A0A077YZM3_TRITR Loading...

Phosphatidylinositol 3-kinase regulatory subunit alpha

AlphaFold DB , UniProt , Accession A0A077YZM3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 558 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.2	Very low	30.9	Very low	246 Å²	246	145.1 Å²	145.1	100%	1.212	85%	0.854	S	S	*	*				0	105.2	0	-71.9	-166.5	167.2	0	0	107.8
2	Q	33.3	Very low	30.7	Very low	198 Å²	198	145.7 Å²	145.7	93%	0.925	85%	0.851	S	S	*	*			trans	-102.5	127.3	172.8	-91.8	-179.4	-32.8	0	0	108.4
3	P	35.6	Very low	30.1	Very low	127 Å²	127	149.2 Å²	149.2	83%	0.825	85%	0.854	S	S	*	*			trans	-89.2	132.4	179.9	32	-27.9	0	0	0	112.5
4	A	33.4	Very low	30.1	Very low	89 Å²	89	148.1 Å²	148.1	74%	0.736	85%	0.852	S	S	*	*			trans	1.1	125.9	159.7	0	0	0	0	0	121	V6	A4-V6 PolarHBondContact O-N 3.24Å
5	N	31.2	Very low	29.6	Very low	172 Å²	172	151.4 Å²	151.4	92%	0.92	86%	0.857	S	S	*	*			trans	-54.4	120.5	152.1	-87.4	-34.7	0	0	0	110.8
6	V	31	Very low	29.4	Very low	125 Å²	125	147.4 Å²	147.4	76%	0.758	85%	0.848	S	S	*	*			trans	-97	103.1	165.2	177.2	0	0	0	0	107.4	A4 V8	A4-V6 PolarHBondContact O-N 3.24Å; V6-V8 HydrophobicContact CG1-CG2 3.96Å
7	A	28.5	Very low	29.2	Very low	102 Å²	102	146 Å²	146	84%	0.843	84%	0.843	S	S	*	*			trans	-75.9	115.7	166.9	0	0	0	0	0	108.4
8	V	29.7	Very low	28.9	Very low	133 Å²	133	145.8 Å²	145.8	81%	0.806	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-101.8	135.5	169.3	179.7	0	0	0	0	109	V6	V6-V8 HydrophobicContact CG1-CG2 3.96Å
9	A	28.8	Very low	28.8	Very low	87 Å²	87	143.6 Å²	143.6	72%	0.719	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-67.1	148.6	-162.4	0	0	0	0	0	114.9
10	K	23.3	Very low	28.6	Very low	213 Å²	213	141.9 Å²	141.9	93%	0.926	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-60	133	160	-71.7	174.6	171.7	-178.7	0	109.5
11	S	27.8	Very low	28.4	Very low	104 Å²	104	142.6 Å²	142.6	73%	0.727	83%	0.834	S	S	*	*			trans	-135.2	126.1	161.1	40.7	0	0	0	0	109.7
12	D	29	Very low	27.8	Very low	152 Å²	152	138.8 Å²	138.8	81%	0.813	82%	0.817	S	S	*	*			trans	63.2	95.9	146.1	-56.7	-18.2	0	0	0	120.7
13	E	23.1	Very low	27.5	Very low	191 Å²	191	136.7 Å²	136.7	89%	0.893	81%	0.811	S	S	*	*			trans	-39	123.4	141.7	-64.9	171.1	150.9	0	0	111.9
14	T	29.6	Very low	27	Very low	135 Å²	135	136.6 Å²	136.6	83%	0.828	81%	0.81	S	S	*	*			trans	-130.7	109.9	150.6	37.4	0	0	0	0	108.3	A16	T14-A16 PolarHBondContact O-N 3.48Å
15	E	22.5	Very low	26.6	Very low	197 Å²	197	137.4 Å²	137.4	92%	0.921	81%	0.811	S	S	*	*			trans	-61.6	124.4	170.5	-63.9	176	144.4	0	0	109.6
16	A	26.5	Very low	26.3	Very low	87 Å²	87	138.1 Å²	138.1	72%	0.719	81%	0.809	S	S	*	*			trans	-133.7	92.2	165.3	0	0	0	0	0	109.3	T14	T14-A16 PolarHBondContact O-N 3.48Å
17	T	26.7	Very low	26.1	Very low	124 Å²	124	140.3 Å²	140.3	76%	0.761	81%	0.814	S	S	*	*			trans	39.9	100.8	141.7	41.5	0	0	0	0	117.6	S19	T17-S19 PolarHBondContact O-N 3.43Å
18	T	23.1	Very low	26.1	Very low	143 Å²	143	140.9 Å²	140.9	88%	0.877	81%	0.812	S	S	*	*			trans	-35.8	102.7	149.3	49.3	0	0	0	0	112.6
19	S	27	Very low	25.9	Very low	103 Å²	103	139.8 Å²	139.8	72%	0.72	81%	0.81	S	S	*	*			trans	-101.9	101.6	159.7	-81.9	0	0	0	0	108.5	T17 L21	T17-S19 PolarHBondContact O-N 3.43Å; S19-L21 PolarHBondContact O-N 3.06Å
20	S	24.1	Very low	25.8	Very low	109 Å²	109	139.6 Å²	139.6	76%	0.762	81%	0.809	S	S	*	*			trans	-63	92.4	169.2	55	0	0	0	0	109.5	I22	S20-I22 PolarHBondContact O-N 3.5Å
21	L	25.7	Very low	26	Very low	158 Å²	158	134.9 Å²	134.9	83%	0.827	80%	0.8	S	S	*	*			trans	-83.8	108.6	167.2	-73.9	173.9	0	0	0	108.2	S19 L23	S19-L21 PolarHBondContact O-N 3.06Å; L21-L23 PolarHBondContact O-N 3.39Å
22	I	24.8	Very low	25.9	Very low	165 Å²	165	136.4 Å²	136.4	85%	0.846	81%	0.809	S	S	*	*			trans	-55.3	114.1	171.3	-64.8	164.7	0	0	0	107.9	S20	S20-I22 PolarHBondContact O-N 3.5Å
23	L	25.6	Very low	25.7	Very low	155 Å²	155	134.2 Å²	134.2	81%	0.812	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-69.5	134.9	170.6	-86.8	151	0	0	0	109.4	L21 S25	L21-L23 PolarHBondContact O-N 3.39Å; L23-S25 PolarHBondContact O-N 2.66Å
24	P	25.4	Very low	25.9	Very low	124 Å²	124	130.3 Å²	130.3	81%	0.805	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-65.1	126.3	168.3	-15.1	29.1	0	0	0	110.1
25	S	24.9	Very low	25.8	Very low	106 Å²	106	130 Å²	130	74%	0.741	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-59.2	153.9	167.6	-29.9	0	0	0	0	111.4	L23	L23-S25 PolarHBondContact O-N 2.66Å
26	E	25.3	Very low	25.9	Very low	188 Å²	188	123.8 Å²	123.8	88%	0.879	79%	0.792	S	S	*	*			trans	77.2	70.7	160.2	-56.5	-179.3	-177.4	0	0	117.1
27	I	26.9	Very low	25.9	Very low	171 Å²	171	125.5 Å²	125.5	88%	0.877	80%	0.798	S	S	*	*			trans	-111.3	113.3	140.6	-59.6	178	0	0	0	107.3	S29	I27-S29 PolarHBondContact O-N 3.38Å
28	S	27.5	Very low	25.8	Very low	113 Å²	113	126.3 Å²	126.3	79%	0.79	80%	0.797	S	S	*	*			trans	-48	118.3	-179.9	-173	0	0	0	0	111.7	A30	S28-A30 PolarHBondContact O-N 2.93Å; S28-A30 VanDerWaalsContact O-N 3.09Å
29	S	26.2	Very low	26.2	Very low	110 Å²	110	124.2 Å²	124.2	77%	0.769	79%	0.786	S	S	*	*			trans	-68.9	96	171.3	54.2	0	0	0	0	109.8	I27	I27-S29 PolarHBondContact O-N 3.38Å
30	A	27.2	Very low	26.6	Very low	83 Å²	83	124.6 Å²	124.6	69%	0.686	80%	0.796	S	S	*	*			trans	-79.3	120.5	160.8	0	0	0	0	0	108.1	S28 C32	S28-A30 PolarHBondContact O-N 2.93Å; S28-A30 VanDerWaalsContact O-N 3.09Å; A30-C32 PolarHBondContact O-N 3.24Å
31	P	28.2	Very low	27.1	Very low	115 Å²	115	122 Å²	122	75%	0.747	79%	0.786	S	S	*	*			trans	-71	116.9	177.6	27.7	-30.1	0	0	0	108.6	S33	P31-S33 PolarHBondContact O-N 2.94Å
32	C	25.1	Very low	27.7	Very low	135 Å²	135	121.3 Å²	121.3	91%	0.912	78%	0.783	S	S	*	*			trans	-65.4	101.9	167.3	-73.2	0	0	0	0	108.2	A30 S34	A30-C32 PolarHBondContact O-N 3.24Å; C32-S34 PolarHBondContact O-N 3.26Å
33	S	25.6	Very low	28.6	Very low	107 Å²	107	115.8 Å²	115.8	75%	0.748	76%	0.755	S	S	*	*			trans	-55.1	127	174.5	-62.6	0	0	0	0	110.7	P31 S35	P31-S33 PolarHBondContact O-N 2.94Å; S33-S35 PolarHBondContact O-N 2.75Å
34	S	26.1	Very low	29.3	Very low	109 Å²	109	112.9 Å²	112.9	76%	0.762	74%	0.74	S	S	*	*			trans	-33.3	126	164.7	53.3	0	0	0	0	113.8	C32	C32-S34 PolarHBondContact O-N 3.26Å
35	S	27	Very low	30.1	Very low	128 Å²	128	110 Å²	110	90%	0.895	72%	0.723	S	S	*	*			trans	153.6	127.1	134.5	47.3	0	0	0	0	110.3	S33	S33-S35 PolarHBondContact O-N 2.75Å
36	G	25.8	Very low	31	Very low	67 Å²	67	111.6 Å²	111.6	69%	0.691	73%	0.728	S	S	*	*			trans	112.4	70.3	175.8	0	0	0	0	0	112.7	L38	G36-L38 PolarHBondContact O-N 3.16Å
37	S	25.1	Very low	32.4	Very low	123 Å²	123	109.3 Å²	109.3	86%	0.86	72%	0.717	S	S	*	*			trans	-59	88.9	161.2	49.7	0	0	0	0	109.1	P39	S37-P39 WeakPolarHBondContact O-CD 3.44Å
38	L	25.5	Very low	34.4	Very low	140 Å²	140	103.9 Å²	103.9	73%	0.733	69%	0.686	S	S	*	*			trans	-75.3	113.7	166.7	-78.7	162.6	0	0	0	106.4	G36	G36-L38 PolarHBondContact O-N 3.16Å
39	P	31.3	Very low	36.6	Very low	99 Å²	99	101.9 Å²	101.9	64%	0.643	67%	0.669	S	S	*	*			trans	-63.9	157.4	-179.1	26.7	-30.7	0	0	0	109.2	S37 G41	S37-P39 WeakPolarHBondContact O-CD 3.44Å; P39-G41 PolarHBondContact O-N 2.72Å
40	A	34.9	Very low	39.5	Very low	112 Å²	112	97.5 Å²	97.5	93%	0.926	64%	0.636	S	S	*	*			trans	-62.8	55	174	0	0	0	0	0	112.2
41	G	36	Very low	42.3	Very low	54 Å²	54	94.3 Å²	94.3	56%	0.557	61%	0.606	S	S	*	*			trans	-78.5	126.8	-176.3	0	0	0	0	0	109.5	P39 I43	P39-G41 PolarHBondContact O-N 2.72Å; G41-I43 PolarHBondContact O-N 2.84Å
42	D	38	Very low	44.9	Very low	144 Å²	144	89 Å²	89	77%	0.77	57%	0.571	S	S	*	*			trans	15.3	91.8	158.1	-77.1	-32.1	0	0	0	114.6	D44	D42-D44 PolarHBondContact O-N 3.29Å
43	I	43.5	Very low	47.5	Very low	48 Å²	48	83 Å²	83	25%	0.246	53%	0.533	C	S	.	.			trans	-66	93.1	152.1	-60.4	173.7	0	0	0	104.9	G41 S45 Y48 F51 L118	G41-I43 PolarHBondContact O-N 2.84Å; I43-S45 PolarHBondContact O-N 3.16Å; I43-Y48 HydrophobicContact CG2-CD2 4.13Å; I43-F51 HydrophobicContact CB-CD1 4.19Å; I43-F51 HydrophobicContact CB-CE1 3.91Å; I43-F51 HydrophobicContact CB-CZ 4.2Å; I43-F51 HydrophobicContact CD1-CD2 4.44Å; I43-F51 HydrophobicContact CD1-CE2 3.99Å; I43-F51 HydrophobicContact CD1-CZ 4.06Å; I43-F51 HydrophobicContact CG2-CB 4.42Å; I43-F51 HydrophobicContact CG2-CD1 3.64Å; I43-F51 HydrophobicContact CG2-CD2 4.39Å; I43-F51 HydrophobicContact CG2-CE1 3.9Å; I43-F51 HydrophobicContact CG2-CG 3.89Å; I43-F51 HydrophobicContact CG2-CZ 4.38Å; I43-L118 HydrophobicContact CD1-CB 4.49Å; I43-L118 HydrophobicContact CD1-CD1 3.62Å; I43-L118 HydrophobicContact CD1-CG 4.33Å
44	D	39.1	Very low	49.8	Very low	94 Å²	94	84.6 Å²	84.6	50%	0.503	53%	0.533	S	S	.	.			trans	-50.7	109.9	170.7	-100.5	-22.8	0	0	0	107.2	D42 V46 Q47	D42-D44 PolarHBondContact O-N 3.29Å; D44-V46 PolarHBondContact O-N 2.64Å; D44-Q47 PolarHBondContact O-N 3.15Å
45	S	44.1	Very low	52.3	Low	64 Å²	64	80.1 Å²	80.1	45%	0.448	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-10.9	-176.4	-64.5	0	0	0	0	112.6	I43	I43-S45 PolarHBondContact O-N 3.16Å
46	V	43.9	Very low	54.7	Low	139 Å²	139	76.3 Å²	76.3	84%	0.842	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-28.1	177.4	-169.3	0	0	0	0	112.3	D44	D44-V46 PolarHBondContact O-N 2.64Å
47	Q	53.2	Low	57.4	Low	140 Å²	140	79.9 Å²	79.9	65%	0.654	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-28.4	-173	-163.6	175.1	15.7	0	0	113.5	D44	D44-Q47 PolarHBondContact O-N 3.15Å
48	Y	69	Low	60	Low	58 Å²	58	80.3 Å²	80.3	23%	0.227	46%	0.456	C	S	.	.			trans	-128.5	104.2	-173.8	-57.7	-74.4	0	0	0	111.5	I43 W50 F51 V119	I43-Y48 HydrophobicContact CG2-CD2 4.13Å; Y48-W50 AromaticContact CD1-CZ2 3.74Å; Y48-W50 HydrophobicContact CD1-CZ2 3.74Å; Y48-W50 AromaticContact CD1-NE1 3.99Å; Y48-W50 HydrophobicContact CG-CH2 4.39Å; Y48-W50 AromaticContact CG-CZ2 3.79Å; Y48-W50 HydrophobicContact CG-CZ2 3.79Å; Y48-W50 PolarHBondContact O-N 3.03Å; Y48-W50 VanDerWaalsContact O-N 3.15Å; Y48-F51 PolarHBondContact O-N 2.62Å; Y48-V119 HydrophobicContact CD1-CG1 4.38Å; Y48-V119 HydrophobicContact CD1-CG2 4.15Å; Y48-V119 HydrophobicContact CD2-CG2 4.09Å; Y48-V119 HydrophobicContact CE1-CB 4.19Å; Y48-V119 HydrophobicContact CE1-CG1 3.52Å; Y48-V119 HydrophobicContact CE1-CG2 3.57Å; Y48-V119 HydrophobicContact CE2-CG2 3.51Å; Y48-V119 HydrophobicContact CG-CG2 4.39Å; Y48-V119 WeakPolarHBondContact OH-CG2 3.19Å
