247 WeakPolarHBondContact O-CB 3.26Å; P244-T247 PolarHBondContact O-N 3.25Å; K245-T247 VanDerWaalsContact C-N 3.26Å; K245-T247 PolarHBondContact O-N 2.98Å; T247-D249 VanDerWaalsContact C-N 3.33Å; T247-D249 PolarHBondContact O-N 3.43Å; T247-Y250 WeakPolarHBondContact O-CB 3.39Å; T247-Y250 PolarHBondContact O-N 3.38Å; T247-I251 HydrophobicContact CG2-CD1 4.2Å; T247-I251 VanDerWaalsContact O-CG1 3.3Å; T247-I251 WeakPolarHBondContact O-CG1 3.47Å; T247-I251 PolarHBondContact O-N 2.78Å
248	Q	93	Very high	91.1	Very high	99 Å²	99	55.8 Å²	55.8	46%	0.463	29%	0.287	S	S	.	.	H	α-helix	trans	-61.6	-39.7	175.9	-66.3	-179.7	19.2	0	0	112.8	V243 P244 K245 Y250 I251 S252	V243-Q248 HydrophobicContact CB-CG 4.1Å; V243-Q248 HydrophobicContact CG1-CG 3.93Å; V243-Q248 PolarHBondContact O-NE2 2.97Å; P244-Q248 WeakPolarHBondContact O-CG 3.1Å; P244-Q248 PolarHBondContact O-N 2.9Å; K245-Q248 PolarHBondContact O-N 3.44Å; Q248-Y250 VanDerWaalsContact C-N 3.31Å; Q248-Y250 PolarHBondContact O-N 2.94Å; Q248-I251 PolarHBondContact O-N 3.43Å; Q248-S252 WeakPolarHBondContact O-CB 3.3Å; Q248-S252 PolarHBondContact O-N 3.47Å; Q248-S252 PolarHBondContact O-OG 3.01Å
249	D	93.9	Very high	90.3	Very high	73 Å²	73	59.1 Å²	59.1	39%	0.39	31%	0.31	S	S	.	.	H	α-helix	trans	-61.9	-41	176	-74.2	-9.2	0	0	0	110.5	K245 E246 T247 S252 A253	K245-D249 WeakPolarHBondContact O-CB 3.46Å; K245-D249 PolarHBondContact O-N 2.8Å; E246-D249 PolarHBondContact O-N 2.86Å; T247-D249 VanDerWaalsContact C-N 3.33Å; T247-D249 PolarHBondContact O-N 3.43Å; D249-S252 PolarHBondContact O-N 2.93Å; D249-A253 WeakPolarHBondContact O-CB 3.36Å; D249-A253 PolarHBondContact O-N 3.1Å
250	Y	94.4	Very high	89	Confident	1 Å²	1	58.7 Å²	58.7	0%	0.004	31%	0.308	C	S	.	.	H	α-helix	trans	-63.5	-48.5	174.1	176.8	-89	0	0	0	112.3	M224 E246 T247 Q248 S252 A253 L254 L292 F295 L344 L345	M224-Y250 HydrophobicContact CE-CD1 3.16Å; M224-Y250 HydrophobicContact CE-CE1 3.78Å; M224-Y250 HydrophobicContact CE-CG 3.84Å; M224-Y250 HydrophobicContact SD-CD1 3.91Å; M224-Y250 HydrophobicContact SD-CE1 4.17Å; E246-Y250 PolarHBondContact O-N 3.33Å; E246-Y250 VanDerWaalsContact O-N 3.1Å; T247-Y250 WeakPolarHBondContact O-CB 3.39Å; T247-Y250 PolarHBondContact O-N 3.38Å; Q248-Y250 VanDerWaalsContact C-N 3.31Å; Q248-Y250 PolarHBondContact O-N 2.94Å; Y250-S252 PolarHBondContact O-N 3.49Å; Y250-A253 WeakPolarHBondContact O-CB 3.35Å; Y250-A253 PolarHBondContact O-N 3.19Å; Y250-A253 VanDerWaalsContact O-N 3.11Å; Y250-L254 HydrophobicContact CE1-CB 4.3Å; Y250-L254 HydrophobicContact CE1-CD2 3.87Å; Y250-L254 WeakPolarHBondContact O-CB 3.39Å; Y250-L254 PolarHBondContact O-N 3.26Å; Y250-L292 HydrophobicContact CD2-CD2 3.78Å; Y250-L292 HydrophobicContact CE2-CB 4.49Å; Y250-L292 HydrophobicContact CE2-CD2 3.31Å; Y250-L292 HydrophobicContact CE2-CG 4.48Å; Y250-F295 HydrophobicContact CD2-CB 3.72Å; Y250-F295 AromaticContact CD2-CD1 3.61Å; Y250-F295 HydrophobicContact CD2-CD1 3.61Å; Y250-F295 HydrophobicContact CD2-CD2 4.28Å; Y250-F295 HydrophobicContact CD2-CE1 4.3Å; Y250-F295 AromaticContact CD2-CG 3.6Å; Y250-F295 HydrophobicContact CD2-CG 3.6Å; Y250-F295 HydrophobicContact CE2-CD1 4.17Å; Y250-F295 HydrophobicContact CG-CB 4.4Å; Y250-F295 HydrophobicContact CG-CD1 4.13Å; Y250-F295 HydrophobicContact CG-CD2 4.2Å; Y250-F295 HydrophobicContact CG-CE1 4.47Å; Y250-F295 AromaticContact CG-CG 3.98Å; Y250-F295 HydrophobicContact CG-CG 3.98Å; Y250-L344 HydrophobicContact CD1-CD2 4.49Å; Y250-L344 HydrophobicContact CD2-CD2 4.1Å; Y250-L344 HydrophobicContact CE1-CD2 3.86Å; Y250-L344 HydrophobicContact CE1-CG 4.34Å; Y250-L344 HydrophobicContact CE2-CD2 3.42Å; Y250-L344 VanDerWaalsContact CE2-CD2 3.42Å; Y250-L344 HydrophobicContact CE2-CG 4.29Å; Y250-L344 WeakPolarHBondContact OH-CD2 3.28Å; Y250-L344 WeakPolarHBondContact OH-CG 3.38Å; Y250-L345 PolarHBondContact OH-N 2.76Å
251	I	92.3	Very high	87.9	Confident	26 Å²	26	55.8 Å²	55.8	13%	0.133	29%	0.294	C	S	.	.	H	α-helix	trans	-57.7	-42.4	179.2	-64.9	173.6	0	0	0	110	F220 M224 T247 Q248 L254 H255	F220-I251 HydrophobicContact CE1-CD1 4.11Å; F220-I251 HydrophobicContact CE1-CG1 3.86Å; F220-I251 HydrophobicContact CE1-CG2 4.03Å; F220-I251 HydrophobicContact CZ-CG1 4.32Å; F220-I251 HydrophobicContact CZ-CG2 4.19Å; M224-I251 HydrophobicContact CE-CG1 4.28Å; M224-I251 HydrophobicContact SD-CD1 4.16Å; M224-I251 HydrophobicContact SD-CG1 3.79Å; T247-I251 HydrophobicContact CG2-CD1 4.2Å; T247-I251 VanDerWaalsContact O-CG1 3.3Å; T247-I251 WeakPolarHBondContact O-CG1 3.47Å; T247-I251 PolarHBondContact O-N 2.78Å; Q248-I251 PolarHBondContact O-N 3.43Å; I251-L254 PolarHBondContact O-N 3.48Å; I251-H255 WeakPolarHBondContact O-CB 3.43Å; I251-H255 PolarHBondContact O-N 3.5Å
252	S	92.8	Very high	86.9	Confident	76 Å²	76	53.1 Å²	53.1	53%	0.531	28%	0.277	S	S	.	.	H	α-helix	trans	-63.3	-43.4	176.9	-57.8	0	0	0	0	112.2	Q248 D249 Y250 L256	Q248-S252 WeakPolarHBondContact O-CB 3.3Å; Q248-S252 PolarHBondContact O-N 3.47Å; Q248-S252 PolarHBondContact O-OG 3.01Å; D249-S252 PolarHBondContact O-N 2.93Å; Y250-S252 PolarHBondContact O-N 3.49Å; S252-L256 WeakPolarHBondContact O-CB 3.36Å; S252-L256 PolarHBondContact O-N 3.29Å
253	A	93.3	Very high	85.6	Confident	9 Å²	9	49.1 Å²	49.1	7%	0.074	26%	0.258	C	S	.	.	H	α-helix	trans	-64.6	-40	176.2	0	0	0	0	0	112.1	D249 Y250 L256 M257 S288 L292	D249-A253 WeakPolarHBondContact O-CB 3.36Å; D249-A253 PolarHBondContact O-N 3.1Å; Y250-A253 WeakPolarHBondContact O-CB 3.35Å; Y250-A253 PolarHBondContact O-N 3.19Å; Y250-A253 VanDerWaalsContact O-N 3.11Å; A253-L256 PolarHBondContact O-N 3.45Å; A253-M257 PolarHBondContact O-N 3.4Å; A253-S288 WeakPolarHBondContact O-CB 3.47Å; A253-L292 HydrophobicContact CB-CD2 4.26Å; A253-L292 HydrophobicContact CB-CG 4.46Å
254	L	90.3	Very high	84.1	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-65.8	-47	177.9	-175.1	60.6	0	0	0	111.7	F220 Y250 I251 L256 M257 F258 L292 L345 V348	F220-L254 HydrophobicContact CE2-CD2 3.78Å; F220-L254 HydrophobicContact CZ-CD2 3.77Å; Y250-L254 HydrophobicContact CE1-CB 4.3Å; Y250-L254 HydrophobicContact CE1-CD2 3.87Å; Y250-L254 WeakPolarHBondContact O-CB 3.39Å; Y250-L254 PolarHBondContact O-N 3.26Å; I251-L254 PolarHBondContact O-N 3.48Å; L254-L256 VanDerWaalsContact C-N 3.3Å; L254-L256 PolarHBondContact O-N 3.22Å; L254-M257 HydrophobicContact CD1-CE 4.22Å; L254-M257 WeakPolarHBondContact O-CB 3.41Å; L254-M257 PolarHBondContact O-N 2.93Å; L254-F258 HydrophobicContact CD1-CD2 3.9Å; L254-F258 HydrophobicContact CD1-CE2 3.52Å; L254-F258 HydrophobicContact CG-CD2 4.05Å; L254-F258 HydrophobicContact CG-CE2 3.97Å; L254-F258 WeakPolarHBondContact O-CD2 3.37Å; L254-F258 PolarHBondContact O-N 3.5Å; L254-L292 HydrophobicContact CB-CD2 4.18Å; L254-L292 HydrophobicContact CD1-CD2 4.3Å; L254-L345 HydrophobicContact CD1-CD1 3.14Å; L254-V348 HydrophobicContact CD2-CB 4.33Å; L254-V348 HydrophobicContact CD2-CG1 4.16Å
255	H	87.5	Confident	82.6	Confident	99 Å²	99	50.5 Å²	50.5	46%	0.458	26%	0.26	S	S	.	.	H	α-helix	trans	-61.3	-38.4	174	-72.8	170.6	0	0	0	112.2	I251 F258 S259	I251-H255 WeakPolarHBondContact O-CB 3.43Å; I251-H255 PolarHBondContact O-N 3.5Å; H255-F258 PolarHBondContact O-N 3.44Å; H255-S259 VanDerWaalsContact O-CB 3.24Å; H255-S259 WeakPolarHBondContact O-CB 3.39Å; H255-S259 PolarHBondContact O-N 2.79Å; H255-S259 PolarHBondContact O-OG 3Å
256	L	88	Confident	80.8	Confident	46 Å²	46	46.3 Å²	46.3	24%	0.241	24%	0.24	C	C	.	.	H	α-helix	trans	-62.3	-45.8	173.8	-176.2	61.1	0	0	0	111	S252 A253 L254 F258 S259 S260 E284 V287	S252-L256 WeakPolarHBondContact O-CB 3.36Å; S252-L256 PolarHBondContact O-N 3.29Å; A253-L256 PolarHBondContact O-N 3.45Å; L254-L256 VanDerWaalsContact C-N 3.3Å; L254-L256 PolarHBondContact O-N 3.22Å; L256-F258 VanDerWaalsContact C-N 3.32Å; L256-F258 PolarHBondContact O-N 2.93Å; L256-S259 WeakPolarHBondContact CA-OG 3.3Å; L256-S259 PolarHBondContact O-N 3.47Å; L256-S259 PolarHBondContact O-OG 3.5Å; L256-S260 VanDerWaalsContact O-CB 3.29Å; L256-S260 WeakPolarHBondContact O-CB 3.28Å; L256-S260 PolarHBondContact O-N 3.35Å; L256-S260 PolarHBondContact O-OG 3.28Å; L256-E284 HydrophobicContact CD1-CB 4.23Å; L256-E284 HydrophobicContact CD1-CG 4.19Å; L256-E284 HydrophobicContact CG-CB 4.48Å; L256-V287 HydrophobicContact CD2-CB 4.47Å; L256-V287 HydrophobicContact CD2-CG1 4.09Å
257	M	84.8	Confident	78.9	Confident	12 Å²	12	41.8 Å²	41.8	6%	0.059	22%	0.22	C	C	.	.	H	α-helix	trans	-57.2	-44.2	177.9	-168.6	-148.5	66	0	0	111.9	A253 L254 F261 W289 L292 L345	A253-M257 PolarHBondContact O-N 3.4Å; L254-M257 HydrophobicContact CD1-CE 4.22Å; L254-M257 WeakPolarHBondContact O-CB 3.41Å; L254-M257 PolarHBondContact O-N 2.93Å; M257-F261 PolarHBondContact O-N 3.23Å; M257-F261 VanDerWaalsContact O-N 3.11Å; M257-W289 HydrophobicContact SD-CZ2 4.44Å; M257-L292 HydrophobicContact SD-CD1 4.06Å; M257-L345 HydrophobicContact CE-CD1 3.59Å; M257-L345 HydrophobicContact SD-CD1 3.61Å; M257-L345 HydrophobicContact SD-CD2 3.82Å; M257-L345 HydrophobicContact SD-CG 4.37Å
258	F	77.6	Confident	77	Confident	25 Å²	25	43.2 Å²	43.2	11%	0.11	24%	0.236	C	C	.	.	H	α-helix	trans	-76.6	-43.4	179.9	-78.5	-65.6	0	0	0	113.5	L254 H255 L256 S260 F261 L345 D349 H521 L523	L254-F258 HydrophobicContact CD1-CD2 3.9Å; L254-F258 HydrophobicContact CD1-CE2 3.52Å; L254-F258 HydrophobicContact CG-CD2 4.05Å; L254-F258 HydrophobicContact CG-CE2 3.97Å; L254-F258 WeakPolarHBondContact O-CD2 3.37Å; L254-F258 PolarHBondContact O-N 3.5Å; H255-F258 PolarHBondContact O-N 3.44Å; L256-F258 VanDerWaalsContact C-N 3.32Å; L256-F258 PolarHBondContact O-N 2.93Å; F258-S260 PolarHBondContact O-N 2.89Å; F258-F261 WeakPolarHBondContact O-CA 3.34Å; F258-F261 WeakPolarHBondContact O-CB 3.34Å; F258-F261 PolarHBondContact O-N 3.1Å; F258-L345 HydrophobicContact CE2-CD1 4.33Å; F258-L345 HydrophobicContact CZ-CD1 4.45Å; F258-D349 WeakPolarHBondContact CD2-OD2 3.18Å; F258-D349 WeakPolarHBondContact CE2-OD2 3.22Å; F258-D349 WeakPolarHBondContact CZ-OD2 3.48Å; F258-H521 PolarHBondContact O-CE1 3.25Å; F258-H521 PolarHBondContact O-NE2 3.02Å; F258-L523 HydrophobicContact CE1-CD1 4.42Å; F258-L523 HydrophobicContact CE1-CG 4.38Å; F258-L523 HydrophobicContact CZ-CD1 4.3Å
259	S	75.9	Confident	75.2	Confident	71 Å²	71	42.1 Å²	42.1	50%	0.497	24%	0.244	S	C	.	.	H	α-helix	trans	-61.6	-36.4	177.6	60	0	0	0	0	111.8	H255 L256 F261	H255-S259 VanDerWaalsContact O-CB 3.24Å; H255-S259 WeakPolarHBondContact O-CB 3.39Å; H255-S259 PolarHBondContact O-N 2.79Å; H255-S259 PolarHBondContact O-OG 3Å; L256-S259 WeakPolarHBondContact CA-OG 3.3Å; L256-S259 PolarHBondContact O-N 3.47Å; L256-S259 PolarHBondContact O-OG 3.5Å; S259-F261 VanDerWaalsContact C-N 3.3Å
260	S	69.8	Low	73.9	Confident	4 Å²	4	40.6 Å²	40.6	3%	0.028	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-3.5	171.1	-54	0	0	0	0	112.7	L256 F258 K262 T263 T264 E284	L256-S260 VanDerWaalsContact O-CB 3.29Å; L256-S260 WeakPolarHBondContact O-CB 3.28Å; L256-S260 PolarHBondContact O-N 3.35Å; L256-S260 PolarHBondContact O-OG 3.28Å; F258-S260 PolarHBondContact O-N 2.89Å; S260-K262 VanDerWaalsContact C-N 3.28Å; S260-K262 PolarHBondContact O-N 3.23Å; S260-K262 VanDerWaalsContact O-N 3.16Å; S260-T263 WeakPolarHBondContact CA-OG1 3.21Å; S260-T263 CarbonylContact O-C 3.59Å; S260-T263 WeakPolarHBondContact O-CA 3.46Å; S260-T263 PolarHBondContact O-N 2.78Å; S260-T263 PolarHBondContact O-OG1 3.5Å; S260-T264 WeakPolarHBondContact O-CB 3.42Å; S260-T264 WeakPolarHBondContact O-CG2 3.45Å; S260-T264 PolarHBondContact O-N 3.49Å; S260-T264 PolarHBondContact O-OG1 3.39Å; S260-E284 PolarHBondContact OG-OE2 2.93Å
261	F	68.8	Low	72.8	Confident	59 Å²	59	43.3 Å²	43.3	26%	0.259	25%	0.252	S	S	.	.	H	α-helix	trans	-53.6	-43.2	-177.4	-175.4	-93.7	0	0	0	113	M257 F258 S259 T263 T264 M265	M257-F261 PolarHBondContact O-N 3.23Å; M257-F261 VanDerWaalsContact O-N 3.11Å; F258-F261 WeakPolarHBondContact O-CA 3.34Å; F258-F261 WeakPolarHBondContact O-CB 3.34Å; F258-F261 PolarHBondContact O-N 3.1Å; S259-F261 VanDerWaalsContact C-N 3.3Å; F261-T263 VanDerWaalsContact C-N 3.35Å; F261-T263 PolarHBondContact O-N 2.82Å; F261-T264 VanDerWaalsContact CA-OG1 3.25Å; F261-T264 WeakPolarHBondContact CA-OG1 3.26Å; F261-T264 PolarHBondContact O-N 2.88Å; F261-T264 PolarHBondContact O-OG1 2.86Å; F261-M265 HydrophobicContact CD1-CG 4.06Å; F261-M265 HydrophobicContact CD1-SD 4.4Å; F261-M265 HydrophobicContact CE1-CG 3.57Å; F261-M265 HydrophobicContact CE1-SD 3.46Å; F261-M265 WeakPolarHBondContact CE1-SD 3.49Å; F261-M265 HydrophobicContact CE2-CG 4.24Å; F261-M265 HydrophobicContact CZ-CG 3.68Å; F261-M265 HydrophobicContact CZ-SD 3.67Å; F261-M265 VanDerWaalsContact O-CB 3.28Å; F261-M265 WeakPolarHBondContact O-CB 2.94Å; F261-M265 WeakPolarHBondContact O-CG 3.21Å; F261-M265 PolarHBondContact O-N 2.95Å
262	K	67.1	Low	72.2	Confident	53 Å²	53	47.3 Å²	47.3	23%	0.23	27%	0.269	C	S	.	.	H	α-helix	trans	-59.5	-47.9	175.5	-70.3	-171.8	-179.1	-171.8	0	110.2	D86 S260 Y266	D86-K262 IonicContact OD1-NZ 2.64Å; D86-K262 PolarHBondContact OD1-NZ 3.42Å; D86-K262 IonicContact OD2-NZ 2.92Å; D86-K262 PolarHBondContact OD2-NZ 3.29Å; S260-K262 VanDerWaalsContact C-N 3.28Å; S260-K262 PolarHBondContact O-N 3.23Å; S260-K262 VanDerWaalsContact O-N 3.16Å; K262-Y266 WeakPolarHBondContact O-CD2 3.46Å; K262-Y266 VanDerWaalsContact O-CE2 3.3Å; K262-Y266 WeakPolarHBondContact O-CE2 3.31Å; K262-Y266 PolarHBondContact O-N 3.19Å
263	T	64.9	Low	71.5	Confident	54 Å²	54	52.4 Å²	52.4	33%	0.331	28%	0.277	S	S	.	.	H	α-helix	trans	-74	-27.1	-178.6	54.7	0	0	0	0	113.3	S260 F261 Y266 A267	S260-T263 WeakPolarHBondContact CA-OG1 3.21Å; S260-T263 CarbonylContact O-C 3.59Å; S260-T263 WeakPolarHBondContact O-CA 3.46Å; S260-T263 PolarHBondContact O-N 2.78Å; S260-T263 PolarHBondContact O-OG1 3.5Å; F261-T263 VanDerWaalsContact C-N 3.35Å; F261-T263 PolarHBondContact O-N 2.82Å; T263-Y266 CarbonylContact O-C 3.27Å; T263-Y266 WeakPolarHBondContact O-CA 3.39Å; T263-Y266 WeakPolarHBondContact O-CB 3.48Å; T263-Y266 PolarHBondContact O-N 3.09Å; T263-A267 PolarHBondContact O-N 3.04Å
264	T	61.4	Low	70.9	Confident	12 Å²	12	54.1 Å²	54.1	7%	0.074	28%	0.284	C	S	.	.	H	α-helix	trans	-87	-31.4	-179.9	54.8	0	0	0	0	113	S260 F261 Y266 A267 G268 F285	S260-T264 WeakPolarHBondContact O-CB 3.42Å; S260-T264 WeakPolarHBondContact O-CG2 3.45Å; S260-T264 PolarHBondContact O-N 3.49Å; S260-T264 PolarHBondContact O-OG1 3.39Å; F261-T264 VanDerWaalsContact CA-OG1 3.25Å; F261-T264 WeakPolarHBondContact CA-OG1 3.26Å; F261-T264 PolarHBondContact O-N 2.88Å; F261-T264 PolarHBondContact O-OG1 2.86Å; T264-Y266 PolarHBondContact O-N 3.26Å; T264-A267 PolarHBondContact O-N 3.03Å; T264-G268 PolarHBondContact O-N 3.12Å; T264-F285 HydrophobicContact CG2-CB 3.61Å; T264-F285 HydrophobicContact CG2-CD2 3.66Å; T264-F285 HydrophobicContact CG2-CG 4Å
265	M	61.8	Low	70.5	Confident	94 Å²	94	55.8 Å²	55.8	46%	0.463	29%	0.291	S	S	.	.	H	α-helix	trans	-54.9	-36.1	160.2	-86.3	-142.9	58.6	0	0	110.9	F88 F261	F88-M265 HydrophobicContact CE1-CE 4.23Å; F88-M265 HydrophobicContact CE1-SD 4.4Å; F261-M265 HydrophobicContact CD1-CG 4.06Å; F261-M265 HydrophobicContact CD1-SD 4.4Å; F261-M265 HydrophobicContact CE1-CG 3.57Å; F261-M265 HydrophobicContact CE1-SD 3.46Å; F261-M265 WeakPolarHBondContact CE1-SD 3.49Å; F261-M265 HydrophobicContact CE2-CG 4.24Å; F261-M265 HydrophobicContact CZ-CG 3.68Å; F261-M265 HydrophobicContact CZ-SD 3.67Å; F261-M265 VanDerWaalsContact O-CB 3.28Å; F261-M265 WeakPolarHBondContact O-CB 2.94Å; F261-M265 WeakPolarHBondContact O-CG 3.21Å; F261-M265 PolarHBondContact O-N 2.95Å
266	Y	56.1	Low	70.3	Confident	58 Å²	58	56.2 Å²	56.2	23%	0.227	30%	0.302	C	S	.	.	H	α-helix	trans	-76.9	-33.1	168.3	-60.1	-59.9	0	0	0	113.1	F83 F88 K262 T263 T264 G268 A269 I270	F83-Y266 HydrophobicContact CD1-CE1 4.35Å; F83-Y266 HydrophobicContact CE1-CD1 4.15Å; F83-Y266 AromaticContact CE1-CE1 3.38Å; F83-Y266 HydrophobicContact CE1-CE1 3.38Å; F83-Y266 AromaticContact CE1-CZ 3.65Å; F83-Y266 HydrophobicContact CZ-CD1 4.25Å; F83-Y266 AromaticContact CZ-CE1 3.5Å; F83-Y266 HydrophobicContact CZ-CE1 3.5Å; F88-Y266 VanDerWaalsContact CD2-OH 3.29Å; F88-Y266 WeakPolarHBondContact CD2-OH 3.16Å; F88-Y266 AromaticContact CE2-CE1 3.87Å; F88-Y266 HydrophobicContact CE2-CE1 3.87Å; F88-Y266 AromaticContact CE2-CZ 3.61Å; F88-Y266 WeakPolarHBondContact CE2-OH 3.45Å; F88-Y266 HydrophobicContact CZ-CE1 4.23Å; K262-Y266 WeakPolarHBondContact O-CD2 3.46Å; K262-Y266 VanDerWaalsContact O-CE2 3.3Å; K262-Y266 WeakPolarHBondContact O-CE2 3.31Å; K262-Y266 PolarHBondContact O-N 3.19Å; T263-Y266 CarbonylContact O-C 3.27Å; T263-Y266 WeakPolarHBondContact O-CA 3.39Å; T263-Y266 WeakPolarHBondContact O-CB 3.48Å; T263-Y266 PolarHBondContact O-N 3.09Å; T264-Y266 PolarHBondContact O-N 3.26Å; Y266-G268 PolarHBondContact O-N 3.02Å; Y266-A269 CarbonylContact O-C 3.3Å; Y266-A269 VanDerWaalsContact O-C 3.27Å; Y266-A269 VanDerWaalsContact O-CA 3.25Å; Y266-A269 WeakPolarHBondContact O-CA 3.35Å; Y266-A269 WeakPolarHBondContact O-CB 3.24Å; Y266-A269 PolarHBondContact O-N 3.17Å; Y266-I270 VanDerWaalsContact O-CG1 3.28Å; Y266-I270 WeakPolarHBondContact O-CG1 3.45Å; Y266-I270 PolarHBondContact O-N 3.21Å
267	A	51.2	Low	70.1	Confident	3 Å²	3	59.8 Å²	59.8	3%	0.025	32%	0.32	C	S	.	.	H	α-helix	trans	-61.3	-28.5	-177.3	0	0	0	0	0	114.2	T263 T264 R275 W282	T263-A267 PolarHBondContact O-N 3.04Å; T264-A267 PolarHBondContact O-N 3.03Å; A267-R275 PolarHBondContact O-NH2 3.43Å; A267-W282 HydrophobicContact CB-CE3 4.34Å
268	G	52.6	Low	70.1	Confident	34 Å²	34	63.5 Å²	63.5	35%	0.351	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-28.9	167.1	0	0	0	0	0	113.9	S142 T264 Y266	S142-G268 WeakPolarHBondContact OG-CA 3.3Å; S142-G268 PolarHBondContact OG-N 2.98Å; T264-G268 PolarHBondContact O-N 3.12Å; Y266-G268 PolarHBondContact O-N 3.02Å
269	A	55.2	Low	70.3	Confident	76 Å²	76	64.8 Å²	64.8	63%	0.628	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-17.9	175.1	0	0	0	0	0	113.9	Y266 P271	Y266-A269 CarbonylContact O-C 3.3Å; Y266-A269 VanDerWaalsContact O-C 3.27Å; Y266-A269 VanDerWaalsContact O-CA 3.25Å; Y266-A269 WeakPolarHBondContact O-CA 3.35Å; Y266-A269 WeakPolarHBondContact O-CB 3.24Å; Y266-A269 PolarHBondContact O-N 3.17Å; A269-P271 VanDerWaalsContact O-CD 3.22Å; A269-P271 WeakPolarHBondContact O-CD 3.31Å
270	I	65.5	Low	70.7	Confident	40 Å²	40	67.9 Å²	67.9	21%	0.205	36%	0.355	C	S	.	.	S	Bend	trans	-71.9	115.6	175.8	-71.6	169	0	0	0	105.9	Y266 K272 L274	Y266-I270 VanDerWaalsContact O-CG1 3.28Å; Y266-I270 WeakPolarHBondContact O-CG1 3.45Å; Y266-I270 PolarHBondContact O-N 3.21Å; I270-K272 PolarHBondContact O-N 3.46Å; I270-L274 HydrophobicContact CG2-CB 3.73Å; I270-L274 HydrophobicContact CG2-CD1 4.43Å
271	P	72.6	Confident	71.4	Confident	58 Å²	58	68.6 Å²	68.6	38%	0.377	36%	0.36	S	S	.	.			trans	-52.1	135.6	176.4	-28	35.4	0	0	0	111.3	A269 W273 L274	A269-P271 VanDerWaalsContact O-CD 3.22Å; A269-P271 WeakPolarHBondContact O-CD 3.31Å; P271-W273 HydrophobicContact CB-CD2 4.46Å; P271-W273 HydrophobicContact CB-CG 4.2Å; P271-W273 PolarHBondContact O-N 3.36Å; P271-L274 WeakPolarHBondContact O-CB 3.39Å; P271-L274 PolarHBondContact O-N 3.14Å
272	K	78.8	Confident	72.2	Confident	110 Å²	110	67 Å²	67	48%	0.478	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-52.6	-31.5	-173.8	-58.9	-168	-178.1	-155.9	0	113.4	E145 I270 L274 R275	E145-K272 WeakPolarHBondContact OE1-CE 3.34Å; E145-K272 IonicContact OE1-NZ 3.75Å; E145-K272 PolarHBondContact OE1-NZ 3.1Å; E145-K272 IonicContact OE2-NZ 3.71Å; I270-K272 PolarHBondContact O-N 3.46Å; K272-L274 VanDerWaalsContact C-N 3.25Å; K272-L274 PolarHBondContact O-N 3.38Å; K272-R275 WeakPolarHBondContact O-CB 3.3Å; K272-R275 PolarHBondContact O-N 3.42Å
273	W	79.1	Confident	73.2	Confident	183 Å²	183	69.9 Å²	69.9	69%	0.693	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-67.1	-17.9	177.7	66.2	-98.3	0	0	0	114.6	P271 P276	P271-W273 HydrophobicContact CB-CD2 4.46Å; P271-W273 HydrophobicContact CB-CG 4.2Å; P271-W273 PolarHBondContact O-N 3.36Å; W273-P276 WeakPolarHBondContact O-CD 3.38Å
274	L	79.8	Confident	74.3	Confident	46 Å²	46	69.7 Å²	69.7	24%	0.241	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-86.6	-15.3	174.7	-77.6	178	0	0	0	113.6	I270 P271 K272 I277 I278	I270-L274 HydrophobicContact CG2-CB 3.73Å; I270-L274 HydrophobicContact CG2-CD1 4.43Å; P271-L274 WeakPolarHBondContact O-CB 3.39Å; P271-L274 PolarHBondContact O-N 3.14Å; K272-L274 VanDerWaalsContact C-N 3.25Å; K272-L274 PolarHBondContact O-N 3.38Å; L274-I277 HydrophobicContact CD2-CD1 4.17Å; L274-I277 WeakPolarHBondContact O-CB 3.43Å; L274-I277 PolarHBondContact O-N 3.3Å; L274-I278 PolarHBondContact O-N 3.33Å
275	R	82.6	Confident	75.6	Confident	34 Å²	34	69.4 Å²	69.4	13%	0.128	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-36	-177.8	-63.7	-179.2	-177.1	169.2	-1.8	113.9	E145 A267 K272 I277 I278 P279	E145-R275 IonicContact OE1-CZ 3.45Å; E145-R275 IonicContact OE1-NH1 3.34Å; E145-R275 PolarHBondContact OE1-NH1 3.44Å; E145-R275 IonicContact OE1-NH2 3.46Å; E145-R275 IonicContact OE2-CZ 3.91Å; E145-R275 VanDerWaalsContact OE2-CZ 3.28Å; E145-R275 IonicContact OE2-NH1 2.75Å; E145-R275 PolarHBondContact OE2-NH1 3.29Å; E145-R275 IonicContact OE2-NH2 2.78Å; E145-R275 PolarHBondContact OE2-NH2 3.08Å; A267-R275 PolarHBondContact O-NH2 3.43Å; K272-R275 WeakPolarHBondContact O-CB 3.3Å; K272-R275 PolarHBondContact O-N 3.42Å; R275-I277 PolarHBondContact O-N 2.68Å; R275-I278 CarbonylContact O-C 3.49Å; R275-I278 VanDerWaalsContact O-C 3.3Å; R275-I278 PolarHBondContact O-N 3.11Å; R275-P279 WeakPolarHBondContact O-CA 3.39Å; R275-P279 WeakPolarHBondContact O-CB 3.39Å; R275-P279 VanDerWaalsContact O-N 3.11Å
276	P	83.1	Confident	76.9	Confident	108 Å²	108	65.2 Å²	65.2	70%	0.701	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-22.9	172.2	-24	35.3	0	0	0	114	W273	W273-P276 WeakPolarHBondContact O-CD 3.38Å
277	I	84.4	Confident	78.7	Confident	121 Å²	121	66.7 Å²	66.7	62%	0.621	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-36.6	-178.8	-57.9	173.6	0	0	0	110.6	L274 R275	L274-I277 HydrophobicContact CD2-CD1 4.17Å; L274-I277 WeakPolarHBondContact O-CB 3.43Å; L274-I277 PolarHBondContact O-N 3.3Å; R275-I277 PolarHBondContact O-N 2.68Å
278	I	82.9	Confident	80.7	Confident	91 Å²	91	66.6 Å²	66.6	47%	0.467	35%	0.353	S	S	.	.	S	Bend	trans	-127.9	72.6	179.4	-46.8	178.2	0	0	0	109.1	L274 R275 P281	L274-I278 PolarHBondContact O-N 3.33Å; R275-I278 CarbonylContact O-C 3.49Å; R275-I278 VanDerWaalsContact O-C 3.3Å; R275-I278 PolarHBondContact O-N 3.11Å; I278-P281 HydrophobicContact CG2-CG 4.24Å
279	P	82.6	Confident	82.6	Confident	52 Å²	52	65 Å²	65	34%	0.338	34%	0.336	S	S	.	.			trans	-75.8	-31.4	-171.5	28.4	-35.2	0	0	0	113.2	R275 W282 E283	R275-P279 WeakPolarHBondContact O-CA 3.39Å; R275-P279 WeakPolarHBondContact O-CB 3.39Å; R275-P279 VanDerWaalsContact O-N 3.11Å; P279-W282 PolarHBondContact O-N 3.36Å; P279-E283 HydrophobicContact CB-CG 4.31Å; P279-E283 PolarHBondContact O-N 2.82Å
280	K	85.4	Confident	84.5	Confident	136 Å²	136	64 Å²	64	59%	0.591	32%	0.321	S	S	*	.	H	α-helix	trans	-49.6	-48.4	-169.2	-178.7	175.2	177.9	178.5	0	114.7	W282 E283 E284	K280-W282 VanDerWaalsContact C-N 3.34Å; K280-W282 PolarHBondContact O-N 3.45Å; K280-E283 PolarHBondContact O-N 3.33Å; K280-E284 WeakPolarHBondContact CE-OE1 3.32Å; K280-E284 HydrophobicContact CG-CG 4.25Å; K280-E284 WeakPolarHBondContact CG-OE1 3.46Å; K280-E284 IonicContact NZ-OE1 3.82Å; K280-E284 WeakPolarHBondContact O-CB 3.44Å; K280-E284 WeakPolarHBondContact O-CG 3.43Å; K280-E284 PolarHBondContact O-N 2.89Å
281	P	83.9	Confident	86	Confident	19 Å²	19	63.1 Å²	63.1	12%	0.123	32%	0.322	C	S	.	.	H	α-helix	trans	-60.4	-39.2	179.3	-26	36.5	0	0	0	114.2	I278 F285	I278-P281 HydrophobicContact CG2-CG 4.24Å; P281-F285 WeakPolarHBondContact O-CB 3.4Å; P281-F285 PolarHBondContact O-N 3.42Å; P281-F285 VanDerWaalsContact O-N 3.16Å
282	W	85.2	Confident	87.1	Confident	26 Å²	26	60.4 Å²	60.4	10%	0.098	30%	0.304	C	S	.	.	H	α-helix	trans	-76.3	-37.1	179.7	-179.8	-104.7	0	0	0	111.9	E145 M149 A267 P279 K280 F285 C286	E145-W282 HydrophobicContact CB-CH2 3.99Å; E145-W282 HydrophobicContact CG-CH2 3.79Å; E145-W282 HydrophobicContact CG-CZ2 3.89Å; M149-W282 HydrophobicContact SD-CZ2 3.72Å; A267-W282 HydrophobicContact CB-CE3 4.34Å; P279-W282 PolarHBondContact O-N 3.36Å; K280-W282 VanDerWaalsContact C-N 3.34Å; K280-W282 PolarHBondContact O-N 3.45Å; W282-F285 HydrophobicContact CE3-CD1 4.1Å; W282-F285 HydrophobicContact CH2-CD1 4.19Å; W282-F285 HydrophobicContact CH2-CE1 4.22Å; W282-F285 AromaticContact CZ3-CD1 3.78Å; W282-F285 HydrophobicContact CZ3-CD1 3.78Å; W282-F285 HydrophobicContact CZ3-CE1 4.01Å; W282-F285 WeakPolarHBondContact O-CB 3.43Å; W282-F285 PolarHBondContact O-N 3.43Å; W282-C286 PolarHBondContact O-N 3.46Å; W282-C286 PolarHBondContact O-SG 2.78Å
283	E	87.6	Confident	87.9	Confident	113 Å²	113	55.2 Å²	55.2	53%	0.528	28%	0.281	S	S	.	.	H	α-helix	trans	-65.1	-46.6	175.3	-72.1	178.1	168.2	0	0	111.4	P279 K280 F285 C286 V287	P279-E283 HydrophobicContact CB-CG 4.31Å; P279-E283 PolarHBondContact O-N 2.82Å; K280-E283 PolarHBondContact O-N 3.33Å; E283-F285 VanDerWaalsContact C-N 3.31Å; E283-F285 PolarHBondContact O-N 3.47Å; E283-C286 PolarHBondContact O-N 2.8Å; E283-V287 WeakPolarHBondContact O-CB 3.39Å; E283-V287 VanDerWaalsContact O-CG2 3.29Å; E283-V287 WeakPolarHBondContact O-CG2 3.44Å; E283-V287 PolarHBondContact O-N 2.88Å
284	E	88.9	Confident	88.8	Confident	49 Å²	49	52.4 Å²	52.4	23%	0.229	27%	0.274	C	S	.	.	H	α-helix	trans	-59.8	-41.7	175.3	-74.6	177	173.6	0	0	111.7	L256 S260 K280 V287 S288	L256-E284 HydrophobicContact CD1-CB 4.23Å; L256-E284 HydrophobicContact CD1-CG 4.19Å; L256-E284 HydrophobicContact CG-CB 4.48Å; S260-E284 PolarHBondContact OG-OE2 2.93Å; K280-E284 WeakPolarHBondContact CE-OE1 3.32Å; K280-E284 HydrophobicContact CG-CG 4.25Å; K280-E284 WeakPolarHBondContact CG-OE1 3.46Å; K280-E284 IonicContact NZ-OE1 3.82Å; K280-E284 WeakPolarHBondContact O-CB 3.44Å; K280-E284 WeakPolarHBondContact O-CG 3.43Å; K280-E284 PolarHBondContact O-N 2.89Å; E284-V287 PolarHBondContact O-N 3.46Å; E284-S288 WeakPolarHBondContact O-CB 3.15Å; E284-S288 PolarHBondContact O-N 3.34Å; E284-S288 PolarHBondContact O-OG 3.43Å
285	F	87.9	Confident	89.6	Confident	6 Å²	6	50.5 Å²	50.5	3%	0.026	26%	0.264	C	S	.	.	H	α-helix	trans	-56.5	-52.6	172.6	-177.6	-106.7	0	0	0	111.5	S142 W143 Y146 T264 P281 W282 E283 V287 S288 W289	S142-F285 VanDerWaalsContact O-CE1 3.32Å; S142-F285 WeakPolarHBondContact O-CE1 3.3Å; W143-F285 AromaticContact CD1-CZ 3.61Å; W143-F285 HydrophobicContact CG-CZ 4.19Å; W143-F285 AromaticContact NE1-CE2 3.96Å; Y146-F285 HydrophobicContact CG-CE1 4.46Å; T264-F285 HydrophobicContact CG2-CB 3.61Å; T264-F285 HydrophobicContact CG2-CD2 3.66Å; T264-F285 HydrophobicContact CG2-CG 4Å; P281-F285 WeakPolarHBondContact O-CB 3.4Å; P281-F285 PolarHBondContact O-N 3.42Å; P281-F285 VanDerWaalsContact O-N 3.16Å; W282-F285 HydrophobicContact CE3-CD1 4.1Å; W282-F285 HydrophobicContact CH2-CD1 4.19Å; W282-F285 HydrophobicContact CH2-CE1 4.22Å; W282-F285 AromaticContact CZ3-CD1 3.78Å; W282-F285 HydrophobicContact CZ3-CD1 3.78Å; W282-F285 HydrophobicContact CZ3-CE1 4.01Å; W282-F285 WeakPolarHBondContact O-CB 3.43Å; W282-F285 PolarHBondContact O-N 3.43Å; E283-F285 VanDerWaalsContact C-N 3.31Å; E283-F285 PolarHBondContact O-N 3.47Å; F285-V287 PolarHBondContact O-N 3.02Å; F285-S288 PolarHBondContact O-N 3.48Å; F285-S288 PolarHBondContact O-OG 3.4Å; F285-W289 AromaticContact CD2-CD1 3.84Å; F285-W289 AromaticContact CD2-NE1 3.83Å; F285-W289 AromaticContact CE1-CD1 3.73Å; F285-W289 AromaticContact CE1-NE1 3.93Å; F285-W289 AromaticContact CE2-CD1 3.53Å; F285-W289 AromaticContact CE2-NE1 3.12Å; F285-W289 AromaticContact CZ-CD1 3.47Å; F285-W289 VanDerWaalsContact CZ-CD1 3.47Å; F285-W289 AromaticContact CZ-NE1 3.17Å; F285-W289 PolarHBondContact O-N 2.94Å; F285-W289 VanDerWaalsContact O-N 3.11Å
286	C	90.6	Very high	90.2	Very high	7 Å²	7	48.9 Å²	48.9	5%	0.047	26%	0.258	C	S	.	.	H	α-helix	trans	-62.6	-43.4	-179.9	-66.7	0	0	0	0	112	Y146 W282 E283 S288 W289 D290	Y146-C286 HydrophobicContact CD2-CB 4.21Å; Y146-C286 HydrophobicContact CE2-CB 4.39Å; W282-C286 PolarHBondContact O-N 3.46Å; W282-C286 PolarHBondContact O-SG 2.78Å; E283-C286 PolarHBondContact O-N 2.8Å; C286-S288 VanDerWaalsContact C-N 3.35Å; C286-S288 PolarHBondContact O-N 2.9Å; C286-W289 PolarHBondContact O-N 3.36Å; C286-D290 WeakPolarHBondContact O-CB 3.28Å; C286-D290 PolarHBondContact O-N 3.27Å
287	V	92.9	Very high	90.9	Very high	88 Å²	88	45.8 Å²	45.8	53%	0.533	23%	0.234	S	C	.	.	H	α-helix	trans	-62.8	-41.8	178.8	169	0	0	0	0	111.1	L256 E283 E284 F285 D290 G291	L256-V287 HydrophobicContact CD2-CB 4.47Å; L256-V287 HydrophobicContact CD2-CG1 4.09Å; E283-V287 WeakPolarHBondContact O-CB 3.39Å; E283-V287 VanDerWaalsContact O-CG2 3.29Å; E283-V287 WeakPolarHBondContact O-CG2 3.44Å; E283-V287 PolarHBondContact O-N 2.88Å; E284-V287 PolarHBondContact O-N 3.46Å; F285-V287 PolarHBondContact O-N 3.02Å; V287-D290 PolarHBondContact O-N 2.53Å; V287-G291 PolarHBondContact O-N 2.98Å
288	S	92.8	Very high	91.4	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.007	22%	0.223	C	C	.	.	H	α-helix	trans	-60.7	-49.4	176.5	71.8	0	0	0	0	111.1	A253 E284 F285 C286 D290 G291 L292	A253-S288 WeakPolarHBondContact O-CB 3.47Å; E284-S288 WeakPolarHBondContact O-CB 3.15Å; E284-S288 PolarHBondContact O-N 3.34Å; E284-S288 PolarHBondContact O-OG 3.43Å; F285-S288 PolarHBondContact O-N 3.48Å; F285-S288 PolarHBondContact O-OG 3.4Å; C286-S288 VanDerWaalsContact C-N 3.35Å; C286-S288 PolarHBondContact O-N 2.9Å; S288-D290 PolarHBondContact O-N 3.2Å; S288-G291 PolarHBondContact O-N 2.8Å; S288-L292 WeakPolarHBondContact O-CG 3.38Å; S288-L292 PolarHBondContact O-N 2.98Å
289	W	93.1	Very high	92.1	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64.3	-39.8	177.4	-82.9	105.6	0	0	0	113.5	W143 Y146 M257 F285 C286 G291 L292 F293 T341 E342 L345	W143-W289 HydrophobicContact CD2-CH2 4.21Å; W143-W289 AromaticContact CD2-CZ2 3.52Å; W143-W289 HydrophobicContact CD2-CZ2 3.52Å; W143-W289 AromaticContact CE2-CZ2 3.63Å; W143-W289 AromaticContact CE3-CH2 3.54Å; W143-W289 HydrophobicContact CE3-CH2 3.54Å; W143-W289 AromaticContact CE3-CZ2 3.34Å; W143-W289 HydrophobicContact CE3-CZ2 3.34Å; W143-W289 HydrophobicContact CG-CZ2 4.4Å; W143-W289 AromaticContact CH2-CH2 3.69Å; W143-W289 HydrophobicContact CH2-CH2 3.69Å; W143-W289 AromaticContact CH2-CZ2 3.44Å; W143-W289 HydrophobicContact CH2-CZ2 3.44Å; W143-W289 VanDerWaalsContact CH2-CZ2 3.44Å; W143-W289 HydrophobicContact CZ2-CH2 4.33Å; W143-W289 AromaticContact CZ2-CZ2 3.6Å; W143-W289 HydrophobicContact CZ2-CZ2 3.6Å; W143-W289 AromaticContact CZ3-CH2 3.26Å; W143-W289 HydrophobicContact CZ3-CH2 3.26Å; W143-W289 AromaticContact CZ3-CZ2 3.32Å; W143-W289 HydrophobicContact CZ3-CZ2 3.32Å; Y146-W289 HydrophobicContact CD1-CB 3.98Å; Y146-W289 HydrophobicContact CD1-CG 4.1Å; Y146-W289 HydrophobicContact CD2-CB 4.02Å; Y146-W289 HydrophobicContact CE1-CB 3.52Å; Y146-W289 HydrophobicContact CE1-CD2 4.45Å; Y146-W289 HydrophobicContact CE1-CG 4.05Å; Y146-W289 HydrophobicContact CE2-CB 3.53Å; Y146-W289 HydrophobicContact CE2-CG 4.48Å; Y146-W289 HydrophobicContact CG-CB 4.23Å; Y146-W289 HydrophobicContact CG-CG 4.4Å; M257-W289 HydrophobicContact SD-CZ2 4.44Å; F285-W289 AromaticContact CD2-CD1 3.84Å; F285-W289 AromaticContact CD2-NE1 3.83Å; F285-W289 AromaticContact CE1-CD1 3.73Å; F285-W289 AromaticContact CE1-NE1 3.93Å; F285-W289 AromaticContact CE2-CD1 3.53Å; F285-W289 AromaticContact CE2-NE1 3.12Å; F285-W289 AromaticContact CZ-CD1 3.47Å; F285-W289 VanDerWaalsContact CZ-CD1 3.47Å; F285-W289 AromaticContact CZ-NE1 3.17Å; F285-W289 PolarHBondContact O-N 2.94Å; F285-W289 VanDerWaalsContact O-N 3.11Å; C286-W289 PolarHBondContact O-N 3.36Å; W289-G291 PolarHBondContact O-N 3.43Å; W289-L292 HydrophobicContact CD2-CD1 4.38Å; W289-L292 HydrophobicContact CE3-CD1 4.1Å; W289-L292 HydrophobicContact CZ3-CD1 4.28Å; W289-L292 PolarHBondContact O-N 2.94Å; W289-F293 AromaticContact CE3-CD2 3.95Å; W289-F293 HydrophobicContact CE3-CD2 3.95Å; W289-F293 AromaticContact CE3-CE2 3.69Å; W289-F293 HydrophobicContact CE3-CE2 3.69Å; W289-F293 HydrophobicContact CZ3-CE2 4.08Å; W289-F293 WeakPolarHBondContact O-CD2 3.28Å; W289-F293 PolarHBondContact O-N 3.36Å; W289-T341 HydrophobicContact CE3-CG2 4.48Å; W289-T341 HydrophobicContact CZ3-CG2 4.06Å; W289-E342 HydrophobicContact CH2-CG 4.4Å; W289-L345 HydrophobicContact CH2-CD2 3.61Å; W289-L345 HydrophobicContact CZ2-CD2 4.13Å; W289-L345 HydrophobicContact CZ3-CD2 4.35Å
290	D	95.8	Very high	92.7	Very high	56 Å²	56	38 Å²	38	30%	0.299	19%	0.19	S	C	.	.	H	α-helix	trans	-58.6	-38.9	175.7	-72.1	-22.8	0	0	0	110.5	Y146 R150 C286 V287 S288 K294	Y146-D290 VanDerWaalsContact CE2-OD1 3.28Å; Y146-D290 WeakPolarHBondContact CE2-OD1 3.37Å; Y146-D290 PolarHBondContact OH-N 2.97Å; Y146-D290 PolarHBondContact OH-OD1 2.85Å; R150-D290 IonicContact CZ-OD1 3.44Å; R150-D290 IonicContact CZ-OD2 3.53Å; R150-D290 IonicContact NE-OD1 2.82Å; R150-D290 PolarHBondContact NE-OD1 3.29Å; R150-D290 IonicContact NE-OD2 3.52Å; R150-D290 PolarHBondContact NE-OD2 3.42Å; R150-D290 IonicContact NH2-OD1 3.9Å; R150-D290 IonicContact NH2-OD2 3.28Å; R150-D290 PolarHBondContact NH2-OD2 3.39Å; C286-D290 WeakPolarHBondContact O-CB 3.28Å; C286-D290 PolarHBondContact O-N 3.27Å; V287-D290 PolarHBondContact O-N 2.53Å; S288-D290 PolarHBondContact O-N 3.2Å; D290-K294 WeakPolarHBondContact O-CB 3.43Å; D290-K294 PolarHBondContact O-N 2.98Å
291	G	95.9	Very high	93.3	Very high	22 Å²	22	34 Å²	34	23%	0.227	18%	0.175	C	C	.	.	H	α-helix	trans	-64.6	-48.1	173	0	0	0	0	0	113.6	V287 S288 W289 F293 K294 F295	V287-G291 PolarHBondContact O-N 2.98Å; S288-G291 PolarHBondContact O-N 2.8Å; W289-G291 PolarHBondContact O-N 3.43Å; G291-F293 PolarHBondContact O-N 3.07Å; G291-K294 PolarHBondContact O-N 3.27Å; G291-F295 PolarHBondContact O-N 2.85Å; G291-F295 VanDerWaalsContact O-N 3.08Å
292	L	95.6	Very high	93.8	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.4	-43.7	179.6	-62.1	176.5	0	0	0	112.1	Y250 A253 L254 M257 S288 W289 S296 T341 L345	Y250-L292 HydrophobicContact CD2-CD2 3.78Å; Y250-L292 HydrophobicContact CE2-CB 4.49Å; Y250-L292 HydrophobicContact CE2-CD2 3.31Å; Y250-L292 HydrophobicContact CE2-CG 4.48Å; A253-L292 HydrophobicContact CB-CD2 4.26Å; A253-L292 HydrophobicContact CB-CG 4.46Å; L254-L292 HydrophobicContact CB-CD2 4.18Å; L254-L292 HydrophobicContact CD1-CD2 4.3Å; M257-L292 HydrophobicContact SD-CD1 4.06Å; S288-L292 WeakPolarHBondContact O-CG 3.38Å; S288-L292 PolarHBondContact O-N 2.98Å; W289-L292 HydrophobicContact CD2-CD1 4.38Å; W289-L292 HydrophobicContact CE3-CD1 4.1Å; W289-L292 HydrophobicContact CZ3-CD1 4.28Å; W289-L292 PolarHBondContact O-N 2.94Å; L292-S296 PolarHBondContact O-N 3.48Å; L292-S296 PolarHBondContact O-OG 2.88Å; L292-T341 HydrophobicContact CB-CG2 3.79Å; L292-L345 HydrophobicContact CD1-CD1 4.39Å; L292-L345 HydrophobicContact CD1-CD2 4.5Å
293	F	96.8	Very high	94.3	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.009	19%	0.193	C	C	.	.	H	α-helix	trans	-66.6	-45.3	176.2	-93.5	-81.3	0	0	0	112	Y146 R147 R152 W289 G291 F295 S296 M297 A338 T341	Y146-F293 AromaticContact CE1-CD2 3.94Å; Y146-F293 HydrophobicContact CE1-CD2 3.94Å; Y146-F293 AromaticContact CE1-CE2 3.84Å; Y146-F293 HydrophobicContact CE1-CE2 3.84Å; R147-F293 VanDerWaalsContact CZ-CE2 3.48Å; R152-F293 HydrophobicContact CB-CE1 4.49Å; R152-F293 HydrophobicContact CB-CZ 4.39Å; R152-F293 HydrophobicContact CG-CE1 4.45Å; W289-F293 AromaticContact CE3-CD2 3.95Å; W289-F293 HydrophobicContact CE3-CD2 3.95Å; W289-F293 AromaticContact CE3-CE2 3.69Å; W289-F293 HydrophobicContact CE3-CE2 3.69Å; W289-F293 HydrophobicContact CZ3-CE2 4.08Å; W289-F293 WeakPolarHBondContact O-CD2 3.28Å; W289-F293 PolarHBondContact O-N 3.36Å; G291-F293 PolarHBondContact O-N 3.07Å; F293-F295 VanDerWaalsContact C-N 3.29Å; F293-F295 PolarHBondContact O-N 3.48Å; F293-S296 PolarHBondContact O-N 2.96Å; F293-M297 VanDerWaalsContact O-CG 3.29Å; F293-M297 WeakPolarHBondContact O-CG 3.03Å; F293-M297 PolarHBondContact O-N 3.48Å; F293-A338 HydrophobicContact CE1-CB 4.16Å; F293-A338 HydrophobicContact CZ-CB 4.21Å; F293-T341 HydrophobicContact CD2-CG2 4.2Å; F293-T341 HydrophobicContact CE2-CG2 4.28Å; F293-T341 HydrophobicContact CG-CG2 4.4Å
294	K	97.1	Very high	94.6	Very high	124 Å²	124	36.2 Å²	36.2	54%	0.539	18%	0.182	S	C	.	.	H	α-helix	trans	-55.9	-46.5	179.1	179.4	-173.6	175	-164.3	0	111.2	D290 G291 M297 I298	D290-K294 WeakPolarHBondContact O-CB 3.43Å; D290-K294 PolarHBondContact O-N 2.98Å; G291-K294 PolarHBondContact O-N 3.27Å; K294-M297 PolarHBondContact O-N 3.1Å; K294-I298 HydrophobicContact CG-CD1 4.13Å; K294-I298 VanDerWaalsContact O-CG1 3.3Å; K294-I298 WeakPolarHBondContact O-CG1 3.31Å; K294-I298 PolarHBondContact O-N 2.88Å; K294-I298 VanDerWaalsContact O-N 3.1Å
295	F	96.4	Very high	94.9	Very high	6 Å²	6	40.8 Å²	40.8	3%	0.026	20%	0.201	C	C	.	.	H	α-helix	trans	-57	-52.4	176.4	-178.5	-94.4	0	0	0	111.3	M224 Y232 L236 E246 Y250 G291 F293 M297 I298 H299 L344	M224-F295 HydrophobicContact CE-CZ 4.18Å; Y232-F295 HydrophobicContact CE2-CE1 4.24Å; L236-F295 HydrophobicContact CD1-CE1 4.34Å; L236-F295 HydrophobicContact CD1-CZ 3.76Å; L236-F295 HydrophobicContact CD2-CZ 3.74Å; L236-F295 HydrophobicContact CG-CZ 4.41Å; E246-F295 WeakPolarHBondContact O-CD2 3.31Å; Y250-F295 HydrophobicContact CD2-CB 3.72Å; Y250-F295 AromaticContact CD2-CD1 3.61Å; Y250-F295 HydrophobicContact CD2-CD1 3.61Å; Y250-F295 HydrophobicContact CD2-CD2 4.28Å; Y250-F295 HydrophobicContact CD2-CE1 4.3Å; Y250-F295 AromaticContact CD2-CG 3.6Å; Y250-F295 HydrophobicContact CD2-CG 3.6Å; Y250-F295 HydrophobicContact CE2-CD1 4.17Å; Y250-F295 HydrophobicContact CG-CB 4.4Å; Y250-F295 HydrophobicContact CG-CD1 4.13Å; Y250-F295 HydrophobicContact CG-CD2 4.2Å; Y250-F295 HydrophobicContact CG-CE1 4.47Å; Y250-F295 AromaticContact CG-CG 3.98Å; Y250-F295 HydrophobicContact CG-CG 3.98Å; G291-F295 PolarHBondContact O-N 2.85Å; G291-F295 VanDerWaalsContact O-N 3.08Å; F293-F295 VanDerWaalsContact C-N 3.29Å; F293-F295 PolarHBondContact O-N 3.48Å; F295-M297 VanDerWaalsContact C-N 3.33Å; F295-M297 PolarHBondContact O-N 3.15Å; F295-I298 WeakPolarHBondContact O-CB 3.48Å; F295-I298 PolarHBondContact O-N 3.44Å; F295-I298 VanDerWaalsContact O-N 3.15Å; F295-H299 AromaticContact CD1-CD2 3.9Å; F295-H299 AromaticContact CD2-NE2 3.95Å; F295-H299 AromaticContact CE1-CD2 3.56Å; F295-H299 AromaticContact CE1-NE2 3.79Å; F295-H299 AromaticContact CE2-CD2 3.8Å; F295-H299 AromaticContact CE2-NE2 3.31Å; F295-H299 VanDerWaalsContact CE2-NE2 3.31Å; F295-H299 WeakPolarHBondContact CE2-NE2 3.44Å; F295-H299 AromaticContact CZ-CD2 3.53Å; F295-H299 AromaticContact CZ-NE2 3.22Å; F295-H299 WeakPolarHBondContact CZ-NE2 3.48Å; F295-H299 PolarHBondContact O-CD2 3.4Å; F295-H299 VanDerWaalsContact O-CD2 3.26Å; F295-H299 PolarHBondContact O-N 3.35Å; F295-L344 HydrophobicContact CD1-CD2 3.87Å; F295-L344 HydrophobicContact CE1-CD2 3.62Å
296	S	96.4	Very high	95.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-58.9	-43.7	-178.6	-56.1	0	0	0	0	112.5	Y232 L292 F293 I298 H299 V300 T341	Y232-S296 WeakPolarHBondContact OH-CB 3.41Å; Y232-S296 PolarHBondContact OH-OG 2.71Å; L292-S296 PolarHBondContact O-N 3.48Å; L292-S296 PolarHBondContact O-OG 2.88Å; F293-S296 PolarHBondContact O-N 2.96Å; S296-I298 PolarHBondContact O-N 3.34Å; S296-H299 PolarHBondContact O-N 2.86Å; S296-V300 WeakPolarHBondContact O-CB 2.93Å; S296-V300 VanDerWaalsContact O-CG2 3.3Å; S296-V300 WeakPolarHBondContact O-CG2 3.36Å; S296-V300 PolarHBondContact O-N 3.11Å; S296-T341 WeakPolarHBondContact CB-OG1 3.39Å; S296-T341 VanDerWaalsContact OG-CA 3.28Å; S296-T341 WeakPolarHBondContact OG-CA 3.4Å; S296-T341 WeakPolarHBondContact OG-CB 3.41Å; S296-T341 PolarHBondContact OG-OG1 3.03Å
297	M	96.8	Very high	95.2	Very high	43 Å²	43	44.4 Å²	44.4	21%	0.212	22%	0.217	C	C	.	.	H	α-helix	trans	-61.5	-42.4	177.2	-71	175.6	72.2	0	0	112.1	R152 F293 K294 F295 H299 V300 D301 Y337	R152-M297 PolarHBondContact NH1-SD 3.16Å; R152-M297 PolarHBondContact NH2-SD 3.36Å; F293-M297 VanDerWaalsContact O-CG 3.29Å; F293-M297 WeakPolarHBondContact O-CG 3.03Å; F293-M297 PolarHBondContact O-N 3.48Å; K294-M297 PolarHBondContact O-N 3.1Å; F295-M297 VanDerWaalsContact C-N 3.33Å; F295-M297 PolarHBondContact O-N 3.15Å; M297-H299 VanDerWaalsContact C-N 3.32Å; M297-H299 PolarHBondContact O-N 3.39Å; M297-V300 PolarHBondContact O-N 2.71Å; M297-D301 WeakPolarHBondContact O-CB 3.06Å; M297-D301 PolarHBondContact O-N 3.02Å; M297-Y337 HydrophobicContact CB-CD1 4.37Å; M297-Y337 HydrophobicContact CB-CE1 4.22Å; M297-Y337 HydrophobicContact CE-CE2 4.18Å; M297-Y337 HydrophobicContact CG-CD1 3.87Å; M297-Y337 HydrophobicContact CG-CD2 4.01Å; M297-Y337 HydrophobicContact CG-CE1 4.02Å; M297-Y337 HydrophobicContact CG-CE2 4.19Å; M297-Y337 HydrophobicContact CG-CG 3.88Å
298	I	95.9	Very high	95.2	Very high	74 Å²	74	45.7 Å²	45.7	38%	0.379	22%	0.215	S	C	.	.	H	α-helix	trans	-57.2	-47.7	178.1	-71.5	163.7	0	0	0	110.6	K294 F295 S296 K302	K294-I298 HydrophobicContact CG-CD1 4.13Å; K294-I298 VanDerWaalsContact O-CG1 3.3Å; K294-I298 WeakPolarHBondContact O-CG1 3.31Å; K294-I298 PolarHBondContact O-N 2.88Å; K294-I298 VanDerWaalsContact O-N 3.1Å; F295-I298 WeakPolarHBondContact O-CB 3.48Å; F295-I298 PolarHBondContact O-N 3.44Å; F295-I298 VanDerWaalsContact O-N 3.15Å; S296-I298 PolarHBondContact O-N 3.34Å; I298-K302 VanDerWaalsContact O-CB 3.31Å; I298-K302 WeakPolarHBondContact O-CB 3.12Å; I298-K302 PolarHBondContact O-N 3.24Å
299	H	95.9	Very high	95.2	Very high	26 Å²	26	47.5 Å²	47.5	12%	0.12	23%	0.23	C	C	.	.	H	α-helix	trans	-71.9	-41.4	-177.6	-73.5	-80.8	0	0	0	112.5	Y232 C234 L236 F295 S296 M297 K302 R303	Y232-H299 HydrophobicContact CD1-CB 3.41Å; Y232-H299 VanDerWaalsContact CD1-CB 3.41Å; Y232-H299 HydrophobicContact CE1-CB 3.92Å; Y232-H299 HydrophobicContact CG-CB 3.82Å; C234-H299 PolarHBondContact SG-ND1 2.84Å; C234-H299 VanDerWaalsContact SG-ND1 3.39Å; L236-H299 WeakPolarHBondContact CD2-CE1 3.32Å; F295-H299 AromaticContact CD1-CD2 3.9Å; F295-H299 AromaticContact CD2-NE2 3.95Å; F295-H299 AromaticContact CE1-CD2 3.56Å; F295-H299 AromaticContact CE1-NE2 3.79Å; F295-H299 AromaticContact CE2-CD2 3.8Å; F295-H299 AromaticContact CE2-NE2 3.31Å; F295-H299 VanDerWaalsContact CE2-NE2 3.31Å; F295-H299 WeakPolarHBondContact CE2-NE2 3.44Å; F295-H299 AromaticContact CZ-CD2 3.53Å; F295-H299 AromaticContact CZ-NE2 3.22Å; F295-H299 WeakPolarHBondContact CZ-NE2 3.48Å; F295-H299 PolarHBondContact O-CD2 3.4Å; F295-H299 VanDerWaalsContact O-CD2 3.26Å; F295-H299 PolarHBondContact O-N 3.35Å; S296-H299 PolarHBondContact O-N 2.86Å; M297-H299 VanDerWaalsContact C-N 3.32Å; M297-H299 PolarHBondContact O-N 3.39Å; H299-K302 PolarHBondContact O-N 2.79Å; H299-R303 PolarHBondContact O-N 3.45Å
300	V	96.8	Very high	95.1	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-64	-44.8	175.6	172.9	0	0	0	0	111.3	Y232 S296 M297 K302 R303 F304 L322 L326 L333 I336 Y337 V340	Y232-V300 HydrophobicContact CD1-CG2 4.4Å; Y232-V300 HydrophobicContact CE1-CG2 4.21Å; S296-V300 WeakPolarHBondContact O-CB 2.93Å; S296-V300 VanDerWaalsContact O-CG2 3.3Å; S296-V300 WeakPolarHBondContact O-CG2 3.36Å; S296-V300 PolarHBondContact O-N 3.11Å; M297-V300 PolarHBondContact O-N 2.71Å; V300-K302 VanDerWaalsContact C-N 3.33Å; V300-K302 PolarHBondContact O-N 3.08Å; V300-R303 PolarHBondContact O-N 3.29Å; V300-F304 WeakPolarHBondContact O-CB 3.43Å; V300-F304 PolarHBondContact O-N 3.26Å; V300-L322 HydrophobicContact CG1-CD1 4.34Å; V300-L322 HydrophobicContact CG2-CD1 3.98Å; V300-L322 HydrophobicContact CG2-CD2 4.17Å; V300-L326 HydrophobicContact CG1-CD2 4.16Å; V300-L333 HydrophobicContact CG1-CD1 4.04Å; V300-I336 HydrophobicContact CG1-CG2 4.18Å; V300-I336 HydrophobicContact CG2-CG2 4.42Å; V300-Y337 HydrophobicContact CB-CD1 3.74Å; V300-Y337 HydrophobicContact CB-CE1 3.6Å; V300-Y337 HydrophobicContact CG1-CD1 3.71Å; V300-Y337 HydrophobicContact CG1-CE1 3.4Å; V300-Y337 HydrophobicContact CG2-CD1 4.05Å; V300-Y337 HydrophobicContact CG2-CE1 4.41Å; V300-V340 HydrophobicContact CG2-CG2 3.69Å
301	D	96.9	Very high	94.8	Very high	52 Å²	52	50.4 Å²	50.4	28%	0.278	25%	0.247	S	C	.	.	H	α-helix	trans	-65	-38.5	179.1	-74.4	-6.8	0	0	0	112	M297 K305 Y337	M297-D301 WeakPolarHBondContact O-CB 3.06Å; M297-D301 PolarHBondContact O-N 3.02Å; D301-K305 WeakPolarHBondContact O-CB 3.35Å; D301-K305 VanDerWaalsContact O-CG 3.24Å; D301-K305 WeakPolarHBondContact O-CG 3.47Å; D301-K305 PolarHBondContact O-N 3.02Å; D301-Y337 PolarHBondContact OD1-OH 3.3Å
302	K	95.3	Very high	94.7	Very high	115 Å²	115	56 Å²	56	50%	0.5	27%	0.268	S	S	.	.	H	α-helix	trans	-59.7	-51.1	173.8	-178	-178	175.4	-175.2	0	110.1	I298 H299 V300 F304 K305 E306	I298-K302 VanDerWaalsContact O-CB 3.31Å; I298-K302 WeakPolarHBondContact O-CB 3.12Å; I298-K302 PolarHBondContact O-N 3.24Å; H299-K302 PolarHBondContact O-N 2.79Å; V300-K302 VanDerWaalsContact C-N 3.33Å; V300-K302 PolarHBondContact O-N 3.08Å; K302-F304 VanDerWaalsContact C-N 3.34Å; K302-F304 PolarHBondContact O-N 3.27Å; K302-K305 PolarHBondContact O-N 3.03Å; K302-E306 WeakPolarHBondContact CE-OE1 3.43Å; K302-E306 WeakPolarHBondContact O-CG 3.3Å; K302-E306 PolarHBondContact O-N 3.3Å
303	R	94.9	Very high	94.5	Very high	25 Å²	25	61.8 Å²	61.8	9%	0.094	30%	0.296	C	S	.	.	H	α-helix	trans	-63.4	-40.9	-179.7	-173.3	56.2	177.2	155.3	-0.7	112.3	E233 H299 V300 K305 E306 I307 K318 L322 T323 L326	E233-R303 IonicContact OE2-CZ 3.52Å; E233-R303 IonicContact OE2-NE 2.68Å; E233-R303 PolarHBondContact OE2-NE 2.85Å; E233-R303 IonicContact OE2-NH2 3.43Å; E233-R303 PolarHBondContact OE2-NH2 2.84Å; H299-R303 PolarHBondContact O-N 3.45Å; V300-R303 PolarHBondContact O-N 3.29Å; R303-K305 VanDerWaalsContact C-N 3.34Å; R303-K305 PolarHBondContact O-N 3.04Å; R303-E306 WeakPolarHBondContact CD-OE2 3.26Å; R303-E306 IonicContact NH1-OE2 3.52Å; R303-E306 PolarHBondContact NH1-OE2 3.24Å; R303-E306 WeakPolarHBondContact O-CB 3.48Å; R303-E306 PolarHBondContact O-N 3.48Å; R303-I307 HydrophobicContact CG-CD1 4.05Å; R303-I307 WeakPolarHBondContact O-CG1 3.27Å; R303-I307 PolarHBondContact O-N 3.4Å; R303-K318 PolarHBondContact NH2-O 3.34Å; R303-L322 HydrophobicContact CB-CD2 3.72Å; R303-L322 HydrophobicContact CB-CG 4.42Å; R303-L322 HydrophobicContact CG-CD2 3.83Å; R303-L322 HydrophobicContact CG-CG 4.11Å; R303-T323 PolarHBondContact NE-OG1 3.05Å; R303-T323 PolarHBondContact NH2-OG1 3.25Å; R303-L326 HydrophobicContact CB-CD1 4.43Å; R303-L326 HydrophobicContact CG-CD1 4.24Å
304	F	93.9	Very high	94.2	Very high	65 Å²	65	65 Å²	65	29%	0.285	33%	0.33	S	S	.	.	H	α-helix	trans	-60.8	-42.4	176.2	-175.7	-102.1	0	0	0	112.2	V300 K302 I307 K308 L326	V300-F304 WeakPolarHBondContact O-CB 3.43Å; V300-F304 PolarHBondContact O-N 3.26Å; K302-F304 VanDerWaalsContact C-N 3.34Å; K302-F304 PolarHBondContact O-N 3.27Å; F304-I307 PolarHBondContact O-N 2.89Å; F304-K308 WeakPolarHBondContact O-CB 3.34Å; F304-K308 PolarHBondContact O-N 3.07Å; F304-L326 HydrophobicContact CB-CD1 4.17Å; F304-L326 HydrophobicContact CD2-CD1 4.42Å; F304-L326 HydrophobicContact CD2-CD2 4.03Å
305	K	94.9	Very high	93.8	Very high	145 Å²	145	64.1 Å²	64.1	63%	0.63	33%	0.327	S	S	*	.	H	α-helix	trans	-63	-41.3	175.2	-73.7	168	-174.4	170.3	0	112.2	D301 K302 R303 K308 A309	D301-K305 WeakPolarHBondContact O-CB 3.35Å; D301-K305 VanDerWaalsContact O-CG 3.24Å; D301-K305 WeakPolarHBondContact O-CG 3.47Å; D301-K305 PolarHBondContact O-N 3.02Å; K302-K305 PolarHBondContact O-N 3.03Å; R303-K305 VanDerWaalsContact C-N 3.34Å; R303-K305 PolarHBondContact O-N 3.04Å; K305-K308 PolarHBondContact O-N 3.1Å; K305-A309 PolarHBondContact O-N 3.35Å
306	E	93.4	Very high	93.4	Very high	76 Å²	76	72.1 Å²	72.1	36%	0.355	36%	0.362	S	S	.	.	H	α-helix	trans	-62.2	-47.3	176.2	-69.7	168.3	-172.8	0	0	111.7	K302 R303 K308 A309 Q310	K302-E306 WeakPolarHBondContact CE-OE1 3.43Å; K302-E306 WeakPolarHBondContact O-CG 3.3Å; K302-E306 PolarHBondContact O-N 3.3Å; R303-E306 WeakPolarHBondContact CD-OE2 3.26Å; R303-E306 IonicContact NH1-OE2 3.52Å; R303-E306 PolarHBondContact NH1-OE2 3.24Å; R303-E306 WeakPolarHBondContact O-CB 3.48Å; R303-E306 PolarHBondContact O-N 3.48Å; E306-K308 VanDerWaalsContact C-N 3.31Å; E306-K308 PolarHBondContact O-N 2.96Å; E306-A309 PolarHBondContact O-N 2.81Å; E306-Q310 WeakPolarHBondContact O-CG 3.47Å; E306-Q310 PolarHBondContact O-N 3.37Å
307	I	92.6	Very high	92.9	Very high	12 Å²	12	74.1 Å²	74.1	6%	0.062	37%	0.374	C	S	.	.	H	α-helix	trans	-59.1	-45.7	176.7	-69	165.6	0	0	0	110.2	R303 F304 A309 Q310 V311 V317 T323 L326 T327	R303-I307 HydrophobicContact CG-CD1 4.05Å; R303-I307 WeakPolarHBondContact O-CG1 3.27Å; R303-I307 PolarHBondContact O-N 3.4Å; F304-I307 PolarHBondContact O-N 2.89Å; I307-A309 VanDerWaalsContact C-N 3.34Å; I307-A309 PolarHBondContact O-N 3.36Å; I307-Q310 PolarHBondContact O-N 3.17Å; I307-V311 HydrophobicContact CG2-CG2 4.49Å; I307-V311 WeakPolarHBondContact O-CG2 3.41Å; I307-V311 PolarHBondContact O-N 2.88Å; I307-V317 HydrophobicContact CG1-CG1 4.11Å; I307-V317 HydrophobicContact CG2-CG1 3.96Å; I307-V317 HydrophobicContact CG2-CG2 4.13Å; I307-T323 HydrophobicContact CD1-CG2 3.85Å; I307-T323 HydrophobicContact CG1-CG2 4.28Å; I307-L326 HydrophobicContact CD1-CB 4.15Å; I307-L326 HydrophobicContact CD1-CD1 3.86Å; I307-T327 HydrophobicContact CG2-CG2 4.37Å
308	K	91.8	Very high	92.2	Very high	115 Å²	115	79.5 Å²	79.5	50%	0.5	40%	0.396	S	S	.	.	H	α-helix	trans	-59.7	-44.9	178.5	-175.8	178.7	170.6	-175	0	111.7	F304 K305 E306 Q310 V311 E312	F304-K308 WeakPolarHBondContact O-CB 3.34Å; F304-K308 PolarHBondContact O-N 3.07Å; K305-K308 PolarHBondContact O-N 3.1Å; E306-K308 VanDerWaalsContact C-N 3.31Å; E306-K308 PolarHBondContact O-N 2.96Å; K308-Q310 PolarHBondContact O-N 3.47Å; K308-V311 PolarHBondContact O-N 2.75Å; K308-E312 WeakPolarHBondContact CE-OE1 3.37Å; K308-E312 IonicContact NZ-OE1 3.86Å; K308-E312 WeakPolarHBondContact O-CG 3.28Å; K308-E312 PolarHBondContact O-N 2.71Å
309	A	92.8	Very high	91.7	Very high	39 Å²	39	78.4 Å²	78.4	32%	0.322	40%	0.403	S	S	.	.	H	α-helix	trans	-62.1	-42.5	177.2	0	0	0	0	0	112	K305 E306 I307 V311 E312 M313	K305-A309 PolarHBondContact O-N 3.35Å; E306-A309 PolarHBondContact O-N 2.81Å; I307-A309 VanDerWaalsContact C-N 3.34Å; I307-A309 PolarHBondContact O-N 3.36Å; A309-V311 PolarHBondContact O-N 2.7Å; A309-E312 PolarHBondContact O-N 3.05Å; A309-M313 HydrophobicContact CB-CE 4.5Å; A309-M313 WeakPolarHBondContact O-CE 3.28Å; A309-M313 VanDerWaalsContact O-CG 3.3Å; A309-M313 WeakPolarHBondContact O-CG 3.26Å; A309-M313 PolarHBondContact O-N 3.4Å
310	Q	91.1	Very high	91.3	Very high	43 Å²	43	78.7 Å²	78.7	20%	0.201	41%	0.413	C	S	.	.	H	α-helix	trans	-60	-44.8	175.8	-71.9	175.9	1.6	0	0	111.8	E306 I307 K308 M313 G314 E315 V317	E306-Q310 WeakPolarHBondContact O-CG 3.47Å; E306-Q310 PolarHBondContact O-N 3.37Å; I307-Q310 PolarHBondContact O-N 3.17Å; K308-Q310 PolarHBondContact O-N 3.47Å; Q310-M313 CarbonylContact O-C 3.59Å; Q310-M313 PolarHBondContact O-N 2.84Å; Q310-G314 PolarHBondContact O-N 3.18Å; Q310-E315 HydrophobicContact CB-CB 4.23Å; Q310-E315 WeakPolarHBondContact O-CB 3.18Å; Q310-E315 PolarHBondContact O-N 3.49Å; Q310-V317 HydrophobicContact CB-CG2 4.35Å
311	V	90.3	Very high	90.9	Very high	74 Å²	74	79 Å²	79	45%	0.448	42%	0.415	S	S	.	.	H	α-helix	trans	-62.9	-43.7	177.1	173.7	0	0	0	0	111.3	I307 K308 A309 M313 G314 V317	I307-V311 HydrophobicContact CG2-CG2 4.49Å; I307-V311 WeakPolarHBondContact O-CG2 3.41Å; I307-V311 PolarHBondContact O-N 2.88Å; K308-V311 PolarHBondContact O-N 2.75Å; A309-V311 PolarHBondContact O-N 2.7Å; V311-M313 VanDerWaalsContact C-N 3.26Å; V311-M313 PolarHBondContact O-N 3.34Å; V311-G314 PolarHBondContact O-N 3.2Å; V311-V317 HydrophobicContact CG2-CG2 3.49Å; V311-V317 VanDerWaalsContact CG2-CG2 3.49Å
312	E	92.8	Very high	90.7	Very high	141 Å²	141	76.5 Å²	76.5	66%	0.659	40%	0.402	S	S	*	.	H	α-helix	trans	-63.6	-31.5	177.4	-73.8	174.3	171.5	0	0	112.5	K308 A309 G314	K308-E312 WeakPolarHBondContact CE-OE1 3.37Å; K308-E312 IonicContact NZ-OE1 3.86Å; K308-E312 WeakPolarHBondContact O-CG 3.28Å; K308-E312 PolarHBondContact O-N 2.71Å; A309-E312 PolarHBondContact O-N 3.05Å; E312-G314 VanDerWaalsContact C-N 3.29Å
313	M	92	Very high	90.6	Very high	121 Å²	121	71.3 Å²	71.3	60%	0.596	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-2.1	174.1	-66.8	-175	-62.1	0	0	113.7	A309 Q310 V311 E315	A309-M313 HydrophobicContact CB-CE 4.5Å; A309-M313 WeakPolarHBondContact O-CE 3.28Å; A309-M313 VanDerWaalsContact O-CG 3.3Å; A309-M313 WeakPolarHBondContact O-CG 3.26Å; A309-M313 PolarHBondContact O-N 3.4Å; Q310-M313 CarbonylContact O-C 3.59Å; Q310-M313 PolarHBondContact O-N 2.84Å; V311-M313 VanDerWaalsContact C-N 3.26Å; V311-M313 PolarHBondContact O-N 3.34Å; M313-E315 VanDerWaalsContact C-N 3.25Å; M313-E315 HydrophobicContact CB-CG 4.03Å; M313-E315 PolarHBondContact O-N 2.81Å
314	G	89.3	Confident	90.3	Very high	69 Å²	69	73.8 Å²	73.8	71%	0.711	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.7	17.5	-176.6	0	0	0	0	0	114	Q310 V311 E312	Q310-G314 PolarHBondContact O-N 3.18Å; V311-G314 PolarHBondContact O-N 3.2Å; E312-G314 VanDerWaalsContact C-N 3.29Å
315	E	90.3	Very high	90.2	Very high	105 Å²	105	70.8 Å²	70.8	49%	0.491	38%	0.379	S	S	.	.			trans	-81.6	149.3	179.2	-63.4	-176.3	165.7	0	0	111.5	Q310 M313 V317	Q310-E315 HydrophobicContact CB-CB 4.23Å; Q310-E315 WeakPolarHBondContact O-CB 3.18Å; Q310-E315 PolarHBondContact O-N 3.49Å; M313-E315 VanDerWaalsContact C-N 3.25Å; M313-E315 HydrophobicContact CB-CG 4.03Å; M313-E315 PolarHBondContact O-N 2.81Å; E315-V317 PolarHBondContact O-N 3.39Å