49	T	74.9	Confident	62.6	Low	71 Å²	71	76.5 Å²	76.5	44%	0.436	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-32.8	-175.8	55.9	0	0	0	0	113.5	F51 P146 R147	T49-F51 VanDerWaalsContact C-N 3.29Å; T49-F51 PolarHBondContact O-N 2.8Å; T49-P146 VanDerWaalsContact O-CA 3.24Å; T49-P146 WeakPolarHBondContact O-CA 3.38Å; T49-R147 PolarHBondContact O-N 3.33Å
50	W	86.4	Confident	65.1	Low	18 Å²	18	71.8 Å²	71.8	7%	0.068	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-11.7	178.5	52	-101.4	0	0	0	113.9	Y48 W52 F72 C73 I74 L118 V119 V122 P144	Y48-W50 AromaticContact CD1-CZ2 3.74Å; Y48-W50 HydrophobicContact CD1-CZ2 3.74Å; Y48-W50 AromaticContact CD1-NE1 3.99Å; Y48-W50 HydrophobicContact CG-CH2 4.39Å; Y48-W50 AromaticContact CG-CZ2 3.79Å; Y48-W50 HydrophobicContact CG-CZ2 3.79Å; Y48-W50 PolarHBondContact O-N 3.03Å; Y48-W50 VanDerWaalsContact O-N 3.15Å; W50-W52 VanDerWaalsContact O-CD1 3.25Å; W50-F72 HydrophobicContact CB-CD2 4.23Å; W50-F72 HydrophobicContact CB-CE2 3.7Å; W50-F72 HydrophobicContact CB-CZ 4.17Å; W50-F72 HydrophobicContact CD2-CE2 4.11Å; W50-F72 AromaticContact CG-CE2 3.68Å; W50-F72 HydrophobicContact CG-CE2 3.68Å; W50-F72 HydrophobicContact CG-CZ 4.09Å; W50-C73 CarbonylContact O-C 3.49Å; W50-C73 VanDerWaalsContact O-CA 3.25Å; W50-C73 WeakPolarHBondContact O-CA 3.24Å; W50-C73 WeakPolarHBondContact O-CB 3.47Å; W50-I74 HydrophobicContact CE3-CB 3.9Å; W50-I74 HydrophobicContact CE3-CD1 3.92Å; W50-I74 HydrophobicContact CE3-CG1 3.95Å; W50-I74 HydrophobicContact CH2-CD1 4.42Å; W50-I74 HydrophobicContact CZ3-CB 3.93Å; W50-I74 HydrophobicContact CZ3-CD1 3.62Å; W50-I74 HydrophobicContact CZ3-CG1 4.05Å; W50-I74 PolarHBondContact O-N 2.95Å; W50-L118 HydrophobicContact CH2-CB 4.11Å; W50-L118 HydrophobicContact CZ3-CB 4.49Å; W50-V119 HydrophobicContact CZ2-CG2 4.4Å; W50-V122 HydrophobicContact CD2-CG2 4.19Å; W50-V122 HydrophobicContact CE3-CG2 4.17Å; W50-V122 HydrophobicContact CH2-CG2 3.82Å; W50-V122 HydrophobicContact CZ2-CB 4.06Å; W50-V122 HydrophobicContact CZ2-CG1 4.32Å; W50-V122 HydrophobicContact CZ2-CG2 3.79Å; W50-V122 HydrophobicContact CZ3-CG2 4.02Å; W50-P144 HydrophobicContact CB-CB 3.74Å; W50-P144 HydrophobicContact CG-CB 4.13Å
51	F	86	Confident	67.5	Low	15 Å²	15	69 Å²	69	7%	0.066	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	116.7	178.3	-173.4	-103.2	0	0	0	110.2	I43 Y48 T49 I74 Y83 L118	I43-F51 HydrophobicContact CB-CD1 4.19Å; I43-F51 HydrophobicContact CB-CE1 3.91Å; I43-F51 HydrophobicContact CB-CZ 4.2Å; I43-F51 HydrophobicContact CD1-CD2 4.44Å; I43-F51 HydrophobicContact CD1-CE2 3.99Å; I43-F51 HydrophobicContact CD1-CZ 4.06Å; I43-F51 HydrophobicContact CG2-CB 4.42Å; I43-F51 HydrophobicContact CG2-CD1 3.64Å; I43-F51 HydrophobicContact CG2-CD2 4.39Å; I43-F51 HydrophobicContact CG2-CE1 3.9Å; I43-F51 HydrophobicContact CG2-CG 3.89Å; I43-F51 HydrophobicContact CG2-CZ 4.38Å; Y48-F51 PolarHBondContact O-N 2.62Å; T49-F51 VanDerWaalsContact C-N 3.29Å; T49-F51 PolarHBondContact O-N 2.8Å; F51-I74 HydrophobicContact CD2-CB 4.34Å; F51-I74 HydrophobicContact CD2-CG2 4.19Å; F51-I74 HydrophobicContact CE2-CG2 4.36Å; F51-Y83 AromaticContact CE2-CD1 3.89Å; F51-Y83 HydrophobicContact CE2-CD1 3.89Å; F51-Y83 AromaticContact CE2-CE1 3.62Å; F51-Y83 HydrophobicContact CE2-CE1 3.62Å; F51-Y83 HydrophobicContact CZ-CD1 4.46Å; F51-Y83 AromaticContact CZ-CE1 3.81Å; F51-Y83 HydrophobicContact CZ-CE1 3.81Å; F51-L118 HydrophobicContact CD2-CD1 4.29Å; F51-L118 HydrophobicContact CE2-CD1 3.93Å
52	W	83.4	Confident	69.7	Low	3 Å²	3	72.2 Å²	72.2	1%	0.011	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	-10.1	-173.4	-72	34.3	0	0	0	113	W50 V55 V59 V60 R63 C73 I74 R75 V145 R147	W50-W52 VanDerWaalsContact O-CD1 3.25Å; W52-V55 HydrophobicContact CB-CG1 3.81Å; W52-V55 HydrophobicContact CE3-CB 4.39Å; W52-V55 HydrophobicContact CE3-CG1 3.93Å; W52-V55 HydrophobicContact CE3-CG2 4.02Å; W52-V55 HydrophobicContact CZ3-CG2 4.39Å; W52-V59 HydrophobicContact CZ3-CG1 4.39Å; W52-V60 HydrophobicContact CD2-CG2 4.47Å; W52-V60 HydrophobicContact CE3-CG2 3.64Å; W52-V60 HydrophobicContact CZ3-CB 4.39Å; W52-V60 HydrophobicContact CZ3-CG2 3.69Å; W52-R63 HydrophobicContact CH2-CB 3.51Å; W52-R63 HydrophobicContact CH2-CG 3.54Å; W52-R63 HydrophobicContact CZ2-CB 4.31Å; W52-R63 HydrophobicContact CZ2-CG 3.93Å; W52-R63 HydrophobicContact CZ3-CB 4.4Å; W52-C73 HydrophobicContact CD2-CB 4.21Å; W52-C73 HydrophobicContact CG-CB 4.09Å; W52-C73 HydrophobicContact CZ2-CB 4.37Å; W52-C73 VanDerWaalsContact NE1-CB 3.26Å; W52-I74 PolarHBondContact N-O 2.98Å; W52-R75 HydrophobicContact CB-CB 4.48Å; W52-V145 HydrophobicContact CZ2-CG1 3.92Å; W52-V145 PolarHBondContact NE1-O 3.44Å; W52-R147 HydrophobicContact CB-CB 4.39Å; W52-R147 HydrophobicContact CB-CG 4.27Å; W52-R147 HydrophobicContact CD2-CB 3.82Å; W52-R147 HydrophobicContact CD2-CG 3.82Å; W52-R147 HydrophobicContact CE3-CB 4.39Å; W52-R147 HydrophobicContact CE3-CG 3.91Å; W52-R147 HydrophobicContact CG-CB 3.75Å; W52-R147 HydrophobicContact CG-CG 3.95Å; W52-R147 WeakPolarHBondContact O-CD 3.2Å; W52-R147 PolarHBondContact O-NH1 3.34Å
53	G	78.1	Confident	71.7	Confident	11 Å²	11	68.6 Å²	68.6	11%	0.113	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	61.2	-137.6	-175.7	0	0	0	0	0	111.7	V55 R75 A76	G53-V55 PolarHBondContact O-N 3.44Å; G53-R75 CarbonylContact O-C 3.48Å; G53-R75 WeakPolarHBondContact O-CA 3.18Å; G53-R75 WeakPolarHBondContact O-CB 3.14Å; G53-A76 PolarHBondContact O-N 3.37Å
54	D	75.1	Confident	73.7	Confident	139 Å²	139	66.3 Å²	66.3	74%	0.743	35%	0.346	S	S	*	.	S	Bend	trans	-79.8	113.8	177.8	-165.6	10.8	0	0	0	111.1
55	V	77.6	Confident	75.8	Confident	16 Å²	16	67 Å²	67	10%	0.097	35%	0.349	C	S	.	.			trans	-153.1	141.8	-178.8	62.6	0	0	0	0	110.1	W52 G53 V59 V60 R75	W52-V55 HydrophobicContact CB-CG1 3.81Å; W52-V55 HydrophobicContact CE3-CB 4.39Å; W52-V55 HydrophobicContact CE3-CG1 3.93Å; W52-V55 HydrophobicContact CE3-CG2 4.02Å; W52-V55 HydrophobicContact CZ3-CG2 4.39Å; G53-V55 PolarHBondContact O-N 3.44Å; V55-V59 HydrophobicContact CG2-CB 3.93Å; V55-V59 HydrophobicContact CG2-CG1 3.97Å; V55-V60 HydrophobicContact CB-CG2 4.34Å; V55-V60 HydrophobicContact CG1-CG2 3.45Å; V55-V60 VanDerWaalsContact CG1-CG2 3.45Å; V55-V60 HydrophobicContact CG2-CG2 3.96Å; V55-R75 HydrophobicContact CG1-CB 3.57Å; V55-R75 HydrophobicContact CG1-CG 4.37Å; V55-R75 PolarHBondContact O-NH1 3.18Å
56	S	78.8	Confident	77.7	Confident	48 Å²	48	67.3 Å²	67.3	34%	0.336	36%	0.362	S	S	.	.			trans	-66.2	152.1	179.1	96.5	0	0	0	0	111.4	E58 V59 V60	S56-E58 WeakPolarHBondContact CB-OE2 2.97Å; S56-E58 PolarHBondContact O-N 3.22Å; S56-E58 PolarHBondContact OG-N 3Å; S56-E58 PolarHBondContact OG-OE2 3.21Å; S56-V59 PolarHBondContact OG-N 3.04Å; S56-V60 WeakPolarHBondContact O-CG2 3.4Å; S56-V60 PolarHBondContact O-N 3.02Å
57	R	81.4	Confident	79.7	Confident	141 Å²	141	64 Å²	64	53%	0.532	34%	0.338	S	S	.	.	H	α-helix	trans	-62.4	-32.6	176.3	-178.7	-179	175.4	174.4	-0.3	111.7	N61	R57-N61 VanDerWaalsContact O-CB 3.3Å; R57-N61 WeakPolarHBondContact O-CB 3.39Å; R57-N61 PolarHBondContact O-N 2.63Å
58	E	80.6	Confident	81.4	Confident	132 Å²	132	60.7 Å²	60.7	62%	0.617	33%	0.328	S	S	*	.	H	α-helix	trans	-65	-52.2	-179.5	-56.3	103	-174.5	0	0	111	S56 V60 N61 D62	S56-E58 WeakPolarHBondContact CB-OE2 2.97Å; S56-E58 PolarHBondContact O-N 3.22Å; S56-E58 PolarHBondContact OG-N 3Å; S56-E58 PolarHBondContact OG-OE2 3.21Å; E58-V60 PolarHBondContact O-N 3.35Å; E58-N61 PolarHBondContact O-N 3.27Å; E58-D62 PolarHBondContact O-N 3.07Å
59	V	79.5	Confident	82.4	Confident	60 Å²	60	61 Å²	61	36%	0.364	33%	0.334	S	S	.	.	H	α-helix	trans	-57	-41	179.9	177.8	0	0	0	0	111.3	W52 V55 S56 R63	W52-V59 HydrophobicContact CZ3-CG1 4.39Å; V55-V59 HydrophobicContact CG2-CB 3.93Å; V55-V59 HydrophobicContact CG2-CG1 3.97Å; S56-V59 PolarHBondContact OG-N 3.04Å; V59-R63 PolarHBondContact O-N 3.04Å; V59-R63 VanDerWaalsContact O-N 3.12Å
60	V	84.2	Confident	83.2	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.006	31%	0.313	C	S	.	.	H	α-helix	trans	-67.8	-45.8	176.3	178.4	0	0	0	0	111.5	W52 V55 S56 E58 D62 R63 M64 C73 T86	W52-V60 HydrophobicContact CD2-CG2 4.47Å; W52-V60 HydrophobicContact CE3-CG2 3.64Å; W52-V60 HydrophobicContact CZ3-CB 4.39Å; W52-V60 HydrophobicContact CZ3-CG2 3.69Å; V55-V60 HydrophobicContact CB-CG2 4.34Å; V55-V60 HydrophobicContact CG1-CG2 3.45Å; V55-V60 VanDerWaalsContact CG1-CG2 3.45Å; V55-V60 HydrophobicContact CG2-CG2 3.96Å; S56-V60 WeakPolarHBondContact O-CG2 3.4Å; S56-V60 PolarHBondContact O-N 3.02Å; E58-V60 PolarHBondContact O-N 3.35Å; V60-D62 VanDerWaalsContact C-N 3.31Å; V60-D62 PolarHBondContact O-N 3.47Å; V60-R63 PolarHBondContact O-N 3.1Å; V60-M64 HydrophobicContact CG1-CG 3.89Å; V60-M64 VanDerWaalsContact O-CB 3.25Å; V60-M64 WeakPolarHBondContact O-CB 3.27Å; V60-M64 WeakPolarHBondContact O-CG 3.47Å; V60-M64 PolarHBondContact O-N 2.94Å; V60-C73 VanDerWaalsContact CG1-SG 3.52Å; V60-T86 HydrophobicContact CG1-CG2 3.72Å
61	N	85	Confident	83.5	Confident	53 Å²	53	56.8 Å²	56.8	28%	0.283	31%	0.31	S	S	.	.	H	α-helix	trans	-59.9	-42.6	178.8	-91.8	-12.5	0	0	0	112.1	R57 E58 R63 M64 N65	R57-N61 VanDerWaalsContact O-CB 3.3Å; R57-N61 WeakPolarHBondContact O-CB 3.39Å; R57-N61 PolarHBondContact O-N 2.63Å; E58-N61 PolarHBondContact O-N 3.27Å; N61-R63 VanDerWaalsContact C-N 3.34Å; N61-M64 PolarHBondContact O-N 2.98Å; N61-N65 PolarHBondContact O-N 2.88Å
62	D	81.1	Confident	83.9	Confident	122 Å²	122	56.2 Å²	56.2	65%	0.652	31%	0.308	S	S	*	.	H	α-helix	trans	-62.7	-43.2	178.3	-70.4	-16.6	0	0	0	110.7	E58 V60 N65	E58-D62 PolarHBondContact O-N 3.07Å; V60-D62 VanDerWaalsContact C-N 3.31Å; V60-D62 PolarHBondContact O-N 3.47Å; D62-N65 VanDerWaalsContact O-CB 3.28Å; D62-N65 WeakPolarHBondContact O-CB 3.2Å; D62-N65 PolarHBondContact O-N 2.89Å
63	R	81.1	Confident	84.3	Confident	68 Å²	68	56.1 Å²	56.1	26%	0.257	31%	0.307	S	S	.	.	H	α-helix	trans	-69.5	-37.1	177	-168.1	68.3	165.6	-161.1	-6	113.8	W52 V59 V60 N61 N65 Q67 V145 P149	W52-R63 HydrophobicContact CH2-CB 3.51Å; W52-R63 HydrophobicContact CH2-CG 3.54Å; W52-R63 HydrophobicContact CZ2-CB 4.31Å; W52-R63 HydrophobicContact CZ2-CG 3.93Å; W52-R63 HydrophobicContact CZ3-CB 4.4Å; V59-R63 PolarHBondContact O-N 3.04Å; V59-R63 VanDerWaalsContact O-N 3.12Å; V60-R63 PolarHBondContact O-N 3.1Å; N61-R63 VanDerWaalsContact C-N 3.34Å; R63-N65 PolarHBondContact O-N 3.24Å; R63-Q67 VanDerWaalsContact O-CG 3.24Å; R63-Q67 WeakPolarHBondContact O-CG 3.2Å; R63-V145 HydrophobicContact CG-CG1 3.97Å; R63-P149 VanDerWaalsContact NH2-CA 3.28Å