316	K	86.4	Confident	90	Very high	175 Å²	175	64.2 Å²	64.2	76%	0.761	35%	0.35	S	S	*	.			trans	-71.5	113.7	173.2	-175.5	176.1	-178.7	176.4	0	109.5	K318	K316-K318 PolarHBondContact O-N 2.92Å
317	V	86.6	Confident	89.8	Confident	41 Å²	41	64.1 Å²	64.1	25%	0.248	36%	0.355	C	S	.	.			trans	-59.7	118.9	173.2	-177.7	0	0	0	0	109.6	I307 Q310 V311 E315 T323 T327	I307-V317 HydrophobicContact CG1-CG1 4.11Å; I307-V317 HydrophobicContact CG2-CG1 3.96Å; I307-V317 HydrophobicContact CG2-CG2 4.13Å; Q310-V317 HydrophobicContact CB-CG2 4.35Å; V311-V317 HydrophobicContact CG2-CG2 3.49Å; V311-V317 VanDerWaalsContact CG2-CG2 3.49Å; E315-V317 PolarHBondContact O-N 3.39Å; V317-T323 HydrophobicContact CG1-CG2 3.55Å; V317-T327 HydrophobicContact CG1-CG2 4.34Å
318	K	82.4	Confident	89.4	Confident	157 Å²	157	66 Å²	66	68%	0.683	37%	0.367	S	S	*	.			trans	-119.7	137.4	173.3	-68.3	-178.2	-176.7	177.5	0	108.9	R303 K316	R303-K318 PolarHBondContact NH2-O 3.34Å; K316-K318 PolarHBondContact O-N 2.92Å
319	G	84.4	Confident	88.9	Confident	51 Å²	51	65 Å²	65	53%	0.526	37%	0.365	S	S	.	.			trans	-177.5	-179.1	175.7	0	0	0	0	0	112.1	E233	E233-G319 VanDerWaalsContact OE2-CA 3.26Å; E233-G319 WeakPolarHBondContact OE2-CA 3.49Å
320	G	87.5	Confident	88.7	Confident	32 Å²	32	68.5 Å²	68.5	33%	0.33	38%	0.375	S	S	.	.	S	Bend	trans	-99.5	-130.6	178.5	0	0	0	0	0	112.3	E233 H324	E233-G320 VanDerWaalsContact OE1-CA 3.28Å; E233-G320 WeakPolarHBondContact OE1-CA 3.49Å; E233-G320 PolarHBondContact OE1-N 3.42Å; E233-G320 PolarHBondContact OE2-N 2.96Å; E233-G320 VanDerWaalsContact OE2-N 3.07Å; G320-H324 WeakPolarHBondContact O-CB 3.22Å; G320-H324 PolarHBondContact O-N 2.94Å; G320-H324 VanDerWaalsContact O-N 3.09Å
321	L	89.1	Confident	88.6	Confident	6 Å²	6	66.9 Å²	66.9	3%	0.031	37%	0.368	C	S	.	.	H	α-helix	trans	-64.8	-51.6	-169.3	-179.4	60.4	0	0	0	113.2	L174 I175 L231 E233 H324 M325 M343	L174-L321 HydrophobicContact CB-CD1 3.46Å; L174-L321 VanDerWaalsContact CB-CD1 3.46Å; L174-L321 HydrophobicContact CD1-CD1 3.58Å; L174-L321 HydrophobicContact CG-CD1 4.12Å; I175-L321 HydrophobicContact CG2-CD1 3.79Å; I175-L321 HydrophobicContact CG2-CD2 3.74Å; I175-L321 HydrophobicContact CG2-CG 4.39Å; L231-L321 HydrophobicContact CD1-CD2 3.82Å; E233-L321 PolarHBondContact OE1-N 3.48Å; L321-H324 WeakPolarHBondContact O-CB 3.49Å; L321-H324 PolarHBondContact O-N 3.04Å; L321-M325 HydrophobicContact CG-CE 4.08Å; L321-M325 WeakPolarHBondContact O-CG 3.37Å; L321-M325 PolarHBondContact O-N 2.98Å; L321-M343 HydrophobicContact CD2-CE 4.11Å
322	L	92.9	Very high	88.7	Confident	0 Å²	0	66 Å²	66	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-67.2	-40.5	-176.8	177.6	56.7	0	0	0	111.9	L231 Y232 E233 V300 R303 H324 M325 L326 I336 V340	L231-L322 WeakPolarHBondContact O-CB 3.22Å; Y232-L322 HydrophobicContact CD1-CD2 4.36Å; E233-L322 PolarHBondContact OE1-N 3.32Å; V300-L322 HydrophobicContact CG1-CD1 4.34Å; V300-L322 HydrophobicContact CG2-CD1 3.98Å; V300-L322 HydrophobicContact CG2-CD2 4.17Å; R303-L322 HydrophobicContact CB-CD2 3.72Å; R303-L322 HydrophobicContact CB-CG 4.42Å; R303-L322 HydrophobicContact CG-CD2 3.83Å; R303-L322 HydrophobicContact CG-CG 4.11Å; L322-H324 VanDerWaalsContact C-N 3.28Å; L322-H324 PolarHBondContact O-N 3.35Å; L322-M325 HydrophobicContact CB-CE 4.47Å; L322-M325 HydrophobicContact CD1-CE 4.1Å; L322-M325 PolarHBondContact O-N 3.02Å; L322-L326 HydrophobicContact CD1-CD1 3.87Å; L322-L326 HydrophobicContact CD1-CG 3.93Å; L322-L326 HydrophobicContact CG-CD1 3.82Å; L322-L326 HydrophobicContact CG-CG 4.32Å; L322-L326 WeakPolarHBondContact O-CB 3.5Å; L322-L326 VanDerWaalsContact O-CG 3.31Å; L322-L326 WeakPolarHBondContact O-CG 3.5Å; L322-L326 PolarHBondContact O-N 3.08Å; L322-I336 HydrophobicContact CD1-CG2 3.8Å; L322-V340 HydrophobicContact CD1-CG1 4.45Å
323	T	92.1	Very high	88.8	Confident	6 Å²	6	62.7 Å²	62.7	4%	0.037	35%	0.351	C	S	.	.	H	α-helix	trans	-60.6	-41.7	175.6	-58.4	0	0	0	0	110.9	E233 R303 I307 V317 L326 T327	E233-T323 WeakPolarHBondContact OE1-CB 3.31Å; E233-T323 PolarHBondContact OE1-N 3.04Å; E233-T323 PolarHBondContact OE1-OG1 2.92Å; E233-T323 PolarHBondContact OE2-OG1 3.19Å; R303-T323 PolarHBondContact NE-OG1 3.05Å; R303-T323 PolarHBondContact NH2-OG1 3.25Å; I307-T323 HydrophobicContact CD1-CG2 3.85Å; I307-T323 HydrophobicContact CG1-CG2 4.28Å; V317-T323 HydrophobicContact CG1-CG2 3.55Å; T323-L326 PolarHBondContact O-N 2.72Å; T323-T327 HydrophobicContact CG2-CG2 4.32Å; T323-T327 WeakPolarHBondContact O-CB 3.49Å; T323-T327 VanDerWaalsContact O-CG2 3.23Å; T323-T327 WeakPolarHBondContact O-CG2 3.38Å; T323-T327 PolarHBondContact O-N 3.3Å; T323-T327 PolarHBondContact O-OG1 2.96Å
324	H	89.6	Confident	88.9	Confident	76 Å²	76	59.7 Å²	59.7	35%	0.352	34%	0.336	S	S	.	.	H	α-helix	trans	-62.6	-46.3	175.1	-171.9	83.8	0	0	0	112	L174 G320 L321 L322 L326 T327 T328	L174-H324 WeakPolarHBondContact CD2-CD2 3.22Å; L174-H324 WeakPolarHBondContact CD2-NE2 3.44Å; G320-H324 WeakPolarHBondContact O-CB 3.22Å; G320-H324 PolarHBondContact O-N 2.94Å; G320-H324 VanDerWaalsContact O-N 3.09Å; L321-H324 WeakPolarHBondContact O-CB 3.49Å; L321-H324 PolarHBondContact O-N 3.04Å; L322-H324 VanDerWaalsContact C-N 3.28Å; L322-H324 PolarHBondContact O-N 3.35Å; H324-L326 VanDerWaalsContact C-N 3.34Å; H324-L326 PolarHBondContact O-N 2.86Å; H324-T327 PolarHBondContact O-N 2.86Å; H324-T327 PolarHBondContact O-OG1 3.27Å; H324-T328 VanDerWaalsContact CE1-CG2 3.45Å; H324-T328 WeakPolarHBondContact CE1-CG2 3.13Å; H324-T328 WeakPolarHBondContact NE2-CG2 3.18Å; H324-T328 WeakPolarHBondContact O-CB 3.46Å; H324-T328 WeakPolarHBondContact O-CG2 3.4Å; H324-T328 PolarHBondContact O-N 2.87Å; H324-T328 PolarHBondContact O-OG1 3.42Å
325	M	90.9	Very high	89.2	Confident	2 Å²	2	58.6 Å²	58.6	1%	0.01	31%	0.313	C	S	.	.	H	α-helix	trans	-60.8	-42.1	176.9	-68.4	-172.7	-65.9	0	0	112.1	L171 L174 L321 L322 T327 L331 I336 V340	L171-M325 HydrophobicContact CD2-SD 3.64Å; L174-M325 HydrophobicContact CD1-CG 4.14Å; L321-M325 HydrophobicContact CG-CE 4.08Å; L321-M325 WeakPolarHBondContact O-CG 3.37Å; L321-M325 PolarHBondContact O-N 2.98Å; L322-M325 HydrophobicContact CB-CE 4.47Å; L322-M325 HydrophobicContact CD1-CE 4.1Å; L322-M325 PolarHBondContact O-N 3.02Å; M325-T327 VanDerWaalsContact C-N 3.34Å; M325-T327 PolarHBondContact O-N 3.44Å; M325-L331 HydrophobicContact SD-CD1 4.44Å; M325-I336 HydrophobicContact CB-CD1 4.07Å; M325-I336 HydrophobicContact CB-CG1 4.25Å; M325-V340 HydrophobicContact CE-CG1 3.76Å
326	L	91.9	Very high	89.5	Confident	7 Å²	7	53.7 Å²	53.7	4%	0.037	29%	0.289	C	S	.	.	H	α-helix	trans	-73.9	-18.4	179.7	-69.6	172.5	0	0	0	114.2	V300 R303 F304 I307 L322 T323 H324 M329 L333 I336	V300-L326 HydrophobicContact CG1-CD2 4.16Å; R303-L326 HydrophobicContact CB-CD1 4.43Å; R303-L326 HydrophobicContact CG-CD1 4.24Å; F304-L326 HydrophobicContact CB-CD1 4.17Å; F304-L326 HydrophobicContact CD2-CD1 4.42Å; F304-L326 HydrophobicContact CD2-CD2 4.03Å; I307-L326 HydrophobicContact CD1-CB 4.15Å; I307-L326 HydrophobicContact CD1-CD1 3.86Å; L322-L326 HydrophobicContact CD1-CD1 3.87Å; L322-L326 HydrophobicContact CD1-CG 3.93Å; L322-L326 HydrophobicContact CG-CD1 3.82Å; L322-L326 HydrophobicContact CG-CG 4.32Å; L322-L326 WeakPolarHBondContact O-CB 3.5Å; L322-L326 VanDerWaalsContact O-CG 3.31Å; L322-L326 WeakPolarHBondContact O-CG 3.5Å; L322-L326 PolarHBondContact O-N 3.08Å; T323-L326 PolarHBondContact O-N 2.72Å; H324-L326 VanDerWaalsContact C-N 3.34Å; H324-L326 PolarHBondContact O-N 2.86Å; L326-M329 WeakPolarHBondContact O-CE 3.43Å; L326-L333 HydrophobicContact CD2-CD1 4Å; L326-I336 HydrophobicContact CD2-CD1 3.82Å; L326-I336 HydrophobicContact CD2-CG2 4.41Å; L326-I336 HydrophobicContact CG-CD1 4.44Å
327	T	88.1	Confident	90	Very high	74 Å²	74	45.9 Å²	45.9	45%	0.454	26%	0.255	S	S	.	.	H	α-helix	trans	-100.9	-33.4	-178.1	50.4	0	0	0	0	112.7	I307 V317 T323 H324 M325	I307-T327 HydrophobicContact CG2-CG2 4.37Å; V317-T327 HydrophobicContact CG1-CG2 4.34Å; T323-T327 HydrophobicContact CG2-CG2 4.32Å; T323-T327 WeakPolarHBondContact O-CB 3.49Å; T323-T327 VanDerWaalsContact O-CG2 3.23Å; T323-T327 WeakPolarHBondContact O-CG2 3.38Å; T323-T327 PolarHBondContact O-N 3.3Å; T323-T327 PolarHBondContact O-OG1 2.96Å; H324-T327 PolarHBondContact O-N 2.86Å; H324-T327 PolarHBondContact O-OG1 3.27Å; M325-T327 VanDerWaalsContact C-N 3.34Å; M325-T327 PolarHBondContact O-N 3.44Å
328	T	85.8	Confident	90.4	Very high	52 Å²	52	43.9 Å²	43.9	32%	0.319	24%	0.243	S	C	.	.	H	α-helix	trans	-75.6	-26.1	179.8	52.6	0	0	0	0	113.3	H324 E330	H324-T328 VanDerWaalsContact CE1-CG2 3.45Å; H324-T328 WeakPolarHBondContact CE1-CG2 3.13Å; H324-T328 WeakPolarHBondContact NE2-CG2 3.18Å; H324-T328 WeakPolarHBondContact O-CB 3.46Å; H324-T328 WeakPolarHBondContact O-CG2 3.4Å; H324-T328 PolarHBondContact O-N 2.87Å; H324-T328 PolarHBondContact O-OG1 3.42Å; T328-E330 PolarHBondContact O-N 3.48Å; T328-E330 VanDerWaalsContact O-N 3.14Å
329	M	80.8	Confident	91	Very high	93 Å²	93	36.4 Å²	36.4	46%	0.458	21%	0.211	S	C	.	.			trans	56.2	25.9	179.8	-63.5	-88	134.3	0	0	113.1	W12 L326	W12-M329 HydrophobicContact CH2-SD 3.9Å; L326-M329 WeakPolarHBondContact O-CE 3.43Å
330	E	88.2	Confident	91.6	Very high	113 Å²	113	34 Å²	34	53%	0.528	19%	0.186	S	C	.	.	S	Bend	trans	-73.8	-17.7	172	-68.4	-175.1	168.9	0	0	112.2	V170 T328	V170-E330 HydrophobicContact CG1-CB 4.25Å; V170-E330 WeakPolarHBondContact CG1-OE2 3.25Å; V170-E330 HydrophobicContact CG2-CB 4.13Å; T328-E330 PolarHBondContact O-N 3.48Å; T328-E330 VanDerWaalsContact O-N 3.14Å
331	L	89.1	Confident	92	Very high	10 Å²	10	32.5 Å²	32.5	5%	0.052	17%	0.17	C	C	.	.	S	Bend	trans	-122.8	144.3	172.9	-62.4	175.2	0	0	0	109.3	M167 V170 L171 M325 E335 I336	M167-L331 HydrophobicContact CG-CD2 4.3Å; V170-L331 HydrophobicContact CG1-CD1 4.35Å; V170-L331 HydrophobicContact CG1-CG 4.32Å; L171-L331 HydrophobicContact CD2-CD1 4.4Å; M325-L331 HydrophobicContact SD-CD1 4.44Å; L331-E335 HydrophobicContact CB-CB 4.21Å; L331-I336 HydrophobicContact CB-CG1 3.92Å
332	S	93.3	Very high	92.2	Very high	55 Å²	55	32.2 Å²	32.2	39%	0.385	17%	0.169	S	C	.	.			trans	-68.3	159.9	169.9	68.4	0	0	0	0	111.4	E334 E335 I336	S332-E334 VanDerWaalsContact C-N 3.3Å; S332-E334 PolarHBondContact O-N 3.48Å; S332-E335 VanDerWaalsContact CB-OE2 3.26Å; S332-E335 WeakPolarHBondContact CB-OE2 3.46Å; S332-E335 PolarHBondContact N-OE2 2.92Å; S332-E335 WeakPolarHBondContact O-CB 3.34Å; S332-E335 PolarHBondContact O-N 3.5Å; S332-E335 VanDerWaalsContact O-N 3.11Å; S332-E335 VanDerWaalsContact OG-CD 3.3Å; S332-E335 WeakPolarHBondContact OG-CG 3.38Å; S332-E335 PolarHBondContact OG-N 3.08Å; S332-E335 PolarHBondContact OG-OE2 2.98Å; S332-I336 WeakPolarHBondContact O-CG1 3.33Å; S332-I336 PolarHBondContact O-N 3.29Å
333	L	94.1	Very high	92.3	Very high	71 Å²	71	33.5 Å²	33.5	37%	0.372	18%	0.175	S	C	.	.	H	α-helix	trans	-60.4	-38.3	-179.5	-175.1	59.7	0	0	0	112.8	V300 L326 I336 Y337	V300-L333 HydrophobicContact CG1-CD1 4.04Å; L326-L333 HydrophobicContact CD2-CD1 4Å; L333-I336 PolarHBondContact O-N 2.82Å; L333-Y337 HydrophobicContact CD1-CE1 4.02Å; L333-Y337 HydrophobicContact CD1-CE2 4.37Å; L333-Y337 HydrophobicContact CD2-CE2 4.21Å; L333-Y337 WeakPolarHBondContact CD2-OH 3.25Å; L333-Y337 HydrophobicContact CG-CD2 4.44Å; L333-Y337 HydrophobicContact CG-CE1 4.27Å; L333-Y337 HydrophobicContact CG-CE2 3.73Å; L333-Y337 WeakPolarHBondContact O-CD2 3.39Å; L333-Y337 PolarHBondContact O-N 2.79Å
334	E	95.1	Very high	92.5	Very high	58 Å²	58	33.2 Å²	33.2	27%	0.271	17%	0.173	S	C	.	.	H	α-helix	trans	-68.9	-35	175.5	-71.8	-63.2	134.1	0	0	112.4	R152 S153 S332 I336 Y337 A338	R152-E334 WeakPolarHBondContact CD-OE2 3.38Å; R152-E334 IonicContact CZ-OE2 3.94Å; R152-E334 IonicContact NH1-OE1 2.84Å; R152-E334 PolarHBondContact NH1-OE1 2.88Å; R152-E334 IonicContact NH1-OE2 3.76Å; R152-E334 PolarHBondContact NH1-OE2 2.78Å; S153-E334 WeakPolarHBondContact OG-CB 3.32Å; S332-E334 VanDerWaalsContact C-N 3.3Å; S332-E334 PolarHBondContact O-N 3.48Å; E334-I336 VanDerWaalsContact C-N 3.34Å; E334-Y337 PolarHBondContact O-N 3.12Å; E334-Y337 WeakPolarHBondContact OE1-CD2 3.44Å; E334-Y337 WeakPolarHBondContact OE1-CE2 3.31Å; E334-A338 WeakPolarHBondContact O-CB 3.23Å; E334-A338 PolarHBondContact O-N 3.18Å
335	E	95.1	Very high	92.7	Very high	47 Å²	47	30.1 Å²	30.1	22%	0.22	16%	0.159	C	C	.	.	H	α-helix	trans	-66.7	-36.8	171.5	-70.7	167.6	124.3	0	0	111.3	M167 L331 S332 A338 N339	M167-E335 HydrophobicContact CE-CG 3.93Å; L331-E335 HydrophobicContact CB-CB 4.21Å; S332-E335 VanDerWaalsContact CB-OE2 3.26Å; S332-E335 WeakPolarHBondContact CB-OE2 3.46Å; S332-E335 PolarHBondContact N-OE2 2.92Å; S332-E335 WeakPolarHBondContact O-CB 3.34Å; S332-E335 PolarHBondContact O-N 3.5Å; S332-E335 VanDerWaalsContact O-N 3.11Å; S332-E335 VanDerWaalsContact OG-CD 3.3Å; S332-E335 WeakPolarHBondContact OG-CG 3.38Å; S332-E335 PolarHBondContact OG-N 3.08Å; S332-E335 PolarHBondContact OG-OE2 2.98Å; E335-A338 PolarHBondContact O-N 3.25Å; E335-N339 VanDerWaalsContact O-CB 3.3Å; E335-N339 WeakPolarHBondContact O-CB 3.48Å; E335-N339 PolarHBondContact O-N 3.07Å; E335-N339 PolarHBondContact O-ND2 2.62Å
336	I	95.6	Very high	92.8	Very high	1 Å²	1	32 Å²	32	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-62.6	-49.8	173.9	-67	171.3	0	0	0	109.7	V300 L322 M325 L326 L331 S332 L333 E334 A338 N339 V340	V300-I336 HydrophobicContact CG1-CG2 4.18Å; V300-I336 HydrophobicContact CG2-CG2 4.42Å; L322-I336 HydrophobicContact CD1-CG2 3.8Å; M325-I336 HydrophobicContact CB-CD1 4.07Å; M325-I336 HydrophobicContact CB-CG1 4.25Å; L326-I336 HydrophobicContact CD2-CD1 3.82Å; L326-I336 HydrophobicContact CD2-CG2 4.41Å; L326-I336 HydrophobicContact CG-CD1 4.44Å; L331-I336 HydrophobicContact CB-CG1 3.92Å; S332-I336 WeakPolarHBondContact O-CG1 3.33Å; S332-I336 PolarHBondContact O-N 3.29Å; L333-I336 PolarHBondContact O-N 2.82Å; E334-I336 VanDerWaalsContact C-N 3.34Å; I336-A338 VanDerWaalsContact C-N 3.34Å; I336-A338 PolarHBondContact O-N 3.45Å; I336-N339 PolarHBondContact O-N 3.37Å; I336-V340 HydrophobicContact CG2-CG1 4.36Å; I336-V340 WeakPolarHBondContact O-CG1 3.43Å; I336-V340 WeakPolarHBondContact O-CG2 3.36Å; I336-V340 PolarHBondContact O-N 2.83Å
337	Y	96.8	Very high	92.9	Very high	11 Å²	11	32.3 Å²	32.3	4%	0.043	18%	0.18	C	C	.	.	H	α-helix	trans	-54.5	-50.3	175.5	-63.3	-39.5	0	0	0	111.3	M297 V300 D301 L333 E334 N339 V340 T341	M297-Y337 HydrophobicContact CB-CD1 4.37Å; M297-Y337 HydrophobicContact CB-CE1 4.22Å; M297-Y337 HydrophobicContact CE-CE2 4.18Å; M297-Y337 HydrophobicContact CG-CD1 3.87Å; M297-Y337 HydrophobicContact CG-CD2 4.01Å; M297-Y337 HydrophobicContact CG-CE1 4.02Å; M297-Y337 HydrophobicContact CG-CE2 4.19Å; M297-Y337 HydrophobicContact CG-CG 3.88Å; V300-Y337 HydrophobicContact CB-CD1 3.74Å; V300-Y337 HydrophobicContact CB-CE1 3.6Å; V300-Y337 HydrophobicContact CG1-CD1 3.71Å; V300-Y337 HydrophobicContact CG1-CE1 3.4Å; V300-Y337 HydrophobicContact CG2-CD1 4.05Å; V300-Y337 HydrophobicContact CG2-CE1 4.41Å; D301-Y337 PolarHBondContact OD1-OH 3.3Å; L333-Y337 HydrophobicContact CD1-CE1 4.02Å; L333-Y337 HydrophobicContact CD1-CE2 4.37Å; L333-Y337 HydrophobicContact CD2-CE2 4.21Å; L333-Y337 WeakPolarHBondContact CD2-OH 3.25Å; L333-Y337 HydrophobicContact CG-CD2 4.44Å; L333-Y337 HydrophobicContact CG-CE1 4.27Å; L333-Y337 HydrophobicContact CG-CE2 3.73Å; L333-Y337 WeakPolarHBondContact O-CD2 3.39Å; L333-Y337 PolarHBondContact O-N 2.79Å; E334-Y337 PolarHBondContact O-N 3.12Å; E334-Y337 WeakPolarHBondContact OE1-CD2 3.44Å; E334-Y337 WeakPolarHBondContact OE1-CE2 3.31Å; Y337-N339 PolarHBondContact O-N 3.38Å; Y337-V340 WeakPolarHBondContact O-CG2 3.42Å; Y337-V340 PolarHBondContact O-N 2.89Å; Y337-T341 WeakPolarHBondContact O-CB 3.21Å; Y337-T341 PolarHBondContact O-N 3.14Å; Y337-T341 PolarHBondContact O-OG1 2.56Å
338	A	96.2	Very high	93.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62.6	-43.4	-178.2	0	0	0	0	0	112.9	S153 T154 F293 E334 E335 I336 E342	S153-A338 WeakPolarHBondContact O-CB 3.42Å; T154-A338 VanDerWaalsContact O-CB 3.31Å; T154-A338 WeakPolarHBondContact O-CB 3.1Å; F293-A338 HydrophobicContact CE1-CB 4.16Å; F293-A338 HydrophobicContact CZ-CB 4.21Å; E334-A338 WeakPolarHBondContact O-CB 3.23Å; E334-A338 PolarHBondContact O-N 3.18Å; E335-A338 PolarHBondContact O-N 3.25Å; I336-A338 VanDerWaalsContact C-N 3.34Å; I336-A338 PolarHBondContact O-N 3.45Å; A338-E342 WeakPolarHBondContact O-CB 3.44Å; A338-E342 WeakPolarHBondContact O-CG 3.49Å; A338-E342 PolarHBondContact O-N 2.68Å
339	N	95.3	Very high	93.6	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-66.4	-46.1	179.3	-82	-73.4	0	0	0	111.8	L156 L171 E335 I336 Y337 T341 E342 M343	L156-N339 VanDerWaalsContact CB-OD1 3.31Å; L156-N339 WeakPolarHBondContact CB-OD1 3.46Å; L156-N339 PolarHBondContact N-OD1 3.47Å; L171-N339 HydrophobicContact CD1-CB 4.48Å; L171-N339 WeakPolarHBondContact CD1-OD1 3.35Å; E335-N339 VanDerWaalsContact O-CB 3.3Å; E335-N339 WeakPolarHBondContact O-CB 3.48Å; E335-N339 PolarHBondContact O-N 3.07Å; E335-N339 PolarHBondContact O-ND2 2.62Å; I336-N339 PolarHBondContact O-N 3.37Å; Y337-N339 PolarHBondContact O-N 3.38Å; N339-T341 VanDerWaalsContact C-N 3.35Å; N339-T341 PolarHBondContact O-N 2.91Å; N339-E342 PolarHBondContact O-N 3.48Å; N339-M343 VanDerWaalsContact O-CB 3.28Å; N339-M343 WeakPolarHBondContact O-CB 3.47Å; N339-M343 WeakPolarHBondContact O-CG 3.34Å; N339-M343 PolarHBondContact O-N 2.97Å
340	V	95.3	Very high	94.3	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-69.3	-33.3	179.3	-55	0	0	0	0	112.1	L231 Y232 V300 L322 M325 I336 Y337 L344	L231-V340 HydrophobicContact CD1-CB 4.13Å; L231-V340 HydrophobicContact CD1-CG1 3.82Å; L231-V340 HydrophobicContact CD2-CB 4.05Å; L231-V340 VanDerWaalsContact CD2-O 3.31Å; L231-V340 WeakPolarHBondContact CD2-O 3.45Å; L231-V340 HydrophobicContact CG-CB 4.02Å; L231-V340 HydrophobicContact CG-CG1 4.13Å; Y232-V340 HydrophobicContact CE1-CB 3.91Å; Y232-V340 HydrophobicContact CE1-CG2 3.61Å; Y232-V340 PolarHBondContact OH-O 3.2Å; V300-V340 HydrophobicContact CG2-CG2 3.69Å; L322-V340 HydrophobicContact CD1-CG1 4.45Å; M325-V340 HydrophobicContact CE-CG1 3.76Å; I336-V340 HydrophobicContact CG2-CG1 4.36Å; I336-V340 WeakPolarHBondContact O-CG1 3.43Å; I336-V340 WeakPolarHBondContact O-CG2 3.36Å; I336-V340 PolarHBondContact O-N 2.83Å; Y337-V340 WeakPolarHBondContact O-CG2 3.42Å; Y337-V340 PolarHBondContact O-N 2.89Å; V340-L344 WeakPolarHBondContact O-CB 3.22Å; V340-L344 PolarHBondContact O-N 3.13Å
341	T	96.3	Very high	94.8	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-59.7	-50.2	172.2	-61	0	0	0	0	111.2	W289 L292 F293 S296 Y337 N339 L345	W289-T341 HydrophobicContact CE3-CG2 4.48Å; W289-T341 HydrophobicContact CZ3-CG2 4.06Å; L292-T341 HydrophobicContact CB-CG2 3.79Å; F293-T341 HydrophobicContact CD2-CG2 4.2Å; F293-T341 HydrophobicContact CE2-CG2 4.28Å; F293-T341 HydrophobicContact CG-CG2 4.4Å; S296-T341 WeakPolarHBondContact CB-OG1 3.39Å; S296-T341 VanDerWaalsContact OG-CA 3.28Å; S296-T341 WeakPolarHBondContact OG-CA 3.4Å; S296-T341 WeakPolarHBondContact OG-CB 3.41Å; S296-T341 PolarHBondContact OG-OG1 3.03Å; Y337-T341 WeakPolarHBondContact O-CB 3.21Å; Y337-T341 PolarHBondContact O-N 3.14Å; Y337-T341 PolarHBondContact O-OG1 2.56Å; N339-T341 VanDerWaalsContact C-N 3.35Å; N339-T341 PolarHBondContact O-N 2.91Å; T341-L345 VanDerWaalsContact O-CB 3.3Å; T341-L345 WeakPolarHBondContact O-CB 3.49Å; T341-L345 PolarHBondContact O-N 3.19Å
342	E	94.6	Very high	95.2	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.005	11%	0.11	C	C	.	.	H	α-helix	trans	-70.9	-34.7	-178.2	-74.5	-179	-164.4	0	0	112.9	R147 G155 L156 I157 S158 W289 A338 N339 A346	R147-E342 IonicContact CZ-OE1 3.85Å; R147-E342 VanDerWaalsContact CZ-OE1 3.29Å; R147-E342 IonicContact NH1-OE1 2.96Å; R147-E342 PolarHBondContact NH1-OE1 2.82Å; R147-E342 IonicContact NH2-OE1 2.84Å; R147-E342 PolarHBondContact NH2-OE1 2.63Å; G155-E342 VanDerWaalsContact CA-CD 3.42Å; G155-E342 WeakPolarHBondContact CA-OE1 3.42Å; G155-E342 WeakPolarHBondContact CA-OE2 3.44Å; G155-E342 PolarHBondContact N-OE1 3.45Å; G155-E342 VanDerWaalsContact N-OE1 3.15Å; L156-E342 PolarHBondContact N-OE2 2.77Å; I157-E342 WeakPolarHBondContact CA-OE2 3.46Å; I157-E342 HydrophobicContact CB-CB 4.45Å; I157-E342 WeakPolarHBondContact CB-OE2 3.4Å; I157-E342 HydrophobicContact CD1-CB 3.93Å; I157-E342 WeakPolarHBondContact CD1-O 3.03Å; I157-E342 HydrophobicContact CG1-CB 4.12Å; I157-E342 PolarHBondContact N-OE2 2.6Å; S158-E342 PolarHBondContact N-OE2 2.97Å; S158-E342 PolarHBondContact OG-OE1 3.06Å; W289-E342 HydrophobicContact CH2-CG 4.4Å; A338-E342 WeakPolarHBondContact O-CB 3.44Å; A338-E342 WeakPolarHBondContact O-CG 3.49Å; A338-E342 PolarHBondContact O-N 2.68Å; N339-E342 PolarHBondContact O-N 3.48Å; E342-A346 WeakPolarHBondContact O-CB 3.46Å; E342-A346 PolarHBondContact O-N 2.67Å
343	M	95.1	Very high	95.4	Very high	27 Å²	27	17.5 Å²	17.5	13%	0.133	10%	0.098	C	C	.	.	H	α-helix	trans	-68.3	-42.2	176.3	-73.7	174.9	66.7	0	0	112.2	L171 I175 L231 L321 N339 A346 G347	L171-M343 HydrophobicContact CD1-SD 4.44Å; I175-M343 HydrophobicContact CD1-CE 3.57Å; L231-M343 HydrophobicContact CD1-CB 4.21Å; L231-M343 HydrophobicContact CD1-CE 3.74Å; L231-M343 HydrophobicContact CD1-SD 4.04Å; L231-M343 HydrophobicContact CD2-CB 3.77Å; L321-M343 HydrophobicContact CD2-CE 4.11Å; N339-M343 VanDerWaalsContact O-CB 3.28Å; N339-M343 WeakPolarHBondContact O-CB 3.47Å; N339-M343 WeakPolarHBondContact O-CG 3.34Å; N339-M343 PolarHBondContact O-N 2.97Å; M343-A346 PolarHBondContact O-N 2.8Å; M343-G347 PolarHBondContact O-N 3.15Å
344	L	95.3	Very high	95.6	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-62.6	-49.8	173.7	-176.2	67.7	0	0	0	110.2	V227 A228 L231 Y232 Y250 F295 V340 A346 G347 V348	V227-L344 HydrophobicContact CB-CD1 4.17Å; V227-L344 HydrophobicContact CG1-CD1 3.79Å; A228-L344 HydrophobicContact CB-CD1 4.44Å; L231-L344 HydrophobicContact CD2-CB 3.98Å; Y232-L344 HydrophobicContact CE2-CB 4.18Å; Y232-L344 HydrophobicContact CE2-CD1 4.23Å; Y232-L344 HydrophobicContact CE2-CD2 3.81Å; Y232-L344 HydrophobicContact CE2-CG 4.27Å; Y250-L344 HydrophobicContact CD1-CD2 4.49Å; Y250-L344 HydrophobicContact CD2-CD2 4.1Å; Y250-L344 HydrophobicContact CE1-CD2 3.86Å; Y250-L344 HydrophobicContact CE1-CG 4.34Å; Y250-L344 HydrophobicContact CE2-CD2 3.42Å; Y250-L344 VanDerWaalsContact CE2-CD2 3.42Å; Y250-L344 HydrophobicContact CE2-CG 4.29Å; Y250-L344 WeakPolarHBondContact OH-CD2 3.28Å; Y250-L344 WeakPolarHBondContact OH-CG 3.38Å; F295-L344 HydrophobicContact CD1-CD2 3.87Å; F295-L344 HydrophobicContact CE1-CD2 3.62Å; V340-L344 WeakPolarHBondContact O-CB 3.22Å; V340-L344 PolarHBondContact O-N 3.13Å; L344-A346 VanDerWaalsContact C-N 3.27Å; L344-A346 PolarHBondContact O-N 2.62Å; L344-G347 PolarHBondContact O-N 3.02Å; L344-G347 VanDerWaalsContact O-N 3.08Å; L344-V348 HydrophobicContact CD1-CG2 4.08Å; L344-V348 HydrophobicContact CG-CG2 4.28Å; L344-V348 VanDerWaalsContact O-CG2 3.26Å; L344-V348 WeakPolarHBondContact O-CG2 3.1Å; L344-V348 PolarHBondContact O-N 3.36Å
345	L	93.3	Very high	95.8	Very high	11 Å²	11	11.6 Å²	11.6	6%	0.058	7%	0.068	C	C	.	.	H	α-helix	trans	-50.1	-47.2	177	171.1	61.5	0	0	0	112.2	W143 Y250 L254 M257 F258 W289 L292 T341	W143-L345 HydrophobicContact CH2-CD2 3.9Å; W143-L345 HydrophobicContact CZ3-CD2 4.38Å; Y250-L345 PolarHBondContact OH-N 2.76Å; L254-L345 HydrophobicContact CD1-CD1 3.14Å; M257-L345 HydrophobicContact CE-CD1 3.59Å; M257-L345 HydrophobicContact SD-CD1 3.61Å; M257-L345 HydrophobicContact SD-CD2 3.82Å; M257-L345 HydrophobicContact SD-CG 4.37Å; F258-L345 HydrophobicContact CE2-CD1 4.33Å; F258-L345 HydrophobicContact CZ-CD1 4.45Å; W289-L345 HydrophobicContact CH2-CD2 3.61Å; W289-L345 HydrophobicContact CZ2-CD2 4.13Å; W289-L345 HydrophobicContact CZ3-CD2 4.35Å; L292-L345 HydrophobicContact CD1-CD1 4.39Å; L292-L345 HydrophobicContact CD1-CD2 4.5Å; T341-L345 VanDerWaalsContact O-CB 3.3Å; T341-L345 WeakPolarHBondContact O-CB 3.49Å; T341-L345 PolarHBondContact O-N 3.19Å
346	A	92.9	Very high	96	Very high	41 Å²	41	9.3 Å²	9.3	34%	0.339	6%	0.058	S	C	.	.	H	α-helix	trans	-75	-27	-178.5	0	0	0	0	0	114	I157 E342 M343 L344 T350	I157-A346 HydrophobicContact CD1-CB 3.68Å; E342-A346 WeakPolarHBondContact O-CB 3.46Å; E342-A346 PolarHBondContact O-N 2.67Å; M343-A346 PolarHBondContact O-N 2.8Å; L344-A346 VanDerWaalsContact C-N 3.27Å; L344-A346 PolarHBondContact O-N 2.62Å; A346-T350 WeakPolarHBondContact O-CB 3.38Å; A346-T350 WeakPolarHBondContact O-CG2 3.47Å; A346-T350 PolarHBondContact O-OG1 2.74Å
347	G	94.6	Very high	96.1	Very high	13 Å²	13	9.4 Å²	9.4	13%	0.134	6%	0.058	C	C	.	.	H	α-helix	trans	-81.6	-26.5	-174.4	0	0	0	0	0	114.7	M343 L344 T351	M343-G347 PolarHBondContact O-N 3.15Å; L344-G347 PolarHBondContact O-N 3.02Å; L344-G347 VanDerWaalsContact O-N 3.08Å; G347-T351 PolarHBondContact O-OG1 3.03Å
348	V	94.5	Very high	96.2	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-72.2	-66.9	-171.8	178.4	0	0	0	0	111.9	F220 A223 M224 L254 L344 T350 S352	F220-V348 HydrophobicContact CD1-CG1 4.36Å; F220-V348 HydrophobicContact CD2-CG1 3.5Å; F220-V348 HydrophobicContact CE1-CG1 4.2Å; F220-V348 HydrophobicContact CE2-CG1 3.33Å; F220-V348 HydrophobicContact CG-CG1 4.03Å; F220-V348 HydrophobicContact CZ-CG1 3.72Å; A223-V348 VanDerWaalsContact CB-O 3.25Å; A223-V348 WeakPolarHBondContact CB-O 3.42Å; M224-V348 HydrophobicContact CB-CG1 4.13Å; M224-V348 HydrophobicContact CB-CG2 3.99Å; M224-V348 HydrophobicContact CG-CG2 4.15Å; L254-V348 HydrophobicContact CD2-CB 4.33Å; L254-V348 HydrophobicContact CD2-CG1 4.16Å; L344-V348 HydrophobicContact CD1-CG2 4.08Å; L344-V348 HydrophobicContact CG-CG2 4.28Å; L344-V348 VanDerWaalsContact O-CG2 3.26Å; L344-V348 WeakPolarHBondContact O-CG2 3.1Å; L344-V348 PolarHBondContact O-N 3.36Å; V348-T350 VanDerWaalsContact C-N 3.31Å; V348-T350 PolarHBondContact O-N 3.35Å; V348-S352 WeakPolarHBondContact O-CB 3.32Å; V348-S352 PolarHBondContact O-N 2.87Å; V348-S352 PolarHBondContact O-OG 3.13Å
349	D	93.6	Very high	96.3	Very high	12 Å²	12	8.9 Å²	8.9	6%	0.064	6%	0.056	C	C	.	.	H	α-helix	trans	-69.9	-29.1	-173.1	-82.6	-7.7	0	0	0	113.3	F220 F258 S352 F353 L523	F220-D349 WeakPolarHBondContact CD2-OD1 3.33Å; F220-D349 VanDerWaalsContact CE2-OD1 3.24Å; F220-D349 WeakPolarHBondContact CE2-OD1 3.36Å; F258-D349 WeakPolarHBondContact CD2-OD2 3.18Å; F258-D349 WeakPolarHBondContact CE2-OD2 3.22Å; F258-D349 WeakPolarHBondContact CZ-OD2 3.48Å; D349-S352 VanDerWaalsContact CA-OG 3.31Å; D349-S352 WeakPolarHBondContact CA-OG 3.46Å; D349-S352 PolarHBondContact O-OG 2.8Å; D349-S352 VanDerWaalsContact O-OG 3.05Å; D349-F353 HydrophobicContact CB-CD2 4.26Å; D349-F353 HydrophobicContact CB-CE2 3.71Å; D349-F353 HydrophobicContact CB-CZ 3.99Å; D349-F353 WeakPolarHBondContact O-CB 3.32Å; D349-F353 WeakPolarHBondContact O-CD2 3.46Å; D349-F353 WeakPolarHBondContact O-CG 3.22Å; D349-F353 PolarHBondContact O-N 3.49Å; D349-L523 HydrophobicContact CB-CD1 3.67Å