64	M	85.2	Confident	85	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-72.7	-12.3	178.2	-69.4	-64.7	-66.6	0	0	111.6	V60 N61 S71 T86 R88 T93 V145	V60-M64 HydrophobicContact CG1-CG 3.89Å; V60-M64 VanDerWaalsContact O-CB 3.25Å; V60-M64 WeakPolarHBondContact O-CB 3.27Å; V60-M64 WeakPolarHBondContact O-CG 3.47Å; V60-M64 PolarHBondContact O-N 2.94Å; N61-M64 PolarHBondContact O-N 2.98Å; M64-S71 WeakPolarHBondContact CE-O 3.28Å; M64-T86 HydrophobicContact CE-CG2 4.38Å; M64-T86 HydrophobicContact CG-CG2 4.01Å; M64-R88 HydrophobicContact CE-CB 4.18Å; M64-R88 WeakPolarHBondContact O-CD 3.47Å; M64-R88 PolarHBondContact O-NH1 2.83Å; M64-T93 HydrophobicContact CB-CG2 4.25Å; M64-V145 HydrophobicContact SD-CB 4.4Å; M64-V145 HydrophobicContact SD-CG2 3.88Å
65	N	83.3	Confident	85.7	Confident	109 Å²	109	50.5 Å²	50.5	58%	0.583	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	133	175.4	-157.6	16.6	0	0	0	111	N61 D62 R63 Q67	N61-N65 PolarHBondContact O-N 2.88Å; D62-N65 VanDerWaalsContact O-CB 3.28Å; D62-N65 WeakPolarHBondContact O-CB 3.2Å; D62-N65 PolarHBondContact O-N 2.89Å; R63-N65 PolarHBondContact O-N 3.24Å; N65-Q67 PolarHBondContact O-N 2.79Å
66	G	83.3	Confident	86.2	Confident	70 Å²	70	51.1 Å²	51.1	72%	0.722	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.8	-6.9	-177.4	0	0	0	0	0	116
67	Q	86.6	Confident	86.5	Confident	69 Å²	69	50.2 Å²	50.2	32%	0.322	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-67.1	147.6	174.4	-64.2	-60.4	-41.1	0	0	111.1	R63 N65 R88 V145	R63-Q67 VanDerWaalsContact O-CG 3.24Å; R63-Q67 WeakPolarHBondContact O-CG 3.2Å; N65-Q67 PolarHBondContact O-N 2.79Å; Q67-R88 WeakPolarHBondContact O-CG 3.47Å; Q67-V145 HydrophobicContact CG-CG2 4.41Å
68	P	89	Confident	86.7	Confident	70 Å²	70	49.6 Å²	49.6	46%	0.455	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-67.7	156.8	177.1	27.4	-33.7	0	0	0	111.8	G70 S71	P68-G70 PolarHBondContact O-N 2.91Å; P68-S71 WeakPolarHBondContact CD-OG 3.3Å; P68-S71 WeakPolarHBondContact CG-OG 3.35Å; P68-S71 WeakPolarHBondContact O-CB 3.38Å; P68-S71 PolarHBondContact O-N 3.3Å; P68-S71 VanDerWaalsContact O-N 3.07Å; P68-S71 PolarHBondContact O-OG 2.97Å
69	D	90.5	Very high	86.8	Confident	65 Å²	65	45.4 Å²	45.4	35%	0.348	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	136.4	174.5	-85	10.8	0	0	0	111.8	S71 R88 K89 D90 G91 I139	D69-S71 VanDerWaalsContact C-N 3.31Å; D69-R88 WeakPolarHBondContact CA-O 3.39Å; D69-K89 WeakPolarHBondContact OD1-CA 3.08Å; D69-D90 VanDerWaalsContact CG-N 3.27Å; D69-D90 PolarHBondContact OD1-N 2.9Å; D69-D90 VanDerWaalsContact OD1-N 3.16Å; D69-D90 WeakPolarHBondContact OD2-CA 3.18Å; D69-D90 PolarHBondContact OD2-N 2.87Å; D69-G91 PolarHBondContact OD1-N 3.41Å; D69-I139 HydrophobicContact CB-CD1 3.94Å
70	G	90.2	Very high	86.8	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.6	-0.9	-173.9	0	0	0	0	0	112.9	P68 R88 R142 H143	P68-G70 PolarHBondContact O-N 2.91Å; G70-R88 PolarHBondContact N-O 3.41Å; G70-R142 PolarHBondContact O-N 2.81Å; G70-H143 PolarHBondContact O-N 3.32Å
71	S	93.4	Very high	86.6	Confident	0 Å²	0	51 Å²	51	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	140.2	167.3	-58.2	0	0	0	0	111.2	M64 P68 D69 L87 R88 H143	M64-S71 WeakPolarHBondContact CE-O 3.28Å; P68-S71 WeakPolarHBondContact CD-OG 3.3Å; P68-S71 WeakPolarHBondContact CG-OG 3.35Å; P68-S71 WeakPolarHBondContact O-CB 3.38Å; P68-S71 PolarHBondContact O-N 3.3Å; P68-S71 VanDerWaalsContact O-N 3.07Å; P68-S71 PolarHBondContact O-OG 2.97Å; D69-S71 VanDerWaalsContact C-N 3.31Å; S71-L87 CarbonylContact O-C 3.5Å; S71-L87 WeakPolarHBondContact O-CA 3.3Å; S71-L87 WeakPolarHBondContact O-CB 3.43Å; S71-R88 PolarHBondContact O-N 2.88Å; S71-H143 CarbonylContact C-O 3.55Å; S71-H143 WeakPolarHBondContact CA-O 3.43Å
72	F	94.4	Very high	86.8	Confident	4 Å²	4	49.6 Å²	49.6	2%	0.018	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	157.8	-175.9	74.4	-79.5	0	0	0	114.5	W50 L85 T86 L87 V122 L141 H143 P144 V145	W50-F72 HydrophobicContact CB-CD2 4.23Å; W50-F72 HydrophobicContact CB-CE2 3.7Å; W50-F72 HydrophobicContact CB-CZ 4.17Å; W50-F72 HydrophobicContact CD2-CE2 4.11Å; W50-F72 AromaticContact CG-CE2 3.68Å; W50-F72 HydrophobicContact CG-CE2 3.68Å; W50-F72 HydrophobicContact CG-CZ 4.09Å; F72-L85 HydrophobicContact CB-CD1 4.06Å; F72-L85 HydrophobicContact CD2-CD1 3.95Å; F72-L85 HydrophobicContact CG-CD1 4.42Å; F72-T86 CarbonylContact C-O 3.37Å; F72-T86 WeakPolarHBondContact CA-O 3.27Å; F72-L87 HydrophobicContact CB-CB 3.91Å; F72-V122 HydrophobicContact CE2-CG1 3.67Å; F72-V122 HydrophobicContact CE2-CG2 4.04Å; F72-V122 HydrophobicContact CZ-CG1 3.58Å; F72-L141 HydrophobicContact CB-CD2 3.82Å; F72-L141 HydrophobicContact CD1-CB 3.71Å; F72-L141 HydrophobicContact CD1-CD2 4.12Å; F72-L141 HydrophobicContact CD1-CG 4.41Å; F72-L141 HydrophobicContact CD2-CB 4.46Å; F72-L141 HydrophobicContact CD2-CD1 4.17Å; F72-L141 HydrophobicContact CD2-CD2 4.24Å; F72-L141 HydrophobicContact CE1-CB 3.65Å; F72-L141 HydrophobicContact CE2-CB 4.41Å; F72-L141 HydrophobicContact CE2-CD1 4.23Å; F72-L141 HydrophobicContact CG-CB 4.13Å; F72-L141 HydrophobicContact CG-CD1 4.48Å; F72-L141 HydrophobicContact CG-CD2 3.8Å; F72-L141 HydrophobicContact CG-CG 4.35Å; F72-L141 HydrophobicContact CZ-CB 4.02Å; F72-H143 PolarHBondContact N-O 2.83Å; F72-P144 HydrophobicContact CE1-CB 3.9Å; F72-P144 HydrophobicContact CZ-CB 3.81Å; F72-V145 PolarHBondContact O-N 2.8Å
73	C	92.2	Very high	87.3	Confident	0 Å²	0	46 Å²	46	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	158.1	166	68.8	0	0	0	0	111	W50 W52 V60 T86	W50-C73 CarbonylContact O-C 3.49Å; W50-C73 VanDerWaalsContact O-CA 3.25Å; W50-C73 WeakPolarHBondContact O-CA 3.24Å; W50-C73 WeakPolarHBondContact O-CB 3.47Å; W52-C73 HydrophobicContact CD2-CB 4.21Å; W52-C73 HydrophobicContact CG-CB 4.09Å; W52-C73 HydrophobicContact CZ2-CB 4.37Å; W52-C73 VanDerWaalsContact NE1-CB 3.26Å; V60-C73 VanDerWaalsContact CG1-SG 3.52Å; C73-T86 PolarHBondContact N-O 2.99Å; C73-T86 PolarHBondContact O-N 2.89Å
74	I	92.9	Very high	87.9	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	129.5	175.6	-62.6	-178.2	0	0	0	109.2	W50 F51 W52 Y83 T84 L85 I98 L118 V122	W50-I74 HydrophobicContact CE3-CB 3.9Å; W50-I74 HydrophobicContact CE3-CD1 3.92Å; W50-I74 HydrophobicContact CE3-CG1 3.95Å; W50-I74 HydrophobicContact CH2-CD1 4.42Å; W50-I74 HydrophobicContact CZ3-CB 3.93Å; W50-I74 HydrophobicContact CZ3-CD1 3.62Å; W50-I74 HydrophobicContact CZ3-CG1 4.05Å; W50-I74 PolarHBondContact O-N 2.95Å; F51-I74 HydrophobicContact CD2-CB 4.34Å; F51-I74 HydrophobicContact CD2-CG2 4.19Å; F51-I74 HydrophobicContact CE2-CG2 4.36Å; W52-I74 PolarHBondContact N-O 2.98Å; I74-Y83 HydrophobicContact CG2-CD1 4.19Å; I74-Y83 HydrophobicContact CG2-CG 4.26Å; I74-T84 WeakPolarHBondContact CA-O 3.15Å; I74-L85 HydrophobicContact CD1-CD1 4.27Å; I74-L85 HydrophobicContact CG1-CB 4.37Å; I74-L85 HydrophobicContact CG1-CD1 3.73Å; I74-I98 HydrophobicContact CD1-CD1 3.75Å; I74-I98 HydrophobicContact CG1-CD1 4.25Å; I74-I98 HydrophobicContact CG2-CD1 4.19Å; I74-L118 HydrophobicContact CG2-CD1 4.16Å; I74-V122 HydrophobicContact CD1-CG2 3.58Å
75	R	90.2	Very high	88.3	Confident	32 Å²	32	43.3 Å²	43.3	12%	0.121	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	161.6	177.3	67.7	-170.6	-172.9	89.8	8.4	111.7	W52 G53 V55 Y83 T84	W52-R75 HydrophobicContact CB-CB 4.48Å; G53-R75 CarbonylContact O-C 3.48Å; G53-R75 WeakPolarHBondContact O-CA 3.18Å; G53-R75 WeakPolarHBondContact O-CB 3.14Å; V55-R75 HydrophobicContact CG1-CB 3.57Å; V55-R75 HydrophobicContact CG1-CG 4.37Å; V55-R75 PolarHBondContact O-NH1 3.18Å; R75-Y83 CarbonylContact O-C 3.5Å; R75-Y83 WeakPolarHBondContact O-CA 3.43Å; R75-T84 PolarHBondContact N-O 3.27Å; R75-T84 PolarHBondContact O-N 2.97Å
76	A	86.9	Confident	88.8	Confident	29 Å²	29	38.1 Å²	38.1	24%	0.24	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	140.3	171.6	0	0	0	0	0	110.8	G53	G53-A76 PolarHBondContact O-N 3.37Å
77	S	86.5	Confident	89.2	Confident	30 Å²	30	34.8 Å²	34.8	21%	0.21	22%	0.22	C	C	.	.			trans	-89.7	165.6	172.4	-162.5	0	0	0	0	110.9	S79 D82	S77-S79 PolarHBondContact O-N 3.47Å; S77-D82 WeakPolarHBondContact CB-O 3.39Å; S77-D82 PolarHBondContact N-O 2.94Å
78	S	84.6	Confident	89.6	Confident	128 Å²	128	32.9 Å²	32.9	90%	0.895	21%	0.21	S	C	*	.	S	Bend	trans	-67.1	-20.7	170.4	-52.2	0	0	0	0	112.5
79	S	83.3	Confident	89.7	Confident	44 Å²	44	30.7 Å²	30.7	31%	0.308	19%	0.193	S	C	.	.	S	Bend	trans	-86.5	119.9	173.4	-56.5	0	0	0	0	109.4	S77 G81 D82 K97	S77-S79 PolarHBondContact O-N 3.47Å; S79-G81 PolarHBondContact O-N 3.35Å; S79-D82 VanDerWaalsContact CB-OD2 3.3Å; S79-D82 WeakPolarHBondContact CB-OD2 3.46Å; S79-D82 WeakPolarHBondContact O-CB 3.48Å; S79-D82 PolarHBondContact O-N 2.84Å; S79-K97 PolarHBondContact OG-NZ 2.92Å
80	P	77.9	Confident	89.6	Confident	132 Å²	132	33.2 Å²	33.2	86%	0.857	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	131.7	-179.4	24.8	-32.9	0	0	0	110.8	D82	P80-D82 VanDerWaalsContact C-N 3.32Å
81	G	81.1	Confident	89.3	Confident	46 Å²	46	35.5 Å²	35.5	47%	0.474	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.5	-18.5	-175.1	0	0	0	0	0	114.5	S79 G100	S79-G81 PolarHBondContact O-N 3.35Å; G81-G100 WeakPolarHBondContact O-CA 3.35Å
82	D	89.4	Confident	89.1	Confident	23 Å²	23	37.3 Å²	37.3	12%	0.123	25%	0.245	C	C	.	.			trans	-96	154.7	178	-65.6	-19.3	0	0	0	111.7	S77 S79 P80 K97 I98 Y99 G100	S77-D82 WeakPolarHBondContact CB-O 3.39Å; S77-D82 PolarHBondContact N-O 2.94Å; S79-D82 VanDerWaalsContact CB-OD2 3.3Å; S79-D82 WeakPolarHBondContact CB-OD2 3.46Å; S79-D82 WeakPolarHBondContact O-CB 3.48Å; S79-D82 PolarHBondContact O-N 2.84Å; P80-D82 VanDerWaalsContact C-N 3.32Å; D82-K97 WeakPolarHBondContact OD2-CE 3.39Å; D82-K97 IonicContact OD2-NZ 2.69Å; D82-K97 PolarHBondContact OD2-NZ 2.82Å; D82-I98 CarbonylContact C-O 3.59Å; D82-I98 WeakPolarHBondContact CA-O 3.24Å; D82-I98 WeakPolarHBondContact CB-O 3.43Å; D82-Y99 WeakPolarHBondContact OD1-CA 3.35Å; D82-G100 PolarHBondContact OD1-N 3.12Å
83	Y	91.5	Very high	89	Confident	47 Å²	47	39 Å²	39	18%	0.184	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	163.8	176.1	-63.1	-88.8	0	0	0	111	F51 I74 R75 I98 F105 L118	F51-Y83 AromaticContact CE2-CD1 3.89Å; F51-Y83 HydrophobicContact CE2-CD1 3.89Å; F51-Y83 AromaticContact CE2-CE1 3.62Å; F51-Y83 HydrophobicContact CE2-CE1 3.62Å; F51-Y83 HydrophobicContact CZ-CD1 4.46Å; F51-Y83 AromaticContact CZ-CE1 3.81Å; F51-Y83 HydrophobicContact CZ-CE1 3.81Å; I74-Y83 HydrophobicContact CG2-CD1 4.19Å; I74-Y83 HydrophobicContact CG2-CG 4.26Å; R75-Y83 CarbonylContact O-C 3.5Å; R75-Y83 WeakPolarHBondContact O-CA 3.43Å; Y83-I98 PolarHBondContact N-O 2.97Å; Y83-I98 PolarHBondContact O-N 3.03Å; Y83-F105 HydrophobicContact CD2-CD1 4.23Å; Y83-F105 AromaticContact CD2-CE1 3.81Å; Y83-F105 HydrophobicContact CD2-CE1 3.81Å; Y83-F105 HydrophobicContact CE2-CD1 4.4Å; Y83-F105 AromaticContact CE2-CE1 3.54Å; Y83-F105 HydrophobicContact CE2-CE1 3.54Å; Y83-F105 HydrophobicContact CE2-CZ 4.11Å; Y83-L118 HydrophobicContact CD1-CD1 3.94Å; Y83-L118 HydrophobicContact CD2-CD1 3.79Å; Y83-L118 HydrophobicContact CD2-CD2 4.04Å; Y83-L118 HydrophobicContact CD2-CG 4.34Å; Y83-L118 HydrophobicContact CE1-CD1 4Å; Y83-L118 HydrophobicContact CE2-CD1 3.85Å; Y83-L118 HydrophobicContact CE2-CG 4.46Å; Y83-L118 HydrophobicContact CG-CD1 3.82Å; Y83-L118 HydrophobicContact CG-CD2 4.36Å
84	T	93.6	Very high	88.9	Confident	12 Å²	12	43.1 Å²	43.1	7%	0.074	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	115.2	173.9	-53.6	0	0	0	0	108.9	I74 R75 L95	I74-T84 WeakPolarHBondContact CA-O 3.15Å; R75-T84 PolarHBondContact N-O 3.27Å; R75-T84 PolarHBondContact O-N 2.97Å; T84-L95 HydrophobicContact CG2-CB 4.25Å; T84-L95 HydrophobicContact CG2-CD2 3.87Å
85	L	93.1	Very high	88.8	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	118.1	167.5	172.9	64.3	0	0	0	108.5	F72 I74 L87 L95 V96 I98 L141	F72-L85 HydrophobicContact CB-CD1 4.06Å; F72-L85 HydrophobicContact CD2-CD1 3.95Å; F72-L85 HydrophobicContact CG-CD1 4.42Å; I74-L85 HydrophobicContact CD1-CD1 4.27Å; I74-L85 HydrophobicContact CG1-CB 4.37Å; I74-L85 HydrophobicContact CG1-CD1 3.73Å; L85-L87 HydrophobicContact CD2-CD2 4Å; L85-L87 HydrophobicContact CG-CD2 3.93Å; L85-L95 WeakPolarHBondContact O-CA 3.48Å; L85-V96 HydrophobicContact CB-CB 4.25Å; L85-V96 HydrophobicContact CD2-CB 4.44Å; L85-V96 PolarHBondContact N-O 3.13Å; L85-V96 PolarHBondContact O-N 2.84Å; L85-I98 HydrophobicContact CB-CD1 3.9Å; L85-I98 HydrophobicContact CB-CG1 4.18Å; L85-L141 HydrophobicContact CD1-CD1 4.39Å; L85-L141 HydrophobicContact CD1-CD2 4.2Å; L85-L141 HydrophobicContact CD2-CD1 4.4Å; L85-L141 HydrophobicContact CD2-CD2 4.22Å
86	T	93.5	Very high	88.9	Confident	0 Å²	0	45 Å²	45	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	123.4	173.9	-50	0	0	0	0	108	V60 M64 F72 C73 T93 K94 L95	V60-T86 HydrophobicContact CG1-CG2 3.72Å; M64-T86 HydrophobicContact CE-CG2 4.38Å; M64-T86 HydrophobicContact CG-CG2 4.01Å; F72-T86 CarbonylContact C-O 3.37Å; F72-T86 WeakPolarHBondContact CA-O 3.27Å; C73-T86 PolarHBondContact N-O 2.99Å; C73-T86 PolarHBondContact O-N 2.89Å; T86-T93 HydrophobicContact CG2-CG2 3.29Å; T86-K94 WeakPolarHBondContact CA-O 3.49Å; T86-L95 HydrophobicContact CG2-CD2 3.65Å; T86-L95 VanDerWaalsContact OG1-CD2 3.24Å; T86-L95 WeakPolarHBondContact OG1-CD2 3.35Å
87	L	93.5	Very high	89	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	156.4	-179.6	69.7	126.6	0	0	0	112.7	S71 F72 L85 K89 K94 V96 L130 I139	S71-L87 CarbonylContact O-C 3.5Å; S71-L87 WeakPolarHBondContact O-CA 3.3Å; S71-L87 WeakPolarHBondContact O-CB 3.43Å; F72-L87 HydrophobicContact CB-CB 3.91Å; L85-L87 HydrophobicContact CD2-CD2 4Å; L85-L87 HydrophobicContact CG-CD2 3.93Å; L87-K89 HydrophobicContact CD1-CB 4.48Å; L87-K94 HydrophobicContact CG-CB 4.28Å; L87-K94 PolarHBondContact N-O 3.14Å; L87-K94 PolarHBondContact O-N 3.32Å; L87-V96 HydrophobicContact CD2-CG2 3.93Å; L87-L130 HydrophobicContact CD1-CD1 4.25Å; L87-L130 HydrophobicContact CD2-CD1 4.16Å; L87-I139 HydrophobicContact CD1-CG2 3.43Å; L87-I139 VanDerWaalsContact CD1-CG2 3.43Å
88	R	93.3	Very high	89.2	Confident	29 Å²	29	45.2 Å²	45.2	11%	0.109	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	130.1	175.2	-159.9	79.3	-177	-164.5	-2.5	110.8	M64 Q67 D69 G70 S71 G91 T93 I139	M64-R88 HydrophobicContact CE-CB 4.18Å; M64-R88 WeakPolarHBondContact O-CD 3.47Å; M64-R88 PolarHBondContact O-NH1 2.83Å; Q67-R88 WeakPolarHBondContact O-CG 3.47Å; D69-R88 WeakPolarHBondContact CA-O 3.39Å; G70-R88 PolarHBondContact N-O 3.41Å; S71-R88 PolarHBondContact O-N 2.88Å; R88-G91 VanDerWaalsContact CZ-O 3.28Å; R88-G91 PolarHBondContact NE-O 3.28Å; R88-G91 PolarHBondContact NH2-O 3.41Å; R88-T93 PolarHBondContact NH1-OG1 2.95Å; R88-I139 WeakPolarHBondContact O-CD1 3.44Å
89	K	90.9	Very high	89.5	Confident	23 Å²	23	42.2 Å²	42.2	10%	0.1	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	136.5	173.7	179.4	175.8	-174.1	-77.7	0	110.9	D69 L87 G91 A92 K94 S136 L137 I139	D69-K89 WeakPolarHBondContact OD1-CA 3.08Å; L87-K89 HydrophobicContact CD1-CB 4.48Å; K89-G91 PolarHBondContact O-N 2.85Å; K89-A92 PolarHBondContact N-O 3.23Å; K89-A92 PolarHBondContact O-N 3.44Å; K89-A92 VanDerWaalsContact O-O 3.06Å; K89-K94 HydrophobicContact CB-CG 4.39Å; K89-S136 WeakPolarHBondContact CE-O 3.25Å; K89-S136 PolarHBondContact NZ-O 3.04Å; K89-L137 HydrophobicContact CD-CD2 4.04Å; K89-I139 HydrophobicContact CB-CD1 3.95Å; K89-I139 HydrophobicContact CD-CB 4.15Å; K89-I139 HydrophobicContact CD-CG2 4.03Å; K89-I139 HydrophobicContact CG-CD1 4.05Å
90	D	89.2	Confident	89.5	Confident	118 Å²	118	41.3 Å²	41.3	63%	0.631	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.4	38.1	-178.6	-51.3	-42.2	0	0	0	112	D69 A92	D69-D90 VanDerWaalsContact CG-N 3.27Å; D69-D90 PolarHBondContact OD1-N 2.9Å; D69-D90 VanDerWaalsContact OD1-N 3.16Å; D69-D90 WeakPolarHBondContact OD2-CA 3.18Å; D69-D90 PolarHBondContact OD2-N 2.87Å; D90-A92 PolarHBondContact O-N 2.63Å
91	G	85	Confident	89.6	Confident	48 Å²	48	41 Å²	41	50%	0.495	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	12.9	-177.4	0	0	0	0	0	114.8	D69 R88 K89	D69-G91 PolarHBondContact OD1-N 3.41Å; R88-G91 VanDerWaalsContact CZ-O 3.28Å; R88-G91 PolarHBondContact NE-O 3.28Å; R88-G91 PolarHBondContact NH2-O 3.41Å; K89-G91 PolarHBondContact O-N 2.85Å
92	A	88.9	Confident	89.3	Confident	38 Å²	38	46 Å²	46	31%	0.314	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	149.7	174.5	0	0	0	0	0	112	K89 D90	K89-A92 PolarHBondContact N-O 3.23Å; K89-A92 PolarHBondContact O-N 3.44Å; K89-A92 VanDerWaalsContact O-O 3.06Å; D90-A92 PolarHBondContact O-N 2.63Å
93	T	91.1	Very high	88.5	Confident	39 Å²	39	47 Å²	47	24%	0.239	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	123.8	171.9	-55	0	0	0	0	109.8	M64 T86 R88	M64-T93 HydrophobicContact CB-CG2 4.25Å; T86-T93 HydrophobicContact CG2-CG2 3.29Å; R88-T93 PolarHBondContact NH1-OG1 2.95Å
94	K	91.7	Very high	87.9	Confident	87 Å²	87	46.5 Å²	46.5	38%	0.378	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	140.1	176.4	-58.2	-64.6	-176.1	-179.6	0	109.8	T86 L87 K89 L137	T86-K94 WeakPolarHBondContact CA-O 3.49Å; L87-K94 HydrophobicContact CG-CB 4.28Å; L87-K94 PolarHBondContact N-O 3.14Å; L87-K94 PolarHBondContact O-N 3.32Å; K89-K94 HydrophobicContact CB-CG 4.39Å; K94-L137 HydrophobicContact CB-CD2 4.21Å; K94-L137 HydrophobicContact CD-CD2 4.3Å; K94-L137 HydrophobicContact CG-CD2 3.85Å
95	L	90.6	Very high	87.6	Confident	64 Å²	64	47.2 Å²	47.2	34%	0.335	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	126.9	177.2	-62.5	171.9	0	0	0	108.7	T84 L85 T86	T84-L95 HydrophobicContact CG2-CB 4.25Å; T84-L95 HydrophobicContact CG2-CD2 3.87Å; L85-L95 WeakPolarHBondContact O-CA 3.48Å; T86-L95 HydrophobicContact CG2-CD2 3.65Å; T86-L95 VanDerWaalsContact OG1-CD2 3.24Å; T86-L95 WeakPolarHBondContact OG1-CD2 3.35Å
96	V	90.7	Very high	87.2	Confident	8 Å²	8	47.2 Å²	47.2	5%	0.048	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	128	175.7	-177.9	0	0	0	0	107.8	L85 L87 L107 F133 L137	L85-V96 HydrophobicContact CB-CB 4.25Å; L85-V96 HydrophobicContact CD2-CB 4.44Å; L85-V96 PolarHBondContact N-O 3.13Å; L85-V96 PolarHBondContact O-N 2.84Å; L87-V96 HydrophobicContact CD2-CG2 3.93Å; V96-L107 HydrophobicContact CG1-CD1 4.49Å; V96-L107 HydrophobicContact CG1-CD2 3.96Å; V96-F133 HydrophobicContact CG1-CE1 4Å; V96-L137 HydrophobicContact CG2-CD1 3.86Å
97	K	90.6	Very high	86.8	Confident	63 Å²	63	47.3 Å²	47.3	27%	0.274	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	130.5	176	-162.7	173.2	-169.6	-153.4	0	109.1	S79 D82 Y99	S79-K97 PolarHBondContact OG-NZ 2.92Å; D82-K97 WeakPolarHBondContact OD2-CE 3.39Å; D82-K97 IonicContact OD2-NZ 2.69Å; D82-K97 PolarHBondContact OD2-NZ 2.82Å; K97-Y99 HydrophobicContact CB-CE2 4.05Å; K97-Y99 HydrophobicContact CD-CD1 4.37Å; K97-Y99 HydrophobicContact CD-CE1 3.71Å; K97-Y99 HydrophobicContact CD-CE2 4.34Å; K97-Y99 HydrophobicContact CG-CE1 4.3Å; K97-Y99 HydrophobicContact CG-CE2 4.22Å
98	I	90.5	Very high	86.1	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	120	170.4	-57.1	170.9	0	0	0	106.3	I74 D82 Y83 L85 F105 L107 L118 L121	I74-I98 HydrophobicContact CD1-CD1 3.75Å; I74-I98 HydrophobicContact CG1-CD1 4.25Å; I74-I98 HydrophobicContact CG2-CD1 4.19Å; D82-I98 CarbonylContact C-O 3.59Å; D82-I98 WeakPolarHBondContact CA-O 3.24Å; D82-I98 WeakPolarHBondContact CB-O 3.43Å; Y83-I98 PolarHBondContact N-O 2.97Å; Y83-I98 PolarHBondContact O-N 3.03Å; L85-I98 HydrophobicContact CB-CD1 3.9Å; L85-I98 HydrophobicContact CB-CG1 4.18Å; I98-F105 HydrophobicContact CG2-CB 3.97Å; I98-F105 HydrophobicContact CG2-CD1 4.11Å; I98-F105 HydrophobicContact CG2-CG 4.45Å; I98-L107 HydrophobicContact CG1-CD2 3.83Å; I98-L118 HydrophobicContact CD1-CD2 4.06Å; I98-L118 HydrophobicContact CG2-CD2 3.93Å; I98-L121 HydrophobicContact CD1-CD1 4.37Å; I98-L121 HydrophobicContact CD1-CD2 4.34Å; I98-L121 HydrophobicContact CG1-CD1 4.46Å; I98-L121 HydrophobicContact CG2-CD1 3.92Å