350	T	96.1	Very high	96.5	Very high	42 Å²	42	9.3 Å²	9.3	26%	0.258	6%	0.058	S	C	.	.	H	α-helix	trans	-69.3	-49.5	-175.3	60.1	0	0	0	0	111.8	A346 V348 T354 V410 L523	A346-T350 WeakPolarHBondContact O-CB 3.38Å; A346-T350 WeakPolarHBondContact O-CG2 3.47Å; A346-T350 PolarHBondContact O-OG1 2.74Å; V348-T350 VanDerWaalsContact C-N 3.31Å; V348-T350 PolarHBondContact O-N 3.35Å; T350-T354 PolarHBondContact O-N 3.15Å; T350-T354 PolarHBondContact O-OG1 3.08Å; T350-V410 HydrophobicContact CG2-CG1 3.77Å; T350-V410 WeakPolarHBondContact O-CG2 3.1Å; T350-L523 HydrophobicContact CG2-CD1 4.18Å
351	T	98	Very high	96.6	Very high	2 Å²	2	9.9 Å²	9.9	1%	0.012	6%	0.061	C	C	.	.	H	α-helix	trans	-67.5	-41	175.7	-59.6	0	0	0	0	110.7	A223 G347 T354 L355 E493 M494	A223-T351 HydrophobicContact CB-CG2 4.19Å; G347-T351 PolarHBondContact O-OG1 3.03Å; T351-T354 PolarHBondContact O-N 2.92Å; T351-L355 HydrophobicContact CG2-CD1 3.95Å; T351-L355 HydrophobicContact CG2-CG 4.42Å; T351-L355 WeakPolarHBondContact O-CG 3.35Å; T351-L355 PolarHBondContact O-N 3.28Å; T351-E493 HydrophobicContact CG2-CB 4.31Å; T351-M494 HydrophobicContact CG2-CG 3.89Å
352	S	97.9	Very high	96.8	Very high	1 Å²	1	9.9 Å²	9.9	1%	0.007	6%	0.061	C	C	.	.	H	α-helix	trans	-64.2	-45.3	-177	73.4	0	0	0	0	113.4	F219 F220 V348 D349 T354 L355 S356	F219-S352 VanDerWaalsContact C-CB 3.44Å; F219-S352 WeakPolarHBondContact O-CB 3.31Å; F220-S352 VanDerWaalsContact CA-CB 3.48Å; V348-S352 WeakPolarHBondContact O-CB 3.32Å; V348-S352 PolarHBondContact O-N 2.87Å; V348-S352 PolarHBondContact O-OG 3.13Å; D349-S352 VanDerWaalsContact CA-OG 3.31Å; D349-S352 WeakPolarHBondContact CA-OG 3.46Å; D349-S352 PolarHBondContact O-OG 2.8Å; D349-S352 VanDerWaalsContact O-OG 3.05Å; S352-T354 VanDerWaalsContact C-N 3.33Å; S352-T354 PolarHBondContact O-N 2.87Å; S352-L355 PolarHBondContact O-N 2.92Å; S352-S356 WeakPolarHBondContact O-CB 3.49Å; S352-S356 PolarHBondContact O-N 2.86Å; S352-S356 PolarHBondContact O-OG 3.42Å
353	F	97.9	Very high	96.9	Very high	30 Å²	30	10.3 Å²	10.3	13%	0.132	6%	0.064	C	C	.	.	H	α-helix	trans	-66	-38.1	177.3	-63.3	-27.3	0	0	0	111.5	D349 S356 W357 L523 C525	D349-F353 HydrophobicContact CB-CD2 4.26Å; D349-F353 HydrophobicContact CB-CE2 3.71Å; D349-F353 HydrophobicContact CB-CZ 3.99Å; D349-F353 WeakPolarHBondContact O-CB 3.32Å; D349-F353 WeakPolarHBondContact O-CD2 3.46Å; D349-F353 WeakPolarHBondContact O-CG 3.22Å; D349-F353 PolarHBondContact O-N 3.49Å; F353-S356 PolarHBondContact O-N 3.01Å; F353-W357 PolarHBondContact O-N 3.48Å; F353-L523 HydrophobicContact CD2-CB 4.31Å; F353-L523 HydrophobicContact CD2-CD1 4.46Å; F353-L523 HydrophobicContact CE2-CB 4.05Å; F353-L523 HydrophobicContact CE2-CD1 4.13Å; F353-C525 HydrophobicContact CD1-CB 4.15Å; F353-C525 HydrophobicContact CD2-CB 3.88Å; F353-C525 HydrophobicContact CE1-CB 3.91Å; F353-C525 HydrophobicContact CE2-CB 3.63Å; F353-C525 HydrophobicContact CG-CB 4.16Å; F353-C525 HydrophobicContact CZ-CB 3.66Å
354	T	98.7	Very high	97.1	Very high	4 Å²	4	13.1 Å²	13.1	3%	0.025	8%	0.077	C	C	.	.	H	α-helix	trans	-65.1	-44.4	177.9	-51.2	0	0	0	0	111.2	T350 T351 S352 W357 A358 T404 L405 V410 M494	T350-T354 PolarHBondContact O-N 3.15Å; T350-T354 PolarHBondContact O-OG1 3.08Å; T351-T354 PolarHBondContact O-N 2.92Å; S352-T354 VanDerWaalsContact C-N 3.33Å; S352-T354 PolarHBondContact O-N 2.87Å; T354-W357 PolarHBondContact O-N 3.17Å; T354-A358 VanDerWaalsContact O-CB 3.32Å; T354-A358 WeakPolarHBondContact O-CB 3.38Å; T354-A358 PolarHBondContact O-N 2.84Å; T354-T404 HydrophobicContact CG2-CG2 4.02Å; T354-T404 WeakPolarHBondContact O-CG2 3.32Å; T354-L405 HydrophobicContact CG2-CD1 4.49Å; T354-L405 HydrophobicContact CG2-CD2 3.69Å; T354-L405 HydrophobicContact CG2-CG 3.79Å; T354-L405 WeakPolarHBondContact OG1-CD2 3.47Å; T354-V410 WeakPolarHBondContact OG1-CG2 2.91Å; T354-M494 VanDerWaalsContact CB-SD 3.59Å; T354-M494 HydrophobicContact CG2-SD 3.35Å; T354-M494 WeakPolarHBondContact CG2-SD 3.31Å
355	L	98.8	Very high	97.2	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-62.5	-42.2	174.4	-73.8	171.3	0	0	0	112.2	F219 Y222 T351 S352 A358 C359 M494 A497 L498	F219-L355 HydrophobicContact CB-CB 4.07Å; F219-L355 HydrophobicContact CB-CD1 4.41Å; F219-L355 HydrophobicContact CD1-CB 3.79Å; F219-L355 HydrophobicContact CD1-CD1 3.88Å; F219-L355 HydrophobicContact CD1-CG 4.41Å; F219-L355 HydrophobicContact CD2-CB 3.96Å; F219-L355 HydrophobicContact CE1-CB 4.21Å; F219-L355 HydrophobicContact CE2-CB 4.35Å; F219-L355 HydrophobicContact CG-CB 3.67Å; F219-L355 HydrophobicContact CG-CD1 4.33Å; F219-L355 HydrophobicContact CZ-CB 4.47Å; Y222-L355 HydrophobicContact CD1-CD1 3.54Å; Y222-L355 HydrophobicContact CE1-CD1 3.61Å; T351-L355 HydrophobicContact CG2-CD1 3.95Å; T351-L355 HydrophobicContact CG2-CG 4.42Å; T351-L355 WeakPolarHBondContact O-CG 3.35Å; T351-L355 PolarHBondContact O-N 3.28Å; S352-L355 PolarHBondContact O-N 2.92Å; L355-A358 PolarHBondContact O-N 3.47Å; L355-C359 PolarHBondContact O-N 3.11Å; L355-C359 PolarHBondContact O-SG 2.99Å; L355-M494 HydrophobicContact CD2-CB 4.34Å; L355-M494 HydrophobicContact CD2-CG 4.19Å; L355-M494 HydrophobicContact CG-CG 4.24Å; L355-A497 HydrophobicContact CD2-CB 4.19Å; L355-L498 HydrophobicContact CD2-CD1 4.19Å; L355-L498 HydrophobicContact CD2-CD2 3.95Å; L355-L498 HydrophobicContact CD2-CG 3.75Å
356	S	98.7	Very high	97.4	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-59.2	-49.1	177.4	-56.3	0	0	0	0	111.4	N216 S352 F353 Y360	N216-S356 WeakPolarHBondContact ND2-CB 3.19Å; N216-S356 PolarHBondContact ND2-OG 3.35Å; S352-S356 WeakPolarHBondContact O-CB 3.49Å; S352-S356 PolarHBondContact O-N 2.86Å; S352-S356 PolarHBondContact O-OG 3.42Å; F353-S356 PolarHBondContact O-N 3.01Å; S356-Y360 VanDerWaalsContact O-CB 3.31Å; S356-Y360 WeakPolarHBondContact O-CB 3.35Å; S356-Y360 PolarHBondContact O-N 3.34Å
357	W	98.6	Very high	97.7	Very high	2 Å²	2	20.3 Å²	20.3	1%	0.008	11%	0.108	C	C	.	.	H	α-helix	trans	-65.2	-41.5	176.1	-75.8	122.7	0	0	0	112.1	F353 T354 C359 Y360 M361 T404 F408 V516 A518 P526	F353-W357 PolarHBondContact O-N 3.48Å; T354-W357 PolarHBondContact O-N 3.17Å; W357-C359 PolarHBondContact O-N 3.17Å; W357-Y360 AromaticContact CE3-CD1 3.86Å; W357-Y360 HydrophobicContact CE3-CD1 3.86Å; W357-Y360 HydrophobicContact CE3-CG 4.48Å; W357-Y360 AromaticContact CZ3-CD1 3.82Å; W357-Y360 HydrophobicContact CZ3-CD1 3.82Å; W357-Y360 HydrophobicContact CZ3-CE1 4.04Å; W357-Y360 PolarHBondContact O-N 2.77Å; W357-M361 WeakPolarHBondContact O-CB 3.35Å; W357-M361 WeakPolarHBondContact O-CG 3.32Å; W357-M361 PolarHBondContact O-N 2.79Å; W357-T404 HydrophobicContact CB-CG2 3.63Å; W357-F408 HydrophobicContact CB-CB 4.32Å; W357-F408 HydrophobicContact CB-CD2 3.94Å; W357-F408 HydrophobicContact CB-CG 4.23Å; W357-F408 AromaticContact CD1-CG 3.9Å; W357-F408 HydrophobicContact CD2-CB 4.17Å; W357-F408 AromaticContact CD2-CD1 3.7Å; W357-F408 HydrophobicContact CD2-CD1 3.7Å; W357-F408 AromaticContact CD2-CD2 3.89Å; W357-F408 HydrophobicContact CD2-CD2 3.89Å; W357-F408 HydrophobicContact CD2-CE1 4.01Å; W357-F408 HydrophobicContact CD2-CE2 4.19Å; W357-F408 AromaticContact CD2-CG 3.63Å; W357-F408 HydrophobicContact CD2-CG 3.63Å; W357-F408 HydrophobicContact CD2-CZ 4.24Å; W357-F408 AromaticContact CE2-CD1 3.58Å; W357-F408 AromaticContact CE2-CG 3.85Å; W357-F408 AromaticContact CE3-CD1 4Å; W357-F408 HydrophobicContact CE3-CD1 4Å; W357-F408 HydrophobicContact CE3-CD2 4.08Å; W357-F408 AromaticContact CE3-CE1 3.8Å; W357-F408 HydrophobicContact CE3-CE1 3.8Å; W357-F408 AromaticContact CE3-CE2 3.89Å; W357-F408 HydrophobicContact CE3-CE2 3.89Å; W357-F408 HydrophobicContact CE3-CG 4.13Å; W357-F408 AromaticContact CE3-CZ 3.73Å; W357-F408 HydrophobicContact CE3-CZ 3.73Å; W357-F408 HydrophobicContact CG-CB 3.78Å; W357-F408 HydrophobicContact CG-CD1 4.23Å; W357-F408 AromaticContact CG-CD2 3.86Å; W357-F408 HydrophobicContact CG-CD2 3.86Å; W357-F408 AromaticContact CG-CG 3.68Å; W357-F408 HydrophobicContact CG-CG 3.68Å; W357-F408 HydrophobicContact CH2-CD1 4.1Å; W357-F408 AromaticContact CH2-CE1 3.78Å; W357-F408 HydrophobicContact CH2-CE1 3.78Å; W357-F408 HydrophobicContact CH2-CZ 4.39Å; W357-F408 AromaticContact CZ2-CD1 3.79Å; W357-F408 HydrophobicContact CZ2-CD1 3.79Å; W357-F408 AromaticContact CZ2-CE1 3.97Å; W357-F408 HydrophobicContact CZ2-CE1 3.97Å; W357-F408 HydrophobicContact CZ3-CD1 4.2Å; W357-F408 AromaticContact CZ3-CE1 3.69Å; W357-F408 HydrophobicContact CZ3-CE1 3.69Å; W357-F408 HydrophobicContact CZ3-CE2 4.45Å; W357-F408 AromaticContact CZ3-CZ 3.83Å; W357-F408 HydrophobicContact CZ3-CZ 3.83Å; W357-F408 AromaticContact NE1-CG 3.98Å; W357-V516 HydrophobicContact CH2-CG1 4.02Å; W357-V516 HydrophobicContact CZ3-CG1 4.38Å; W357-A518 HydrophobicContact CH2-CB 4.47Å; W357-A518 HydrophobicContact CZ2-CB 4.01Å; W357-P526 HydrophobicContact CD2-CG 4.25Å; W357-P526 HydrophobicContact CH2-CB 4.46Å; W357-P526 HydrophobicContact CH2-CG 4.38Å; W357-P526 HydrophobicContact CZ2-CB 4.12Å; W357-P526 HydrophobicContact CZ2-CG 3.75Å
358	A	98.8	Very high	97.8	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.008	11%	0.105	C	C	.	.	H	α-helix	trans	-59.1	-49.5	178	0	0	0	0	0	111.2	T354 L355 Y360 M361 L362 L400 T404 L498	T354-A358 VanDerWaalsContact O-CB 3.32Å; T354-A358 WeakPolarHBondContact O-CB 3.38Å; T354-A358 PolarHBondContact O-N 2.84Å; L355-A358 PolarHBondContact O-N 3.47Å; A358-Y360 PolarHBondContact O-N 3.11Å; A358-M361 PolarHBondContact O-N 2.99Å; A358-L362 VanDerWaalsContact O-CG 3.26Å; A358-L362 WeakPolarHBondContact O-CG 3.28Å; A358-L362 PolarHBondContact O-N 3.27Å; A358-L400 HydrophobicContact CB-CD1 4.27Å; A358-T404 HydrophobicContact CB-CG2 4.12Å; A358-L498 HydrophobicContact CB-CD1 4.12Å; A358-L498 HydrophobicContact CB-CD2 3.94Å
359	C	98.8	Very high	98	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-66.2	-37.2	177.9	-68.9	0	0	0	0	112.7	F219 L355 W357 L362 A363 I507 L532	F219-C359 HydrophobicContact CE2-CB 4.14Å; F219-C359 HydrophobicContact CZ-CB 4.29Å; F219-C359 VanDerWaalsContact CZ-SG 3.51Å; L355-C359 PolarHBondContact O-N 3.11Å; L355-C359 PolarHBondContact O-SG 2.99Å; W357-C359 PolarHBondContact O-N 3.17Å; C359-L362 PolarHBondContact O-N 3.31Å; C359-A363 WeakPolarHBondContact O-CB 3.44Å; C359-A363 PolarHBondContact O-N 3.46Å; C359-I507 HydrophobicContact CB-CD1 4.34Å; C359-I507 HydrophobicContact CB-CG2 4.47Å; C359-L532 HydrophobicContact CB-CD1 3.57Å
360	Y	98.6	Very high	98.2	Very high	9 Å²	9	23.5 Å²	23.5	4%	0.035	12%	0.119	C	C	.	.	H	α-helix	trans	-60.9	-47.4	173.3	-178.1	-107	0	0	0	112	S356 W357 A358 L362 A363 Q364 M509 T513 V516 I530	S356-Y360 VanDerWaalsContact O-CB 3.31Å; S356-Y360 WeakPolarHBondContact O-CB 3.35Å; S356-Y360 PolarHBondContact O-N 3.34Å; W357-Y360 AromaticContact CE3-CD1 3.86Å; W357-Y360 HydrophobicContact CE3-CD1 3.86Å; W357-Y360 HydrophobicContact CE3-CG 4.48Å; W357-Y360 AromaticContact CZ3-CD1 3.82Å; W357-Y360 HydrophobicContact CZ3-CD1 3.82Å; W357-Y360 HydrophobicContact CZ3-CE1 4.04Å; W357-Y360 PolarHBondContact O-N 2.77Å; A358-Y360 PolarHBondContact O-N 3.11Å; Y360-L362 PolarHBondContact O-N 3.36Å; Y360-A363 PolarHBondContact O-N 3.32Å; Y360-Q364 HydrophobicContact CE1-CG 4.47Å; Y360-Q364 VanDerWaalsContact CZ-NE2 3.29Å; Y360-Q364 WeakPolarHBondContact O-CG 3.29Å; Y360-Q364 PolarHBondContact O-N 3.09Å; Y360-Q364 VanDerWaalsContact O-N 3.08Å; Y360-Q364 PolarHBondContact OH-NE2 3.45Å; Y360-Q364 VanDerWaalsContact OH-NE2 3.1Å; Y360-M509 HydrophobicContact CD2-CE 3.69Å; Y360-M509 HydrophobicContact CD2-SD 4.24Å; Y360-M509 HydrophobicContact CE2-CE 3.52Å; Y360-M509 HydrophobicContact CE2-SD 4Å; Y360-T513 HydrophobicContact CE2-CG2 3.94Å; Y360-V516 HydrophobicContact CE2-CB 4.23Å; Y360-V516 HydrophobicContact CE2-CG2 4.04Å; Y360-V516 PolarHBondContact OH-N 3.47Å; Y360-I530 HydrophobicContact CD2-CD1 4.44Å; Y360-I530 HydrophobicContact CD2-CG1 4.24Å; Y360-I530 HydrophobicContact CD2-CG2 3.75Å; Y360-I530 HydrophobicContact CG-CD1 4.36Å; Y360-I530 HydrophobicContact CG-CG2 4.42Å
361	M	98.4	Very high	98.3	Very high	12 Å²	12	26.3 Å²	26.3	6%	0.059	13%	0.13	C	C	.	.	H	α-helix	trans	-65.8	-39	178.5	-65.9	-53.4	-70.8	0	0	111.8	W357 A358 A363 Q364 H365 L407 F408 F455	W357-M361 WeakPolarHBondContact O-CB 3.35Å; W357-M361 WeakPolarHBondContact O-CG 3.32Å; W357-M361 PolarHBondContact O-N 2.79Å; A358-M361 PolarHBondContact O-N 2.99Å; M361-A363 VanDerWaalsContact C-N 3.33Å; M361-A363 PolarHBondContact O-N 3.12Å; M361-Q364 PolarHBondContact O-N 3.08Å; M361-Q364 PolarHBondContact SD-OE1 2.93Å; M361-H365 PolarHBondContact O-N 3Å; M361-H365 PolarHBondContact O-ND1 3.15Å; M361-L407 HydrophobicContact CE-CD1 3.94Å; M361-F408 HydrophobicContact CE-CE2 4.49Å; M361-F408 HydrophobicContact CG-CE2 3.94Å; M361-F408 HydrophobicContact SD-CE2 3.69Å; M361-F408 HydrophobicContact SD-CZ 4.11Å; M361-F455 HydrophobicContact CB-CD1 3.99Å; M361-F455 HydrophobicContact CB-CD2 4.14Å; M361-F455 HydrophobicContact CB-CE1 3.73Å; M361-F455 HydrophobicContact CB-CE2 3.89Å; M361-F455 HydrophobicContact CB-CG 4.19Å; M361-F455 HydrophobicContact CB-CZ 3.65Å; M361-F455 HydrophobicContact CE-CB 3.39Å; M361-F455 HydrophobicContact CE-CD1 4.19Å; M361-F455 HydrophobicContact CE-CD2 3.85Å; M361-F455 HydrophobicContact CE-CG 3.55Å; M361-F455 HydrophobicContact CG-CD2 4.28Å; M361-F455 HydrophobicContact CG-CE2 4.26Å
362	L	98.6	Very high	98.3	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-62.4	-39.1	174.1	-72.2	173	0	0	0	112.5	A358 C359 Y360 Q364 H365 I368 Q369 I372 L400 I502	A358-L362 VanDerWaalsContact O-CG 3.26Å; A358-L362 WeakPolarHBondContact O-CG 3.28Å; A358-L362 PolarHBondContact O-N 3.27Å; C359-L362 PolarHBondContact O-N 3.31Å; Y360-L362 PolarHBondContact O-N 3.36Å; L362-Q364 VanDerWaalsContact C-N 3.31Å; L362-H365 CarbonylContact O-C 3.56Å; L362-H365 VanDerWaalsContact O-C 3.31Å; L362-H365 PolarHBondContact O-N 3.45Å; L362-I368 HydrophobicContact CD2-CG2 4.47Å; L362-Q369 HydrophobicContact CB-CB 4.49Å; L362-Q369 HydrophobicContact CB-CG 4.27Å; L362-Q369 HydrophobicContact CD2-CB 4.09Å; L362-Q369 HydrophobicContact CD2-CG 4.17Å; L362-Q369 PolarHBondContact O-NE2 3.45Å; L362-Q369 VanDerWaalsContact O-NE2 3.1Å; L362-I372 HydrophobicContact CD2-CD1 3.79Å; L362-L400 HydrophobicContact CD1-CD1 4.44Å; L362-L400 HydrophobicContact CD1-CD2 3.92Å; L362-L400 HydrophobicContact CD2-CD1 4.06Å; L362-L400 HydrophobicContact CD2-CD2 4.3Å; L362-L400 HydrophobicContact CG-CD1 4.12Å; L362-L400 HydrophobicContact CG-CD2 4.4Å; L362-I502 HydrophobicContact CD1-CD1 3.87Å; L362-I502 HydrophobicContact CD1-CG1 4.22Å
363	A	98.3	Very high	98.2	Very high	10 Å²	10	27.7 Å²	27.7	8%	0.083	14%	0.135	C	C	.	.	H	α-helix	trans	-67.3	-32.3	176.6	0	0	0	0	0	112.5	C359 Y360 M361 I507 M509 L532	C359-A363 WeakPolarHBondContact O-CB 3.44Å; C359-A363 PolarHBondContact O-N 3.46Å; Y360-A363 PolarHBondContact O-N 3.32Å; M361-A363 VanDerWaalsContact C-N 3.33Å; M361-A363 PolarHBondContact O-N 3.12Å; A363-I507 WeakPolarHBondContact CA-O 3.41Å; A363-I507 HydrophobicContact CB-CG2 4.31Å; A363-M509 HydrophobicContact CB-CB 4.45Å; A363-M509 HydrophobicContact CB-CE 3.92Å; A363-L532 HydrophobicContact CB-CD2 3.78Å
364	Q	97.6	Very high	98.2	Very high	85 Å²	85	28.8 Å²	28.8	40%	0.397	14%	0.144	S	C	.	.	H	α-helix	trans	-76.4	-21.8	173.3	-70.2	-176.1	-37.5	0	0	113.4	Y360 M361 L362 P366 M509	Y360-Q364 HydrophobicContact CE1-CG 4.47Å; Y360-Q364 VanDerWaalsContact CZ-NE2 3.29Å; Y360-Q364 WeakPolarHBondContact O-CG 3.29Å; Y360-Q364 PolarHBondContact O-N 3.09Å; Y360-Q364 VanDerWaalsContact O-N 3.08Å; Y360-Q364 PolarHBondContact OH-NE2 3.45Å; Y360-Q364 VanDerWaalsContact OH-NE2 3.1Å; M361-Q364 PolarHBondContact O-N 3.08Å; M361-Q364 PolarHBondContact SD-OE1 2.93Å; L362-Q364 VanDerWaalsContact C-N 3.31Å; Q364-P366 VanDerWaalsContact C-CD 3.46Å; Q364-P366 WeakPolarHBondContact O-CD 3.44Å; Q364-M509 HydrophobicContact CG-CE 3.54Å
365	H	98.4	Very high	98.1	Very high	36 Å²	36	29.7 Å²	29.7	17%	0.167	15%	0.148	C	C	.	.			trans	-125.6	71.3	-175.8	-55.6	79.1	0	0	0	112.2	M361 L362 H367 I368 Q369 F455	M361-H365 PolarHBondContact O-N 3Å; M361-H365 PolarHBondContact O-ND1 3.15Å; L362-H365 CarbonylContact O-C 3.56Å; L362-H365 VanDerWaalsContact O-C 3.31Å; L362-H365 PolarHBondContact O-N 3.45Å; H365-H367 PolarHBondContact O-N 3.08Å; H365-H367 VanDerWaalsContact O-N 3.13Å; H365-I368 HydrophobicContact CB-CB 4.06Å; H365-I368 HydrophobicContact CB-CD1 3.83Å; H365-I368 HydrophobicContact CB-CG1 4.16Å; H365-I368 PolarHBondContact O-N 3.21Å; H365-Q369 PolarHBondContact O-N 3.11Å; H365-Q369 VanDerWaalsContact O-N 3.12Å; H365-F455 HydrophobicContact CB-CD1 4.23Å; H365-F455 AromaticContact CG-CD1 3.8Å; H365-F455 AromaticContact ND1-CD1 3.63Å
366	P	97.9	Very high	98	Very high	57 Å²	57	29.7 Å²	29.7	37%	0.37	15%	0.148	S	C	.	.	H	α-helix	trans	-52.2	-37.8	-179.4	-31.1	37.3	0	0	0	114.8	Q364 Q369 E370 Y506	Q364-P366 VanDerWaalsContact C-CD 3.46Å; Q364-P366 WeakPolarHBondContact O-CD 3.44Å; P366-Q369 WeakPolarHBondContact O-CB 3.3Å; P366-Q369 PolarHBondContact O-N 3.31Å; P366-E370 PolarHBondContact O-N 2.85Å; P366-Y506 HydrophobicContact CB-CE2 4.4Å; P366-Y506 WeakPolarHBondContact CB-OH 3.43Å; P366-Y506 WeakPolarHBondContact CG-OH 3.49Å
367	H	97.9	Very high	97.8	Very high	111 Å²	111	31.4 Å²	31.4	51%	0.514	16%	0.159	S	C	.	.	H	α-helix	trans	-65.2	-39.3	-179.9	67.3	-78.6	0	0	0	112.8	H365 E370 Q371	H365-H367 PolarHBondContact O-N 3.08Å; H365-H367 VanDerWaalsContact O-N 3.13Å; H367-E370 PolarHBondContact O-N 2.82Å; H367-Q371 WeakPolarHBondContact O-CG 3.19Å; H367-Q371 PolarHBondContact O-N 3.1Å; H367-Q371 VanDerWaalsContact O-N 3.12Å
368	I	98.3	Very high	97.6	Very high	12 Å²	12	38.8 Å²	38.8	6%	0.062	19%	0.193	C	C	.	.	H	α-helix	trans	-68.2	-42.4	175.2	-69.4	173.1	0	0	0	109.8	L362 H365 E370 Q371 I372 F455 P457	L362-I368 HydrophobicContact CD2-CG2 4.47Å; H365-I368 HydrophobicContact CB-CB 4.06Å; H365-I368 HydrophobicContact CB-CD1 3.83Å; H365-I368 HydrophobicContact CB-CG1 4.16Å; H365-I368 PolarHBondContact O-N 3.21Å; I368-E370 VanDerWaalsContact C-N 3.27Å; I368-E370 PolarHBondContact O-N 3.34Å; I368-Q371 PolarHBondContact O-N 2.98Å; I368-I372 HydrophobicContact CG2-CD1 3.75Å; I368-I372 HydrophobicContact CG2-CG1 4.45Å; I368-I372 VanDerWaalsContact O-CG1 3.32Å; I368-I372 WeakPolarHBondContact O-CG1 3.2Å; I368-I372 PolarHBondContact O-N 3.49Å; I368-F455 HydrophobicContact CD1-CD1 3.69Å; I368-F455 HydrophobicContact CD1-CE1 4.17Å; I368-F455 WeakPolarHBondContact CD1-O 3.48Å; I368-F455 HydrophobicContact CG2-CE1 4.08Å; I368-P457 HydrophobicContact CG2-CG 3.76Å
369	Q	98.4	Very high	97.5	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-58.6	-41.2	177.2	-164	-173.6	147	0	0	111.7	L362 H365 P366 I372 Y373 I507	L362-Q369 HydrophobicContact CB-CB 4.49Å; L362-Q369 HydrophobicContact CB-CG 4.27Å; L362-Q369 HydrophobicContact CD2-CB 4.09Å; L362-Q369 HydrophobicContact CD2-CG 4.17Å; L362-Q369 PolarHBondContact O-NE2 3.45Å; L362-Q369 VanDerWaalsContact O-NE2 3.1Å; H365-Q369 PolarHBondContact O-N 3.11Å; H365-Q369 VanDerWaalsContact O-N 3.12Å; P366-Q369 WeakPolarHBondContact O-CB 3.3Å; P366-Q369 PolarHBondContact O-N 3.31Å; Q369-I372 PolarHBondContact O-N 3.37Å; Q369-Y373 WeakPolarHBondContact O-CB 3.38Å; Q369-Y373 PolarHBondContact O-N 2.85Å; Q369-I507 PolarHBondContact NE2-O 2.64Å
370	E	97.8	Very high	97.3	Very high	79 Å²	79	42.2 Å²	42.2	37%	0.369	21%	0.213	S	C	.	.	H	α-helix	trans	-70.6	-36.6	178.8	-165.4	55.4	-148.9	0	0	113.1	P366 H367 I368 Y373 T374 R537	P366-E370 PolarHBondContact O-N 2.85Å; H367-E370 PolarHBondContact O-N 2.82Å; I368-E370 VanDerWaalsContact C-N 3.27Å; I368-E370 PolarHBondContact O-N 3.34Å; E370-Y373 PolarHBondContact O-N 2.94Å; E370-Y373 WeakPolarHBondContact OE1-CD1 3.18Å; E370-T374 WeakPolarHBondContact O-CB 3.35Å; E370-T374 PolarHBondContact O-N 3.18Å; E370-T374 PolarHBondContact O-OG1 3.4Å; E370-R537 IonicContact OE1-NH1 2.76Å; E370-R537 IonicContact OE2-CZ 2.6Å; E370-R537 IonicContact OE2-NH1 2.97Å; E370-R537 PolarHBondContact OE2-NH1 3.48Å; E370-R537 IonicContact OE2-NH2 3.32Å; E370-R537 PolarHBondContact OE2-NH2 3.2Å; E370-R537 VanDerWaalsContact OE2-NH2 3.09Å
371	Q	97.7	Very high	96.8	Very high	102 Å²	102	42.9 Å²	42.9	48%	0.477	22%	0.222	S	C	.	.	H	α-helix	trans	-61.7	-44.9	172.3	-72.2	172.7	7.6	0	0	111.6	H367 I368 T374 E375 L396	H367-Q371 WeakPolarHBondContact O-CG 3.19Å; H367-Q371 PolarHBondContact O-N 3.1Å; H367-Q371 VanDerWaalsContact O-N 3.12Å; I368-Q371 PolarHBondContact O-N 2.98Å; Q371-T374 PolarHBondContact O-N 3.05Å; Q371-E375 PolarHBondContact O-N 3.39Å; Q371-L396 HydrophobicContact CB-CD1 4.47Å
372	I	97.6	Very high	95.9	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-65.4	-43.6	177.4	-64.4	165.3	0	0	0	110.6	L362 I368 Q369 T374 E375 V376 L396 I397 L400 I502	L362-I372 HydrophobicContact CD2-CD1 3.79Å; I368-I372 HydrophobicContact CG2-CD1 3.75Å; I368-I372 HydrophobicContact CG2-CG1 4.45Å; I368-I372 VanDerWaalsContact O-CG1 3.32Å; I368-I372 WeakPolarHBondContact O-CG1 3.2Å; I368-I372 PolarHBondContact O-N 3.49Å; Q369-I372 PolarHBondContact O-N 3.37Å; I372-T374 VanDerWaalsContact C-N 3.29Å; I372-T374 PolarHBondContact O-N 3.01Å; I372-E375 PolarHBondContact O-N 3.14Å; I372-V376 HydrophobicContact CG2-CG2 4.35Å; I372-V376 VanDerWaalsContact O-CG2 3.31Å; I372-V376 WeakPolarHBondContact O-CG2 3.21Å; I372-V376 PolarHBondContact O-N 2.77Å; I372-L396 HydrophobicContact CG1-CB 3.9Å; I372-I397 HydrophobicContact CG2-CD1 3.38Å; I372-I397 HydrophobicContact CG2-CG1 3.9Å; I372-L400 HydrophobicContact CD1-CB 4.21Å; I372-L400 HydrophobicContact CD1-CD2 4.18Å; I372-I502 HydrophobicContact CB-CD1 4.44Å; I372-I502 HydrophobicContact CG2-CD1 3.63Å; I372-I502 HydrophobicContact CG2-CG2 4.43Å
373	Y	97.2	Very high	94.8	Very high	30 Å²	30	48.9 Å²	48.9	12%	0.118	27%	0.27	C	S	.	.	H	α-helix	trans	-57.9	-43.1	175.1	173.6	-105.9	0	0	0	112.1	Q369 E370 V376 T377 I502 R537	Q369-Y373 WeakPolarHBondContact O-CB 3.38Å; Q369-Y373 PolarHBondContact O-N 2.85Å; E370-Y373 PolarHBondContact O-N 2.94Å; E370-Y373 WeakPolarHBondContact OE1-CD1 3.18Å; Y373-V376 PolarHBondContact O-N 2.87Å; Y373-T377 WeakPolarHBondContact CE2-OG1 3.39Å; Y373-T377 WeakPolarHBondContact O-CB 3.47Å; Y373-T377 PolarHBondContact O-N 3.43Å; Y373-T377 PolarHBondContact O-OG1 2.85Å; Y373-I502 HydrophobicContact CD2-CG2 4.17Å; Y373-I502 WeakPolarHBondContact CD2-O 3.34Å; Y373-R537 VanDerWaalsContact CD2-CD 3.44Å; Y373-R537 VanDerWaalsContact CG-NH1 3.32Å
374	T	96.7	Very high	94.5	Very high	54 Å²	54	50.1 Å²	50.1	33%	0.331	28%	0.281	S	S	.	.	H	α-helix	trans	-61.9	-46.9	177	-60.1	0	0	0	0	111.2	E370 Q371 I372 V376 T377 Q378	E370-T374 WeakPolarHBondContact O-CB 3.35Å; E370-T374 PolarHBondContact O-N 3.18Å; E370-T374 PolarHBondContact O-OG1 3.4Å; Q371-T374 PolarHBondContact O-N 3.05Å; I372-T374 VanDerWaalsContact C-N 3.29Å; I372-T374 PolarHBondContact O-N 3.01Å; T374-V376 PolarHBondContact O-N 3.23Å; T374-T377 PolarHBondContact O-N 3.1Å; T374-Q378 HydrophobicContact CG2-CG 4.28Å; T374-Q378 VanDerWaalsContact O-CB 3.31Å; T374-Q378 WeakPolarHBondContact O-CB 3.33Å; T374-Q378 VanDerWaalsContact O-CG 3.24Å; T374-Q378 WeakPolarHBondContact O-CG 2.86Å; T374-Q378 PolarHBondContact O-N 2.85Å
375	E	96.6	Very high	94.4	Very high	23 Å²	23	49.7 Å²	49.7	11%	0.107	28%	0.284	C	S	.	.	H	α-helix	trans	-55.4	-51.5	175.1	173.1	-172.7	-92	0	0	111.3	Q371 I372 Q378 T379 L394 P395 L396 I397	Q371-E375 PolarHBondContact O-N 3.39Å; I372-E375 PolarHBondContact O-N 3.14Å; E375-Q378 PolarHBondContact O-N 3.2Å; E375-T379 WeakPolarHBondContact O-CB 3.35Å; E375-T379 PolarHBondContact O-N 2.97Å; E375-T379 PolarHBondContact O-OG1 2.78Å; E375-L394 HydrophobicContact CG-CD2 4.26Å; E375-L394 VanDerWaalsContact OE2-C 3.24Å; E375-L394 VanDerWaalsContact OE2-CA 3.3Å; E375-L394 WeakPolarHBondContact OE2-CA 3.43Å; E375-P395 WeakPolarHBondContact OE1-CD 3.35Å; E375-P395 VanDerWaalsContact OE1-CG 3.24Å; E375-P395 WeakPolarHBondContact OE1-CG 3.34Å; E375-L396 HydrophobicContact CB-CD1 4.13Å; E375-L396 VanDerWaalsContact OE1-CB 3.27Å; E375-L396 WeakPolarHBondContact OE1-CB 3.3Å; E375-L396 WeakPolarHBondContact OE1-CG 3.21Å; E375-L396 PolarHBondContact OE1-N 3.15Å; E375-L396 WeakPolarHBondContact OE2-CB 3.45Å; E375-L396 PolarHBondContact OE2-N 3Å; E375-L396 VanDerWaalsContact OE2-N 3.15Å; E375-I397 PolarHBondContact OE2-N 3.23Å
376	V	96.5	Very high	94.2	Very high	0 Å²	0	48 Å²	48	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-62	-48.5	-176	171.4	0	0	0	0	110.8	I372 Y373 T374 T379 L380 L394 I397 T499 Q503	I372-V376 HydrophobicContact CG2-CG2 4.35Å; I372-V376 VanDerWaalsContact O-CG2 3.31Å; I372-V376 WeakPolarHBondContact O-CG2 3.21Å; I372-V376 PolarHBondContact O-N 2.77Å; Y373-V376 PolarHBondContact O-N 2.87Å; T374-V376 PolarHBondContact O-N 3.23Å; V376-T379 PolarHBondContact O-N 3.06Å; V376-L380 HydrophobicContact CG1-CD1 4.25Å; V376-L380 PolarHBondContact O-N 2.88Å; V376-L394 HydrophobicContact CG2-CD2 4.15Å; V376-I397 HydrophobicContact CG2-CD1 4.05Å; V376-I397 HydrophobicContact CG2-CG1 3.78Å; V376-T499 HydrophobicContact CG1-CG2 3.63Å; V376-T499 HydrophobicContact CG2-CG2 4.11Å; V376-Q503 HydrophobicContact CG1-CG 3.47Å; V376-Q503 VanDerWaalsContact CG1-CG 3.47Å
377	T	94.4	Very high	94.1	Very high	36 Å²	36	47.5 Å²	47.5	22%	0.221	27%	0.272	C	S	.	.	H	α-helix	trans	-65.9	-40.4	-178.2	-57.6	0	0	0	0	111.8	Y373 T374 G381	Y373-T377 WeakPolarHBondContact CE2-OG1 3.39Å; Y373-T377 WeakPolarHBondContact O-CB 3.47Å; Y373-T377 PolarHBondContact O-N 3.43Å; Y373-T377 PolarHBondContact O-OG1 2.85Å; T374-T377 PolarHBondContact O-N 3.1Å; T377-G381 CarbonylContact O-C 3.56Å; T377-G381 WeakPolarHBondContact O-CA 3.43Å; T377-G381 PolarHBondContact O-N 2.74Å
378	Q	95.1	Very high	93.9	Very high	157 Å²	157	43.2 Å²	43.2	73%	0.734	26%	0.256	S	S	*	.	H	α-helix	trans	-69.7	-34.4	177.3	-72.2	178.5	-3.8	0	0	112.8	T374 E375	T374-Q378 HydrophobicContact CG2-CG 4.28Å; T374-Q378 VanDerWaalsContact O-CB 3.31Å; T374-Q378 WeakPolarHBondContact O-CB 3.33Å; T374-Q378 VanDerWaalsContact O-CG 3.24Å; T374-Q378 WeakPolarHBondContact O-CG 2.86Å; T374-Q378 PolarHBondContact O-N 2.85Å; E375-Q378 PolarHBondContact O-N 3.2Å