99	Y	89.6	Confident	85.3	Confident	66 Å²	66	51.4 Å²	51.4	26%	0.259	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	127	179.7	-64.5	-88.7	0	0	0	109.5	D82 K97 F105 G106 P109	D82-Y99 WeakPolarHBondContact OD1-CA 3.35Å; K97-Y99 HydrophobicContact CB-CE2 4.05Å; K97-Y99 HydrophobicContact CD-CD1 4.37Å; K97-Y99 HydrophobicContact CD-CE1 3.71Å; K97-Y99 HydrophobicContact CD-CE2 4.34Å; K97-Y99 HydrophobicContact CG-CE1 4.3Å; K97-Y99 HydrophobicContact CG-CE2 4.22Å; Y99-F105 WeakPolarHBondContact O-CA 3.26Å; Y99-G106 PolarHBondContact N-O 2.99Å; Y99-G106 PolarHBondContact O-N 2.9Å; Y99-P109 HydrophobicContact CD1-CB 4.25Å; Y99-P109 HydrophobicContact CD2-CB 4.37Å; Y99-P109 HydrophobicContact CE1-CB 3.97Å; Y99-P109 HydrophobicContact CE2-CB 4.15Å; Y99-P109 HydrophobicContact CE2-CG 4.36Å; Y99-P109 HydrophobicContact CG-CB 4.41Å
100	G	83.5	Confident	84.6	Confident	25 Å²	25	56.5 Å²	56.5	26%	0.258	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	124.4	177	0	0	0	0	0	110.9	G81 D82 C104	G81-G100 WeakPolarHBondContact O-CA 3.35Å; D82-G100 PolarHBondContact OD1-N 3.12Å; G100-C104 CarbonylContact C-O 3.55Å; G100-C104 WeakPolarHBondContact CA-O 3.25Å
101	K	80.9	Confident	83.9	Confident	126 Å²	126	54.7 Å²	54.7	55%	0.548	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	131.2	174.1	-170.3	-176	173.8	-175.5	0	110.5	G103 C104 T112	K101-G103 PolarHBondContact O-N 3.42Å; K101-G103 VanDerWaalsContact O-N 3.15Å; K101-C104 PolarHBondContact N-O 2.97Å; K101-C104 PolarHBondContact O-N 3.27Å; K101-T112 HydrophobicContact CB-CG2 4.21Å; K101-T112 WeakPolarHBondContact CB-OG1 3.48Å
102	D	74.7	Confident	83.3	Confident	149 Å²	149	53 Å²	53	80%	0.797	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	33.1	176.5	-55.8	-39.5	0	0	0	114	C104	D102-C104 VanDerWaalsContact C-N 3.26Å; D102-C104 PolarHBondContact O-N 3.43Å
103	G	72.2	Confident	82.6	Confident	46 Å²	46	55.6 Å²	55.6	47%	0.474	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.2	-3	-177.8	0	0	0	0	0	114.8	K101	K101-G103 PolarHBondContact O-N 3.42Å; K101-G103 VanDerWaalsContact O-N 3.15Å
104	C	79.7	Confident	81.9	Confident	35 Å²	35	57 Å²	57	24%	0.236	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	153.3	175.2	-61.5	0	0	0	0	111.7	G100 K101 D102 T112 F115	G100-C104 CarbonylContact C-O 3.55Å; G100-C104 WeakPolarHBondContact CA-O 3.25Å; K101-C104 PolarHBondContact N-O 2.97Å; K101-C104 PolarHBondContact O-N 3.27Å; D102-C104 VanDerWaalsContact C-N 3.26Å; D102-C104 PolarHBondContact O-N 3.43Å; C104-T112 CarbonylContact C-O 3.49Å; C104-T112 VanDerWaalsContact C-O 3.27Å; C104-T112 WeakPolarHBondContact CB-O 3.18Å; C104-F115 CarbonylContact C-O 3.53Å; C104-F115 WeakPolarHBondContact CA-O 3.44Å
105	F	86	Confident	81.5	Confident	27 Å²	27	53.3 Å²	53.3	12%	0.118	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	140.9	-178.6	-59.3	-76.3	0	0	0	111	Y83 I98 Y99 T112 F115 L118 L121	Y83-F105 HydrophobicContact CD2-CD1 4.23Å; Y83-F105 AromaticContact CD2-CE1 3.81Å; Y83-F105 HydrophobicContact CD2-CE1 3.81Å; Y83-F105 HydrophobicContact CE2-CD1 4.4Å; Y83-F105 AromaticContact CE2-CE1 3.54Å; Y83-F105 HydrophobicContact CE2-CE1 3.54Å; Y83-F105 HydrophobicContact CE2-CZ 4.11Å; I98-F105 HydrophobicContact CG2-CB 3.97Å; I98-F105 HydrophobicContact CG2-CD1 4.11Å; I98-F105 HydrophobicContact CG2-CG 4.45Å; Y99-F105 WeakPolarHBondContact O-CA 3.26Å; F105-T112 CarbonylContact C-O 3.6Å; F105-T112 WeakPolarHBondContact CA-O 3.48Å; F105-T112 PolarHBondContact N-O 3.42Å; F105-T112 VanDerWaalsContact N-O 3.1Å; F105-T112 VanDerWaalsContact O-O 3.1Å; F105-F115 HydrophobicContact CB-CB 4.5Å; F105-F115 PolarHBondContact N-O 3.15Å; F105-F115 WeakPolarHBondContact O-CB 3.38Å; F105-F115 WeakPolarHBondContact O-CD2 3.1Å; F105-F115 PolarHBondContact O-N 2.85Å; F105-L118 HydrophobicContact CB-CD2 4.26Å; F105-L118 HydrophobicContact CD1-CD2 3.74Å; F105-L118 HydrophobicContact CD1-CG 4.3Å; F105-L118 HydrophobicContact CD2-CD2 4.27Å; F105-L118 HydrophobicContact CD2-CG 4.3Å; F105-L118 HydrophobicContact CE1-CD2 4.17Å; F105-L118 HydrophobicContact CE1-CG 4.31Å; F105-L118 HydrophobicContact CE2-CG 4.28Å; F105-L118 HydrophobicContact CG-CD2 3.79Å; F105-L118 HydrophobicContact CG-CG 4.29Å; F105-L118 HydrophobicContact CZ-CG 4.28Å; F105-L121 HydrophobicContact CB-CD1 4.23Å
106	G	85.6	Confident	81.1	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	162.1	173.5	0	0	0	0	0	112.3	Y99	Y99-G106 PolarHBondContact N-O 2.99Å; Y99-G106 PolarHBondContact O-N 2.9Å
107	L	84.5	Confident	80.6	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.01	33%	0.332	C	S	.	.	S	Bend	trans	-87.1	-15.6	177	-57.5	-174.5	0	0	0	112.5	V96 I98 L121 Y125 L130 F133	V96-L107 HydrophobicContact CG1-CD1 4.49Å; V96-L107 HydrophobicContact CG1-CD2 3.96Å; I98-L107 HydrophobicContact CG1-CD2 3.83Å; L107-L121 HydrophobicContact CD2-CD1 4.22Å; L107-Y125 HydrophobicContact CD1-CD2 4.43Å; L107-Y125 HydrophobicContact CD1-CE1 4.26Å; L107-Y125 HydrophobicContact CD1-CE2 3.64Å; L107-Y125 WeakPolarHBondContact CD1-OH 3.4Å; L107-Y125 HydrophobicContact CG-CE2 4.12Å; L107-L130 HydrophobicContact CD1-CD2 3.53Å; L107-F133 HydrophobicContact CB-CD1 4.43Å; L107-F133 HydrophobicContact CB-CD2 3.65Å; L107-F133 HydrophobicContact CB-CE1 4.45Å; L107-F133 HydrophobicContact CB-CE2 3.68Å; L107-F133 HydrophobicContact CB-CG 4.05Å; L107-F133 HydrophobicContact CB-CZ 4.08Å; L107-F133 HydrophobicContact CD1-CB 4.16Å; L107-F133 HydrophobicContact CD1-CD1 4.23Å; L107-F133 HydrophobicContact CD1-CD2 4.45Å; L107-F133 HydrophobicContact CD1-CG 4.02Å; L107-F133 WeakPolarHBondContact O-CE2 3.05Å; L107-F133 WeakPolarHBondContact O-CZ 3.25Å
108	S	80.1	Confident	80.2	Confident	31 Å²	31	53.4 Å²	53.4	22%	0.217	32%	0.32	C	S	.	.	B	Isolated β-bridge	trans	-102.3	136.8	176.3	-176	0	0	0	0	110.7	T110 D111	S108-T110 PolarHBondContact O-N 2.68Å; S108-T110 PolarHBondContact OG-N 2.97Å; S108-T110 PolarHBondContact OG-OG1 2.89Å; S108-D111 CarbonylContact O-C 3.55Å; S108-D111 PolarHBondContact O-N 2.71Å
109	P	76.4	Confident	79.9	Confident	84 Å²	84	54.7 Å²	54.7	55%	0.545	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-22.3	174.5	24.9	-32.4	0	0	0	113.4	Y99	Y99-P109 HydrophobicContact CD1-CB 4.25Å; Y99-P109 HydrophobicContact CD2-CB 4.37Å; Y99-P109 HydrophobicContact CE1-CB 3.97Å; Y99-P109 HydrophobicContact CE2-CB 4.15Å; Y99-P109 HydrophobicContact CE2-CG 4.36Å; Y99-P109 HydrophobicContact CG-CB 4.41Å
110	T	74.7	Confident	79.6	Confident	131 Å²	131	56.2 Å²	56.2	80%	0.804	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-19.1	179.4	52.8	0	0	0	0	113.7	S108	S108-T110 PolarHBondContact O-N 2.68Å; S108-T110 PolarHBondContact OG-N 2.97Å; S108-T110 PolarHBondContact OG-OG1 2.89Å
111	D	74.2	Confident	79.9	Confident	79 Å²	79	55 Å²	55	42%	0.422	33%	0.325	S	S	.	.	B	Isolated β-bridge	trans	-136.1	75	-175.7	-172.5	12.2	0	0	0	110	S108 S113 Q114	S108-D111 CarbonylContact O-C 3.55Å; S108-D111 PolarHBondContact O-N 2.71Å; D111-S113 VanDerWaalsContact C-N 3.28Å; D111-Q114 PolarHBondContact O-NE2 3.22Å
112	T	73.9	Confident	80.2	Confident	14 Å²	14	49.3 Å²	49.3	9%	0.086	30%	0.301	C	S	.	.			trans	-83.1	-7.1	176.6	56	0	0	0	0	112.6	K101 C104 F105 Q114	K101-T112 HydrophobicContact CB-CG2 4.21Å; K101-T112 WeakPolarHBondContact CB-OG1 3.48Å; C104-T112 CarbonylContact C-O 3.49Å; C104-T112 VanDerWaalsContact C-O 3.27Å; C104-T112 WeakPolarHBondContact CB-O 3.18Å; F105-T112 CarbonylContact C-O 3.6Å; F105-T112 WeakPolarHBondContact CA-O 3.48Å; F105-T112 PolarHBondContact N-O 3.42Å; F105-T112 VanDerWaalsContact N-O 3.1Å; F105-T112 VanDerWaalsContact O-O 3.1Å; T112-Q114 PolarHBondContact O-N 3.49Å
113	S	73.5	Confident	80.6	Confident	91 Å²	91	46.6 Å²	46.6	64%	0.636	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	18.3	-173.1	-60.5	0	0	0	0	113.3	D111	D111-S113 VanDerWaalsContact C-N 3.28Å
114	Q	76.6	Confident	81.3	Confident	70 Å²	70	48 Å²	48	33%	0.327	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-37.5	-176.4	-68.4	176.5	60.3	0	0	112.7	D111 T112	D111-Q114 PolarHBondContact O-NE2 3.22Å; T112-Q114 PolarHBondContact O-N 3.49Å
115	F	83.7	Confident	81.8	Confident	9 Å²	9	46.7 Å²	46.7	4%	0.039	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-133.7	136.3	-173.7	-53.4	-77.1	0	0	0	111.1	C104 F105 S117 H120 L121 F124 Y125	C104-F115 CarbonylContact C-O 3.53Å; C104-F115 WeakPolarHBondContact CA-O 3.44Å; F105-F115 HydrophobicContact CB-CB 4.5Å; F105-F115 PolarHBondContact N-O 3.15Å; F105-F115 WeakPolarHBondContact O-CB 3.38Å; F105-F115 WeakPolarHBondContact O-CD2 3.1Å; F105-F115 PolarHBondContact O-N 2.85Å; F115-S117 VanDerWaalsContact C-N 3.33Å; F115-H120 AromaticContact CD1-ND1 3.57Å; F115-L121 HydrophobicContact CB-CB 4.01Å; F115-L121 HydrophobicContact CD1-CB 4.2Å; F115-L121 HydrophobicContact CD2-CB 3.84Å; F115-L121 HydrophobicContact CD2-CD1 3.75Å; F115-L121 HydrophobicContact CD2-CG 3.8Å; F115-L121 HydrophobicContact CE2-CB 4.42Å; F115-L121 HydrophobicContact CE2-CD1 4.23Å; F115-L121 HydrophobicContact CE2-CG 4.06Å; F115-L121 HydrophobicContact CG-CB 3.73Å; F115-L121 HydrophobicContact CG-CD1 4.43Å; F115-L121 HydrophobicContact CG-CG 4.23Å; F115-F124 HydrophobicContact CD1-CB 4.35Å; F115-F124 HydrophobicContact CE1-CB 3.52Å; F115-F124 AromaticContact CE1-CD1 3.72Å; F115-F124 HydrophobicContact CE1-CD1 3.72Å; F115-F124 HydrophobicContact CE1-CD2 4.17Å; F115-F124 HydrophobicContact CE1-CE1 4.48Å; F115-F124 AromaticContact CE1-CG 3.53Å; F115-F124 HydrophobicContact CE1-CG 3.53Å; F115-F124 HydrophobicContact CZ-CB 4.16Å; F115-F124 AromaticContact CZ-CD1 3.56Å; F115-F124 HydrophobicContact CZ-CD1 3.56Å; F115-F124 HydrophobicContact CZ-CE1 4.1Å; F115-F124 AromaticContact CZ-CG 3.91Å; F115-F124 HydrophobicContact CZ-CG 3.91Å; F115-Y125 AromaticContact CE2-CE2 3.67Å; F115-Y125 HydrophobicContact CE2-CE2 3.67Å; F115-Y125 HydrophobicContact CZ-CD2 4.37Å; F115-Y125 AromaticContact CZ-CE2 3.66Å; F115-Y125 HydrophobicContact CZ-CE2 3.66Å
116	S	81.8	Confident	82	Confident	91 Å²	91	47.7 Å²	47.7	64%	0.636	28%	0.28	S	S	*	.	S	Bend	trans	-82.9	-6.9	177.2	52.8	0	0	0	0	113.9
117	S	79.5	Confident	81.9	Confident	42 Å²	42	52.5 Å²	52.5	29%	0.294	31%	0.31	S	S	.	.	S	Bend	trans	-157.6	158.4	174.4	73.9	0	0	0	0	111.4	F115 V119 H120 L121	F115-S117 VanDerWaalsContact C-N 3.33Å; S117-V119 PolarHBondContact O-N 2.73Å; S117-V119 PolarHBondContact OG-N 3.32Å; S117-H120 PolarHBondContact O-N 2.82Å; S117-H120 PolarHBondContact OG-N 2.83Å; S117-L121 PolarHBondContact O-N 2.84Å; S117-L121 VanDerWaalsContact O-N 3.15Å
118	L	83.5	Confident	82	Confident	3 Å²	3	56.9 Å²	56.9	2%	0.016	33%	0.33	C	S	.	.	H	α-helix	trans	-61.3	-29.8	171.7	-70.5	-177.5	0	0	0	112.3	I43 W50 F51 I74 Y83 I98 F105 L121 V122	I43-L118 HydrophobicContact CD1-CB 4.49Å; I43-L118 HydrophobicContact CD1-CD1 3.62Å; I43-L118 HydrophobicContact CD1-CG 4.33Å; W50-L118 HydrophobicContact CH2-CB 4.11Å; W50-L118 HydrophobicContact CZ3-CB 4.49Å; F51-L118 HydrophobicContact CD2-CD1 4.29Å; F51-L118 HydrophobicContact CE2-CD1 3.93Å; I74-L118 HydrophobicContact CG2-CD1 4.16Å; Y83-L118 HydrophobicContact CD1-CD1 3.94Å; Y83-L118 HydrophobicContact CD2-CD1 3.79Å; Y83-L118 HydrophobicContact CD2-CD2 4.04Å; Y83-L118 HydrophobicContact CD2-CG 4.34Å; Y83-L118 HydrophobicContact CE1-CD1 4Å; Y83-L118 HydrophobicContact CE2-CD1 3.85Å; Y83-L118 HydrophobicContact CE2-CG 4.46Å; Y83-L118 HydrophobicContact CG-CD1 3.82Å; Y83-L118 HydrophobicContact CG-CD2 4.36Å; I98-L118 HydrophobicContact CD1-CD2 4.06Å; I98-L118 HydrophobicContact CG2-CD2 3.93Å; F105-L118 HydrophobicContact CB-CD2 4.26Å; F105-L118 HydrophobicContact CD1-CD2 3.74Å; F105-L118 HydrophobicContact CD1-CG 4.3Å; F105-L118 HydrophobicContact CD2-CD2 4.27Å; F105-L118 HydrophobicContact CD2-CG 4.3Å; F105-L118 HydrophobicContact CE1-CD2 4.17Å; F105-L118 HydrophobicContact CE1-CG 4.31Å; F105-L118 HydrophobicContact CE2-CG 4.28Å; F105-L118 HydrophobicContact CG-CD2 3.79Å; F105-L118 HydrophobicContact CG-CG 4.29Å; F105-L118 HydrophobicContact CZ-CG 4.28Å; L118-L121 WeakPolarHBondContact O-CB 3.28Å; L118-L121 PolarHBondContact O-N 3.46Å; L118-V122 WeakPolarHBondContact O-CG2 3.24Å; L118-V122 PolarHBondContact O-N 3.36Å
119	V	83.6	Confident	82.4	Confident	27 Å²	27	57 Å²	57	16%	0.164	33%	0.331	C	S	.	.	H	α-helix	trans	-65.8	-49	178.1	-175.2	0	0	0	0	109.9	Y48 W50 S117 L121 V122 D123	Y48-V119 HydrophobicContact CD1-CG1 4.38Å; Y48-V119 HydrophobicContact CD1-CG2 4.15Å; Y48-V119 HydrophobicContact CD2-CG2 4.09Å; Y48-V119 HydrophobicContact CE1-CB 4.19Å; Y48-V119 HydrophobicContact CE1-CG1 3.52Å; Y48-V119 HydrophobicContact CE1-CG2 3.57Å; Y48-V119 HydrophobicContact CE2-CG2 3.51Å; Y48-V119 HydrophobicContact CG-CG2 4.39Å; Y48-V119 WeakPolarHBondContact OH-CG2 3.19Å; W50-V119 HydrophobicContact CZ2-CG2 4.4Å; S117-V119 PolarHBondContact O-N 2.73Å; S117-V119 PolarHBondContact OG-N 3.32Å; V119-L121 VanDerWaalsContact C-N 3.26Å; V119-L121 PolarHBondContact O-N 3.34Å; V119-V122 PolarHBondContact O-N 3.36Å; V119-V122 VanDerWaalsContact O-N 3.1Å; V119-D123 WeakPolarHBondContact O-CB 3.45Å; V119-D123 PolarHBondContact O-N 3.33Å
120	H	83.8	Confident	82.9	Confident	98 Å²	98	53 Å²	53	45%	0.454	31%	0.305	S	S	.	.	H	α-helix	trans	-63.5	-34.9	178.3	-165.2	-107.3	0	0	0	111.9	F115 S117 F124	F115-H120 AromaticContact CD1-ND1 3.57Å; S117-H120 PolarHBondContact O-N 2.82Å; S117-H120 PolarHBondContact OG-N 2.83Å; H120-F124 VanDerWaalsContact O-CB 3.26Å; H120-F124 WeakPolarHBondContact O-CB 3.4Å; H120-F124 PolarHBondContact O-N 3.2Å
121	L	88.5	Confident	83.4	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-61.3	-48.7	171.8	-177.4	155.7	0	0	0	111.3	I98 F105 L107 F115 S117 L118 V119 F124 Y125	I98-L121 HydrophobicContact CD1-CD1 4.37Å; I98-L121 HydrophobicContact CD1-CD2 4.34Å; I98-L121 HydrophobicContact CG1-CD1 4.46Å; I98-L121 HydrophobicContact CG2-CD1 3.92Å; F105-L121 HydrophobicContact CB-CD1 4.23Å; L107-L121 HydrophobicContact CD2-CD1 4.22Å; F115-L121 HydrophobicContact CB-CB 4.01Å; F115-L121 HydrophobicContact CD1-CB 4.2Å; F115-L121 HydrophobicContact CD2-CB 3.84Å; F115-L121 HydrophobicContact CD2-CD1 3.75Å; F115-L121 HydrophobicContact CD2-CG 3.8Å; F115-L121 HydrophobicContact CE2-CB 4.42Å; F115-L121 HydrophobicContact CE2-CD1 4.23Å; F115-L121 HydrophobicContact CE2-CG 4.06Å; F115-L121 HydrophobicContact CG-CB 3.73Å; F115-L121 HydrophobicContact CG-CD1 4.43Å; F115-L121 HydrophobicContact CG-CG 4.23Å; S117-L121 PolarHBondContact O-N 2.84Å; S117-L121 VanDerWaalsContact O-N 3.15Å; L118-L121 WeakPolarHBondContact O-CB 3.28Å; L118-L121 PolarHBondContact O-N 3.46Å; V119-L121 VanDerWaalsContact C-N 3.26Å; V119-L121 PolarHBondContact O-N 3.34Å; L121-F124 PolarHBondContact O-N 3Å; L121-Y125 HydrophobicContact CD2-CD2 3.9Å; L121-Y125 HydrophobicContact CD2-CE2 4.37Å; L121-Y125 HydrophobicContact CG-CD2 3.97Å; L121-Y125 HydrophobicContact CG-CE2 4.08Å; L121-Y125 VanDerWaalsContact O-CD2 3.25Å; L121-Y125 WeakPolarHBondContact O-CD2 3.48Å; L121-Y125 PolarHBondContact O-N 3.43Å
122	V	87	Confident	83.6	Confident	7 Å²	7	51.4 Å²	51.4	4%	0.042	30%	0.3	C	S	.	.	H	α-helix	trans	-64	-46.1	179.2	169.9	0	0	0	0	111.1	W50 F72 I74 L118 V119 F124 Y125 S126 L141	W50-V122 HydrophobicContact CD2-CG2 4.19Å; W50-V122 HydrophobicContact CE3-CG2 4.17Å; W50-V122 HydrophobicContact CH2-CG2 3.82Å; W50-V122 HydrophobicContact CZ2-CB 4.06Å; W50-V122 HydrophobicContact CZ2-CG1 4.32Å; W50-V122 HydrophobicContact CZ2-CG2 3.79Å; W50-V122 HydrophobicContact CZ3-CG2 4.02Å; F72-V122 HydrophobicContact CE2-CG1 3.67Å; F72-V122 HydrophobicContact CE2-CG2 4.04Å; F72-V122 HydrophobicContact CZ-CG1 3.58Å; I74-V122 HydrophobicContact CD1-CG2 3.58Å; L118-V122 WeakPolarHBondContact O-CG2 3.24Å; L118-V122 PolarHBondContact O-N 3.36Å; V119-V122 PolarHBondContact O-N 3.36Å; V119-V122 VanDerWaalsContact O-N 3.1Å; V122-F124 VanDerWaalsContact C-N 3.32Å; V122-F124 PolarHBondContact O-N 2.82Å; V122-Y125 CarbonylContact O-C 3.56Å; V122-Y125 PolarHBondContact O-N 3.1Å; V122-S126 WeakPolarHBondContact O-CB 3.25Å; V122-S126 PolarHBondContact O-N 3.15Å; V122-L141 HydrophobicContact CG1-CD1 4.49Å; V122-L141 HydrophobicContact CG2-CD1 4.37Å
123	D	83.9	Confident	83.8	Confident	92 Å²	92	54.9 Å²	54.9	49%	0.492	32%	0.315	S	S	.	.	H	α-helix	trans	-60.7	-42	178.7	-70.8	-17.9	0	0	0	111.2	V119 S126	V119-D123 WeakPolarHBondContact O-CB 3.45Å; V119-D123 PolarHBondContact O-N 3.33Å; D123-S126 PolarHBondContact O-N 2.8Å; D123-S126 PolarHBondContact O-OG 2.99Å
124	F	87.7	Confident	84.2	Confident	76 Å²	76	53.7 Å²	53.7	33%	0.333	30%	0.301	S	S	.	.	H	α-helix	trans	-61.9	-52.7	175.4	-178.2	-95.5	0	0	0	111.8	F115 H120 L121 V122 S126 T127 H128	F115-F124 HydrophobicContact CD1-CB 4.35Å; F115-F124 HydrophobicContact CE1-CB 3.52Å; F115-F124 AromaticContact CE1-CD1 3.72Å; F115-F124 HydrophobicContact CE1-CD1 3.72Å; F115-F124 HydrophobicContact CE1-CD2 4.17Å; F115-F124 HydrophobicContact CE1-CE1 4.48Å; F115-F124 AromaticContact CE1-CG 3.53Å; F115-F124 HydrophobicContact CE1-CG 3.53Å; F115-F124 HydrophobicContact CZ-CB 4.16Å; F115-F124 AromaticContact CZ-CD1 3.56Å; F115-F124 HydrophobicContact CZ-CD1 3.56Å; F115-F124 HydrophobicContact CZ-CE1 4.1Å; F115-F124 AromaticContact CZ-CG 3.91Å; F115-F124 HydrophobicContact CZ-CG 3.91Å; H120-F124 VanDerWaalsContact O-CB 3.26Å; H120-F124 WeakPolarHBondContact O-CB 3.4Å; H120-F124 PolarHBondContact O-N 3.2Å; L121-F124 PolarHBondContact O-N 3Å; V122-F124 VanDerWaalsContact C-N 3.32Å; V122-F124 PolarHBondContact O-N 2.82Å; F124-S126 PolarHBondContact O-N 3.04Å; F124-T127 PolarHBondContact O-N 3Å; F124-T127 PolarHBondContact O-OG1 2.69Å; F124-T127 VanDerWaalsContact O-OG1 3.14Å; F124-H128 HydrophobicContact CD1-CB 4.07Å; F124-H128 AromaticContact CD2-ND1 3.71Å; F124-H128 HydrophobicContact CE1-CB 3.73Å; F124-H128 AromaticContact CE1-CG 3.93Å; F124-H128 AromaticContact CE2-CE1 3.8Å; F124-H128 AromaticContact CE2-CG 3.82Å; F124-H128 AromaticContact CE2-ND1 3.68Å; F124-H128 HydrophobicContact CZ-CB 3.97Å; F124-H128 AromaticContact CZ-CD2 3.89Å; F124-H128 AromaticContact CZ-CG 3.67Å; F124-H128 WeakPolarHBondContact O-CB 3.36Å; F124-H128 PolarHBondContact O-N 2.83Å; F124-H128 PolarHBondContact O-ND1 2.98Å
125	Y	90.6	Very high	84.6	Confident	6 Å²	6	56.9 Å²	56.9	2%	0.024	32%	0.316	C	S	.	.	H	α-helix	trans	-76.6	-4.1	-178.5	-72.2	-66.7	0	0	0	114.3	L107 F115 L121 V122 T127 H128 L130 V140 L141	L107-Y125 HydrophobicContact CD1-CD2 4.43Å; L107-Y125 HydrophobicContact CD1-CE1 4.26Å; L107-Y125 HydrophobicContact CD1-CE2 3.64Å; L107-Y125 WeakPolarHBondContact CD1-OH 3.4Å; L107-Y125 HydrophobicContact CG-CE2 4.12Å; F115-Y125 AromaticContact CE2-CE2 3.67Å; F115-Y125 HydrophobicContact CE2-CE2 3.67Å; F115-Y125 HydrophobicContact CZ-CD2 4.37Å; F115-Y125 AromaticContact CZ-CE2 3.66Å; F115-Y125 HydrophobicContact CZ-CE2 3.66Å; L121-Y125 HydrophobicContact CD2-CD2 3.9Å; L121-Y125 HydrophobicContact CD2-CE2 4.37Å; L121-Y125 HydrophobicContact CG-CD2 3.97Å; L121-Y125 HydrophobicContact CG-CE2 4.08Å; L121-Y125 VanDerWaalsContact O-CD2 3.25Å; L121-Y125 WeakPolarHBondContact O-CD2 3.48Å; L121-Y125 PolarHBondContact O-N 3.43Å; V122-Y125 CarbonylContact O-C 3.56Å; V122-Y125 PolarHBondContact O-N 3.1Å; Y125-T127 VanDerWaalsContact C-N 3.31Å; Y125-H128 CarbonylContact C-O 3.43Å; Y125-H128 WeakPolarHBondContact CA-O 3.49Å; Y125-L130 HydrophobicContact CD1-CD2 3.55Å; Y125-L130 HydrophobicContact CD1-CG 3.88Å; Y125-L130 HydrophobicContact CD2-CD2 4.31Å; Y125-L130 HydrophobicContact CE1-CD2 3.69Å; Y125-L130 HydrophobicContact CE1-CG 4.36Å; Y125-L130 HydrophobicContact CE2-CD2 4.45Å; Y125-L130 HydrophobicContact CG-CD2 3.9Å; Y125-L130 HydrophobicContact CG-CG 4.35Å; Y125-V140 WeakPolarHBondContact O-CA 3.33Å; Y125-L141 PolarHBondContact O-N 2.76Å
126	S	88.2	Confident	84.5	Confident	49 Å²	49	60 Å²	60	34%	0.343	34%	0.339	S	S	.	.	H	α-helix	trans	-71.4	-29.9	168.8	78	0	0	0	0	112.2	V122 D123 F124 L141	V122-S126 WeakPolarHBondContact O-CB 3.25Å; V122-S126 PolarHBondContact O-N 3.15Å; D123-S126 PolarHBondContact O-N 2.8Å; D123-S126 PolarHBondContact O-OG 2.99Å; F124-S126 PolarHBondContact O-N 3.04Å; S126-L141 WeakPolarHBondContact CA-O 3.17Å; S126-L141 WeakPolarHBondContact CB-O 3.35Å
127	T	83.8	Confident	84.7	Confident	101 Å²	101	56.3 Å²	56.3	62%	0.62	31%	0.312	S	S	*	.	H	α-helix	trans	-109.1	-27.1	179.6	51.6	0	0	0	0	112.6	F124 Y125	F124-T127 PolarHBondContact O-N 3Å; F124-T127 PolarHBondContact O-OG1 2.69Å; F124-T127 VanDerWaalsContact O-OG1 3.14Å; Y125-T127 VanDerWaalsContact C-N 3.31Å