379	T	96.2	Very high	93.7	Very high	44 Å²	44	50.2 Å²	50.2	27%	0.27	29%	0.288	S	S	.	.	H	α-helix	trans	-84.4	-37.2	-173.3	-57.2	0	0	0	0	113.2	E375 V376 R393 L394	E375-T379 WeakPolarHBondContact O-CB 3.35Å; E375-T379 PolarHBondContact O-N 2.97Å; E375-T379 PolarHBondContact O-OG1 2.78Å; V376-T379 PolarHBondContact O-N 3.06Å; T379-R393 HydrophobicContact CG2-CB 3.73Å; T379-R393 PolarHBondContact O-NH1 2.91Å; T379-R393 VanDerWaalsContact O-NH1 3.09Å; T379-L394 HydrophobicContact CG2-CD2 3.99Å
380	L	94.9	Very high	93.6	Very high	28 Å²	28	51.5 Å²	51.5	15%	0.147	30%	0.296	C	S	.	.	H	α-helix	trans	-106.1	-20.2	-175.9	-52.3	-173.7	0	0	0	113.3	V376 A384 P386 D390 L394 T499	V376-L380 HydrophobicContact CG1-CD1 4.25Å; V376-L380 PolarHBondContact O-N 2.88Å; L380-A384 HydrophobicContact CB-CB 4.07Å; L380-A384 VanDerWaalsContact O-CB 3.29Å; L380-A384 WeakPolarHBondContact O-CB 3.31Å; L380-P386 HydrophobicContact CD1-CB 3.86Å; L380-D390 HydrophobicContact CD2-CB 3.76Å; L380-L394 HydrophobicContact CD1-CD1 4.18Å; L380-L394 HydrophobicContact CG-CD2 4.32Å; L380-T499 HydrophobicContact CD1-CG2 4.08Å
381	G	87.7	Confident	93.4	Very high	23 Å²	23	48.4 Å²	48.4	24%	0.237	28%	0.282	C	S	.	.			trans	83.2	164.4	-165.9	0	0	0	0	0	112.6	T377 G383	T377-G381 CarbonylContact O-C 3.56Å; T377-G381 WeakPolarHBondContact O-CA 3.43Å; T377-G381 PolarHBondContact O-N 2.74Å; G381-G383 PolarHBondContact O-N 3.05Å
382	P	79.8	Confident	93.2	Very high	92 Å²	92	47.5 Å²	47.5	60%	0.597	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	131.9	179.9	27.7	-33.8	0	0	0	111	A384	P382-A384 PolarHBondContact O-N 2.97Å
383	G	76.7	Confident	93.1	Very high	46 Å²	46	53.4 Å²	53.4	47%	0.474	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.9	1.7	172.6	0	0	0	0	0	116.8	G381	G381-G383 PolarHBondContact O-N 3.05Å
384	A	90.7	Very high	93.1	Very high	37 Å²	37	52 Å²	52	31%	0.306	30%	0.301	S	S	.	.			trans	-65.3	134.6	175.4	0	0	0	0	0	111.3	L380 P382 P386 Q503	L380-A384 HydrophobicContact CB-CB 4.07Å; L380-A384 VanDerWaalsContact O-CB 3.29Å; L380-A384 WeakPolarHBondContact O-CB 3.31Å; P382-A384 PolarHBondContact O-N 2.97Å; A384-P386 WeakPolarHBondContact O-CD 3.45Å; A384-Q503 PolarHBondContact O-NE2 2.78Å; A384-Q503 PolarHBondContact O-OE1 2.89Å
385	V	95.3	Very high	93.1	Very high	76 Å²	76	51.6 Å²	51.6	46%	0.461	30%	0.3	S	S	.	.			trans	-79.7	115.9	174.3	179.2	0	0	0	0	108.4	N189	N189-V385 HydrophobicContact CB-CG1 4.09Å
386	P	95.9	Very high	93.2	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.006	30%	0.302	C	S	.	.			trans	-67.9	146.8	-178.2	28.2	-35.5	0	0	0	111.5	N189 L380 A384 L496 T499 R500	N189-P386 PolarHBondContact ND2-O 3.04Å; L380-P386 HydrophobicContact CD1-CB 3.86Å; A384-P386 WeakPolarHBondContact O-CD 3.45Å; P386-L496 HydrophobicContact CB-CD2 3.93Å; P386-L496 HydrophobicContact CG-CD2 3.95Å; P386-L496 WeakPolarHBondContact O-CD2 3.5Å; P386-T499 HydrophobicContact CB-CG2 3.99Å; P386-T499 HydrophobicContact CG-CG2 3.78Å; P386-R500 VanDerWaalsContact CD-CG 3.49Å; P386-R500 HydrophobicContact CG-CG 3.61Å
387	T	95.3	Very high	93.2	Very high	45 Å²	45	51.9 Å²	51.9	28%	0.276	30%	0.302	S	S	.	.			trans	-112.9	169.5	171.9	69.2	0	0	0	0	111.5	S185 E389 D390	S185-T387 WeakPolarHBondContact OG-CA 3.4Å; T387-E389 PolarHBondContact O-N 3.07Å; T387-E389 VanDerWaalsContact O-N 3.17Å; T387-E389 PolarHBondContact OG1-N 2.93Å; T387-D390 WeakPolarHBondContact CB-OD2 3.27Å; T387-D390 PolarHBondContact N-OD2 3.13Å; T387-D390 WeakPolarHBondContact O-CB 3.49Å; T387-D390 PolarHBondContact O-N 3.34Å; T387-D390 PolarHBondContact OG1-OD2 3.06Å
388	A	93.9	Very high	93.4	Very high	22 Å²	22	54.9 Å²	54.9	18%	0.182	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-30	172.3	0	0	0	0	0	113.4	A182 S185 D390 P392 L492	A182-A388 HydrophobicContact CB-CB 3.81Å; S185-A388 PolarHBondContact OG-N 3.16Å; S185-A388 VanDerWaalsContact OG-N 3.08Å; A388-D390 VanDerWaalsContact C-N 3.32Å; A388-P392 WeakPolarHBondContact O-CD 3.36Å; A388-L492 HydrophobicContact CB-CD1 3.65Å
389	E	93.8	Very high	93.5	Very high	158 Å²	158	47.4 Å²	47.4	74%	0.738	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-20.1	179.9	-61.5	-173.3	171.4	0	0	112.9	T387 P392	T387-E389 PolarHBondContact O-N 3.07Å; T387-E389 VanDerWaalsContact O-N 3.17Å; T387-E389 PolarHBondContact OG1-N 2.93Å; E389-P392 WeakPolarHBondContact O-CD 3.18Å
390	D	95.3	Very high	93.6	Very high	28 Å²	28	45.3 Å²	45.3	15%	0.15	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-32.8	178.8	-62.2	-48.6	0	0	0	112.6	L380 T387 A388 P392 R393	L380-D390 HydrophobicContact CD2-CB 3.76Å; T387-D390 WeakPolarHBondContact CB-OD2 3.27Å; T387-D390 PolarHBondContact N-OD2 3.13Å; T387-D390 WeakPolarHBondContact O-CB 3.49Å; T387-D390 PolarHBondContact O-N 3.34Å; T387-D390 PolarHBondContact OG1-OD2 3.06Å; A388-D390 VanDerWaalsContact C-N 3.32Å; D390-P392 VanDerWaalsContact C-CD 3.43Å; D390-P392 VanDerWaalsContact C-N 3.35Å; D390-R393 WeakPolarHBondContact O-CA 3.24Å; D390-R393 VanDerWaalsContact O-CB 3.3Å; D390-R393 WeakPolarHBondContact O-CB 3.3Å; D390-R393 PolarHBondContact O-N 3.35Å; D390-R393 IonicContact OD1-CZ 3.62Å; D390-R393 IonicContact OD1-NE 3.81Å; D390-R393 IonicContact OD1-NH2 2.65Å; D390-R393 PolarHBondContact OD1-NH2 3.28Å
391	V	94.7	Very high	93.8	Very high	14 Å²	14	44.2 Å²	44.2	9%	0.085	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-50.9	-42.3	-176.7	172.9	0	0	0	0	113.8	R393 L394 R398 H495 L496	V391-R393 PolarHBondContact O-N 2.86Å; V391-R393 VanDerWaalsContact O-N 3.14Å; V391-L394 PolarHBondContact O-N 3.45Å; V391-R398 HydrophobicContact CG1-CG 3.92Å; V391-R398 VanDerWaalsContact O-CD 3.27Å; V391-R398 WeakPolarHBondContact O-CD 3Å; V391-H495 HydrophobicContact CG1-CB 4Å; V391-H495 WeakPolarHBondContact CG1-ND1 3.31Å; V391-H495 HydrophobicContact CG2-CB 3.86Å; V391-L496 HydrophobicContact CG2-CD2 4.3Å
392	P	93.8	Very high	94.2	Very high	82 Å²	82	46.8 Å²	46.8	53%	0.532	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-56.8	-27	175.3	-26.7	36.1	0	0	0	114.5	A388 E389 D390 L394	A388-P392 WeakPolarHBondContact O-CD 3.36Å; E389-P392 WeakPolarHBondContact O-CD 3.18Å; D390-P392 VanDerWaalsContact C-CD 3.43Å; D390-P392 VanDerWaalsContact C-N 3.35Å; P392-L394 VanDerWaalsContact C-N 3.33Å
393	R	95.4	Very high	95.1	Very high	125 Å²	125	42.4 Å²	42.4	47%	0.472	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-84.8	-2.7	178.2	-52.3	-171.3	-70.2	131.7	-5.5	113.4	T379 D390 V391 P395	T379-R393 HydrophobicContact CG2-CB 3.73Å; T379-R393 PolarHBondContact O-NH1 2.91Å; T379-R393 VanDerWaalsContact O-NH1 3.09Å; D390-R393 WeakPolarHBondContact O-CA 3.24Å; D390-R393 VanDerWaalsContact O-CB 3.3Å; D390-R393 WeakPolarHBondContact O-CB 3.3Å; D390-R393 PolarHBondContact O-N 3.35Å; D390-R393 IonicContact OD1-CZ 3.62Å; D390-R393 IonicContact OD1-NE 3.81Å; D390-R393 IonicContact OD1-NH2 2.65Å; D390-R393 PolarHBondContact OD1-NH2 3.28Å; V391-R393 PolarHBondContact O-N 2.86Å; V391-R393 VanDerWaalsContact O-N 3.14Å; R393-P395 WeakPolarHBondContact O-CD 3.29Å
394	L	96.9	Very high	96.1	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.21	C	C	.	.			trans	-112.5	69.5	179.2	-57.5	173.9	0	0	0	110.9	E375 V376 T379 L380 V391 P392 L396 I397 R398 T499	E375-L394 HydrophobicContact CG-CD2 4.26Å; E375-L394 VanDerWaalsContact OE2-C 3.24Å; E375-L394 VanDerWaalsContact OE2-CA 3.3Å; E375-L394 WeakPolarHBondContact OE2-CA 3.43Å; V376-L394 HydrophobicContact CG2-CD2 4.15Å; T379-L394 HydrophobicContact CG2-CD2 3.99Å; L380-L394 HydrophobicContact CD1-CD1 4.18Å; L380-L394 HydrophobicContact CG-CD2 4.32Å; V391-L394 PolarHBondContact O-N 3.45Å; P392-L394 VanDerWaalsContact C-N 3.33Å; L394-L396 VanDerWaalsContact C-N 3.32Å; L394-L396 PolarHBondContact O-N 3.22Å; L394-I397 HydrophobicContact CB-CB 3.92Å; L394-I397 HydrophobicContact CB-CG1 4.11Å; L394-I397 HydrophobicContact CD1-CG1 4.38Å; L394-I397 PolarHBondContact O-N 3.15Å; L394-R398 WeakPolarHBondContact O-CG 3.33Å; L394-R398 PolarHBondContact O-N 2.97Å; L394-R398 VanDerWaalsContact O-N 3.14Å; L394-T499 HydrophobicContact CD1-CG2 3.98Å
395	P	96.5	Very high	96.4	Very high	47 Å²	47	38.8 Å²	38.8	31%	0.305	20%	0.197	S	C	.	.	H	α-helix	trans	-63.6	-31.9	-174.3	26.6	-35	0	0	0	113.6	E375 R393 R398 G399 V461	E375-P395 WeakPolarHBondContact OE1-CD 3.35Å; E375-P395 VanDerWaalsContact OE1-CG 3.24Å; E375-P395 WeakPolarHBondContact OE1-CG 3.34Å; R393-P395 WeakPolarHBondContact O-CD 3.29Å; P395-R398 PolarHBondContact O-N 3Å; P395-G399 PolarHBondContact O-N 2.71Å; P395-V461 HydrophobicContact CB-CG1 4.13Å; P395-V461 HydrophobicContact CB-CG2 4.04Å; P395-V461 HydrophobicContact CG-CG1 4.49Å
396	L	97.9	Very high	96.5	Very high	28 Å²	28	35.2 Å²	35.2	15%	0.147	18%	0.175	C	C	.	.	H	α-helix	trans	-73.7	-35.4	176.2	-65.5	172	0	0	0	112.5	Q371 I372 E375 L394 R398 G399 L400 D458 V461	Q371-L396 HydrophobicContact CB-CD1 4.47Å; I372-L396 HydrophobicContact CG1-CB 3.9Å; E375-L396 HydrophobicContact CB-CD1 4.13Å; E375-L396 VanDerWaalsContact OE1-CB 3.27Å; E375-L396 WeakPolarHBondContact OE1-CB 3.3Å; E375-L396 WeakPolarHBondContact OE1-CG 3.21Å; E375-L396 PolarHBondContact OE1-N 3.15Å; E375-L396 WeakPolarHBondContact OE2-CB 3.45Å; E375-L396 PolarHBondContact OE2-N 3Å; E375-L396 VanDerWaalsContact OE2-N 3.15Å; L394-L396 VanDerWaalsContact C-N 3.32Å; L394-L396 PolarHBondContact O-N 3.22Å; L396-R398 VanDerWaalsContact C-N 3.3Å; L396-R398 PolarHBondContact O-N 3.2Å; L396-G399 CarbonylContact O-C 3.51Å; L396-G399 PolarHBondContact O-N 2.83Å; L396-L400 WeakPolarHBondContact O-CB 3.37Å; L396-L400 PolarHBondContact O-N 2.81Å; L396-D458 HydrophobicContact CD2-CB 4.06Å; L396-V461 HydrophobicContact CD2-CG2 3.86Å; L396-V461 HydrophobicContact CG-CG2 4.49Å
397	I	98.1	Very high	96.5	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.7	-42	170.5	-71.5	-71.5	0	0	0	111.1	I372 E375 V376 L394 G399 L400 V401 H495 I502	I372-I397 HydrophobicContact CG2-CD1 3.38Å; I372-I397 HydrophobicContact CG2-CG1 3.9Å; E375-I397 PolarHBondContact OE2-N 3.23Å; V376-I397 HydrophobicContact CG2-CD1 4.05Å; V376-I397 HydrophobicContact CG2-CG1 3.78Å; L394-I397 HydrophobicContact CB-CB 3.92Å; L394-I397 HydrophobicContact CB-CG1 4.11Å; L394-I397 HydrophobicContact CD1-CG1 4.38Å; L394-I397 PolarHBondContact O-N 3.15Å; I397-G399 VanDerWaalsContact C-N 3.34Å; I397-L400 WeakPolarHBondContact O-CB 3.21Å; I397-L400 PolarHBondContact O-N 3.47Å; I397-V401 PolarHBondContact O-N 2.67Å; I397-H495 HydrophobicContact CG2-CB 4.03Å; I397-I502 HydrophobicContact CD1-CD1 3.89Å
398	R	97.3	Very high	96.6	Very high	99 Å²	99	35 Å²	35	37%	0.374	17%	0.171	S	C	.	.	H	α-helix	trans	-67.4	-37.4	175.4	-66.9	170.7	62	-158.6	0.4	111.8	V391 L394 P395 L396 K402	V391-R398 HydrophobicContact CG1-CG 3.92Å; V391-R398 VanDerWaalsContact O-CD 3.27Å; V391-R398 WeakPolarHBondContact O-CD 3Å; L394-R398 WeakPolarHBondContact O-CG 3.33Å; L394-R398 PolarHBondContact O-N 2.97Å; L394-R398 VanDerWaalsContact O-N 3.14Å; P395-R398 PolarHBondContact O-N 3Å; L396-R398 VanDerWaalsContact C-N 3.3Å; L396-R398 PolarHBondContact O-N 3.2Å; R398-K402 WeakPolarHBondContact O-CG 3.31Å; R398-K402 PolarHBondContact O-N 3.42Å
399	G	97	Very high	96.7	Very high	1 Å²	1	34 Å²	34	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-65.3	-38.2	174.5	0	0	0	0	0	112.5	P395 L396 I397 K402 E403 P457	P395-G399 PolarHBondContact O-N 2.71Å; L396-G399 CarbonylContact O-C 3.51Å; L396-G399 PolarHBondContact O-N 2.83Å; I397-G399 VanDerWaalsContact C-N 3.34Å; G399-K402 PolarHBondContact O-N 2.86Å; G399-E403 VanDerWaalsContact O-CB 3.28Å; G399-E403 WeakPolarHBondContact O-CB 3.12Å; G399-E403 PolarHBondContact O-N 2.88Å; G399-P457 WeakPolarHBondContact CA-O 3.44Å
400	L	98.6	Very high	96.8	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-57.8	-54.3	176.2	165.2	62	0	0	0	110.2	A358 L362 I372 L396 I397 K402 E403 T404 F455 L498 I502	A358-L400 HydrophobicContact CB-CD1 4.27Å; L362-L400 HydrophobicContact CD1-CD1 4.44Å; L362-L400 HydrophobicContact CD1-CD2 3.92Å; L362-L400 HydrophobicContact CD2-CD1 4.06Å; L362-L400 HydrophobicContact CD2-CD2 4.3Å; L362-L400 HydrophobicContact CG-CD1 4.12Å; L362-L400 HydrophobicContact CG-CD2 4.4Å; I372-L400 HydrophobicContact CD1-CB 4.21Å; I372-L400 HydrophobicContact CD1-CD2 4.18Å; L396-L400 WeakPolarHBondContact O-CB 3.37Å; L396-L400 PolarHBondContact O-N 2.81Å; I397-L400 WeakPolarHBondContact O-CB 3.21Å; I397-L400 PolarHBondContact O-N 3.47Å; L400-K402 VanDerWaalsContact C-N 3.34Å; L400-K402 PolarHBondContact O-N 2.85Å; L400-E403 PolarHBondContact O-N 3.19Å; L400-T404 WeakPolarHBondContact O-CB 3.07Å; L400-T404 PolarHBondContact O-N 3.12Å; L400-T404 PolarHBondContact O-OG1 2.84Å; L400-F455 HydrophobicContact CD1-CE2 4.33Å; L400-F455 HydrophobicContact CD1-CZ 3.56Å; L400-L498 HydrophobicContact CD2-CB 4.32Å; L400-L498 HydrophobicContact CD2-CD1 3.86Å; L400-L498 HydrophobicContact CD2-CD2 4.35Å; L400-L498 HydrophobicContact CD2-CG 4.4Å; L400-L498 HydrophobicContact CG-CD1 4.22Å; L400-I502 HydrophobicContact CD2-CD1 4.2Å
401	V	98.3	Very high	96.6	Very high	4 Å²	4	28.9 Å²	28.9	2%	0.024	14%	0.14	C	C	.	.	H	α-helix	trans	-60.4	-43.5	179.2	174.6	0	0	0	0	111.5	I397 L405 M494 L498	I397-V401 PolarHBondContact O-N 2.67Å; V401-L405 HydrophobicContact CG1-CD1 3.96Å; V401-L405 WeakPolarHBondContact O-CB 3.24Å; V401-L405 WeakPolarHBondContact O-CG 3.46Å; V401-L405 PolarHBondContact O-N 3.3Å; V401-M494 HydrophobicContact CG1-CE 3.64Å; V401-M494 HydrophobicContact CG1-SD 3.97Å; V401-M494 HydrophobicContact CG2-CB 3.98Å; V401-L498 HydrophobicContact CG2-CD1 3.67Å
402	K	97.1	Very high	96.4	Very high	78 Å²	78	28.6 Å²	28.6	34%	0.339	14%	0.139	S	C	.	.	H	α-helix	trans	-64.9	-43.8	178.9	-75.2	177.9	174	-172.4	0	112.9	R398 G399 L400 L405 R406 W460	R398-K402 WeakPolarHBondContact O-CG 3.31Å; R398-K402 PolarHBondContact O-N 3.42Å; G399-K402 PolarHBondContact O-N 2.86Å; L400-K402 VanDerWaalsContact C-N 3.34Å; L400-K402 PolarHBondContact O-N 2.85Å; K402-L405 PolarHBondContact O-N 3.41Å; K402-R406 WeakPolarHBondContact O-CB 3.29Å; K402-R406 PolarHBondContact O-N 3.46Å; K402-W460 HydrophobicContact CB-CD2 3.73Å; K402-W460 HydrophobicContact CB-CE3 4.37Å; K402-W460 HydrophobicContact CB-CG 3.77Å; K402-W460 HydrophobicContact CB-CZ2 4.3Å; K402-W460 HydrophobicContact CD-CB 3.92Å; K402-W460 HydrophobicContact CD-CD2 3.82Å; K402-W460 HydrophobicContact CD-CE3 3.85Å; K402-W460 HydrophobicContact CD-CG 3.87Å; K402-W460 HydrophobicContact CG-CD2 4.45Å
403	E	97.8	Very high	96.2	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-70.2	-38.9	-179.1	-171.3	68.8	169.8	0	0	111.5	G399 L400 L405 R406 L407 F455 Q456 R459 W460	G399-E403 VanDerWaalsContact O-CB 3.28Å; G399-E403 WeakPolarHBondContact O-CB 3.12Å; G399-E403 PolarHBondContact O-N 2.88Å; L400-E403 PolarHBondContact O-N 3.19Å; E403-L405 VanDerWaalsContact C-N 3.35Å; E403-L405 PolarHBondContact O-N 3.33Å; E403-R406 VanDerWaalsContact CD-NE 3.35Å; E403-R406 WeakPolarHBondContact O-CB 3.28Å; E403-R406 PolarHBondContact O-N 3.02Å; E403-R406 IonicContact OE1-CZ 2.82Å; E403-R406 IonicContact OE1-NE 2.77Å; E403-R406 PolarHBondContact OE1-NE 3.05Å; E403-R406 IonicContact OE1-NH2 3.78Å; E403-R406 PolarHBondContact OE1-NH2 3.07Å; E403-R406 IonicContact OE2-CZ 2.79Å; E403-R406 IonicContact OE2-NE 3.98Å; E403-R406 PolarHBondContact OE2-NE 2.88Å; E403-R406 IonicContact OE2-NH2 3.95Å; E403-L407 PolarHBondContact O-N 2.66Å; E403-F455 HydrophobicContact CB-CD2 4.34Å; E403-F455 HydrophobicContact CB-CE2 4.1Å; E403-F455 HydrophobicContact CG-CD2 3.59Å; E403-F455 HydrophobicContact CG-CE2 3.87Å; E403-Q456 PolarHBondContact OE1-N 3.47Å; E403-Q456 VanDerWaalsContact OE1-N 3.1Å; E403-R459 IonicContact OE1-CZ 3.3Å; E403-R459 IonicContact OE1-NE 3.8Å; E403-R459 PolarHBondContact OE1-NE 2.83Å; E403-R459 IonicContact OE1-NH2 3.01Å; E403-R459 PolarHBondContact OE1-NH2 3.03Å; E403-R459 IonicContact OE2-NE 3.38Å; E403-W460 PolarHBondContact OE2-NE1 2.97Å
404	T	98.4	Very high	95.8	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-58.2	-47.5	170.7	-61.6	0	0	0	0	111.1	T354 W357 A358 L400 R406 L407 F408	T354-T404 HydrophobicContact CG2-CG2 4.02Å; T354-T404 WeakPolarHBondContact O-CG2 3.32Å; W357-T404 HydrophobicContact CB-CG2 3.63Å; A358-T404 HydrophobicContact CB-CG2 4.12Å; L400-T404 WeakPolarHBondContact O-CB 3.07Å; L400-T404 PolarHBondContact O-N 3.12Å; L400-T404 PolarHBondContact O-OG1 2.84Å; T404-R406 VanDerWaalsContact C-N 3.28Å; T404-R406 PolarHBondContact O-N 2.9Å; T404-L407 PolarHBondContact O-N 3.42Å; T404-F408 WeakPolarHBondContact O-CA 3.46Å; T404-F408 PolarHBondContact O-N 3.43Å
405	L	97.5	Very high	95.5	Very high	7 Å²	7	21.8 Å²	21.8	4%	0.037	12%	0.119	C	C	.	.	H	α-helix	trans	-70.1	-21.5	178.2	-74.3	171.1	0	0	0	113.8	T354 V401 K402 E403 P409 V410 P476 F477	T354-L405 HydrophobicContact CG2-CD1 4.49Å; T354-L405 HydrophobicContact CG2-CD2 3.69Å; T354-L405 HydrophobicContact CG2-CG 3.79Å; T354-L405 WeakPolarHBondContact OG1-CD2 3.47Å; V401-L405 HydrophobicContact CG1-CD1 3.96Å; V401-L405 WeakPolarHBondContact O-CB 3.24Å; V401-L405 WeakPolarHBondContact O-CG 3.46Å; V401-L405 PolarHBondContact O-N 3.3Å; K402-L405 PolarHBondContact O-N 3.41Å; E403-L405 VanDerWaalsContact C-N 3.35Å; E403-L405 PolarHBondContact O-N 3.33Å; L405-P409 WeakPolarHBondContact O-CA 3.4Å; L405-P409 VanDerWaalsContact O-CB 3.28Å; L405-P409 WeakPolarHBondContact O-CB 3.32Å; L405-P409 WeakPolarHBondContact O-CD 3.48Å; L405-P409 VanDerWaalsContact O-N 3.15Å; L405-V410 HydrophobicContact CD2-CG2 4.23Å; L405-P476 HydrophobicContact CB-CB 3.72Å; L405-P476 HydrophobicContact CB-CG 3.77Å; L405-P476 HydrophobicContact CD1-CB 4.19Å; L405-P476 HydrophobicContact CD1-CG 4.02Å; L405-P476 HydrophobicContact CD2-CB 4.25Å; L405-P476 HydrophobicContact CG-CB 4.29Å; L405-P476 HydrophobicContact CG-CG 4.45Å; L405-F477 HydrophobicContact CD1-CD2 4.43Å; L405-F477 HydrophobicContact CD1-CE2 3.52Å; L405-F477 HydrophobicContact CD1-CZ 3.78Å
406	R	96.8	Very high	95.4	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-72.7	-47.5	172.7	-174.6	-168.3	63.4	77.7	-1.7	111	K402 E403 T404 S443 F449 P452 E454 W460	K402-R406 WeakPolarHBondContact O-CB 3.29Å; K402-R406 PolarHBondContact O-N 3.46Å; E403-R406 VanDerWaalsContact CD-NE 3.35Å; E403-R406 WeakPolarHBondContact O-CB 3.28Å; E403-R406 PolarHBondContact O-N 3.02Å; E403-R406 IonicContact OE1-CZ 2.82Å; E403-R406 IonicContact OE1-NE 2.77Å; E403-R406 PolarHBondContact OE1-NE 3.05Å; E403-R406 IonicContact OE1-NH2 3.78Å; E403-R406 PolarHBondContact OE1-NH2 3.07Å; E403-R406 IonicContact OE2-CZ 2.79Å; E403-R406 IonicContact OE2-NE 3.98Å; E403-R406 PolarHBondContact OE2-NE 2.88Å; E403-R406 IonicContact OE2-NH2 3.95Å; T404-R406 VanDerWaalsContact C-N 3.28Å; T404-R406 PolarHBondContact O-N 2.9Å; R406-S443 WeakPolarHBondContact CG-O 3.46Å; R406-S443 PolarHBondContact NH1-O 3.35Å; R406-S443 WeakPolarHBondContact O-CB 3.33Å; R406-F449 HydrophobicContact CG-CE2 4.36Å; R406-F449 HydrophobicContact CG-CZ 4.39Å; R406-P452 VanDerWaalsContact CZ-O 3.24Å; R406-P452 PolarHBondContact NH1-O 3.18Å; R406-P452 PolarHBondContact NH2-O 3.11Å; R406-E454 PolarHBondContact NH2-O 3.22Å; R406-W460 HydrophobicContact CB-CZ2 4.03Å; R406-W460 HydrophobicContact CG-CZ2 4.29Å
407	L	97.1	Very high	95.1	Very high	11 Å²	11	20.3 Å²	20.3	6%	0.058	11%	0.108	C	C	.	.	H	α-helix	trans	-73.6	-38.3	179.5	-70.7	175.2	0	0	0	112.3	M361 E403 T404 P409 Y440 L444 P452 F455	M361-L407 HydrophobicContact CE-CD1 3.94Å; E403-L407 PolarHBondContact O-N 2.66Å; T404-L407 PolarHBondContact O-N 3.42Å; L407-P409 VanDerWaalsContact C-CD 3.48Å; L407-Y440 WeakPolarHBondContact O-CE2 3.45Å; L407-L444 HydrophobicContact CD2-CD2 3.85Å; L407-P452 WeakPolarHBondContact CD2-O 3.43Å; L407-F455 HydrophobicContact CD1-CB 4.14Å; L407-F455 HydrophobicContact CD1-CD2 3.81Å; L407-F455 HydrophobicContact CD1-CG 4.45Å
408	F	97	Very high	94.9	Very high	30 Å²	30	20.6 Å²	20.6	13%	0.132	11%	0.109	C	C	.	.	S	Bend	trans	-129.3	64.9	-175.6	-52.1	-77.8	0	0	0	111.1	W357 M361 T404 V410 A518 L524	W357-F408 HydrophobicContact CB-CB 4.32Å; W357-F408 HydrophobicContact CB-CD2 3.94Å; W357-F408 HydrophobicContact CB-CG 4.23Å; W357-F408 AromaticContact CD1-CG 3.9Å; W357-F408 HydrophobicContact CD2-CB 4.17Å; W357-F408 AromaticContact CD2-CD1 3.7Å; W357-F408 HydrophobicContact CD2-CD1 3.7Å; W357-F408 AromaticContact CD2-CD2 3.89Å; W357-F408 HydrophobicContact CD2-CD2 3.89Å; W357-F408 HydrophobicContact CD2-CE1 4.01Å; W357-F408 HydrophobicContact CD2-CE2 4.19Å; W357-F408 AromaticContact CD2-CG 3.63Å; W357-F408 HydrophobicContact CD2-CG 3.63Å; W357-F408 HydrophobicContact CD2-CZ 4.24Å; W357-F408 AromaticContact CE2-CD1 3.58Å; W357-F408 AromaticContact CE2-CG 3.85Å; W357-F408 AromaticContact CE3-CD1 4Å; W357-F408 HydrophobicContact CE3-CD1 4Å; W357-F408 HydrophobicContact CE3-CD2 4.08Å; W357-F408 AromaticContact CE3-CE1 3.8Å; W357-F408 HydrophobicContact CE3-CE1 3.8Å; W357-F408 AromaticContact CE3-CE2 3.89Å; W357-F408 HydrophobicContact CE3-CE2 3.89Å; W357-F408 HydrophobicContact CE3-CG 4.13Å; W357-F408 AromaticContact CE3-CZ 3.73Å; W357-F408 HydrophobicContact CE3-CZ 3.73Å; W357-F408 HydrophobicContact CG-CB 3.78Å; W357-F408 HydrophobicContact CG-CD1 4.23Å; W357-F408 AromaticContact CG-CD2 3.86Å; W357-F408 HydrophobicContact CG-CD2 3.86Å; W357-F408 AromaticContact CG-CG 3.68Å; W357-F408 HydrophobicContact CG-CG 3.68Å; W357-F408 HydrophobicContact CH2-CD1 4.1Å; W357-F408 AromaticContact CH2-CE1 3.78Å; W357-F408 HydrophobicContact CH2-CE1 3.78Å; W357-F408 HydrophobicContact CH2-CZ 4.39Å; W357-F408 AromaticContact CZ2-CD1 3.79Å; W357-F408 HydrophobicContact CZ2-CD1 3.79Å; W357-F408 AromaticContact CZ2-CE1 3.97Å; W357-F408 HydrophobicContact CZ2-CE1 3.97Å; W357-F408 HydrophobicContact CZ3-CD1 4.2Å; W357-F408 AromaticContact CZ3-CE1 3.69Å; W357-F408 HydrophobicContact CZ3-CE1 3.69Å; W357-F408 HydrophobicContact CZ3-CE2 4.45Å; W357-F408 AromaticContact CZ3-CZ 3.83Å; W357-F408 HydrophobicContact CZ3-CZ 3.83Å; W357-F408 AromaticContact NE1-CG 3.98Å; M361-F408 HydrophobicContact CE-CE2 4.49Å; M361-F408 HydrophobicContact CG-CE2 3.94Å; M361-F408 HydrophobicContact SD-CE2 3.69Å; M361-F408 HydrophobicContact SD-CZ 4.11Å; T404-F408 WeakPolarHBondContact O-CA 3.46Å; T404-F408 PolarHBondContact O-N 3.43Å; F408-V410 PolarHBondContact O-N 2.88Å; F408-A518 HydrophobicContact CD1-CB 4.3Å; F408-L524 HydrophobicContact CB-CD2 4.43Å
409	P	95.7	Very high	94.6	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.006	10%	0.102	C	C	.	.			trans	-65.8	122	176.6	28	-34	0	0	0	109.3	L405 L407 L411 Y440 L524	L405-P409 WeakPolarHBondContact O-CA 3.4Å; L405-P409 VanDerWaalsContact O-CB 3.28Å; L405-P409 WeakPolarHBondContact O-CB 3.32Å; L405-P409 WeakPolarHBondContact O-CD 3.48Å; L405-P409 VanDerWaalsContact O-N 3.15Å; L407-P409 VanDerWaalsContact C-CD 3.48Å; P409-L411 CarbonylContact O-C 3.59Å; P409-L411 PolarHBondContact O-N 2.81Å; P409-L411 VanDerWaalsContact O-N 3.08Å; P409-Y440 HydrophobicContact CG-CD2 3.67Å; P409-Y440 HydrophobicContact CG-CE2 4.47Å; P409-L524 HydrophobicContact CG-CD2 4.45Å; P409-L524 WeakPolarHBondContact O-CB 3.29Å; P409-L524 WeakPolarHBondContact O-CD2 3.28Å
410	V	94.9	Very high	94.4	Very high	13 Å²	13	22.8 Å²	22.8	8%	0.079	13%	0.127	C	C	.	.	S	Bend	trans	-53.6	-35.1	-179.2	179.9	0	0	0	0	112.2	T350 T354 L405 F408 L523 L524	T350-V410 HydrophobicContact CG2-CG1 3.77Å; T350-V410 WeakPolarHBondContact O-CG2 3.1Å; T354-V410 WeakPolarHBondContact OG1-CG2 2.91Å; L405-V410 HydrophobicContact CD2-CG2 4.23Å; F408-V410 PolarHBondContact O-N 2.88Å; V410-L523 HydrophobicContact CG1-CB 3.99Å; V410-L523 HydrophobicContact CG1-CD1 3.95Å; V410-L523 HydrophobicContact CG1-CD2 4.01Å; V410-L523 HydrophobicContact CG1-CG 4.19Å; V410-L523 CarbonylContact O-C 3.31Å; V410-L523 WeakPolarHBondContact O-CA 3.37Å; V410-L524 PolarHBondContact O-N 2.91Å
411	L	92.6	Very high	94.2	Very high	67 Å²	67	27.5 Å²	27.5	35%	0.351	15%	0.152	S	C	.	.	S	Bend	trans	-107.9	109.2	166.5	-70.1	174.1	0	0	0	109.2	P409 G413 L523	P409-L411 CarbonylContact O-C 3.59Å; P409-L411 PolarHBondContact O-N 2.81Å; P409-L411 VanDerWaalsContact O-N 3.08Å; L411-G413 PolarHBondContact O-N 3.42Å; L411-L523 HydrophobicContact CD2-CD2 3.53Å; L411-L523 HydrophobicContact CG-CD2 4.28Å
412	P	90.4	Very high	94	Very high	8 Å²	8	28.9 Å²	28.9	5%	0.052	16%	0.159	C	C	.	.	S	Bend	trans	-59.3	-16.8	176.8	-27.3	35.8	0	0	0	114.2	H92 Q95 H439 Y440 L524	H92-P412 HydrophobicContact CB-CB 4.02Å; H92-P412 HydrophobicContact CB-CG 4.13Å; Q95-P412 PolarHBondContact NE2-O 3.35Å; Q95-P412 PolarHBondContact OE1-O 3.44Å; Q95-P412 VanDerWaalsContact OE1-O 3.12Å; P412-H439 PolarHBondContact O-N 2.84Å; P412-H439 VanDerWaalsContact O-N 3.11Å; P412-Y440 PolarHBondContact O-N 3.03Å; P412-L524 HydrophobicContact CG-CB 3.95Å; P412-L524 HydrophobicContact CG-CD1 4.15Å; P412-L524 HydrophobicContact CG-CG 4.48Å
413	G	89.1	Confident	93.9	Very high	25 Å²	25	28.2 Å²	28.2	26%	0.258	16%	0.161	S	C	.	.			trans	-166.2	162.1	175.2	0	0	0	0	0	112.8	L411 L437	L411-G413 PolarHBondContact O-N 3.42Å; G413-L437 CarbonylContact C-O 3.56Å; G413-L437 WeakPolarHBondContact CA-O 3.48Å
414	N	87.7	Confident	93.7	Very high	16 Å²	16	28.3 Å²	28.3	9%	0.086	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	142.6	174.6	-70.1	135.6	0	0	0	111.7	L437 H439	N414-L437 HydrophobicContact CB-CD1 4.43Å; N414-L437 PolarHBondContact N-O 3.36Å; N414-L437 VanDerWaalsContact N-O 3.12Å; N414-L437 PolarHBondContact O-N 3.28Å; N414-H439 WeakPolarHBondContact CB-NE2 3.39Å; N414-H439 VanDerWaalsContact CG-NE2 3.34Å; N414-H439 PolarHBondContact N-CD2 3.05Å; N414-H439 PolarHBondContact N-NE2 3.24Å; N414-H439 PolarHBondContact OD1-CD2 2.96Å; N414-H439 VanDerWaalsContact OD1-CD2 3.28Å; N414-H439 PolarHBondContact OD1-NE2 2.91Å
415	G	90.5	Very high	93.4	Very high	23 Å²	23	30.1 Å²	30.1	24%	0.237	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	144.2	172.4	0	0	0	0	0	112.3	L435	G415-L435 VanDerWaalsContact CA-O 3.29Å; G415-L435 WeakPolarHBondContact CA-O 3.43Å
416	R	92.9	Very high	93.2	Very high	7 Å²	7	31.3 Å²	31.3	3%	0.026	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	148.8	164	-72.6	-58.2	-174.1	-75.1	-13.3	112	E131 Q136 Q434 L435	E131-R416 VanDerWaalsContact OE1-CD 3.22Å; E131-R416 WeakPolarHBondContact OE1-CD 3.4Å; E131-R416 WeakPolarHBondContact OE1-CG 3.27Å; E131-R416 IonicContact OE1-CZ 3.98Å; E131-R416 IonicContact OE1-NE 3.33Å; E131-R416 PolarHBondContact OE1-NE 3.33Å; E131-R416 IonicContact OE1-NH2 3.78Å; E131-R416 PolarHBondContact OE1-NH2 2.94Å; E131-R416 IonicContact OE2-NE 3.49Å; Q136-R416 CarbonylContact O-C 3.44Å; Q136-R416 WeakPolarHBondContact O-CA 3.48Å; Q136-R416 VanDerWaalsContact O-CD 3.32Å; Q136-R416 WeakPolarHBondContact O-CD 3.33Å; R416-Q434 CarbonylContact O-C 3.57Å; R416-Q434 PolarHBondContact O-NE2 2.98Å; R416-Q434 VanDerWaalsContact O-NE2 3.15Å; R416-L435 HydrophobicContact CB-CB 4.29Å; R416-L435 PolarHBondContact N-O 3.18Å; R416-L435 PolarHBondContact O-N 3.29Å
417	I	93.1	Very high	93.2	Very high	37 Å²	37	32.4 Å²	32.4	19%	0.19	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	124.4	166.1	-61.5	176.1	0	0	0	107.7	Q136 R137 Q419	Q136-I417 HydrophobicContact CB-CB 4.12Å; Q136-I417 PolarHBondContact O-N 3.17Å; R137-I417 WeakPolarHBondContact O-CD1 3.39Å; R137-I417 VanDerWaalsContact O-CG1 3.31Å; R137-I417 WeakPolarHBondContact O-CG1 3.39Å; I417-Q419 PolarHBondContact O-N 2.84Å; I417-Q419 PolarHBondContact O-NE2 2.86Å
418	T	93.1	Very high	93.2	Very high	6 Å²	6	36 Å²	36	4%	0.037	21%	0.213	C	C	.	.			trans	-59.9	125.9	176.9	47.8	0	0	0	0	110.7	L422 I429 P430 G432 T433 L435	T418-L422 HydrophobicContact CG2-CD1 3.61Å; T418-L422 HydrophobicContact CG2-CG 4.32Å; T418-I429 HydrophobicContact CG2-CG2 4.04Å; T418-P430 PolarHBondContact OG1-O 3Å; T418-P430 VanDerWaalsContact OG1-O 3.04Å; T418-G432 PolarHBondContact O-N 2.65Å; T418-G432 PolarHBondContact OG1-N 3.25Å; T418-G432 VanDerWaalsContact OG1-N 3.08Å; T418-T433 PolarHBondContact N-O 3.36Å; T418-T433 VanDerWaalsContact N-O 3.07Å; T418-T433 PolarHBondContact OG1-N 3.47Å; T418-T433 PolarHBondContact OG1-O 3.49Å; T418-L435 HydrophobicContact CG2-CD1 3.67Å; T418-L435 HydrophobicContact CG2-CD2 4.13Å; T418-L435 HydrophobicContact CG2-CG 3.88Å
419	Q	90.6	Very high	93.1	Very high	49 Å²	49	34.5 Å²	34.5	23%	0.229	21%	0.207	C	C	.	.	S	Bend	trans	-89.1	-20.2	179.9	-61.9	-54.8	-66.4	0	0	112.6	I417 K431	I417-Q419 PolarHBondContact O-N 2.84Å; I417-Q419 PolarHBondContact O-NE2 2.86Å; Q419-K431 WeakPolarHBondContact O-CD 3.48Å; Q419-K431 WeakPolarHBondContact O-CE 3.34Å; Q419-K431 WeakPolarHBondContact O-CG 3.47Å; Q419-K431 PolarHBondContact O-NZ 2.89Å
420	D	92.3	Very high	93.1	Very high	97 Å²	97	36.6 Å²	36.6	52%	0.519	22%	0.221	S	C	.	.	S	Bend	trans	-139.4	168.3	176.8	-63.6	-59.4	0	0	0	109.4
421	D	94.8	Very high	93	Very high	98 Å²	98	42 Å²	42	52%	0.524	24%	0.243	S	C	.	.			trans	-66.9	133.5	172.4	-68.5	-17.2	0	0	0	110	F428 P430 K431	D421-F428 HydrophobicContact CB-CE2 3.77Å; D421-F428 HydrophobicContact CB-CZ 3.89Å; D421-P430 WeakPolarHBondContact OD1-CA 3.46Å; D421-K431 PolarHBondContact OD1-N 2.91Å
422	L	93.9	Very high	93	Very high	34 Å²	34	41.3 Å²	41.3	18%	0.178	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	152.6	-177.5	-57.3	177.6	0	0	0	111.1	A130 T418 V424 I429	A130-L422 HydrophobicContact CB-CD2 4.07Å; T418-L422 HydrophobicContact CG2-CD1 3.61Å; T418-L422 HydrophobicContact CG2-CG 4.32Å; L422-V424 HydrophobicContact CB-CG2 4.05Å; L422-I429 HydrophobicContact CB-CB 4.48Å; L422-I429 PolarHBondContact N-O 2.76Å; L422-I429 PolarHBondContact O-N 3.2Å
423	V	95	Very high	93.1	Very high	63 Å²	63	41.7 Å²	41.7	38%	0.382	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	112.3	164.6	179.7	0	0	0	0	107.4	I64 E126 Y427 F428	I64-V423 HydrophobicContact CD1-CG2 4.21Å; I64-V423 HydrophobicContact CG1-CG1 4.46Å; I64-V423 HydrophobicContact CG2-CG1 4.2Å; I64-V423 HydrophobicContact CG2-CG2 4.36Å; E126-V423 VanDerWaalsContact OE1-O 3.11Å; V423-Y427 CarbonylContact C-O 3.58Å; V423-Y427 VanDerWaalsContact CA-O 3.29Å; V423-Y427 WeakPolarHBondContact CA-O 3.44Å; V423-F428 HydrophobicContact CG2-CD2 4.33Å
424	V	93.8	Very high	93.4	Very high	3 Å²	3	41.2 Å²	41.2	2%	0.018	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	129.5	-176.5	-177.8	0	0	0	0	108.8	I105 I118 L123 V127 L422 G426 Y427 I429	I105-V424 HydrophobicContact CD1-CG1 4.34Å; I118-V424 HydrophobicContact CD1-CG1 4.36Å; L123-V424 HydrophobicContact CB-CG1 4.05Å; L123-V424 HydrophobicContact CD2-CG1 4.01Å; L123-V424 HydrophobicContact CG-CG1 4.44Å; V127-V424 HydrophobicContact CG2-CG1 4.06Å; V127-V424 HydrophobicContact CG2-CG2 3.8Å; L422-V424 HydrophobicContact CB-CG2 4.05Å; V424-G426 PolarHBondContact O-N 2.77Å; V424-G426 VanDerWaalsContact O-N 3.15Å; V424-Y427 PolarHBondContact N-O 3.08Å; V424-Y427 PolarHBondContact O-N 3.48Å; V424-I429 HydrophobicContact CB-CD1 3.92Å; V424-I429 HydrophobicContact CG2-CD1 4.13Å
425	G	91.9	Very high	93.7	Very high	38 Å²	38	40.5 Å²	40.5	39%	0.392	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	28.5	-179.1	0	0	0	0	0	113.8	Y427	G425-Y427 VanDerWaalsContact C-N 3.34Å; G425-Y427 WeakPolarHBondContact O-CD2 3.48Å
426	G	93.8	Very high	93.9	Very high	31 Å²	31	40.8 Å²	40.8	32%	0.32	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.2	8.3	-177	0	0	0	0	0	115.3	K65 V424	K65-G426 PolarHBondContact N-O 2.86Å; V424-G426 PolarHBondContact O-N 2.77Å; V424-G426 VanDerWaalsContact O-N 3.15Å
427	Y	96.5	Very high	94	Very high	24 Å²	24	40.5 Å²	40.5	9%	0.094	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	136	177.2	-69.1	-86.1	0	0	0	111.8	K65 E69 M70 I105 V423 V424 G425	K65-Y427 HydrophobicContact CB-CD1 3.49Å; K65-Y427 VanDerWaalsContact CB-CD1 3.49Å; K65-Y427 HydrophobicContact CB-CE1 3.49Å; K65-Y427 VanDerWaalsContact CB-CE1 3.49Å; K65-Y427 HydrophobicContact CB-CG 4.29Å; K65-Y427 HydrophobicContact CD-CD1 4.48Å; K65-Y427 HydrophobicContact CD-CE1 3.76Å; K65-Y427 HydrophobicContact CG-CE1 4.28Å; K65-Y427 WeakPolarHBondContact O-CA 3.42Å; E69-Y427 HydrophobicContact CB-CE1 4.4Å; M70-Y427 VanDerWaalsContact CA-CE1 3.48Å; M70-Y427 HydrophobicContact CB-CD1 3.96Å; M70-Y427 HydrophobicContact CB-CE1 3.79Å; M70-Y427 HydrophobicContact CE-CD1 4.04Å; M70-Y427 HydrophobicContact CE-CD2 4.07Å; M70-Y427 HydrophobicContact CE-CG 3.66Å; M70-Y427 HydrophobicContact CG-CD1 4.5Å; M70-Y427 HydrophobicContact CG-CE1 4.37Å; I105-Y427 HydrophobicContact CG2-CD2 3.92Å; I105-Y427 HydrophobicContact CG2-CE2 3.87Å; V423-Y427 CarbonylContact C-O 3.58Å; V423-Y427 VanDerWaalsContact CA-O 3.29Å; V423-Y427 WeakPolarHBondContact CA-O 3.44Å; V424-Y427 PolarHBondContact N-O 3.08Å; V424-Y427 PolarHBondContact O-N 3.48Å; G425-Y427 VanDerWaalsContact C-N 3.34Å; G425-Y427 WeakPolarHBondContact O-CD2 3.48Å
428	F	96.6	Very high	94.1	Very high	85 Å²	85	38.9 Å²	38.9	37%	0.373	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	123.3	168.1	-179.6	-102.1	0	0	0	110.4	I64 K65 L67 D421 V423 P430	I64-F428 HydrophobicContact CG2-CB 3.81Å; K65-F428 PolarHBondContact O-N 2.95Å; L67-F428 WeakPolarHBondContact CG-O 3.39Å; D421-F428 HydrophobicContact CB-CE2 3.77Å; D421-F428 HydrophobicContact CB-CZ 3.89Å; V423-F428 HydrophobicContact CG2-CD2 4.33Å; F428-P430 HydrophobicContact CD1-CG 4.22Å; F428-P430 HydrophobicContact CE1-CB 4.3Å; F428-P430 HydrophobicContact CE1-CG 3.86Å
429	I	96.1	Very high	94	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	109.6	179.3	-56.6	-180	0	0	0	107.8	L67 I105 V116 T418 L422 V424 T433 L435	L67-I429 HydrophobicContact CD2-CG1 4.23Å; I105-I429 HydrophobicContact CD1-CD1 4.4Å; V116-I429 HydrophobicContact CG1-CD1 4.1Å; T418-I429 HydrophobicContact CG2-CG2 4.04Å; L422-I429 HydrophobicContact CB-CB 4.48Å; L422-I429 PolarHBondContact N-O 2.76Å; L422-I429 PolarHBondContact O-N 3.2Å; V424-I429 HydrophobicContact CB-CD1 3.92Å; V424-I429 HydrophobicContact CG2-CD1 4.13Å; I429-T433 HydrophobicContact CG2-CG2 3.79Å; I429-L435 HydrophobicContact CD1-CD2 4.33Å; I429-L435 HydrophobicContact CG2-CD2 4.17Å
430	P	94.9	Very high	94.2	Very high	45 Å²	45	37.7 Å²	37.7	29%	0.292	23%	0.225	S	C	.	.			trans	-66.3	151.1	179	-16.8	29.6	0	0	0	112.3	L67 T418 D421 F428 T433	L67-P430 VanDerWaalsContact CD1-CD 3.48Å; L67-P430 HydrophobicContact CD1-CG 4.21Å; T418-P430 PolarHBondContact OG1-O 3Å; T418-P430 VanDerWaalsContact OG1-O 3.04Å; D421-P430 WeakPolarHBondContact OD1-CA 3.46Å; F428-P430 HydrophobicContact CD1-CG 4.22Å; F428-P430 HydrophobicContact CE1-CB 4.3Å; F428-P430 HydrophobicContact CE1-CG 3.86Å; P430-T433 VanDerWaalsContact O-CB 3.25Å; P430-T433 WeakPolarHBondContact O-CB 3.23Å; P430-T433 PolarHBondContact O-N 2.86Å; P430-T433 PolarHBondContact O-OG1 3.02Å
431	K	94.2	Very high	94.3	Very high	127 Å²	127	33.5 Å²	33.5	55%	0.552	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-46.6	142.3	166.3	176.1	174.5	-178.1	138.9	0	111.9	Q419 D421 T433	Q419-K431 WeakPolarHBondContact O-CD 3.48Å; Q419-K431 WeakPolarHBondContact O-CE 3.34Å; Q419-K431 WeakPolarHBondContact O-CG 3.47Å; Q419-K431 PolarHBondContact O-NZ 2.89Å; D421-K431 PolarHBondContact OD1-N 2.91Å; K431-T433 VanDerWaalsContact C-N 3.27Å; K431-T433 PolarHBondContact O-N 3.26Å
432	G	91.8	Very high	94.3	Very high	52 Å²	52	28.9 Å²	28.9	54%	0.536	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.4	0.3	-178.6	0	0	0	0	0	114.2	T418	T418-G432 PolarHBondContact O-N 2.65Å; T418-G432 PolarHBondContact OG1-N 3.25Å; T418-G432 VanDerWaalsContact OG1-N 3.08Å
433	T	93.4	Very high	94.3	Very high	15 Å²	15	27.3 Å²	27.3	9%	0.092	17%	0.171	C	C	.	.	P	Polyproline II helix	trans	-71.7	131.6	173.9	-58.8	0	0	0	0	110.8	V116 T418 I429 P430 K431 L435	V116-T433 HydrophobicContact CB-CG2 4.41Å; V116-T433 HydrophobicContact CG2-CG2 3.79Å; T418-T433 PolarHBondContact N-O 3.36Å; T418-T433 VanDerWaalsContact N-O 3.07Å; T418-T433 PolarHBondContact OG1-N 3.47Å; T418-T433 PolarHBondContact OG1-O 3.49Å; I429-T433 HydrophobicContact CG2-CG2 3.79Å; P430-T433 VanDerWaalsContact O-CB 3.25Å; P430-T433 WeakPolarHBondContact O-CB 3.23Å; P430-T433 PolarHBondContact O-N 2.86Å; P430-T433 PolarHBondContact O-OG1 3.02Å; K431-T433 VanDerWaalsContact C-N 3.27Å; K431-T433 PolarHBondContact O-N 3.26Å; T433-L435 HydrophobicContact CG2-CD2 4.29Å
434	Q	93.9	Very high	94.2	Very high	16 Å²	16	25.4 Å²	25.4	8%	0.075	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	123.9	171.2	-177.7	68.1	56.3	0	0	110.1	V115 V116 R416	V115-Q434 CarbonylContact C-O 3.58Å; V115-Q434 WeakPolarHBondContact CA-O 3.36Å; V115-Q434 HydrophobicContact CG1-CG 4.31Å; V115-Q434 HydrophobicContact CG2-CB 4.28Å; V115-Q434 HydrophobicContact CG2-CG 3.99Å; V116-Q434 PolarHBondContact N-O 3.38Å; R416-Q434 CarbonylContact O-C 3.57Å; R416-Q434 PolarHBondContact O-NE2 2.98Å; R416-Q434 VanDerWaalsContact O-NE2 3.15Å
435	L	95	Very high	94.2	Very high	1 Å²	1	27 Å²	27	1%	0.005	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	142.7	172.4	-52	-175.7	0	0	0	109.9	V116 I118 V127 G415 R416 T418 I429 T433	V116-L435 HydrophobicContact CB-CD2 3.8Å; V116-L435 HydrophobicContact CG1-CD2 4.21Å; V116-L435 CarbonylContact O-C 3.52Å; V116-L435 VanDerWaalsContact O-CA 3.24Å; V116-L435 WeakPolarHBondContact O-CA 3.36Å; I118-L435 HydrophobicContact CD1-CD1 4.34Å; V127-L435 HydrophobicContact CB-CD1 4.44Å; V127-L435 HydrophobicContact CG1-CD1 3.46Å; V127-L435 VanDerWaalsContact CG1-CD1 3.46Å; V127-L435 HydrophobicContact CG2-CD1 4.06Å; G415-L435 VanDerWaalsContact CA-O 3.29Å; G415-L435 WeakPolarHBondContact CA-O 3.43Å; R416-L435 HydrophobicContact CB-CB 4.29Å; R416-L435 PolarHBondContact N-O 3.18Å; R416-L435 PolarHBondContact O-N 3.29Å; T418-L435 HydrophobicContact CG2-CD1 3.67Å; T418-L435 HydrophobicContact CG2-CD2 4.13Å; T418-L435 HydrophobicContact CG2-CG 3.88Å; I429-L435 HydrophobicContact CD1-CD2 4.33Å; I429-L435 HydrophobicContact CG2-CD2 4.17Å; T433-L435 HydrophobicContact CG2-CD2 4.29Å
436	A	94.4	Very high	94.2	Very high	29 Å²	29	31.8 Å²	31.8	24%	0.24	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	111.9	168.5	0	0	0	0	0	109.1	V115 V116 S117 I118 C438	V115-A436 HydrophobicContact CG1-CB 3.67Å; V116-A436 PolarHBondContact O-N 2.87Å; S117-A436 CarbonylContact C-O 3.52Å; S117-A436 VanDerWaalsContact CA-O 3.28Å; S117-A436 WeakPolarHBondContact CA-O 3.25Å; I118-A436 PolarHBondContact N-O 2.63Å; A436-C438 PolarHBondContact O-N 3Å
437	L	94.8	Very high	94	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	110.5	177.4	-49.8	179.8	0	0	0	108.2	I118 V124 V127 L128 G413 N414 H439	I118-L437 HydrophobicContact CB-CD2 4.34Å; I118-L437 HydrophobicContact CD1-CD2 4.2Å; V124-L437 HydrophobicContact CG1-CD1 4.45Å; V124-L437 HydrophobicContact CG2-CB 4.37Å; V124-L437 HydrophobicContact CG2-CD2 4.27Å; V127-L437 HydrophobicContact CG1-CD2 4.26Å; L128-L437 HydrophobicContact CD1-CD1 4.17Å; L128-L437 HydrophobicContact CD2-CD1 3.71Å; L128-L437 HydrophobicContact CG-CD1 3.99Å; G413-L437 CarbonylContact C-O 3.56Å; G413-L437 WeakPolarHBondContact CA-O 3.48Å; N414-L437 HydrophobicContact CB-CD1 4.43Å; N414-L437 PolarHBondContact N-O 3.36Å; N414-L437 VanDerWaalsContact N-O 3.12Å; N414-L437 PolarHBondContact O-N 3.28Å; L437-H439 VanDerWaalsContact C-N 3.33Å; L437-H439 WeakPolarHBondContact CB-CE1 3.44Å; L437-H439 PolarHBondContact O-N 3.12Å
438	C	94.9	Very high	93.7	Very high	3 Å²	3	36.2 Å²	36.2	2%	0.02	19%	0.193	C	C	.	.			trans	-82.9	69.8	-170.5	-64.8	0	0	0	0	112.3	Q95 I118 A119 A436 Y440 S441 T442	Q95-C438 HydrophobicContact CB-CB 4.26Å; Q95-C438 HydrophobicContact CG-CB 3.98Å; Q95-C438 VanDerWaalsContact OE1-CB 3.29Å; Q95-C438 PolarHBondContact OE1-O 3.22Å; I118-C438 WeakPolarHBondContact O-CB 3.35Å; I118-C438 PolarHBondContact O-N 2.94Å; A119-C438 HydrophobicContact CB-CB 3.8Å; A436-C438 PolarHBondContact O-N 3Å; C438-Y440 VanDerWaalsContact C-N 3.3Å; C438-Y440 PolarHBondContact O-N 3.3Å; C438-S441 PolarHBondContact O-N 2.88Å; C438-T442 PolarHBondContact O-N 3.11Å; C438-T442 VanDerWaalsContact O-N 3.09Å
439	H	91.3	Very high	93.5	Very high	3 Å²	3	32.2 Å²	32.2	1%	0.014	18%	0.175	C	C	.	.	H	α-helix	trans	-60.6	-34	-174.9	-61.7	-32.4	0	0	0	114.5	P412 N414 L437 S441 T442 S443 I475	P412-H439 PolarHBondContact O-N 2.84Å; P412-H439 VanDerWaalsContact O-N 3.11Å; N414-H439 WeakPolarHBondContact CB-NE2 3.39Å; N414-H439 VanDerWaalsContact CG-NE2 3.34Å; N414-H439 PolarHBondContact N-CD2 3.05Å; N414-H439 PolarHBondContact N-NE2 3.24Å; N414-H439 PolarHBondContact OD1-CD2 2.96Å; N414-H439 VanDerWaalsContact OD1-CD2 3.28Å; N414-H439 PolarHBondContact OD1-NE2 2.91Å; L437-H439 VanDerWaalsContact C-N 3.33Å; L437-H439 WeakPolarHBondContact CB-CE1 3.44Å; L437-H439 PolarHBondContact O-N 3.12Å; H439-S441 VanDerWaalsContact C-N 3.34Å; H439-T442 WeakPolarHBondContact CA-OG1 3.2Å; H439-T442 PolarHBondContact O-N 3.29Å; H439-T442 PolarHBondContact O-OG1 3.04Å; H439-T442 VanDerWaalsContact O-OG1 3.11Å; H439-S443 WeakPolarHBondContact O-CB 3.32Å; H439-S443 PolarHBondContact O-N 2.82Å; H439-S443 PolarHBondContact O-OG 3.19Å; H439-I475 WeakPolarHBondContact CE1-CD1 3.29Å
440	Y	94.9	Very high	93.2	Very high	27 Å²	27	36.5 Å²	36.5	11%	0.106	20%	0.203	C	C	.	.	H	α-helix	trans	-63.6	-44.2	177.3	-166.4	-99.4	0	0	0	110.7	H92 I96 L407 P409 P412 C438 S443 L444 L524	H92-Y440 HydrophobicContact CB-CD1 3.66Å; H92-Y440 HydrophobicContact CB-CD2 3.96Å; H92-Y440 HydrophobicContact CB-CE1 3.89Å; H92-Y440 HydrophobicContact CB-CE2 4.23Å; H92-Y440 HydrophobicContact CB-CG 3.68Å; H92-Y440 AromaticContact CD2-CE1 3.86Å; H92-Y440 AromaticContact CD2-CZ 3.84Å; H92-Y440 WeakPolarHBondContact O-CD1 3.45Å; I96-Y440 HydrophobicContact CD1-CD1 3.91Å; I96-Y440 HydrophobicContact CD1-CE1 3.63Å; I96-Y440 HydrophobicContact CG1-CD1 4.15Å; I96-Y440 HydrophobicContact CG1-CE1 4.37Å; L407-Y440 WeakPolarHBondContact O-CE2 3.45Å; P409-Y440 HydrophobicContact CG-CD2 3.67Å; P409-Y440 HydrophobicContact CG-CE2 4.47Å; P412-Y440 PolarHBondContact O-N 3.03Å; C438-Y440 VanDerWaalsContact C-N 3.3Å; C438-Y440 PolarHBondContact O-N 3.3Å; Y440-S443 PolarHBondContact O-N 3.26Å; Y440-L444 HydrophobicContact CD1-CD1 3.99Å; Y440-L444 HydrophobicContact CE1-CD1 3.47Å; Y440-L444 VanDerWaalsContact CE1-CD1 3.47Å; Y440-L444 HydrophobicContact CE2-CD1 4.29Å; Y440-L444 WeakPolarHBondContact O-CG 3.36Å; Y440-L444 PolarHBondContact O-N 2.99Å; Y440-L524 HydrophobicContact CD2-CD2 4.02Å; Y440-L524 HydrophobicContact CE2-CD2 3.74Å
441	S	94.9	Very high	93.2	Very high	10 Å²	10	37.3 Å²	37.3	7%	0.07	21%	0.21	C	C	.	.	H	α-helix	trans	-64.1	-47.1	176.1	-167	0	0	0	0	111.9	T99 C438 H439 S443 L444 D445	T99-S441 PolarHBondContact OG1-OG 3.01Å; C438-S441 PolarHBondContact O-N 2.88Å; H439-S441 VanDerWaalsContact C-N 3.34Å; S441-S443 VanDerWaalsContact C-N 3.27Å; S441-S443 PolarHBondContact O-N 3.49Å; S441-L444 PolarHBondContact O-N 2.84Å; S441-D445 PolarHBondContact O-N 2.95Å; S441-D445 VanDerWaalsContact O-N 3.15Å
442	T	93.9	Very high	93.2	Very high	0 Å²	0	32 Å²	32	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-66.8	-30.3	-178.9	61.8	0	0	0	0	112.7	C438 H439 L444 N448 G473	C438-T442 PolarHBondContact O-N 3.11Å; C438-T442 VanDerWaalsContact O-N 3.09Å; H439-T442 WeakPolarHBondContact CA-OG1 3.2Å; H439-T442 PolarHBondContact O-N 3.29Å; H439-T442 PolarHBondContact O-OG1 3.04Å; H439-T442 VanDerWaalsContact O-OG1 3.11Å; T442-L444 VanDerWaalsContact C-N 3.29Å; T442-N448 PolarHBondContact O-ND2 3.26Å; T442-G473 CarbonylContact C-O 3.48Å; T442-G473 WeakPolarHBondContact CB-O 3.38Å; T442-G473 PolarHBondContact OG1-O 2.76Å
443	S	93.9	Very high	93.4	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.007	20%	0.196	C	C	.	.	H	α-helix	trans	-74.3	-20.8	179.6	-62.2	0	0	0	0	113.1	R406 H439 Y440 S441 F449 G473	R406-S443 WeakPolarHBondContact CG-O 3.46Å; R406-S443 PolarHBondContact NH1-O 3.35Å; R406-S443 WeakPolarHBondContact O-CB 3.33Å; H439-S443 WeakPolarHBondContact O-CB 3.32Å; H439-S443 PolarHBondContact O-N 2.82Å; H439-S443 PolarHBondContact O-OG 3.19Å; Y440-S443 PolarHBondContact O-N 3.26Å; S441-S443 VanDerWaalsContact C-N 3.27Å; S441-S443 PolarHBondContact O-N 3.49Å; S443-F449 VanDerWaalsContact O-CD2 3.26Å; S443-F449 WeakPolarHBondContact O-CD2 3.22Å; S443-G473 VanDerWaalsContact CA-O 3.28Å; S443-G473 WeakPolarHBondContact CA-O 3.39Å; S443-G473 PolarHBondContact N-O 3.32Å; S443-G473 VanDerWaalsContact N-O 3.07Å; S443-G473 PolarHBondContact OG-O 2.95Å; S443-G473 VanDerWaalsContact OG-O 3.1Å
444	L	93.9	Very high	93.5	Very high	24 Å²	24	40.1 Å²	40.1	13%	0.126	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.2	8.6	179.2	-60.4	-177.4	0	0	0	113.1	I96 L407 Y440 S441 T442 P452 L453	I96-L444 HydrophobicContact CD1-CD1 4.04Å; L407-L444 HydrophobicContact CD2-CD2 3.85Å; Y440-L444 HydrophobicContact CD1-CD1 3.99Å; Y440-L444 HydrophobicContact CE1-CD1 3.47Å; Y440-L444 VanDerWaalsContact CE1-CD1 3.47Å; Y440-L444 HydrophobicContact CE2-CD1 4.29Å; Y440-L444 WeakPolarHBondContact O-CG 3.36Å; Y440-L444 PolarHBondContact O-N 2.99Å; S441-L444 PolarHBondContact O-N 2.84Å; T442-L444 VanDerWaalsContact C-N 3.29Å; L444-P452 VanDerWaalsContact O-CB 3.31Å; L444-P452 WeakPolarHBondContact O-CB 3.46Å; L444-P452 VanDerWaalsContact O-CG 3.27Å; L444-P452 WeakPolarHBondContact O-CG 3.28Å; L444-L453 HydrophobicContact CD1-CD2 4.44Å; L444-L453 HydrophobicContact CD2-CD2 4.27Å
445	D	92.7	Very high	93.7	Very high	36 Å²	36	39.6 Å²	39.6	19%	0.193	21%	0.212	C	C	.	.			trans	-78.4	128.4	176.7	-169	-17.5	0	0	0	110.2	S441 E447 N448 F449	S441-D445 PolarHBondContact O-N 2.95Å; S441-D445 VanDerWaalsContact O-N 3.15Å; D445-E447 VanDerWaalsContact C-N 3.27Å; D445-E447 PolarHBondContact O-N 2.79Å; D445-E447 PolarHBondContact OD1-N 3.24Å; D445-N448 HydrophobicContact CB-CB 4.25Å; D445-N448 WeakPolarHBondContact O-CB 3.39Å; D445-N448 PolarHBondContact O-N 2.86Å; D445-F449 PolarHBondContact O-N 2.95Å
446	E	92.4	Very high	93.7	Very high	139 Å²	139	42.6 Å²	42.6	65%	0.65	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-25.8	-179.5	-167.3	168.7	-165	0	0	112.3	N448 F449 P452	E446-N448 PolarHBondContact O-N 3.42Å; E446-F449 WeakPolarHBondContact CA-O 3.17Å; E446-P452 HydrophobicContact CB-CG 4.26Å
447	E	89.9	Confident	93.8	Very high	133 Å²	133	41.4 Å²	41.4	62%	0.621	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-25.8	170.9	-66	-174.7	173.3	0	0	111.8	K104 D445	K104-E447 IonicContact NZ-OE1 2.78Å; K104-E447 IonicContact NZ-OE2 2.75Å; K104-E447 PolarHBondContact NZ-OE2 3.49Å; D445-E447 VanDerWaalsContact C-N 3.27Å; D445-E447 PolarHBondContact O-N 2.79Å; D445-E447 PolarHBondContact OD1-N 3.24Å
448	N	89.9	Confident	93.7	Very high	14 Å²	14	45.3 Å²	45.3	8%	0.075	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-38.9	-177.6	-67.5	-30.7	0	0	0	112.7	R121 T442 D445 E446 N471	R121-N448 WeakPolarHBondContact CD-OD1 3.32Å; R121-N448 VanDerWaalsContact CG-OD1 3.31Å; R121-N448 WeakPolarHBondContact CG-OD1 3.41Å; T442-N448 PolarHBondContact O-ND2 3.26Å; D445-N448 HydrophobicContact CB-CB 4.25Å; D445-N448 WeakPolarHBondContact O-CB 3.39Å; D445-N448 PolarHBondContact O-N 2.86Å; E446-N448 PolarHBondContact O-N 3.42Å; N448-N471 VanDerWaalsContact CA-ND2 3.34Å; N448-N471 WeakPolarHBondContact CA-ND2 3.42Å; N448-N471 VanDerWaalsContact CB-ND2 3.27Å; N448-N471 WeakPolarHBondContact CB-ND2 3.29Å; N448-N471 PolarHBondContact O-ND2 3.49Å
449	F	92.1	Very high	93.6	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.009	24%	0.243	C	C	.	.	S	Bend	trans	-139.9	105.3	-174.5	-59.8	-78.6	0	0	0	109.2	R406 S443 D445 E446 S451 P452 W460 V469 N471	R406-F449 HydrophobicContact CG-CE2 4.36Å; R406-F449 HydrophobicContact CG-CZ 4.39Å; S443-F449 VanDerWaalsContact O-CD2 3.26Å; S443-F449 WeakPolarHBondContact O-CD2 3.22Å; D445-F449 PolarHBondContact O-N 2.95Å; E446-F449 WeakPolarHBondContact CA-O 3.17Å; F449-S451 PolarHBondContact O-N 2.71Å; F449-P452 HydrophobicContact CB-CB 4.3Å; F449-P452 WeakPolarHBondContact O-CB 3.47Å; F449-P452 WeakPolarHBondContact O-CD 3.43Å; F449-W460 AromaticContact CE1-CH2 3.69Å; F449-W460 HydrophobicContact CE1-CH2 3.69Å; F449-W460 HydrophobicContact CE1-CZ2 4.06Å; F449-W460 HydrophobicContact CE1-CZ3 4.43Å; F449-W460 HydrophobicContact CZ-CH2 4.03Å; F449-V469 HydrophobicContact CE1-CG1 4.1Å; F449-N471 HydrophobicContact CZ-CB 4.46Å
450	P	90.7	Very high	93.6	Very high	89 Å²	89	48.7 Å²	48.7	58%	0.578	25%	0.249	S	C	*	.	S	Bend	trans	-56.6	138	172.6	-24.9	34.5	0	0	0	111	R459	P450-R459 PolarHBondContact O-NH1 3.44Å
451	S	94.3	Very high	93.4	Very high	63 Å²	63	49.4 Å²	49.4	44%	0.441	26%	0.256	S	S	.	.	S	Bend	trans	50.7	58.7	-173	-56.7	0	0	0	0	112.1	F449 L453 E454	F449-S451 PolarHBondContact O-N 2.71Å; S451-L453 PolarHBondContact O-N 3.32Å; S451-L453 VanDerWaalsContact O-N 3.08Å; S451-E454 WeakPolarHBondContact O-CB 3.25Å; S451-E454 PolarHBondContact O-N 3.35Å
452	P	94	Very high	92.6	Very high	15 Å²	15	57.8 Å²	57.8	10%	0.097	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-19.5	-165.6	24.5	-32.7	0	0	0	114.1	R406 L407 L444 E446 F449	R406-P452 VanDerWaalsContact CZ-O 3.24Å; R406-P452 PolarHBondContact NH1-O 3.18Å; R406-P452 PolarHBondContact NH2-O 3.11Å; L407-P452 WeakPolarHBondContact CD2-O 3.43Å; L444-P452 VanDerWaalsContact O-CB 3.31Å; L444-P452 WeakPolarHBondContact O-CB 3.46Å; L444-P452 VanDerWaalsContact O-CG 3.27Å; L444-P452 WeakPolarHBondContact O-CG 3.28Å; E446-P452 HydrophobicContact CB-CG 4.26Å; F449-P452 HydrophobicContact CB-CB 4.3Å; F449-P452 WeakPolarHBondContact O-CB 3.47Å; F449-P452 WeakPolarHBondContact O-CD 3.43Å
453	L	95.2	Very high	91.8	Very high	133 Å²	133	66.3 Å²	66.3	70%	0.696	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-13.4	178.3	-59.2	179.4	0	0	0	113	L444 S451	L444-L453 HydrophobicContact CD1-CD2 4.44Å; L444-L453 HydrophobicContact CD2-CD2 4.27Å; S451-L453 PolarHBondContact O-N 3.32Å; S451-L453 VanDerWaalsContact O-N 3.08Å
454	E	96.6	Very high	90.8	Very high	104 Å²	104	70.3 Å²	70.3	49%	0.486	35%	0.345	S	S	.	.	S	Bend	trans	-78.3	139.8	178.9	-63.4	-61.4	151.8	0	0	110.9	R406 S451 Q456 R459	R406-E454 PolarHBondContact NH2-O 3.22Å; S451-E454 WeakPolarHBondContact O-CB 3.25Å; S451-E454 PolarHBondContact O-N 3.35Å; E454-Q456 HydrophobicContact CB-CG 4.02Å; E454-Q456 PolarHBondContact O-N 3.16Å; E454-R459 PolarHBondContact O-NH2 3.44Å
455	F	97.7	Very high	89.4	Confident	5 Å²	5	75.5 Å²	75.5	2%	0.022	38%	0.378	C	S	.	.			trans	-86.4	103.3	176.5	-179.4	-119.9	0	0	0	110.5	M361 H365 I368 L400 E403 L407 P457	M361-F455 HydrophobicContact CB-CD1 3.99Å; M361-F455 HydrophobicContact CB-CD2 4.14Å; M361-F455 HydrophobicContact CB-CE1 3.73Å; M361-F455 HydrophobicContact CB-CE2 3.89Å; M361-F455 HydrophobicContact CB-CG 4.19Å; M361-F455 HydrophobicContact CB-CZ 3.65Å; M361-F455 HydrophobicContact CE-CB 3.39Å; M361-F455 HydrophobicContact CE-CD1 4.19Å; M361-F455 HydrophobicContact CE-CD2 3.85Å; M361-F455 HydrophobicContact CE-CG 3.55Å; M361-F455 HydrophobicContact CG-CD2 4.28Å; M361-F455 HydrophobicContact CG-CE2 4.26Å; H365-F455 HydrophobicContact CB-CD1 4.23Å; H365-F455 AromaticContact CG-CD1 3.8Å; H365-F455 AromaticContact ND1-CD1 3.63Å; I368-F455 HydrophobicContact CD1-CD1 3.69Å; I368-F455 HydrophobicContact CD1-CE1 4.17Å; I368-F455 WeakPolarHBondContact CD1-O 3.48Å; I368-F455 HydrophobicContact CG2-CE1 4.08Å; L400-F455 HydrophobicContact CD1-CE2 4.33Å; L400-F455 HydrophobicContact CD1-CZ 3.56Å; E403-F455 HydrophobicContact CB-CD2 4.34Å; E403-F455 HydrophobicContact CB-CE2 4.1Å; E403-F455 HydrophobicContact CG-CD2 3.59Å; E403-F455 HydrophobicContact CG-CE2 3.87Å; L407-F455 HydrophobicContact CD1-CB 4.14Å; L407-F455 HydrophobicContact CD1-CD2 3.81Å; L407-F455 HydrophobicContact CD1-CG 4.45Å; F455-P457 HydrophobicContact CE1-CG 3.97Å; F455-P457 HydrophobicContact CE2-CG 4.13Å; F455-P457 HydrophobicContact CZ-CG 3.75Å
456	Q	95.5	Very high	88	Confident	65 Å²	65	78.5 Å²	78.5	30%	0.304	40%	0.401	S	S	.	.			trans	-133.9	87.6	-176.2	-50.9	176	-19.5	0	0	110.9	E403 E454 D458 R459	E403-Q456 PolarHBondContact OE1-N 3.47Å; E403-Q456 VanDerWaalsContact OE1-N 3.1Å; E454-Q456 HydrophobicContact CB-CG 4.02Å; E454-Q456 PolarHBondContact O-N 3.16Å; Q456-D458 WeakPolarHBondContact CB-OD1 3.35Å; Q456-D458 PolarHBondContact O-N 3.42Å; Q456-R459 VanDerWaalsContact CB-NH2 3.34Å; Q456-R459 WeakPolarHBondContact O-CB 3.44Å; Q456-R459 PolarHBondContact O-N 2.88Å
457	P	96	Very high	86.6	Confident	3 Å²	3	74 Å²	74	2%	0.019	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-57.2	-32.4	176.3	-31.7	40.7	0	0	0	114.7	I368 G399 F455 R459 W460	I368-P457 HydrophobicContact CG2-CG 3.76Å; G399-P457 WeakPolarHBondContact CA-O 3.44Å; F455-P457 HydrophobicContact CE1-CG 3.97Å; F455-P457 HydrophobicContact CE2-CG 4.13Å; F455-P457 HydrophobicContact CZ-CG 3.75Å; P457-R459 PolarHBondContact O-N 3.42Å; P457-W460 PolarHBondContact O-N 3.03Å
458	D	93.9	Very high	85	Confident	82 Å²	82	75.9 Å²	75.9	44%	0.439	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-64.9	-20.8	180	67.3	-29.6	0	0	0	113.3	L396 Q456 W460 V461	L396-D458 HydrophobicContact CD2-CB 4.06Å; Q456-D458 WeakPolarHBondContact CB-OD1 3.35Å; Q456-D458 PolarHBondContact O-N 3.42Å; D458-W460 PolarHBondContact O-N 3.38Å; D458-V461 WeakPolarHBondContact O-CB 3.29Å; D458-V461 PolarHBondContact O-N 3.48Å
459	R	91.7	Very high	83.5	Confident	41 Å²	41	77.9 Å²	77.9	16%	0.155	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-53.4	-27.4	171.5	-166.4	-166.7	-36	-69.2	4.5	113.3	E403 P450 E454 Q456 P457	E403-R459 IonicContact OE1-CZ 3.3Å; E403-R459 IonicContact OE1-NE 3.8Å; E403-R459 PolarHBondContact OE1-NE 2.83Å; E403-R459 IonicContact OE1-NH2 3.01Å; E403-R459 PolarHBondContact OE1-NH2 3.03Å; E403-R459 IonicContact OE2-NE 3.38Å; P450-R459 PolarHBondContact O-NH1 3.44Å; E454-R459 PolarHBondContact O-NH2 3.44Å; Q456-R459 VanDerWaalsContact CB-NH2 3.34Å; Q456-R459 WeakPolarHBondContact O-CB 3.44Å; Q456-R459 PolarHBondContact O-N 2.88Å; P457-R459 PolarHBondContact O-N 3.42Å