128	H	86.8	Confident	85	Confident	94 Å²	94	58.7 Å²	58.7	44%	0.435	32%	0.321	S	S	.	.	S	Bend	trans	-104.3	129.5	-179.6	-61.5	79	0	0	0	111.4	F124 Y125	F124-H128 HydrophobicContact CD1-CB 4.07Å; F124-H128 AromaticContact CD2-ND1 3.71Å; F124-H128 HydrophobicContact CE1-CB 3.73Å; F124-H128 AromaticContact CE1-CG 3.93Å; F124-H128 AromaticContact CE2-CE1 3.8Å; F124-H128 AromaticContact CE2-CG 3.82Å; F124-H128 AromaticContact CE2-ND1 3.68Å; F124-H128 HydrophobicContact CZ-CB 3.97Å; F124-H128 AromaticContact CZ-CD2 3.89Å; F124-H128 AromaticContact CZ-CG 3.67Å; F124-H128 WeakPolarHBondContact O-CB 3.36Å; F124-H128 PolarHBondContact O-N 2.83Å; F124-H128 PolarHBondContact O-ND1 2.98Å; Y125-H128 CarbonylContact C-O 3.43Å; Y125-H128 WeakPolarHBondContact CA-O 3.49Å
129	S	89.1	Confident	85.3	Confident	33 Å²	33	59.5 Å²	59.5	23%	0.231	33%	0.325	C	S	.	.			trans	-66.4	136.9	179.3	179.4	0	0	0	0	111.7	K131 A132 N138 I139	S129-K131 PolarHBondContact O-N 3.26Å; S129-K131 VanDerWaalsContact OG-CB 3.3Å; S129-K131 WeakPolarHBondContact OG-CB 3.35Å; S129-K131 PolarHBondContact OG-N 2.84Å; S129-K131 VanDerWaalsContact OG-N 3.15Å; S129-A132 PolarHBondContact O-N 3.31Å; S129-N138 WeakPolarHBondContact OG-CA 3.48Å; S129-N138 PolarHBondContact OG-OD1 3.26Å; S129-I139 PolarHBondContact OG-N 2.93Å
130	L	86.8	Confident	85.7	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-61.1	-5.8	169.7	-75.4	162.5	0	0	0	113.2	L87 L107 Y125 A132 F133 N134 L137 I139 L141	L87-L130 HydrophobicContact CD1-CD1 4.25Å; L87-L130 HydrophobicContact CD2-CD1 4.16Å; L107-L130 HydrophobicContact CD1-CD2 3.53Å; Y125-L130 HydrophobicContact CD1-CD2 3.55Å; Y125-L130 HydrophobicContact CD1-CG 3.88Å; Y125-L130 HydrophobicContact CD2-CD2 4.31Å; Y125-L130 HydrophobicContact CE1-CD2 3.69Å; Y125-L130 HydrophobicContact CE1-CG 4.36Å; Y125-L130 HydrophobicContact CE2-CD2 4.45Å; Y125-L130 HydrophobicContact CG-CD2 3.9Å; Y125-L130 HydrophobicContact CG-CG 4.35Å; L130-A132 PolarHBondContact O-N 3.3Å; L130-F133 WeakPolarHBondContact O-CB 3.48Å; L130-F133 PolarHBondContact O-N 3.09Å; L130-N134 PolarHBondContact O-N 2.89Å; L130-L137 CarbonylContact C-O 3.22Å; L130-L137 HydrophobicContact CB-CB 4.29Å; L130-L137 WeakPolarHBondContact CB-O 3.49Å; L130-I139 WeakPolarHBondContact CB-O 3.42Å; L130-I139 HydrophobicContact CD1-CG2 4.16Å; L130-I139 PolarHBondContact N-O 3.43Å; L130-L141 HydrophobicContact CD1-CD2 4.11Å
131	K	84.8	Confident	86.1	Confident	83 Å²	83	54.9 Å²	54.9	36%	0.361	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-51.2	-34.9	169.6	-168.1	-177.2	179.1	176.1	0	112.8	S129 F133 N134 H135 L137 N138	S129-K131 PolarHBondContact O-N 3.26Å; S129-K131 VanDerWaalsContact OG-CB 3.3Å; S129-K131 WeakPolarHBondContact OG-CB 3.35Å; S129-K131 PolarHBondContact OG-N 2.84Å; S129-K131 VanDerWaalsContact OG-N 3.15Å; K131-F133 PolarHBondContact O-N 3.38Å; K131-N134 WeakPolarHBondContact CA-O 3.08Å; K131-N134 CarbonylContact O-C 3.6Å; K131-N134 PolarHBondContact O-N 2.86Å; K131-H135 WeakPolarHBondContact CE-CE1 3.32Å; K131-H135 VanDerWaalsContact CE-ND1 3.27Å; K131-H135 WeakPolarHBondContact CE-ND1 3.47Å; K131-H135 WeakPolarHBondContact CE-NE2 3.21Å; K131-H135 PolarHBondContact NZ-CE1 3.34Å; K131-H135 PolarHBondContact NZ-NE2 2.75Å; K131-H135 PolarHBondContact O-N 2.9Å; K131-L137 PolarHBondContact N-O 3.48Å; K131-L137 VanDerWaalsContact N-O 3.16Å; K131-N138 HydrophobicContact CB-CB 4Å; K131-N138 HydrophobicContact CD-CB 4.24Å; K131-N138 HydrophobicContact CG-CB 4.15Å
132	A	79.5	Confident	86	Confident	94 Å²	94	62.9 Å²	62.9	78%	0.777	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-61.4	-31.2	178.3	0	0	0	0	0	112.4	S129 L130	S129-A132 PolarHBondContact O-N 3.31Å; L130-A132 PolarHBondContact O-N 3.3Å
133	F	78.4	Confident	86.1	Confident	87 Å²	87	66.7 Å²	66.7	38%	0.382	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-46.8	174.8	171.7	-107.8	0	0	0	111.8	V96 L107 L130 K131	V96-F133 HydrophobicContact CG1-CE1 4Å; L107-F133 HydrophobicContact CB-CD1 4.43Å; L107-F133 HydrophobicContact CB-CD2 3.65Å; L107-F133 HydrophobicContact CB-CE1 4.45Å; L107-F133 HydrophobicContact CB-CE2 3.68Å; L107-F133 HydrophobicContact CB-CG 4.05Å; L107-F133 HydrophobicContact CB-CZ 4.08Å; L107-F133 HydrophobicContact CD1-CB 4.16Å; L107-F133 HydrophobicContact CD1-CD1 4.23Å; L107-F133 HydrophobicContact CD1-CD2 4.45Å; L107-F133 HydrophobicContact CD1-CG 4.02Å; L107-F133 WeakPolarHBondContact O-CE2 3.05Å; L107-F133 WeakPolarHBondContact O-CZ 3.25Å; L130-F133 WeakPolarHBondContact O-CB 3.48Å; L130-F133 PolarHBondContact O-N 3.09Å; K131-F133 PolarHBondContact O-N 3.38Å
134	N	81.6	Confident	86.2	Confident	65 Å²	65	65.1 Å²	65.1	35%	0.348	35%	0.346	S	S	.	.			trans	-143.2	116.1	179.9	-176	-30.6	0	0	0	109.9	L130 K131 S136 L137	L130-N134 PolarHBondContact O-N 2.89Å; K131-N134 WeakPolarHBondContact CA-O 3.08Å; K131-N134 CarbonylContact O-C 3.6Å; K131-N134 PolarHBondContact O-N 2.86Å; N134-S136 PolarHBondContact O-N 3.34Å; N134-S136 WeakPolarHBondContact OD1-CB 3.43Å; N134-S136 PolarHBondContact OD1-N 2.97Å; N134-S136 PolarHBondContact OD1-OG 3.44Å; N134-L137 HydrophobicContact CB-CB 4.21Å; N134-L137 HydrophobicContact CB-CD1 4.18Å; N134-L137 HydrophobicContact CB-CG 4.21Å; N134-L137 CarbonylContact O-C 3.27Å; N134-L137 WeakPolarHBondContact O-CA 3.37Å; N134-L137 PolarHBondContact O-N 2.89Å
135	H	83.7	Confident	86.1	Confident	138 Å²	138	61.7 Å²	61.7	64%	0.639	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-27.9	-175.9	-152.9	99.9	0	0	0	113.5	K131 L137	K131-H135 WeakPolarHBondContact CE-CE1 3.32Å; K131-H135 VanDerWaalsContact CE-ND1 3.27Å; K131-H135 WeakPolarHBondContact CE-ND1 3.47Å; K131-H135 WeakPolarHBondContact CE-NE2 3.21Å; K131-H135 PolarHBondContact NZ-CE1 3.34Å; K131-H135 PolarHBondContact NZ-NE2 2.75Å; K131-H135 PolarHBondContact O-N 2.9Å; H135-L137 VanDerWaalsContact C-N 3.34Å
136	S	82.5	Confident	85.4	Confident	75 Å²	75	63.3 Å²	63.3	52%	0.524	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-17.1	176.2	74	0	0	0	0	113.8	K89 N134	K89-S136 WeakPolarHBondContact CE-O 3.25Å; K89-S136 PolarHBondContact NZ-O 3.04Å; N134-S136 PolarHBondContact O-N 3.34Å; N134-S136 WeakPolarHBondContact OD1-CB 3.43Å; N134-S136 PolarHBondContact OD1-N 2.97Å; N134-S136 PolarHBondContact OD1-OG 3.44Å
137	L	85.2	Confident	84.6	Confident	13 Å²	13	64 Å²	64	7%	0.068	34%	0.337	C	S	.	.			trans	-102	49.1	175.7	-64.2	-179.6	0	0	0	111	K89 K94 V96 L130 K131 N134 H135 I139	K89-L137 HydrophobicContact CD-CD2 4.04Å; K94-L137 HydrophobicContact CB-CD2 4.21Å; K94-L137 HydrophobicContact CD-CD2 4.3Å; K94-L137 HydrophobicContact CG-CD2 3.85Å; V96-L137 HydrophobicContact CG2-CD1 3.86Å; L130-L137 CarbonylContact C-O 3.22Å; L130-L137 HydrophobicContact CB-CB 4.29Å; L130-L137 WeakPolarHBondContact CB-O 3.49Å; K131-L137 PolarHBondContact N-O 3.48Å; K131-L137 VanDerWaalsContact N-O 3.16Å; N134-L137 HydrophobicContact CB-CB 4.21Å; N134-L137 HydrophobicContact CB-CD1 4.18Å; N134-L137 HydrophobicContact CB-CG 4.21Å; N134-L137 CarbonylContact O-C 3.27Å; N134-L137 WeakPolarHBondContact O-CA 3.37Å; N134-L137 PolarHBondContact O-N 2.89Å; H135-L137 VanDerWaalsContact C-N 3.34Å; L137-I139 VanDerWaalsContact C-N 3.25Å; L137-I139 PolarHBondContact O-N 2.95Å
138	N	86.8	Confident	83.8	Confident	91 Å²	91	63.5 Å²	63.5	49%	0.487	33%	0.325	S	S	.	.			trans	-72.2	79.7	173.6	-175.3	26.9	0	0	0	111.7	S129 K131	S129-N138 WeakPolarHBondContact OG-CA 3.48Å; S129-N138 PolarHBondContact OG-OD1 3.26Å; K131-N138 HydrophobicContact CB-CB 4Å; K131-N138 HydrophobicContact CD-CB 4.24Å; K131-N138 HydrophobicContact CG-CB 4.15Å
139	I	90.3	Very high	82.3	Confident	21 Å²	21	62 Å²	62	11%	0.108	32%	0.324	C	S	.	.			trans	-152.6	153.5	179.2	-161.4	159.6	0	0	0	110.4	D69 L87 R88 K89 S129 L130 L137	D69-I139 HydrophobicContact CB-CD1 3.94Å; L87-I139 HydrophobicContact CD1-CG2 3.43Å; L87-I139 VanDerWaalsContact CD1-CG2 3.43Å; R88-I139 WeakPolarHBondContact O-CD1 3.44Å; K89-I139 HydrophobicContact CB-CD1 3.95Å; K89-I139 HydrophobicContact CD-CB 4.15Å; K89-I139 HydrophobicContact CD-CG2 4.03Å; K89-I139 HydrophobicContact CG-CD1 4.05Å; S129-I139 PolarHBondContact OG-N 2.93Å; L130-I139 WeakPolarHBondContact CB-O 3.42Å; L130-I139 HydrophobicContact CD1-CG2 4.16Å; L130-I139 PolarHBondContact N-O 3.43Å; L137-I139 VanDerWaalsContact C-N 3.25Å; L137-I139 PolarHBondContact O-N 2.95Å
140	V	91.7	Very high	80.3	Confident	23 Å²	23	64.9 Å²	64.9	14%	0.139	34%	0.343	C	S	.	.			trans	-108.5	151.5	174.8	-75.6	0	0	0	0	110.2	Y125 R142	Y125-V140 WeakPolarHBondContact O-CA 3.33Å; V140-R142 HydrophobicContact CG2-CG 3.7Å; V140-R142 VanDerWaalsContact CG2-NE 3.27Å; V140-R142 PolarHBondContact O-N 3.44Å; V140-R142 VanDerWaalsContact O-N 3.1Å
141	L	90.8	Very high	78.2	Confident	5 Å²	5	70.5 Å²	70.5	3%	0.026	38%	0.383	C	S	.	.			trans	-75.3	94.7	176.7	-59.2	-175.1	0	0	0	109.8	F72 L85 V122 Y125 S126 L130	F72-L141 HydrophobicContact CB-CD2 3.82Å; F72-L141 HydrophobicContact CD1-CB 3.71Å; F72-L141 HydrophobicContact CD1-CD2 4.12Å; F72-L141 HydrophobicContact CD1-CG 4.41Å; F72-L141 HydrophobicContact CD2-CB 4.46Å; F72-L141 HydrophobicContact CD2-CD1 4.17Å; F72-L141 HydrophobicContact CD2-CD2 4.24Å; F72-L141 HydrophobicContact CE1-CB 3.65Å; F72-L141 HydrophobicContact CE2-CB 4.41Å; F72-L141 HydrophobicContact CE2-CD1 4.23Å; F72-L141 HydrophobicContact CG-CB 4.13Å; F72-L141 HydrophobicContact CG-CD1 4.48Å; F72-L141 HydrophobicContact CG-CD2 3.8Å; F72-L141 HydrophobicContact CG-CG 4.35Å; F72-L141 HydrophobicContact CZ-CB 4.02Å; L85-L141 HydrophobicContact CD1-CD1 4.39Å; L85-L141 HydrophobicContact CD1-CD2 4.2Å; L85-L141 HydrophobicContact CD2-CD1 4.4Å; L85-L141 HydrophobicContact CD2-CD2 4.22Å; V122-L141 HydrophobicContact CG1-CD1 4.49Å; V122-L141 HydrophobicContact CG2-CD1 4.37Å; Y125-L141 PolarHBondContact O-N 2.76Å; S126-L141 WeakPolarHBondContact CA-O 3.17Å; S126-L141 WeakPolarHBondContact CB-O 3.35Å; L130-L141 HydrophobicContact CD1-CD2 4.11Å
142	R	87	Confident	76.2	Confident	168 Å²	168	70 Å²	70	63%	0.634	40%	0.401	S	S	*	.			trans	-101.5	-43.3	-172.6	-78.2	179	179.4	-172.3	1.3	114.1	G70 V140 P144	G70-R142 PolarHBondContact O-N 2.81Å; V140-R142 HydrophobicContact CG2-CG 3.7Å; V140-R142 VanDerWaalsContact CG2-NE 3.27Å; V140-R142 PolarHBondContact O-N 3.44Å; V140-R142 VanDerWaalsContact O-N 3.1Å; R142-P144 VanDerWaalsContact O-CD 3.27Å; R142-P144 WeakPolarHBondContact O-CD 3.36Å