460	W	91.8	Very high	81.8	Confident	36 Å²	36	84 Å²	84	14%	0.136	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-94	-4.2	-178.1	-57.4	100.1	0	0	0	113.6	K402 E403 R406 F449 P457 D458 V469	K402-W460 HydrophobicContact CB-CD2 3.73Å; K402-W460 HydrophobicContact CB-CE3 4.37Å; K402-W460 HydrophobicContact CB-CG 3.77Å; K402-W460 HydrophobicContact CB-CZ2 4.3Å; K402-W460 HydrophobicContact CD-CB 3.92Å; K402-W460 HydrophobicContact CD-CD2 3.82Å; K402-W460 HydrophobicContact CD-CE3 3.85Å; K402-W460 HydrophobicContact CD-CG 3.87Å; K402-W460 HydrophobicContact CG-CD2 4.45Å; E403-W460 PolarHBondContact OE2-NE1 2.97Å; R406-W460 HydrophobicContact CB-CZ2 4.03Å; R406-W460 HydrophobicContact CG-CZ2 4.29Å; F449-W460 AromaticContact CE1-CH2 3.69Å; F449-W460 HydrophobicContact CE1-CH2 3.69Å; F449-W460 HydrophobicContact CE1-CZ2 4.06Å; F449-W460 HydrophobicContact CE1-CZ3 4.43Å; F449-W460 HydrophobicContact CZ-CH2 4.03Å; P457-W460 PolarHBondContact O-N 3.03Å; D458-W460 PolarHBondContact O-N 3.38Å; W460-V469 HydrophobicContact CE3-CB 4.23Å; W460-V469 HydrophobicContact CE3-CG1 3.96Å; W460-V469 HydrophobicContact CH2-CG1 4.23Å; W460-V469 HydrophobicContact CZ3-CB 4.19Å; W460-V469 HydrophobicContact CZ3-CG1 3.51Å
461	V	89.7	Confident	80.7	Confident	42 Å²	42	80.7 Å²	80.7	26%	0.255	41%	0.406	S	S	.	.	S	Bend	trans	-86.1	119.6	176.5	-176.6	0	0	0	0	107.8	P395 L396 D458 K463	P395-V461 HydrophobicContact CB-CG1 4.13Å; P395-V461 HydrophobicContact CB-CG2 4.04Å; P395-V461 HydrophobicContact CG-CG1 4.49Å; L396-V461 HydrophobicContact CD2-CG2 3.86Å; L396-V461 HydrophobicContact CG-CG2 4.49Å; D458-V461 WeakPolarHBondContact O-CB 3.29Å; D458-V461 PolarHBondContact O-N 3.48Å; V461-K463 PolarHBondContact O-N 2.86Å
462	R	79.8	Confident	80.3	Confident	186 Å²	186	78.5 Å²	78.5	70%	0.702	39%	0.388	S	S	*	.			trans	-65.9	123.5	-179.1	-65.9	-175.8	178	173.9	-2.4	109.7
463	K	76.7	Confident	80	Confident	179 Å²	179	77.8 Å²	77.8	78%	0.778	38%	0.384	S	S	*	.	S	Bend	trans	-78.7	-37	171.8	-63.3	176.2	-177.4	177.7	0	111.5	V461 D467	V461-K463 PolarHBondContact O-N 2.86Å; K463-D467 HydrophobicContact CB-CB 4.38Å; K463-D467 WeakPolarHBondContact CB-OD2 3.36Å; K463-D467 WeakPolarHBondContact CG-OD2 3.39Å; K463-D467 PolarHBondContact N-OD2 2.96Å
464	D	72.2	Confident	79.8	Confident	85 Å²	85	72.2 Å²	72.2	46%	0.455	36%	0.356	S	S	.	.	S	Bend	trans	-153.1	-176.4	176.9	64.5	55.6	0	0	0	112.4	S466 D467	D464-S466 VanDerWaalsContact C-N 3.29Å; D464-S466 PolarHBondContact O-N 2.97Å; D464-S466 VanDerWaalsContact OD1-CA 3.24Å; D464-S466 WeakPolarHBondContact OD1-CA 3.44Å; D464-S466 WeakPolarHBondContact OD1-CB 3.33Å; D464-S466 PolarHBondContact OD1-N 3.42Å; D464-S466 PolarHBondContact OD1-OG 3.45Å; D464-D467 PolarHBondContact O-N 3.25Å; D464-D467 PolarHBondContact OD1-N 3.04Å
465	T	65	Low	79.7	Confident	134 Å²	134	68.2 Å²	68.2	82%	0.822	34%	0.338	S	S	*	.	S	Bend	trans	-70.3	-22.1	-178.5	49.3	0	0	0	0	114.4
466	S	62.3	Low	79.4	Confident	98 Å²	98	69.8 Å²	69.8	69%	0.685	35%	0.348	S	S	*	.	S	Bend	trans	-88.9	-21.1	176.6	71.8	0	0	0	0	112.8	D464 R468	D464-S466 VanDerWaalsContact C-N 3.29Å; D464-S466 PolarHBondContact O-N 2.97Å; D464-S466 VanDerWaalsContact OD1-CA 3.24Å; D464-S466 WeakPolarHBondContact OD1-CA 3.44Å; D464-S466 WeakPolarHBondContact OD1-CB 3.33Å; D464-S466 PolarHBondContact OD1-N 3.42Å; D464-S466 PolarHBondContact OD1-OG 3.45Å; S466-R468 PolarHBondContact O-N 2.98Å
467	D	63.2	Low	79.4	Confident	44 Å²	44	68.3 Å²	68.3	24%	0.235	34%	0.341	C	S	.	.			trans	-71.6	74.4	172.6	-169.9	17.1	0	0	0	111	K463 D464	K463-D467 HydrophobicContact CB-CB 4.38Å; K463-D467 WeakPolarHBondContact CB-OD2 3.36Å; K463-D467 WeakPolarHBondContact CG-OD2 3.39Å; K463-D467 PolarHBondContact N-OD2 2.96Å; D464-D467 PolarHBondContact O-N 3.25Å; D464-D467 PolarHBondContact OD1-N 3.04Å
468	R	57.6	Low	79.2	Confident	174 Å²	174	68.8 Å²	68.8	66%	0.657	35%	0.346	S	S	*	.			trans	-103.7	106.2	170.8	-66.7	-172.1	-179.6	-171.3	1	108.5	S466 D470	S466-R468 PolarHBondContact O-N 2.98Å; R468-D470 HydrophobicContact CB-CB 4.23Å; R468-D470 PolarHBondContact O-N 3.33Å
469	V	57.3	Low	79	Confident	56 Å²	56	69.4 Å²	69.4	34%	0.339	34%	0.343	S	S	.	.			trans	-71.4	60.7	155.4	-166.8	0	0	0	0	108.2	F449 W460 N471	F449-V469 HydrophobicContact CE1-CG1 4.1Å; W460-V469 HydrophobicContact CE3-CB 4.23Å; W460-V469 HydrophobicContact CE3-CG1 3.96Å; W460-V469 HydrophobicContact CH2-CG1 4.23Å; W460-V469 HydrophobicContact CZ3-CB 4.19Å; W460-V469 HydrophobicContact CZ3-CG1 3.51Å; V469-N471 HydrophobicContact CG1-CB 4.19Å; V469-N471 PolarHBondContact O-N 3.18Å
470	D	57.4	Low	79	Confident	130 Å²	130	69 Å²	69	70%	0.695	35%	0.351	S	S	*	.			trans	-88.4	69.7	169.3	-161.2	11.9	0	0	0	107.2	R468	R468-D470 HydrophobicContact CB-CB 4.23Å; R468-D470 PolarHBondContact O-N 3.33Å
471	N	66.2	Low	78.9	Confident	20 Å²	20	71 Å²	71	11%	0.107	36%	0.364	C	S	.	.			trans	-114.4	110.4	-171.7	-164.3	-8	0	0	0	109.1	R121 N448 F449 V469 G473 S474	R121-N471 WeakPolarHBondContact CD-OD1 3.24Å; N448-N471 VanDerWaalsContact CA-ND2 3.34Å; N448-N471 WeakPolarHBondContact CA-ND2 3.42Å; N448-N471 VanDerWaalsContact CB-ND2 3.27Å; N448-N471 WeakPolarHBondContact CB-ND2 3.29Å; N448-N471 PolarHBondContact O-ND2 3.49Å; F449-N471 HydrophobicContact CZ-CB 4.46Å; V469-N471 HydrophobicContact CG1-CB 4.19Å; V469-N471 PolarHBondContact O-N 3.18Å; N471-G473 PolarHBondContact O-N 3.06Å; N471-G473 WeakPolarHBondContact OD1-CA 3.43Å; N471-G473 PolarHBondContact OD1-N 3.11Å; N471-S474 PolarHBondContact O-N 3.38Å
472	F	86.1	Confident	79.1	Confident	16 Å²	16	69.2 Å²	69.2	7%	0.07	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-6	164.1	-82.6	-93.4	0	0	0	112.8	R121 V124 A125 L128 S474 I475 Y479	R121-F472 HydrophobicContact CB-CB 4.19Å; R121-F472 WeakPolarHBondContact O-CB 2.94Å; V124-F472 HydrophobicContact CG1-CD1 4.24Å; A125-F472 HydrophobicContact CB-CB 4.18Å; A125-F472 HydrophobicContact CB-CD1 3.81Å; A125-F472 HydrophobicContact CB-CD2 3.47Å; A125-F472 VanDerWaalsContact CB-CD2 3.47Å; A125-F472 HydrophobicContact CB-CE1 3.96Å; A125-F472 HydrophobicContact CB-CE2 3.66Å; A125-F472 HydrophobicContact CB-CG 3.55Å; A125-F472 HydrophobicContact CB-CZ 3.88Å; L128-F472 HydrophobicContact CB-CE1 4.33Å; L128-F472 HydrophobicContact CD1-CD1 3.93Å; L128-F472 HydrophobicContact CD1-CE1 3.81Å; F472-S474 VanDerWaalsContact C-N 3.26Å; F472-S474 PolarHBondContact O-N 2.81Å; F472-I475 HydrophobicContact CD1-CD1 4.48Å; F472-Y479 HydrophobicContact CE1-CD1 4.1Å; F472-Y479 AromaticContact CE1-CD2 3.77Å; F472-Y479 HydrophobicContact CE1-CD2 3.77Å; F472-Y479 HydrophobicContact CE1-CE1 4.3Å; F472-Y479 AromaticContact CE1-CE2 3.99Å; F472-Y479 HydrophobicContact CE1-CE2 3.99Å; F472-Y479 AromaticContact CE1-CG 3.83Å; F472-Y479 HydrophobicContact CE1-CG 3.83Å; F472-Y479 HydrophobicContact CZ-CD1 4.37Å; F472-Y479 AromaticContact CZ-CD2 3.89Å; F472-Y479 HydrophobicContact CZ-CD2 3.89Å; F472-Y479 HydrophobicContact CZ-CE1 4.12Å; F472-Y479 AromaticContact CZ-CE2 3.6Å; F472-Y479 HydrophobicContact CZ-CE2 3.6Å; F472-Y479 HydrophobicContact CZ-CG 4.27Å; F472-Y479 AromaticContact CZ-CZ 3.72Å
473	G	87.8	Confident	79.7	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-33.6	165.1	0	0	0	0	0	114.2	T442 S443 N471	T442-G473 CarbonylContact C-O 3.48Å; T442-G473 WeakPolarHBondContact CB-O 3.38Å; T442-G473 PolarHBondContact OG1-O 2.76Å; S443-G473 VanDerWaalsContact CA-O 3.28Å; S443-G473 WeakPolarHBondContact CA-O 3.39Å; S443-G473 PolarHBondContact N-O 3.32Å; S443-G473 VanDerWaalsContact N-O 3.07Å; S443-G473 PolarHBondContact OG-O 2.95Å; S443-G473 VanDerWaalsContact OG-O 3.1Å; N471-G473 PolarHBondContact O-N 3.06Å; N471-G473 WeakPolarHBondContact OD1-CA 3.43Å; N471-G473 PolarHBondContact OD1-N 3.11Å
474	S	92	Very high	80.6	Confident	16 Å²	16	55.1 Å²	55.1	11%	0.112	31%	0.305	C	S	.	.			trans	-137.7	109.8	174.3	-167	0	0	0	0	112.7	N471 F472	N471-S474 PolarHBondContact O-N 3.38Å; F472-S474 VanDerWaalsContact C-N 3.26Å; F472-S474 PolarHBondContact O-N 2.81Å
475	I	93.1	Very high	81.6	Confident	20 Å²	20	52 Å²	52	10%	0.103	29%	0.288	C	S	.	.			trans	-130.9	64.6	178.3	49.3	167.5	0	0	0	110.8	V124 L128 H439 F472 F477 G478	V124-I475 HydrophobicContact CG1-CD1 4.07Å; L128-I475 HydrophobicContact CD1-CD1 3.63Å; H439-I475 WeakPolarHBondContact CE1-CD1 3.29Å; F472-I475 HydrophobicContact CD1-CD1 4.48Å; I475-F477 PolarHBondContact O-N 3.47Å; I475-F477 VanDerWaalsContact O-N 3.11Å; I475-G478 WeakPolarHBondContact O-CA 3.24Å; I475-G478 PolarHBondContact O-N 2.83Å
476	P	92.8	Very high	83	Confident	38 Å²	38	46.6 Å²	46.6	25%	0.247	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-22.4	-171.6	26.3	-36	0	0	0	114	L405	L405-P476 HydrophobicContact CB-CB 3.72Å; L405-P476 HydrophobicContact CB-CG 3.77Å; L405-P476 HydrophobicContact CD1-CB 4.19Å; L405-P476 HydrophobicContact CD1-CG 4.02Å; L405-P476 HydrophobicContact CD2-CB 4.25Å; L405-P476 HydrophobicContact CG-CB 4.29Å; L405-P476 HydrophobicContact CG-CG 4.45Å
477	F	94.1	Very high	84.6	Confident	35 Å²	35	46.1 Å²	46.1	15%	0.154	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	9.4	173.9	-66.1	-75	0	0	0	113.3	L405 I475 C484 R487 A490 E491 M494	L405-F477 HydrophobicContact CD1-CD2 4.43Å; L405-F477 HydrophobicContact CD1-CE2 3.52Å; L405-F477 HydrophobicContact CD1-CZ 3.78Å; I475-F477 PolarHBondContact O-N 3.47Å; I475-F477 VanDerWaalsContact O-N 3.11Å; F477-C484 HydrophobicContact CB-CB 3.97Å; F477-C484 HydrophobicContact CD1-CB 3.82Å; F477-C484 HydrophobicContact CG-CB 4.4Å; F477-C484 WeakPolarHBondContact O-CB 3.44Å; F477-C484 PolarHBondContact O-N 3.45Å; F477-R487 HydrophobicContact CB-CB 4.32Å; F477-R487 HydrophobicContact CB-CG 4.1Å; F477-R487 HydrophobicContact CD1-CB 3.87Å; F477-R487 HydrophobicContact CD1-CG 3.9Å; F477-R487 HydrophobicContact CD2-CG 3.89Å; F477-R487 HydrophobicContact CE1-CB 4.36Å; F477-R487 HydrophobicContact CE1-CG 4.27Å; F477-R487 HydrophobicContact CE2-CG 4.25Å; F477-R487 HydrophobicContact CG-CB 4.06Å; F477-R487 HydrophobicContact CG-CG 3.68Å; F477-R487 HydrophobicContact CZ-CG 4.43Å; F477-A490 HydrophobicContact CE1-CB 4.21Å; F477-E491 HydrophobicContact CE2-CG 4.26Å; F477-E491 HydrophobicContact CZ-CG 4.33Å; F477-M494 HydrophobicContact CZ-CE 4.05Å
478	G	92.1	Very high	86	Confident	12 Å²	12	48.2 Å²	48.2	12%	0.124	25%	0.247	C	C	.	.			trans	67.6	-171.7	-170.8	0	0	0	0	0	113.4	I475	I475-G478 WeakPolarHBondContact O-CA 3.24Å; I475-G478 PolarHBondContact O-N 2.83Å
479	Y	91.2	Very high	87.7	Confident	95 Å²	95	40.7 Å²	40.7	37%	0.373	22%	0.219	S	C	.	.			trans	-134.1	162.8	-177.1	-174.7	-94.2	0	0	0	111	L128 F472 S483	L128-Y479 HydrophobicContact CB-CD1 3.9Å; L128-Y479 HydrophobicContact CD1-CD1 4.48Å; L128-Y479 HydrophobicContact CD1-CG 4.39Å; F472-Y479 HydrophobicContact CE1-CD1 4.1Å; F472-Y479 AromaticContact CE1-CD2 3.77Å; F472-Y479 HydrophobicContact CE1-CD2 3.77Å; F472-Y479 HydrophobicContact CE1-CE1 4.3Å; F472-Y479 AromaticContact CE1-CE2 3.99Å; F472-Y479 HydrophobicContact CE1-CE2 3.99Å; F472-Y479 AromaticContact CE1-CG 3.83Å; F472-Y479 HydrophobicContact CE1-CG 3.83Å; F472-Y479 HydrophobicContact CZ-CD1 4.37Å; F472-Y479 AromaticContact CZ-CD2 3.89Å; F472-Y479 HydrophobicContact CZ-CD2 3.89Å; F472-Y479 HydrophobicContact CZ-CE1 4.12Å; F472-Y479 AromaticContact CZ-CE2 3.6Å; F472-Y479 HydrophobicContact CZ-CE2 3.6Å; F472-Y479 HydrophobicContact CZ-CG 4.27Å; F472-Y479 AromaticContact CZ-CZ 3.72Å; Y479-S483 PolarHBondContact O-N 2.91Å
480	G	90.9	Very high	89.6	Confident	32 Å²	32	38.5 Å²	38.5	33%	0.33	21%	0.207	S	C	.	.	S	Bend	trans	74.6	-167.6	173.4	0	0	0	0	0	113.8	R482 S483	G480-R482 PolarHBondContact O-N 3.11Å; G480-R482 VanDerWaalsContact O-N 3.17Å; G480-S483 VanDerWaalsContact O-CB 3.3Å; G480-S483 WeakPolarHBondContact O-CB 3.47Å; G480-S483 PolarHBondContact O-N 3.15Å; G480-S483 PolarHBondContact O-OG 2.8Å
481	I	90.6	Very high	91.5	Very high	80 Å²	80	33.5 Å²	33.5	41%	0.41	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-21.6	-174.7	55	164	0	0	0	113.2	A133 P135 W164 R168	A133-I481 WeakPolarHBondContact O-CD1 3.5Å; P135-I481 HydrophobicContact CG-CD1 3.92Å; P135-I481 HydrophobicContact CG-CG1 3.73Å; W164-I481 HydrophobicContact CH2-CB 4.44Å; W164-I481 HydrophobicContact CH2-CD1 3.96Å; W164-I481 HydrophobicContact CH2-CG1 4.08Å; W164-I481 HydrophobicContact CZ3-CD1 4.04Å; R168-I481 PolarHBondContact NE-O 3.17Å; R168-I481 PolarHBondContact NH2-O 3.04Å
482	R	92.6	Very high	92.9	Very high	4 Å²	4	33 Å²	33	2%	0.015	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	22.2	176.7	-156.2	153.9	-170.4	-154.6	-4.5	113.3	P135 Q136 R137 A159 E160 W164 G480	P135-R482 HydrophobicContact CB-CB 4.37Å; P135-R482 HydrophobicContact CG-CB 4.33Å; P135-R482 WeakPolarHBondContact O-CD 3.44Å; P135-R482 PolarHBondContact O-NH1 3.5Å; Q136-R482 VanDerWaalsContact CA-NH1 3.33Å; R137-R482 PolarHBondContact NH2-O 2.96Å; A159-R482 PolarHBondContact O-NH2 3.1Å; E160-R482 VanDerWaalsContact CD-NH2 3.3Å; E160-R482 IonicContact OE1-CZ 3.16Å; E160-R482 IonicContact OE1-NH1 3.03Å; E160-R482 PolarHBondContact OE1-NH1 2.82Å; E160-R482 IonicContact OE1-NH2 2.66Å; E160-R482 PolarHBondContact OE1-NH2 2.75Å; E160-R482 IonicContact OE2-CZ 3.94Å; E160-R482 IonicContact OE2-NH1 3.24Å; E160-R482 PolarHBondContact OE2-NH1 3.44Å; E160-R482 IonicContact OE2-NH2 3.01Å; W164-R482 VanDerWaalsContact CE2-CD 3.45Å; W164-R482 VanDerWaalsContact CE2-NE 3.33Å; W164-R482 HydrophobicContact CH2-CB 3.84Å; W164-R482 HydrophobicContact CH2-CG 4.06Å; W164-R482 HydrophobicContact CZ2-CB 3.59Å; W164-R482 VanDerWaalsContact CZ2-CD 3.45Å; W164-R482 HydrophobicContact CZ2-CG 3.36Å; W164-R482 VanDerWaalsContact NE1-NE 3.17Å; G480-R482 PolarHBondContact O-N 3.11Å; G480-R482 VanDerWaalsContact O-N 3.17Å
483	S	93.1	Very high	93.4	Very high	22 Å²	22	32.3 Å²	32.3	15%	0.154	17%	0.174	C	C	.	.	S	Bend	trans	-59.6	162.5	163.6	71.3	0	0	0	0	111.3	R168 Y479 G480 I485	R168-S483 PolarHBondContact NH1-O 3.43Å; R168-S483 VanDerWaalsContact NH1-O 3.14Å; R168-S483 PolarHBondContact NH2-O 3.25Å; Y479-S483 PolarHBondContact O-N 2.91Å; G480-S483 VanDerWaalsContact O-CB 3.3Å; G480-S483 WeakPolarHBondContact O-CB 3.47Å; G480-S483 PolarHBondContact O-N 3.15Å; G480-S483 PolarHBondContact O-OG 2.8Å; S483-I485 PolarHBondContact O-N 2.82Å
484	C	94.8	Very high	93.9	Very high	46 Å²	46	32.4 Å²	32.4	31%	0.311	17%	0.174	S	C	.	.			trans	-49.4	125.3	178	-179	0	0	0	0	111.3	F477 G486 R487	F477-C484 HydrophobicContact CB-CB 3.97Å; F477-C484 HydrophobicContact CD1-CB 3.82Å; F477-C484 HydrophobicContact CG-CB 4.4Å; F477-C484 WeakPolarHBondContact O-CB 3.44Å; F477-C484 PolarHBondContact O-N 3.45Å; C484-G486 PolarHBondContact SG-N 3.45Å; C484-R487 HydrophobicContact CB-CB 4.29Å
485	I	93.8	Very high	94.2	Very high	19 Å²	19	32.3 Å²	32.3	10%	0.097	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-36.4	178.6	-153.7	170.3	0	0	0	111.8	L156 R168 L171 I175 M176 S483 R487	L156-I485 HydrophobicContact CD2-CB 3.88Å; L156-I485 HydrophobicContact CD2-CD1 3.34Å; L156-I485 HydrophobicContact CD2-CG1 4.15Å; L156-I485 HydrophobicContact CD2-CG2 3.8Å; R168-I485 VanDerWaalsContact NH1-CG1 3.27Å; L171-I485 HydrophobicContact CB-CD1 3.46Å; L171-I485 VanDerWaalsContact CB-CD1 3.46Å; L171-I485 HydrophobicContact CD1-CD1 4.28Å; I175-I485 HydrophobicContact CD1-CB 4.3Å; I175-I485 HydrophobicContact CD1-CD1 3.86Å; I175-I485 HydrophobicContact CD1-CG1 3.64Å; I175-I485 HydrophobicContact CD1-CG2 3.94Å; I175-I485 HydrophobicContact CG1-CD1 4.22Å; I175-I485 HydrophobicContact CG1-CG1 3.95Å; M176-I485 HydrophobicContact CG-CG1 4Å; M176-I485 HydrophobicContact SD-CG1 4.29Å; S483-I485 PolarHBondContact O-N 2.82Å; I485-R487 PolarHBondContact O-N 3.07Å
486	G	94.4	Very high	94.5	Very high	21 Å²	21	31.3 Å²	31.3	22%	0.216	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	5.7	-178.4	0	0	0	0	0	113.7	C484 R488 I489 A490	C484-G486 PolarHBondContact SG-N 3.45Å; G486-R488 VanDerWaalsContact C-N 3.26Å; G486-R488 PolarHBondContact O-N 2.71Å; G486-R488 VanDerWaalsContact O-N 3.15Å; G486-I489 PolarHBondContact O-N 2.89Å; G486-I489 VanDerWaalsContact O-N 3.1Å; G486-A490 WeakPolarHBondContact O-CB 3.49Å; G486-A490 PolarHBondContact O-N 3Å
487	R	94.9	Very high	94.8	Very high	88 Å²	88	29.5 Å²	29.5	33%	0.332	16%	0.155	S	C	.	.	H	α-helix	trans	-49.4	-47	-174.2	173.3	179.5	173.9	175.3	4	112.4	F477 C484 I485 E491	F477-R487 HydrophobicContact CB-CB 4.32Å; F477-R487 HydrophobicContact CB-CG 4.1Å; F477-R487 HydrophobicContact CD1-CB 3.87Å; F477-R487 HydrophobicContact CD1-CG 3.9Å; F477-R487 HydrophobicContact CD2-CG 3.89Å; F477-R487 HydrophobicContact CE1-CB 4.36Å; F477-R487 HydrophobicContact CE1-CG 4.27Å; F477-R487 HydrophobicContact CE2-CG 4.25Å; F477-R487 HydrophobicContact CG-CB 4.06Å; F477-R487 HydrophobicContact CG-CG 3.68Å; F477-R487 HydrophobicContact CZ-CG 4.43Å; C484-R487 HydrophobicContact CB-CB 4.29Å; I485-R487 PolarHBondContact O-N 3.07Å; R487-E491 HydrophobicContact CG-CG 4.36Å; R487-E491 IonicContact CZ-OE1 3.12Å; R487-E491 IonicContact NE-OE1 2.78Å; R487-E491 PolarHBondContact NE-OE1 3.37Å; R487-E491 IonicContact NE-OE2 2.74Å; R487-E491 IonicContact NH2-OE1 2.63Å; R487-E491 PolarHBondContact NH2-OE1 3.48Å; R487-E491 VanDerWaalsContact O-CB 3.29Å; R487-E491 WeakPolarHBondContact O-CB 3.43Å; R487-E491 VanDerWaalsContact O-CG 3.28Å; R487-E491 WeakPolarHBondContact O-CG 3.2Å; R487-E491 PolarHBondContact O-N 2.84Å
488	R	93.3	Very high	95	Very high	88 Å²	88	28 Å²	28	33%	0.332	15%	0.149	S	C	.	.	H	α-helix	trans	-71.4	-37.8	-175.9	-65.2	-52.6	-173.6	-172.7	4.6	112.5	M176 V181 G486 E491 L492	M176-R488 WeakPolarHBondContact O-CG 3.28Å; V181-R488 HydrophobicContact CB-CB 4.21Å; V181-R488 HydrophobicContact CG1-CB 4.2Å; V181-R488 HydrophobicContact CG2-CB 3.71Å; G486-R488 VanDerWaalsContact C-N 3.26Å; G486-R488 PolarHBondContact O-N 2.71Å; G486-R488 VanDerWaalsContact O-N 3.15Å; R488-E491 IonicContact CZ-OE2 2.86Å; R488-E491 IonicContact NH1-OE1 2.77Å; R488-E491 IonicContact NH1-OE2 3.42Å; R488-E491 PolarHBondContact NH1-OE2 2.86Å; R488-L492 WeakPolarHBondContact O-CB 3.27Å; R488-L492 PolarHBondContact O-N 2.9Å
489	I	93.9	Very high	95.3	Very high	16 Å²	16	27.4 Å²	27.4	8%	0.082	14%	0.143	C	C	.	.	H	α-helix	trans	-64.7	-50.5	174.6	-67.5	169.1	0	0	0	109.5	I175 V181 I230 G486 E491 L492 E493	I175-I489 HydrophobicContact CB-CD1 3.92Å; I175-I489 HydrophobicContact CG2-CD1 3.88Å; V181-I489 HydrophobicContact CG1-CG1 4.31Å; V181-I489 HydrophobicContact CG2-CG1 4.22Å; I230-I489 HydrophobicContact CD1-CG1 4.5Å; I230-I489 HydrophobicContact CD1-CG2 3.61Å; I230-I489 HydrophobicContact CG2-CD1 4.08Å; G486-I489 PolarHBondContact O-N 2.89Å; G486-I489 VanDerWaalsContact O-N 3.1Å; I489-E491 PolarHBondContact O-N 2.75Å; I489-L492 WeakPolarHBondContact O-CB 3.36Å; I489-L492 PolarHBondContact O-N 2.77Å; I489-L492 VanDerWaalsContact O-N 3.11Å; I489-E493 HydrophobicContact CG2-CG 4.34Å; I489-E493 WeakPolarHBondContact O-CG 3.35Å; I489-E493 PolarHBondContact O-N 3.29Å
490	A	96.8	Very high	95.6	Very high	10 Å²	10	23.8 Å²	23.8	8%	0.083	13%	0.128	C	C	.	.	H	α-helix	trans	-60.6	-45.3	178.6	0	0	0	0	0	112.1	F477 G486 L492 E493 M494	F477-A490 HydrophobicContact CE1-CB 4.21Å; G486-A490 WeakPolarHBondContact O-CB 3.49Å; G486-A490 PolarHBondContact O-N 3Å; A490-L492 VanDerWaalsContact C-N 3.34Å; A490-L492 PolarHBondContact O-N 3.28Å; A490-E493 PolarHBondContact O-N 3.19Å; A490-M494 HydrophobicContact CB-CE 4.13Å; A490-M494 WeakPolarHBondContact O-CB 3.43Å; A490-M494 WeakPolarHBondContact O-CE 3.49Å; A490-M494 VanDerWaalsContact O-CG 3.25Å; A490-M494 WeakPolarHBondContact O-CG 3.45Å; A490-M494 PolarHBondContact O-N 3.5Å
491	E	96.9	Very high	95.9	Very high	25 Å²	25	22.2 Å²	22.2	12%	0.117	11%	0.113	C	C	.	.	H	α-helix	trans	-57.1	-47.1	173.2	-79.5	174.5	170.4	0	0	110.6	F477 R487 R488 I489 M494 H495	F477-E491 HydrophobicContact CE2-CG 4.26Å; F477-E491 HydrophobicContact CZ-CG 4.33Å; R487-E491 HydrophobicContact CG-CG 4.36Å; R487-E491 IonicContact CZ-OE1 3.12Å; R487-E491 IonicContact NE-OE1 2.78Å; R487-E491 PolarHBondContact NE-OE1 3.37Å; R487-E491 IonicContact NE-OE2 2.74Å; R487-E491 IonicContact NH2-OE1 2.63Å; R487-E491 PolarHBondContact NH2-OE1 3.48Å; R487-E491 VanDerWaalsContact O-CB 3.29Å; R487-E491 WeakPolarHBondContact O-CB 3.43Å; R487-E491 VanDerWaalsContact O-CG 3.28Å; R487-E491 WeakPolarHBondContact O-CG 3.2Å; R487-E491 PolarHBondContact O-N 2.84Å; R488-E491 IonicContact CZ-OE2 2.86Å; R488-E491 IonicContact NH1-OE1 2.77Å; R488-E491 IonicContact NH1-OE2 3.42Å; R488-E491 PolarHBondContact NH1-OE2 2.86Å; I489-E491 PolarHBondContact O-N 2.75Å; E491-M494 PolarHBondContact O-N 2.91Å; E491-H495 WeakPolarHBondContact O-CB 3.07Å; E491-H495 PolarHBondContact O-CE1 2.89Å; E491-H495 PolarHBondContact O-N 2.82Å; E491-H495 PolarHBondContact O-ND1 2.8Å
492	L	95.9	Very high	96.2	Very high	11 Å²	11	18.4 Å²	18.4	6%	0.058	9%	0.093	C	C	.	.	H	α-helix	trans	-60	-52.3	178.1	-178.8	68.4	0	0	0	111.8	V181 F184 V188 A388 R488 I489 A490 M494 H495 L496	V181-L492 HydrophobicContact CG1-CB 4.1Å; V181-L492 HydrophobicContact CG1-CD2 3.74Å; V181-L492 WeakPolarHBondContact O-CD2 3.45Å; F184-L492 HydrophobicContact CB-CD2 4.26Å; V188-L492 HydrophobicContact CG2-CD2 4.14Å; A388-L492 HydrophobicContact CB-CD1 3.65Å; R488-L492 WeakPolarHBondContact O-CB 3.27Å; R488-L492 PolarHBondContact O-N 2.9Å; I489-L492 WeakPolarHBondContact O-CB 3.36Å; I489-L492 PolarHBondContact O-N 2.77Å; I489-L492 VanDerWaalsContact O-N 3.11Å; A490-L492 VanDerWaalsContact C-N 3.34Å; A490-L492 PolarHBondContact O-N 3.28Å; L492-M494 VanDerWaalsContact C-N 3.32Å; L492-M494 PolarHBondContact O-N 3.32Å; L492-H495 PolarHBondContact O-N 3.39Å; L492-L496 HydrophobicContact CD1-CD1 3.67Å; L492-L496 HydrophobicContact CD1-CD2 4.45Å; L492-L496 HydrophobicContact CD1-CG 3.9Å; L492-L496 HydrophobicContact CG-CD1 3.94Å; L492-L496 HydrophobicContact CG-CG 4.35Å; L492-L496 WeakPolarHBondContact O-CB 3.44Å; L492-L496 WeakPolarHBondContact O-CG 3.47Å; L492-L496 PolarHBondContact O-N 3.16Å
493	E	96.9	Very high	96.4	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-56.7	-44.8	179.9	-73.5	-176.5	144.4	0	0	112.2	V188 Y222 G226 V227 T351 I489 A490 A497	V188-E493 HydrophobicContact CG1-CG 4.26Å; V188-E493 HydrophobicContact CG2-CG 4.2Å; Y222-E493 PolarHBondContact OH-O 2.96Å; G226-E493 VanDerWaalsContact CA-OE1 3.29Å; G226-E493 WeakPolarHBondContact CA-OE1 3.36Å; V227-E493 PolarHBondContact N-OE1 2.78Å; V227-E493 VanDerWaalsContact N-OE1 3.14Å; T351-E493 HydrophobicContact CG2-CB 4.31Å; I489-E493 HydrophobicContact CG2-CG 4.34Å; I489-E493 WeakPolarHBondContact O-CG 3.35Å; I489-E493 PolarHBondContact O-N 3.29Å; A490-E493 PolarHBondContact O-N 3.19Å; E493-A497 WeakPolarHBondContact O-CB 3.4Å; E493-A497 PolarHBondContact O-N 3.35Å
494	M	98.6	Very high	96.5	Very high	2 Å²	2	21.3 Å²	21.3	1%	0.01	10%	0.103	C	C	.	.	H	α-helix	trans	-69.5	-46	180	-69	-175.7	-73.4	0	0	112	T351 T354 L355 V401 F477 A490 E491 L492 L498	T351-M494 HydrophobicContact CG2-CG 3.89Å; T354-M494 VanDerWaalsContact CB-SD 3.59Å; T354-M494 HydrophobicContact CG2-SD 3.35Å; T354-M494 WeakPolarHBondContact CG2-SD 3.31Å; L355-M494 HydrophobicContact CD2-CB 4.34Å; L355-M494 HydrophobicContact CD2-CG 4.19Å; L355-M494 HydrophobicContact CG-CG 4.24Å; V401-M494 HydrophobicContact CG1-CE 3.64Å; V401-M494 HydrophobicContact CG1-SD 3.97Å; V401-M494 HydrophobicContact CG2-CB 3.98Å; F477-M494 HydrophobicContact CZ-CE 4.05Å; A490-M494 HydrophobicContact CB-CE 4.13Å; A490-M494 WeakPolarHBondContact O-CB 3.43Å; A490-M494 WeakPolarHBondContact O-CE 3.49Å; A490-M494 VanDerWaalsContact O-CG 3.25Å; A490-M494 WeakPolarHBondContact O-CG 3.45Å; A490-M494 PolarHBondContact O-N 3.5Å; E491-M494 PolarHBondContact O-N 2.91Å; L492-M494 VanDerWaalsContact C-N 3.32Å; L492-M494 PolarHBondContact O-N 3.32Å; M494-L498 VanDerWaalsContact O-CB 3.27Å; M494-L498 WeakPolarHBondContact O-CB 3.22Å; M494-L498 WeakPolarHBondContact O-CD1 3.38Å; M494-L498 VanDerWaalsContact O-CG 3.22Å; M494-L498 WeakPolarHBondContact O-CG 3.27Å; M494-L498 PolarHBondContact O-N 3.45Å
495	H	98.4	Very high	96.7	Very high	13 Å²	13	19.1 Å²	19.1	6%	0.06	9%	0.088	C	C	.	.	H	α-helix	trans	-64.2	-44.8	-179	-63.8	135.7	0	0	0	111.5	V391 I397 E491 L492 T499	V391-H495 HydrophobicContact CG1-CB 4Å; V391-H495 WeakPolarHBondContact CG1-ND1 3.31Å; V391-H495 HydrophobicContact CG2-CB 3.86Å; I397-H495 HydrophobicContact CG2-CB 4.03Å; E491-H495 WeakPolarHBondContact O-CB 3.07Å; E491-H495 PolarHBondContact O-CE1 2.89Å; E491-H495 PolarHBondContact O-N 2.82Å; E491-H495 PolarHBondContact O-ND1 2.8Å; L492-H495 PolarHBondContact O-N 3.39Å; H495-T499 VanDerWaalsContact O-CB 3.23Å; H495-T499 WeakPolarHBondContact O-CB 3.03Å; H495-T499 PolarHBondContact O-N 3.33Å; H495-T499 PolarHBondContact O-OG1 2.72Å
496	L	98.3	Very high	96.9	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-67	-45.4	179.5	-63.9	-174.4	0	0	0	111.4	V188 P386 V391 L492 R500	V188-L496 HydrophobicContact CB-CD1 4.04Å; V188-L496 HydrophobicContact CG1-CB 4.19Å; V188-L496 HydrophobicContact CG1-CD1 3.74Å; V188-L496 HydrophobicContact CG1-CG 4.5Å; P386-L496 HydrophobicContact CB-CD2 3.93Å; P386-L496 HydrophobicContact CG-CD2 3.95Å; P386-L496 WeakPolarHBondContact O-CD2 3.5Å; V391-L496 HydrophobicContact CG2-CD2 4.3Å; L492-L496 HydrophobicContact CD1-CD1 3.67Å; L492-L496 HydrophobicContact CD1-CD2 4.45Å; L492-L496 HydrophobicContact CD1-CG 3.9Å; L492-L496 HydrophobicContact CG-CD1 3.94Å; L492-L496 HydrophobicContact CG-CG 4.35Å; L492-L496 WeakPolarHBondContact O-CB 3.44Å; L492-L496 WeakPolarHBondContact O-CG 3.47Å; L492-L496 PolarHBondContact O-N 3.16Å; L496-R500 WeakPolarHBondContact O-CB 2.84Å; L496-R500 VanDerWaalsContact O-CG 3.3Å; L496-R500 WeakPolarHBondContact O-CG 3.38Å; L496-R500 PolarHBondContact O-N 3.4Å; L496-R500 VanDerWaalsContact O-N 3.07Å
497	A	98.6	Very high	97.1	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-59.5	-52.2	176.7	0	0	0	0	0	112.1	V192 L195 Y222 L355 E493 T499 R500 L501	V192-A497 HydrophobicContact CG2-CB 4.24Å; L195-A497 HydrophobicContact CD2-CB 4.39Å; Y222-A497 HydrophobicContact CE1-CB 3.91Å; L355-A497 HydrophobicContact CD2-CB 4.19Å; E493-A497 WeakPolarHBondContact O-CB 3.4Å; E493-A497 PolarHBondContact O-N 3.35Å; A497-T499 PolarHBondContact O-N 2.98Å; A497-R500 PolarHBondContact O-N 2.95Å; A497-L501 WeakPolarHBondContact O-CB 3.3Å; A497-L501 VanDerWaalsContact O-CG 3.23Å; A497-L501 WeakPolarHBondContact O-CG 3.27Å; A497-L501 PolarHBondContact O-N 3.03Å
498	L	98.7	Very high	97.2	Very high	2 Å²	2	16.7 Å²	16.7	1%	0.01	7%	0.074	C	C	.	.	H	α-helix	trans	-64.5	-41.5	-177.3	-69.4	167.6	0	0	0	111.8	L355 A358 L400 V401 M494 R500 L501 I502	L355-L498 HydrophobicContact CD2-CD1 4.19Å; L355-L498 HydrophobicContact CD2-CD2 3.95Å; L355-L498 HydrophobicContact CD2-CG 3.75Å; A358-L498 HydrophobicContact CB-CD1 4.12Å; A358-L498 HydrophobicContact CB-CD2 3.94Å; L400-L498 HydrophobicContact CD2-CB 4.32Å; L400-L498 HydrophobicContact CD2-CD1 3.86Å; L400-L498 HydrophobicContact CD2-CD2 4.35Å; L400-L498 HydrophobicContact CD2-CG 4.4Å; L400-L498 HydrophobicContact CG-CD1 4.22Å; V401-L498 HydrophobicContact CG2-CD1 3.67Å; M494-L498 VanDerWaalsContact O-CB 3.27Å; M494-L498 WeakPolarHBondContact O-CB 3.22Å; M494-L498 WeakPolarHBondContact O-CD1 3.38Å; M494-L498 VanDerWaalsContact O-CG 3.22Å; M494-L498 WeakPolarHBondContact O-CG 3.27Å; M494-L498 PolarHBondContact O-N 3.45Å; L498-R500 PolarHBondContact O-N 3.25Å; L498-L501 PolarHBondContact O-N 2.89Å; L498-I502 WeakPolarHBondContact O-CB 2.99Å; L498-I502 WeakPolarHBondContact O-CD1 3.3Å; L498-I502 WeakPolarHBondContact O-CG1 3.48Å; L498-I502 PolarHBondContact O-N 3.34Å
499	T	98.3	Very high	97.4	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-58	-49.7	176.3	-57.7	0	0	0	0	110.5	V376 L380 P386 L394 H495 A497 I502 Q503	V376-T499 HydrophobicContact CG1-CG2 3.63Å; V376-T499 HydrophobicContact CG2-CG2 4.11Å; L380-T499 HydrophobicContact CD1-CG2 4.08Å; P386-T499 HydrophobicContact CB-CG2 3.99Å; P386-T499 HydrophobicContact CG-CG2 3.78Å; L394-T499 HydrophobicContact CD1-CG2 3.98Å; H495-T499 VanDerWaalsContact O-CB 3.23Å; H495-T499 WeakPolarHBondContact O-CB 3.03Å; H495-T499 PolarHBondContact O-N 3.33Å; H495-T499 PolarHBondContact O-OG1 2.72Å; A497-T499 PolarHBondContact O-N 2.98Å; T499-I502 PolarHBondContact O-N 3.01Å; T499-Q503 VanDerWaalsContact O-CG 3.32Å; T499-Q503 WeakPolarHBondContact O-CG 3.41Å; T499-Q503 PolarHBondContact O-N 2.92Å
500	R	97.6	Very high	97.6	Very high	19 Å²	19	14.6 Å²	14.6	7%	0.072	7%	0.068	C	C	.	.	H	α-helix	trans	-72	-36.1	-176.6	-65.9	-168.8	66.6	-158.7	-1.6	113.3	N189 V192 D193 I196 P386 L496 A497 L498 Q503 K504	N189-R500 PolarHBondContact O-NH1 2.84Å; N189-R500 WeakPolarHBondContact OD1-CD 3.23Å; V192-R500 HydrophobicContact CG1-CB 3.75Å; V192-R500 HydrophobicContact CG1-CG 4.18Å; D193-R500 IonicContact OD1-CZ 3.17Å; D193-R500 IonicContact OD1-NH1 2.91Å; D193-R500 PolarHBondContact OD1-NH1 3.11Å; D193-R500 IonicContact OD1-NH2 3.4Å; D193-R500 PolarHBondContact OD1-NH2 2.88Å; I196-R500 HydrophobicContact CD1-CB 4.17Å; P386-R500 VanDerWaalsContact CD-CG 3.49Å; P386-R500 HydrophobicContact CG-CG 3.61Å; L496-R500 WeakPolarHBondContact O-CB 2.84Å; L496-R500 VanDerWaalsContact O-CG 3.3Å; L496-R500 WeakPolarHBondContact O-CG 3.38Å; L496-R500 PolarHBondContact O-N 3.4Å; L496-R500 VanDerWaalsContact O-N 3.07Å; A497-R500 PolarHBondContact O-N 2.95Å; L498-R500 PolarHBondContact O-N 3.25Å; R500-Q503 PolarHBondContact O-N 2.64Å; R500-K504 WeakPolarHBondContact O-CG 3.34Å; R500-K504 PolarHBondContact O-N 2.89Å; R500-K504 VanDerWaalsContact O-N 3.14Å
501	L	98	Very high	97.5	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-63.7	-44.3	173.4	-72.6	171.5	0	0	0	111	L195 I196 V199 F219 A497 L498 K504 F505 F534	L195-L501 HydrophobicContact CD2-CD1 4.24Å; L195-L501 HydrophobicContact CD2-CD2 4.48Å; I196-L501 HydrophobicContact CG1-CD2 4.44Å; V199-L501 HydrophobicContact CG2-CD2 4.5Å; F219-L501 HydrophobicContact CE1-CD1 3.9Å; F219-L501 HydrophobicContact CZ-CD1 4.18Å; A497-L501 WeakPolarHBondContact O-CB 3.3Å; A497-L501 VanDerWaalsContact O-CG 3.23Å; A497-L501 WeakPolarHBondContact O-CG 3.27Å; A497-L501 PolarHBondContact O-N 3.03Å; L498-L501 PolarHBondContact O-N 2.89Å; L501-K504 PolarHBondContact O-N 3.18Å; L501-F505 HydrophobicContact CD2-CD2 4.12Å; L501-F505 HydrophobicContact CD2-CE2 4.26Å; L501-F505 WeakPolarHBondContact O-CA 3.43Å; L501-F505 WeakPolarHBondContact O-CB 3.4Å; L501-F505 PolarHBondContact O-N 2.69Å; L501-F534 HydrophobicContact CD2-CE1 4.33Å
502	I	96.9	Very high	97.4	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-67.7	-36.6	178.3	-69.3	168.6	0	0	0	111.6	L362 I372 Y373 I397 L400 L498 T499 K504 R537	L362-I502 HydrophobicContact CD1-CD1 3.87Å; L362-I502 HydrophobicContact CD1-CG1 4.22Å; I372-I502 HydrophobicContact CB-CD1 4.44Å; I372-I502 HydrophobicContact CG2-CD1 3.63Å; I372-I502 HydrophobicContact CG2-CG2 4.43Å; Y373-I502 HydrophobicContact CD2-CG2 4.17Å; Y373-I502 WeakPolarHBondContact CD2-O 3.34Å; I397-I502 HydrophobicContact CD1-CD1 3.89Å; L400-I502 HydrophobicContact CD2-CD1 4.2Å; L498-I502 WeakPolarHBondContact O-CB 2.99Å; L498-I502 WeakPolarHBondContact O-CD1 3.3Å; L498-I502 WeakPolarHBondContact O-CG1 3.48Å; L498-I502 PolarHBondContact O-N 3.34Å; T499-I502 PolarHBondContact O-N 3.01Å; I502-K504 VanDerWaalsContact C-N 3.29Å; I502-K504 PolarHBondContact O-N 2.96Å; I502-R537 VanDerWaalsContact O-CD 3.31Å; I502-R537 WeakPolarHBondContact O-CD 3.42Å; I502-R537 PolarHBondContact O-NE 3.17Å
503	Q	95.4	Very high	97.4	Very high	12 Å²	12	24.1 Å²	24.1	6%	0.056	13%	0.125	C	C	.	.	H	α-helix	trans	-60.9	-38.4	173.3	-77.5	174.7	-46.2	0	0	112.2	V376 A384 T499 R500	V376-Q503 HydrophobicContact CG1-CG 3.47Å; V376-Q503 VanDerWaalsContact CG1-CG 3.47Å; A384-Q503 PolarHBondContact O-NE2 2.78Å; A384-Q503 PolarHBondContact O-OE1 2.89Å; T499-Q503 VanDerWaalsContact O-CG 3.32Å; T499-Q503 WeakPolarHBondContact O-CG 3.41Å; T499-Q503 PolarHBondContact O-N 2.92Å; R500-Q503 PolarHBondContact O-N 2.64Å
504	K	96.3	Very high	97.3	Very high	74 Å²	74	28.6 Å²	28.6	32%	0.322	15%	0.153	S	C	.	.	H	α-helix	trans	-90.5	-33.7	-174.3	-69.7	-62	-176.5	-173.1	0	113.8	I196 R500 L501 I502 R537	I196-K504 HydrophobicContact CD1-CG 4.27Å; R500-K504 WeakPolarHBondContact O-CG 3.34Å; R500-K504 PolarHBondContact O-N 2.89Å; R500-K504 VanDerWaalsContact O-N 3.14Å; L501-K504 PolarHBondContact O-N 3.18Å; I502-K504 VanDerWaalsContact C-N 3.29Å; I502-K504 PolarHBondContact O-N 2.96Å; K504-R537 PolarHBondContact O-N 2.99Å
505	F	97.9	Very high	97	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	140.8	-168.3	-54.1	-70.9	0	0	0	112.2	I196 V199 Y200 L501 I507 F534 I535 E536 R537	I196-F505 HydrophobicContact CG2-CE2 4.23Å; I196-F505 HydrophobicContact CG2-CZ 4.27Å; V199-F505 HydrophobicContact CB-CE2 4.46Å; V199-F505 HydrophobicContact CB-CZ 4.46Å; V199-F505 HydrophobicContact CG1-CE1 4.36Å; V199-F505 HydrophobicContact CG1-CE2 4Å; V199-F505 HydrophobicContact CG1-CZ 3.85Å; Y200-F505 HydrophobicContact CD2-CZ 4.34Å; Y200-F505 HydrophobicContact CE1-CE1 4.22Å; Y200-F505 HydrophobicContact CE1-CZ 4.41Å; Y200-F505 HydrophobicContact CE2-CE1 4.4Å; Y200-F505 AromaticContact CE2-CZ 3.85Å; Y200-F505 HydrophobicContact CE2-CZ 3.85Å; Y200-F505 AromaticContact CZ-CE1 3.97Å; Y200-F505 AromaticContact CZ-CZ 3.89Å; L501-F505 HydrophobicContact CD2-CD2 4.12Å; L501-F505 HydrophobicContact CD2-CE2 4.26Å; L501-F505 WeakPolarHBondContact O-CA 3.43Å; L501-F505 WeakPolarHBondContact O-CB 3.4Å; L501-F505 PolarHBondContact O-N 2.69Å; F505-I507 HydrophobicContact CB-CG1 4.48Å; F505-F534 HydrophobicContact CB-CB 4.35Å; F505-F534 HydrophobicContact CB-CD1 4.08Å; F505-F534 HydrophobicContact CD1-CB 3.9Å; F505-F534 AromaticContact CD2-CD1 3.93Å; F505-F534 HydrophobicContact CD2-CD1 3.93Å; F505-F534 HydrophobicContact CE1-CB 4.34Å; F505-F534 HydrophobicContact CG-CB 4.03Å; F505-F534 AromaticContact CG-CD1 3.97Å; F505-F534 HydrophobicContact CG-CD1 3.97Å; F505-I535 CarbonylContact C-O 3.58Å; F505-I535 WeakPolarHBondContact CA-O 3.37Å; F505-E536 HydrophobicContact CD1-CG 4.34Å; F505-E536 HydrophobicContact CE1-CG 4.15Å; F505-R537 PolarHBondContact O-NE 3.24Å
506	Y	98.4	Very high	96.9	Very high	71 Å²	71	33.7 Å²	33.7	28%	0.278	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	118.5	149.7	178.3	-87.9	0	0	0	107.9	P366 I535	P366-Y506 HydrophobicContact CB-CE2 4.4Å; P366-Y506 WeakPolarHBondContact CB-OH 3.43Å; P366-Y506 WeakPolarHBondContact CG-OH 3.49Å; Y506-I535 HydrophobicContact CD1-CD1 3.91Å; Y506-I535 HydrophobicContact CE1-CD1 4.44Å; Y506-I535 PolarHBondContact N-O 3.34Å; Y506-I535 PolarHBondContact O-N 2.78Å
507	I	98.6	Very high	96.7	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	109.9	-179.1	-54.3	177.7	0	0	0	108.2	C359 A363 Q369 F505 L532 Q533 F534	C359-I507 HydrophobicContact CB-CD1 4.34Å; C359-I507 HydrophobicContact CB-CG2 4.47Å; A363-I507 WeakPolarHBondContact CA-O 3.41Å; A363-I507 HydrophobicContact CB-CG2 4.31Å; Q369-I507 PolarHBondContact NE2-O 2.64Å; F505-I507 HydrophobicContact CB-CG1 4.48Å; I507-L532 HydrophobicContact CG2-CB 4.21Å; I507-L532 HydrophobicContact CG2-CD1 3.85Å; I507-L532 HydrophobicContact CG2-CG 4.46Å; I507-Q533 CarbonylContact C-O 3.58Å; I507-Q533 WeakPolarHBondContact CA-O 2.77Å; I507-F534 HydrophobicContact CD1-CE1 4.22Å; I507-F534 HydrophobicContact CG1-CD1 4.25Å; I507-F534 HydrophobicContact CG1-CE1 4.16Å
508	G	98	Very high	96.5	Very high	6 Å²	6	41.4 Å²	41.4	6%	0.062	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	159.2	178.7	0	0	0	0	0	113	L532 Q533	G508-L532 WeakPolarHBondContact O-CA 3.25Å; G508-Q533 PolarHBondContact N-O 2.92Å; G508-Q533 PolarHBondContact O-N 3.4Å
509	M	97.6	Very high	96.3	Very high	58 Å²	58	45.4 Å²	45.4	29%	0.286	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	124.9	172.3	-168.4	62.3	66.5	0	0	109.7	Y360 A363 Q364 T513 L532	Y360-M509 HydrophobicContact CD2-CE 3.69Å; Y360-M509 HydrophobicContact CD2-SD 4.24Å; Y360-M509 HydrophobicContact CE2-CE 3.52Å; Y360-M509 HydrophobicContact CE2-SD 4Å; A363-M509 HydrophobicContact CB-CB 4.45Å; A363-M509 HydrophobicContact CB-CE 3.92Å; Q364-M509 HydrophobicContact CG-CE 3.54Å; M509-T513 HydrophobicContact SD-CG2 3.51Å; M509-T513 VanDerWaalsContact SD-CG2 3.51Å; M509-L532 HydrophobicContact CE-CD2 4.5Å; M509-L532 HydrophobicContact SD-CD2 4.05Å
510	S	97.3	Very high	95.9	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.014	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-71.3	141	171.7	-177.2	0	0	0	0	110.1	T211 L512 T513 N531	T211-S510 PolarHBondContact OG1-OG 3.25Å; S510-L512 PolarHBondContact O-N 3.39Å; S510-L512 PolarHBondContact OG-N 3.26Å; S510-T513 WeakPolarHBondContact O-CB 3.28Å; S510-T513 PolarHBondContact O-N 3.13Å; S510-N531 VanDerWaalsContact CB-O 3.22Å; S510-N531 WeakPolarHBondContact CB-O 3.46Å; S510-N531 PolarHBondContact N-O 2.91Å
511	P	95.3	Very high	95.3	Very high	119 Å²	119	47.3 Å²	47.3	77%	0.773	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-18.2	171.3	-24.1	34.1	0	0	0	114.1	T513	P511-T513 VanDerWaalsContact C-N 3.28Å
512	L	95.4	Very high	94.5	Very high	107 Å²	107	48.3 Å²	48.3	56%	0.56	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-9.9	176.8	-59.9	176.4	0	0	0	113.1	L213 S510 N531	L213-L512 HydrophobicContact CD2-CD1 3.66Å; S510-L512 PolarHBondContact O-N 3.39Å; S510-L512 PolarHBondContact OG-N 3.26Å; L512-N531 HydrophobicContact CB-CB 4.36Å; L512-N531 PolarHBondContact O-ND2 2.97Å
513	T	95.9	Very high	94.3	Very high	20 Å²	20	49.4 Å²	49.4	12%	0.123	26%	0.26	C	S	.	.			trans	-87.2	122.6	179.2	-65.2	0	0	0	0	110.6	Y360 M509 S510 P511 V516 N531	Y360-T513 HydrophobicContact CE2-CG2 3.94Å; M509-T513 HydrophobicContact SD-CG2 3.51Å; M509-T513 VanDerWaalsContact SD-CG2 3.51Å; S510-T513 WeakPolarHBondContact O-CB 3.28Å; S510-T513 PolarHBondContact O-N 3.13Å; P511-T513 VanDerWaalsContact C-N 3.28Å; T513-V516 HydrophobicContact CG2-CG2 4.04Å; T513-N531 VanDerWaalsContact OG1-C 3.25Å; T513-N531 WeakPolarHBondContact OG1-CA 3.46Å; T513-N531 WeakPolarHBondContact OG1-CB 3.48Å; T513-N531 PolarHBondContact OG1-N 3.29Å; T513-N531 PolarHBondContact OG1-O 2.93Å
514	T	93.6	Very high	94.2	Very high	95 Å²	95	48.8 Å²	48.8	58%	0.583	26%	0.258	S	S	*	.			trans	-85.5	176.7	172.1	55	0	0	0	0	110.7	V516	T514-V516 VanDerWaalsContact O-CG2 3.29Å; T514-V516 WeakPolarHBondContact O-CG2 3.33Å; T514-V516 PolarHBondContact O-N 2.97Å
515	D	92.5	Very high	94.1	Very high	114 Å²	114	46.1 Å²	46.1	61%	0.61	25%	0.248	S	C	*	.			trans	-59.5	119.7	169.3	-178.9	43.3	0	0	0	110.1	K517	D515-K517 VanDerWaalsContact OD2-CE 3.23Å; D515-K517 WeakPolarHBondContact OD2-CE 3.47Å
516	V	95.7	Very high	94	Very high	8 Å²	8	46.9 Å²	46.9	5%	0.048	25%	0.253	C	S	.	.			trans	-106.1	106.2	-174.8	-175	0	0	0	0	109.3	W357 Y360 T513 T514 P526 A528 I530	W357-V516 HydrophobicContact CH2-CG1 4.02Å; W357-V516 HydrophobicContact CZ3-CG1 4.38Å; Y360-V516 HydrophobicContact CE2-CB 4.23Å; Y360-V516 HydrophobicContact CE2-CG2 4.04Å; Y360-V516 PolarHBondContact OH-N 3.47Å; T513-V516 HydrophobicContact CG2-CG2 4.04Å; T514-V516 VanDerWaalsContact O-CG2 3.29Å; T514-V516 WeakPolarHBondContact O-CG2 3.33Å; T514-V516 PolarHBondContact O-N 2.97Å; V516-P526 HydrophobicContact CG1-CB 3.77Å; V516-A528 HydrophobicContact CG2-CB 4.49Å; V516-I530 HydrophobicContact CB-CG1 4.36Å; V516-I530 HydrophobicContact CG1-CD1 4.35Å; V516-I530 HydrophobicContact CG1-CG1 3.98Å; V516-I530 HydrophobicContact CG2-CG1 3.97Å
517	K	94.8	Very high	93.8	Very high	147 Å²	147	45.8 Å²	45.8	64%	0.639	26%	0.263	S	S	*	.			trans	-88.4	152	175.9	-62.4	-173.2	179.3	-177.2	0	111.3	D515 G527	D515-K517 VanDerWaalsContact OD2-CE 3.23Å; D515-K517 WeakPolarHBondContact OD2-CE 3.47Å; K517-G527 WeakPolarHBondContact O-CA 3.34Å; K517-G527 PolarHBondContact O-N 3.44Å
518	A	95.2	Very high	93.7	Very high	16 Å²	16	47.3 Å²	47.3	13%	0.132	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	147.1	171.4	0	0	0	0	0	111	H92 W357 F408 L524 C525	H92-A518 PolarHBondContact NE2-O 3.3Å; W357-A518 HydrophobicContact CH2-CB 4.47Å; W357-A518 HydrophobicContact CZ2-CB 4.01Å; F408-A518 HydrophobicContact CD1-CB 4.3Å; A518-L524 HydrophobicContact CB-CD1 3.86Å; A518-L524 HydrophobicContact CB-CD2 4.4Å; A518-L524 HydrophobicContact CB-CG 4.1Å; A518-C525 WeakPolarHBondContact CA-O 3.33Å
519	K	93.4	Very high	93.6	Very high	85 Å²	85	50.5 Å²	50.5	37%	0.37	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	147	174.1	-178.5	-179.6	176.5	-176.2	0	108.7	L524 C525	K519-L524 WeakPolarHBondContact O-CA 3.4Å; K519-C525 PolarHBondContact N-O 3.48Å; K519-C525 PolarHBondContact O-N 3.47Å
520	T	90.3	Very high	93.6	Very high	4 Å²	4	47.7 Å²	47.7	3%	0.025	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	122.8	172.2	-56.4	0	0	0	0	110.7	F88 G89 I91 H92 L523	F88-T520 WeakPolarHBondContact O-CB 3.29Å; G89-T520 VanDerWaalsContact CA-O 3.27Å; G89-T520 WeakPolarHBondContact CA-O 3.33Å; G89-T520 PolarHBondContact O-N 3.08Å; I91-T520 HydrophobicContact CB-CG2 4.28Å; I91-T520 HydrophobicContact CD1-CG2 4.17Å; I91-T520 HydrophobicContact CG1-CG2 4.49Å; H92-T520 PolarHBondContact ND1-OG1 3.3Å; T520-L523 CarbonylContact C-O 3.14Å; T520-L523 WeakPolarHBondContact CA-O 3.27Å
521	H	84.9	Confident	93.7	Very high	56 Å²	56	48.6 Å²	48.6	26%	0.259	29%	0.286	S	S	.	.	S	Bend	trans	-136.6	67.4	173	-168.1	52.3	0	0	0	109.3	F258 L523	F258-H521 PolarHBondContact O-CE1 3.25Å; F258-H521 PolarHBondContact O-NE2 3.02Å; H521-L523 PolarHBondContact N-O 3.43Å; H521-L523 PolarHBondContact O-N 2.93Å
522	G	82	Confident	93.8	Very high	20 Å²	20	42.9 Å²	42.9	21%	0.206	25%	0.249	C	C	.	.	S	Bend	trans	75.7	-49.7	-163.6	0	0	0	0	0	112.3
523	L	91	Very high	94	Very high	23 Å²	23	39.7 Å²	39.7	12%	0.12	23%	0.231	C	C	.	.	S	Bend	trans	-111.3	159.9	171.2	-56	-178.6	0	0	0	110.7	F258 D349 T350 F353 V410 L411 T520 H521 C525	F258-L523 HydrophobicContact CE1-CD1 4.42Å; F258-L523 HydrophobicContact CE1-CG 4.38Å; F258-L523 HydrophobicContact CZ-CD1 4.3Å; D349-L523 HydrophobicContact CB-CD1 3.67Å; T350-L523 HydrophobicContact CG2-CD1 4.18Å; F353-L523 HydrophobicContact CD2-CB 4.31Å; F353-L523 HydrophobicContact CD2-CD1 4.46Å; F353-L523 HydrophobicContact CE2-CB 4.05Å; F353-L523 HydrophobicContact CE2-CD1 4.13Å; V410-L523 HydrophobicContact CG1-CB 3.99Å; V410-L523 HydrophobicContact CG1-CD1 3.95Å; V410-L523 HydrophobicContact CG1-CD2 4.01Å; V410-L523 HydrophobicContact CG1-CG 4.19Å; V410-L523 CarbonylContact O-C 3.31Å; V410-L523 WeakPolarHBondContact O-CA 3.37Å; L411-L523 HydrophobicContact CD2-CD2 3.53Å; L411-L523 HydrophobicContact CG-CD2 4.28Å; T520-L523 CarbonylContact C-O 3.14Å; T520-L523 WeakPolarHBondContact CA-O 3.27Å; H521-L523 PolarHBondContact N-O 3.43Å; H521-L523 PolarHBondContact O-N 2.93Å; L523-C525 PolarHBondContact O-N 2.98Å
524	L	94.3	Very high	94.1	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	113.9	169.1	-165.8	71.3	0	0	0	109.2	H92 F408 P409 V410 P412 Y440 A518 K519	H92-L524 HydrophobicContact CB-CD1 3.97Å; H92-L524 WeakPolarHBondContact ND1-CD1 3.41Å; F408-L524 HydrophobicContact CB-CD2 4.43Å; P409-L524 HydrophobicContact CG-CD2 4.45Å; P409-L524 WeakPolarHBondContact O-CB 3.29Å; P409-L524 WeakPolarHBondContact O-CD2 3.28Å; V410-L524 PolarHBondContact O-N 2.91Å; P412-L524 HydrophobicContact CG-CB 3.95Å; P412-L524 HydrophobicContact CG-CD1 4.15Å; P412-L524 HydrophobicContact CG-CG 4.48Å; Y440-L524 HydrophobicContact CD2-CD2 4.02Å; Y440-L524 HydrophobicContact CE2-CD2 3.74Å; A518-L524 HydrophobicContact CB-CD1 3.86Å; A518-L524 HydrophobicContact CB-CD2 4.4Å; A518-L524 HydrophobicContact CB-CG 4.1Å; K519-L524 WeakPolarHBondContact O-CA 3.4Å
525	C	94.4	Very high	94.3	Very high	17 Å²	17	37 Å²	37	12%	0.115	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	165.2	-175.8	69.3	0	0	0	0	111.3	F353 A518 K519 L523	F353-C525 HydrophobicContact CD1-CB 4.15Å; F353-C525 HydrophobicContact CD2-CB 3.88Å; F353-C525 HydrophobicContact CE1-CB 3.91Å; F353-C525 HydrophobicContact CE2-CB 3.63Å; F353-C525 HydrophobicContact CG-CB 4.16Å; F353-C525 HydrophobicContact CZ-CB 3.66Å; A518-C525 WeakPolarHBondContact CA-O 3.33Å; K519-C525 PolarHBondContact N-O 3.48Å; K519-C525 PolarHBondContact O-N 3.47Å; L523-C525 PolarHBondContact O-N 2.98Å
526	P	95.9	Very high	94.5	Very high	16 Å²	16	36.3 Å²	36.3	10%	0.104	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	135	165.5	-30.9	43.6	0	0	0	111.8	N216 W357 V516 A528 I530	N216-P526 VanDerWaalsContact ND2-CG 3.34Å; N216-P526 WeakPolarHBondContact ND2-CG 3.46Å; W357-P526 HydrophobicContact CD2-CG 4.25Å; W357-P526 HydrophobicContact CH2-CB 4.46Å; W357-P526 HydrophobicContact CH2-CG 4.38Å; W357-P526 HydrophobicContact CZ2-CB 4.12Å; W357-P526 HydrophobicContact CZ2-CG 3.75Å; V516-P526 HydrophobicContact CG1-CB 3.77Å; P526-A528 VanDerWaalsContact C-N 3.32Å; P526-I530 HydrophobicContact CB-CD1 3.89Å; P526-I530 HydrophobicContact CB-CG1 4.37Å; P526-I530 HydrophobicContact CG-CD1 3.67Å
527	G	94.4	Very high	94.3	Very high	49 Å²	49	37.4 Å²	37.4	51%	0.505	21%	0.209	S	C	.	.	S	Bend	trans	-81.7	-11.1	179.1	0	0	0	0	0	114	K517	K517-G527 WeakPolarHBondContact O-CA 3.34Å; K517-G527 PolarHBondContact O-N 3.44Å
528	A	95.1	Very high	93.3	Very high	31 Å²	31	39.4 Å²	39.4	26%	0.256	22%	0.22	S	C	.	.	S	Bend	trans	-146.3	158.5	177.2	0	0	0	0	0	110	V516 P526	V516-A528 HydrophobicContact CG2-CB 4.49Å; P526-A528 VanDerWaalsContact C-N 3.32Å
529	P	96.1	Very high	91.5	Very high	73 Å²	73	46 Å²	46	47%	0.474	25%	0.253	S	S	.	.			trans	-58.1	137.1	174.7	-24.4	34.9	0	0	0	112.2	N214	N214-P529 HydrophobicContact CB-CB 4.19Å
530	I	98.3	Very high	91.4	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.247	C	C	.	.			trans	-98.9	119.5	174.4	-63.1	162.4	0	0	0	108.7	N214 V215 N216 Y360 V516 P526 L532	N214-I530 CarbonylContact C-O 3.55Å; N214-I530 VanDerWaalsContact CA-O 3.3Å; N214-I530 WeakPolarHBondContact CA-O 3.22Å; N214-I530 PolarHBondContact N-O 3.42Å; V215-I530 HydrophobicContact CG2-CB 3.87Å; V215-I530 HydrophobicContact CG2-CG2 3.73Å; V215-I530 WeakPolarHBondContact CG2-O 3.3Å; V215-I530 PolarHBondContact N-O 2.97Å; N216-I530 PolarHBondContact OD1-N 3.45Å; N216-I530 VanDerWaalsContact OD1-N 3.14Å; Y360-I530 HydrophobicContact CD2-CD1 4.44Å; Y360-I530 HydrophobicContact CD2-CG1 4.24Å; Y360-I530 HydrophobicContact CD2-CG2 3.75Å; Y360-I530 HydrophobicContact CG-CD1 4.36Å; Y360-I530 HydrophobicContact CG-CG2 4.42Å; V516-I530 HydrophobicContact CB-CG1 4.36Å; V516-I530 HydrophobicContact CG1-CD1 4.35Å; V516-I530 HydrophobicContact CG1-CG1 3.98Å; V516-I530 HydrophobicContact CG2-CG1 3.97Å; P526-I530 HydrophobicContact CB-CD1 3.89Å; P526-I530 HydrophobicContact CB-CG1 4.37Å; P526-I530 HydrophobicContact CG-CD1 3.67Å; I530-L532 HydrophobicContact CG2-CD1 4.15Å; I530-L532 HydrophobicContact CG2-CD2 3.91Å; I530-L532 HydrophobicContact CG2-CG 3.82Å
531	N	98.4	Very high	91.5	Very high	20 Å²	20	46.1 Å²	46.1	11%	0.107	26%	0.259	C	S	.	.			trans	-106.7	127.6	174.4	-46.1	-62.6	0	0	0	109.8	L213 N214 S510 L512 T513	L213-N531 WeakPolarHBondContact CA-OD1 3.15Å; L213-N531 HydrophobicContact CD2-CB 4.26Å; N214-N531 PolarHBondContact N-OD1 3.46Å; S510-N531 VanDerWaalsContact CB-O 3.22Å; S510-N531 WeakPolarHBondContact CB-O 3.46Å; S510-N531 PolarHBondContact N-O 2.91Å; L512-N531 HydrophobicContact CB-CB 4.36Å; L512-N531 PolarHBondContact O-ND2 2.97Å; T513-N531 VanDerWaalsContact OG1-C 3.25Å; T513-N531 WeakPolarHBondContact OG1-CA 3.46Å; T513-N531 WeakPolarHBondContact OG1-CB 3.48Å; T513-N531 PolarHBondContact OG1-N 3.29Å; T513-N531 PolarHBondContact OG1-O 2.93Å
532	L	98.7	Very high	91.8	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	150.5	-176.4	-60.4	176.2	0	0	0	110.8	T211 V212 V215 C359 A363 I507 G508 M509 I530 F534	T211-L532 CarbonylContact C-O 3.56Å; T211-L532 WeakPolarHBondContact CA-O 3.46Å; V212-L532 PolarHBondContact N-O 3.3Å; V212-L532 PolarHBondContact O-N 2.85Å; V212-L532 VanDerWaalsContact O-N 3.12Å; V215-L532 HydrophobicContact CG1-CB 4.02Å; V215-L532 HydrophobicContact CG1-CD1 4.13Å; V215-L532 HydrophobicContact CG1-CG 4.08Å; V215-L532 HydrophobicContact CG2-CD1 3.96Å; V215-L532 HydrophobicContact CG2-CG 4.32Å; C359-L532 HydrophobicContact CB-CD1 3.57Å; A363-L532 HydrophobicContact CB-CD2 3.78Å; I507-L532 HydrophobicContact CG2-CB 4.21Å; I507-L532 HydrophobicContact CG2-CD1 3.85Å; I507-L532 HydrophobicContact CG2-CG 4.46Å; G508-L532 WeakPolarHBondContact O-CA 3.25Å; M509-L532 HydrophobicContact CE-CD2 4.5Å; M509-L532 HydrophobicContact SD-CD2 4.05Å; I530-L532 HydrophobicContact CG2-CD1 4.15Å; I530-L532 HydrophobicContact CG2-CD2 3.91Å; I530-L532 HydrophobicContact CG2-CG 3.82Å; L532-F534 HydrophobicContact CB-CD2 4.5Å; L532-F534 HydrophobicContact CB-CE2 3.92Å
533	Q	98.6	Very high	92.4	Very high	39 Å²	39	47.1 Å²	47.1	18%	0.182	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	133.8	170.6	-71.6	179.3	-36.2	0	0	109.8	D208 L210 T211 I507 G508	D208-Q533 PolarHBondContact OD2-NE2 3.22Å; D208-Q533 VanDerWaalsContact OD2-NE2 3.07Å; L210-Q533 HydrophobicContact CB-CB 4.32Å; L210-Q533 HydrophobicContact CB-CG 4.24Å; L210-Q533 CarbonylContact O-C 3.55Å; L210-Q533 WeakPolarHBondContact O-CA 3.37Å; T211-Q533 WeakPolarHBondContact OG1-CG 3.31Å; I507-Q533 CarbonylContact C-O 3.58Å; I507-Q533 WeakPolarHBondContact CA-O 2.77Å; G508-Q533 PolarHBondContact N-O 2.92Å; G508-Q533 PolarHBondContact O-N 3.4Å
534	F	98.6	Very high	92.5	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	89.5	176.6	-70.9	-97.3	0	0	0	109.3	V199 R203 L210 V212 V215 L501 F505 I507 L532	V199-F534 HydrophobicContact CG1-CB 3.67Å; V199-F534 HydrophobicContact CG1-CD1 3.84Å; V199-F534 HydrophobicContact CG1-CD2 4.08Å; V199-F534 HydrophobicContact CG1-CE1 4.5Å; V199-F534 HydrophobicContact CG1-CG 3.6Å; V199-F534 HydrophobicContact CG2-CE1 4.45Å; R203-F534 PolarHBondContact NH1-O 2.96Å; L210-F534 PolarHBondContact O-N 3.45Å; V212-F534 HydrophobicContact CB-CD2 3.95Å; V212-F534 HydrophobicContact CB-CE2 3.84Å; V212-F534 HydrophobicContact CG2-CD2 3.59Å; V212-F534 HydrophobicContact CG2-CE2 3.88Å; V215-F534 HydrophobicContact CG1-CE2 3.97Å; V215-F534 HydrophobicContact CG1-CZ 4.34Å; L501-F534 HydrophobicContact CD2-CE1 4.33Å; F505-F534 HydrophobicContact CB-CB 4.35Å; F505-F534 HydrophobicContact CB-CD1 4.08Å; F505-F534 HydrophobicContact CD1-CB 3.9Å; F505-F534 AromaticContact CD2-CD1 3.93Å; F505-F534 HydrophobicContact CD2-CD1 3.93Å; F505-F534 HydrophobicContact CE1-CB 4.34Å; F505-F534 HydrophobicContact CG-CB 4.03Å; F505-F534 AromaticContact CG-CD1 3.97Å; F505-F534 HydrophobicContact CG-CD1 3.97Å; I507-F534 HydrophobicContact CD1-CE1 4.22Å; I507-F534 HydrophobicContact CG1-CD1 4.25Å; I507-F534 HydrophobicContact CG1-CE1 4.16Å; L532-F534 HydrophobicContact CB-CD2 4.5Å; L532-F534 HydrophobicContact CB-CE2 3.92Å
535	I	98	Very high	92.4	Very high	58 Å²	58	51.8 Å²	51.8	30%	0.297	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	129.5	-177.2	-61.5	155.4	0	0	0	108.4	L210 F505 Y506	L210-I535 HydrophobicContact CD1-CG1 4.1Å; L210-I535 HydrophobicContact CD2-CB 4.45Å; L210-I535 HydrophobicContact CD2-CG1 3.9Å; L210-I535 HydrophobicContact CG-CG1 4.46Å; F505-I535 CarbonylContact C-O 3.58Å; F505-I535 WeakPolarHBondContact CA-O 3.37Å; Y506-I535 HydrophobicContact CD1-CD1 3.91Å; Y506-I535 HydrophobicContact CE1-CD1 4.44Å; Y506-I535 PolarHBondContact N-O 3.34Å; Y506-I535 PolarHBondContact O-N 2.78Å
536	E	95.9	Very high	92.2	Very high	101 Å²	101	54.3 Å²	54.3	47%	0.472	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	139.1	179.2	-78	175.5	-127.1	0	0	112.1	Y200 R203 F505	Y200-E536 HydrophobicContact CE1-CG 4.34Å; Y200-E536 VanDerWaalsContact CE1-OE1 3.29Å; Y200-E536 WeakPolarHBondContact CE1-OE1 3.29Å; R203-E536 IonicContact CZ-OE1 2.74Å; R203-E536 IonicContact NH1-OE1 3.02Å; R203-E536 PolarHBondContact NH1-OE1 3.25Å; R203-E536 IonicContact NH2-OE1 3.29Å; R203-E536 PolarHBondContact NH2-OE1 2.98Å; F505-E536 HydrophobicContact CD1-CG 4.34Å; F505-E536 HydrophobicContact CE1-CG 4.15Å
537	R	91.8	Very high	92	Very high	31 Å²	31	57.2 Å²	57.2	12%	0.117	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-84.6	133.7	167.6	-67.8	-175.5	173.2	-97.5	0.8	109.4	E370 Y373 I502 K504 F505 N539	E370-R537 IonicContact OE1-NH1 2.76Å; E370-R537 IonicContact OE2-CZ 2.6Å; E370-R537 IonicContact OE2-NH1 2.97Å; E370-R537 PolarHBondContact OE2-NH1 3.48Å; E370-R537 IonicContact OE2-NH2 3.32Å; E370-R537 PolarHBondContact OE2-NH2 3.2Å; E370-R537 VanDerWaalsContact OE2-NH2 3.09Å; Y373-R537 VanDerWaalsContact CD2-CD 3.44Å; Y373-R537 VanDerWaalsContact CG-NH1 3.32Å; I502-R537 VanDerWaalsContact O-CD 3.31Å; I502-R537 WeakPolarHBondContact O-CD 3.42Å; I502-R537 PolarHBondContact O-NE 3.17Å; K504-R537 PolarHBondContact O-N 2.99Å; F505-R537 PolarHBondContact O-NE 3.24Å; R537-N539 PolarHBondContact O-N 2.97Å
538	E	74.6	Confident	91.8	Very high	189 Å²	189	57.9 Å²	57.9	88%	0.883	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-69.4	124.4	168	-63.7	-176.4	172.8	0	0	108
539	N	57	Low	91.5	Very high	153 Å²	153	60.4 Å²	60.4	82%	0.818	31%	0.305	S	S	*	.			trans	-78.1	0	-179.1	-69.2	-63.4	0	0	0	112.3	R537	R537-N539 PolarHBondContact O-N 2.97Å

Retrieved 539 of 539 residues in 205.1 ms (Link to these results)

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