143	H	88.5	Confident	74.6	Confident	87 Å²	87	73 Å²	73	40%	0.403	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	88.6	-167.9	-54.3	-60.2	0	0	0	109	G70 S71 F72 V145	G70-H143 PolarHBondContact O-N 3.32Å; S71-H143 CarbonylContact C-O 3.55Å; S71-H143 WeakPolarHBondContact CA-O 3.43Å; F72-H143 PolarHBondContact N-O 2.83Å; H143-V145 PolarHBondContact O-N 3.06Å; H143-V145 VanDerWaalsContact O-N 3.13Å
144	P	87.7	Confident	72.9	Confident	59 Å²	59	78.2 Å²	78.2	38%	0.383	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	120.5	176.1	25	-32.6	0	0	0	108.7	W50 F72 R142 P146	W50-P144 HydrophobicContact CB-CB 3.74Å; W50-P144 HydrophobicContact CG-CB 4.13Å; F72-P144 HydrophobicContact CE1-CB 3.9Å; F72-P144 HydrophobicContact CZ-CB 3.81Å; R142-P144 VanDerWaalsContact O-CD 3.27Å; R142-P144 WeakPolarHBondContact O-CD 3.36Å; P144-P146 VanDerWaalsContact O-CD 3.28Å; P144-P146 WeakPolarHBondContact O-CD 3.5Å
145	V	84.2	Confident	71.4	Confident	4 Å²	4	79.8 Å²	79.8	2%	0.024	43%	0.429	C	S	.	.			trans	-87.7	114.3	-179.7	-175.6	0	0	0	0	108.1	W52 R63 M64 Q67 F72 H143 R147	W52-V145 HydrophobicContact CZ2-CG1 3.92Å; W52-V145 PolarHBondContact NE1-O 3.44Å; R63-V145 HydrophobicContact CG-CG1 3.97Å; M64-V145 HydrophobicContact SD-CB 4.4Å; M64-V145 HydrophobicContact SD-CG2 3.88Å; Q67-V145 HydrophobicContact CG-CG2 4.41Å; F72-V145 PolarHBondContact O-N 2.8Å; H143-V145 PolarHBondContact O-N 3.06Å; H143-V145 VanDerWaalsContact O-N 3.13Å; V145-R147 PolarHBondContact O-N 3.34Å
146	P	76.2	Confident	70.1	Confident	39 Å²	39	78 Å²	78	25%	0.253	42%	0.422	S	S	.	.			trans	-60.9	136.4	175.4	-23.8	37.1	0	0	0	111	T49 P144 Y148	T49-P146 VanDerWaalsContact O-CA 3.24Å; T49-P146 WeakPolarHBondContact O-CA 3.38Å; P144-P146 VanDerWaalsContact O-CD 3.28Å; P144-P146 WeakPolarHBondContact O-CD 3.5Å; P146-Y148 WeakPolarHBondContact CB-O 3.48Å; P146-Y148 PolarHBondContact O-N 3.05Å
147	R	71.9	Confident	68.9	Low	64 Å²	64	78 Å²	78	24%	0.242	43%	0.425	C	S	.	.	S	Bend	trans	-54	-39.2	169.3	-173.3	-179.7	168.4	169.4	-8.3	111	T49 W52 V145	T49-R147 PolarHBondContact O-N 3.33Å; W52-R147 HydrophobicContact CB-CB 4.39Å; W52-R147 HydrophobicContact CB-CG 4.27Å; W52-R147 HydrophobicContact CD2-CB 3.82Å; W52-R147 HydrophobicContact CD2-CG 3.82Å; W52-R147 HydrophobicContact CE3-CB 4.39Å; W52-R147 HydrophobicContact CE3-CG 3.91Å; W52-R147 HydrophobicContact CG-CB 3.75Å; W52-R147 HydrophobicContact CG-CG 3.95Å; W52-R147 WeakPolarHBondContact O-CD 3.2Å; W52-R147 PolarHBondContact O-NH1 3.34Å; V145-R147 PolarHBondContact O-N 3.34Å
148	Y	66.1	Low	67.7	Low	90 Å²	90	83.9 Å²	83.9	35%	0.353	45%	0.453	S	S	.	.	S	Bend	trans	-116.2	128.2	-178.7	-47.1	-47.7	0	0	0	108.8	P146 S150	P146-Y148 WeakPolarHBondContact CB-O 3.48Å; P146-Y148 PolarHBondContact O-N 3.05Å; Y148-S150 PolarHBondContact O-N 2.87Å
149	P	56.1	Low	67	Low	64 Å²	64	85.4 Å²	85.4	42%	0.416	46%	0.455	S	S	.	.			trans	-57.6	105.5	176.6	14.9	-19.7	0	0	0	110.4	R63 S151	R63-P149 VanDerWaalsContact NH2-CA 3.28Å; P149-S151 VanDerWaalsContact C-N 3.26Å; P149-S151 PolarHBondContact O-N 3.06Å
150	S	47.3	Very low	66.3	Low	92 Å²	92	87.8 Å²	87.8	64%	0.643	47%	0.466	S	S	*	.	S	Bend	trans	-73.7	89.1	161.1	-59.5	0	0	0	0	107	Y148	Y148-S150 PolarHBondContact O-N 2.87Å
151	S	42.7	Very low	65.8	Low	119 Å²	119	91.8 Å²	91.8	83%	0.832	49%	0.486	S	S	*	.	S	Bend	trans	64	118.1	174.7	68.3	0	0	0	0	116.6	P149	P149-S151 VanDerWaalsContact C-N 3.26Å; P149-S151 PolarHBondContact O-N 3.06Å
152	G	43.2	Very low	65.6	Low	72 Å²	72	97.4 Å²	97.4	74%	0.742	51%	0.512	S	S	*	.			trans	166.4	-52.4	160.5	0	0	0	0	0	116.3	K154	G152-K154 PolarHBondContact O-N 2.77Å
153	E	45.8	Very low	65.5	Low	156 Å²	156	90.8 Å²	90.8	73%	0.729	49%	0.489	S	S	*	.			trans	-95.3	105.6	178.2	-76	-177.6	157.6	0	0	108.7	L155	E153-L155 PolarHBondContact O-N 2.99Å
154	K	42.4	Very low	65.4	Low	198 Å²	198	87.2 Å²	87.2	86%	0.861	47%	0.474	S	S	*	.			trans	-62.8	65.6	170.4	-61.3	172.8	179.7	176.2	0	110.3	G152 Q156	G152-K154 PolarHBondContact O-N 2.77Å; K154-Q156 PolarHBondContact O-N 3.1Å
155	L	49.1	Very low	65.4	Low	98 Å²	98	89.7 Å²	89.7	51%	0.513	48%	0.479	S	S	.	.	S	Bend	trans	-51.6	109.5	137.8	-118.4	83.1	0	0	0	103.3	E153 A157	E153-L155 PolarHBondContact O-N 2.99Å; L155-A157 PolarHBondContact O-N 3.19Å
156	Q	55.8	Low	65.7	Low	101 Å²	101	96.1 Å²	96.1	47%	0.472	51%	0.506	S	S	.	.			trans	-44	117.1	-163.8	-76	149.4	-38.5	0	0	108.3	K154 E158 K159 E160	K154-Q156 PolarHBondContact O-N 3.1Å; Q156-E158 CarbonylContact O-C 3.44Å; Q156-E158 PolarHBondContact O-N 2.89Å; Q156-K159 HydrophobicContact CB-CD 4.38Å; Q156-K159 HydrophobicContact CB-CG 4.25Å; Q156-K159 WeakPolarHBondContact O-CA 3.3Å; Q156-K159 WeakPolarHBondContact O-CB 3.33Å; Q156-K159 PolarHBondContact O-N 3.24Å; Q156-E160 PolarHBondContact O-N 3.46Å
157	A	58.5	Low	66.2	Low	73 Å²	73	94.5 Å²	94.5	60%	0.603	50%	0.495	S	S	*	.	H	α-helix	trans	-50.8	-26.7	-179.3	0	0	0	0	0	111.6	L155 E160 D161	L155-A157 PolarHBondContact O-N 3.19Å; A157-E160 PolarHBondContact O-N 3.4Å; A157-D161 WeakPolarHBondContact O-CB 3.37Å; A157-D161 PolarHBondContact O-N 2.9Å
158	E	60.2	Low	67	Low	137 Å²	137	91.4 Å²	91.4	64%	0.64	48%	0.484	S	S	*	.	H	α-helix	trans	-57.9	-40.2	169.1	-64	-178.6	166.3	0	0	114.4	Q156 Q162	Q156-E158 CarbonylContact O-C 3.44Å; Q156-E158 PolarHBondContact O-N 2.89Å; E158-Q162 WeakPolarHBondContact O-CB 3.44Å; E158-Q162 WeakPolarHBondContact O-CG 3.19Å; E158-Q162 PolarHBondContact O-N 3.49Å; E158-Q162 PolarHBondContact O-NE2 3.48Å
159	K	71.6	Confident	68.1	Low	123 Å²	123	90.5 Å²	90.5	54%	0.535	49%	0.485	S	S	.	.	H	α-helix	trans	-69.7	-38.9	175.5	-74.4	178.3	172.6	160.3	0	111.9	Q156 L163	Q156-K159 HydrophobicContact CB-CD 4.38Å; Q156-K159 HydrophobicContact CB-CG 4.25Å; Q156-K159 WeakPolarHBondContact O-CA 3.3Å; Q156-K159 WeakPolarHBondContact O-CB 3.33Å; Q156-K159 PolarHBondContact O-N 3.24Å; K159-L163 VanDerWaalsContact O-CB 3.25Å; K159-L163 WeakPolarHBondContact O-CB 3.25Å; K159-L163 PolarHBondContact O-N 2.85Å
160	E	74.9	Confident	69.8	Low	72 Å²	72	88.2 Å²	88.2	34%	0.336	47%	0.469	S	S	.	.	H	α-helix	trans	-65.9	-46.3	174.9	-69	-177.4	178	0	0	110.9	Q156 A157 Q162 L163 V164 I299	Q156-E160 PolarHBondContact O-N 3.46Å; A157-E160 PolarHBondContact O-N 3.4Å; E160-Q162 PolarHBondContact O-N 3.48Å; E160-L163 WeakPolarHBondContact O-CB 3.25Å; E160-L163 PolarHBondContact O-N 2.97Å; E160-V164 VanDerWaalsContact O-CG2 3.3Å; E160-V164 WeakPolarHBondContact O-CG2 3.3Å; E160-V164 PolarHBondContact O-N 2.83Å; E160-I299 HydrophobicContact CB-CD1 4.39Å; E160-I299 HydrophobicContact CG-CD1 4.45Å
161	D	82.6	Confident	71.6	Confident	107 Å²	107	85.8 Å²	85.8	57%	0.572	45%	0.447	S	S	*	.	H	α-helix	trans	-63	-42.4	176.5	-172.8	66.8	0	0	0	111.8	A157 L163 V164 K165	A157-D161 WeakPolarHBondContact O-CB 3.37Å; A157-D161 PolarHBondContact O-N 2.9Å; D161-L163 VanDerWaalsContact C-N 3.34Å; D161-L163 PolarHBondContact O-N 3.42Å; D161-V164 PolarHBondContact O-N 2.85Å; D161-K165 VanDerWaalsContact O-CB 3.25Å; D161-K165 WeakPolarHBondContact O-CB 3.48Å; D161-K165 PolarHBondContact O-N 3.18Å
162	Q	85.2	Confident	73.7	Confident	122 Å²	122	82.2 Å²	82.2	57%	0.57	42%	0.419	S	S	*	.	H	α-helix	trans	-62	-40.4	173.1	-76.9	171.4	44.6	0	0	112.3	E158 E160 K166	E158-Q162 WeakPolarHBondContact O-CB 3.44Å; E158-Q162 WeakPolarHBondContact O-CG 3.19Å; E158-Q162 PolarHBondContact O-N 3.49Å; E158-Q162 PolarHBondContact O-NE2 3.48Å; E160-Q162 PolarHBondContact O-N 3.48Å; Q162-K166 VanDerWaalsContact O-CB 3.25Å; Q162-K166 WeakPolarHBondContact O-CB 3.27Å; Q162-K166 PolarHBondContact O-N 2.87Å
163	L	85	Confident	76	Confident	29 Å²	29	83.2 Å²	83.2	15%	0.152	40%	0.404	C	S	.	.	H	α-helix	trans	-63.9	-51.9	176	179.1	61.3	0	0	0	110.3	K159 E160 D161 K165 K166 V167 M290 L294 I299	K159-L163 VanDerWaalsContact O-CB 3.25Å; K159-L163 WeakPolarHBondContact O-CB 3.25Å; K159-L163 PolarHBondContact O-N 2.85Å; E160-L163 WeakPolarHBondContact O-CB 3.25Å; E160-L163 PolarHBondContact O-N 2.97Å; D161-L163 VanDerWaalsContact C-N 3.34Å; D161-L163 PolarHBondContact O-N 3.42Å; L163-K165 VanDerWaalsContact C-N 3.29Å; L163-K165 PolarHBondContact O-N 3.35Å; L163-K166 PolarHBondContact O-N 3.04Å; L163-K166 VanDerWaalsContact O-N 3.14Å; L163-V167 HydrophobicContact CD1-CG2 4.11Å; L163-V167 HydrophobicContact CG-CG2 4.44Å; L163-V167 VanDerWaalsContact O-CG2 3.27Å; L163-V167 WeakPolarHBondContact O-CG2 3.47Å; L163-V167 PolarHBondContact O-N 3.34Å; L163-M290 HydrophobicContact CD1-SD 4.49Å; L163-L294 HydrophobicContact CD2-CD2 4.21Å; L163-L294 HydrophobicContact CG-CD2 4.13Å; L163-I299 HydrophobicContact CD2-CD1 4.03Å
164	V	86.2	Confident	78.1	Confident	13 Å²	13	75.9 Å²	75.9	8%	0.079	37%	0.37	C	S	.	.	H	α-helix	trans	-55.1	-45.7	177	171.4	0	0	0	0	111	E160 D161 V167 A168 I299 T303 V304 L307	E160-V164 VanDerWaalsContact O-CG2 3.3Å; E160-V164 WeakPolarHBondContact O-CG2 3.3Å; E160-V164 PolarHBondContact O-N 2.83Å; D161-V164 PolarHBondContact O-N 2.85Å; V164-V167 PolarHBondContact O-N 2.87Å; V164-A168 WeakPolarHBondContact O-CB 3.38Å; V164-A168 PolarHBondContact O-N 2.92Å; V164-I299 HydrophobicContact CG2-CD1 4.15Å; V164-I299 HydrophobicContact CG2-CG2 3.74Å; V164-T303 HydrophobicContact CG1-CG2 4.24Å; V164-T303 HydrophobicContact CG2-CG2 4.38Å; V164-V304 HydrophobicContact CG1-CG2 4.27Å; V164-L307 HydrophobicContact CG1-CD2 3.81Å
165	K	89	Confident	80.2	Confident	111 Å²	111	67.6 Å²	67.6	48%	0.483	34%	0.337	S	S	.	.	H	α-helix	trans	-62.3	-46.3	177.9	-173	175.4	-178.7	176.6	0	111.7	D161 L163 A168 D169 L307	D161-K165 VanDerWaalsContact O-CB 3.25Å; D161-K165 WeakPolarHBondContact O-CB 3.48Å; D161-K165 PolarHBondContact O-N 3.18Å; L163-K165 VanDerWaalsContact C-N 3.29Å; L163-K165 PolarHBondContact O-N 3.35Å; K165-A168 PolarHBondContact O-N 3.49Å; K165-D169 PolarHBondContact O-N 3.06Å; K165-D169 VanDerWaalsContact O-OD2 3.1Å; K165-L307 HydrophobicContact CB-CD2 4.4Å
166	K	89.1	Confident	82.1	Confident	139 Å²	139	69.1 Å²	69.1	60%	0.604	34%	0.336	S	S	*	.	H	α-helix	trans	-63.2	-41.2	178.1	-173.6	176.2	-178.8	179.4	0	112	Q162 L163 D169 L170	Q162-K166 VanDerWaalsContact O-CB 3.25Å; Q162-K166 WeakPolarHBondContact O-CB 3.27Å; Q162-K166 PolarHBondContact O-N 2.87Å; L163-K166 PolarHBondContact O-N 3.04Å; L163-K166 VanDerWaalsContact O-N 3.14Å; K166-D169 PolarHBondContact O-N 3.21Å; K166-L170 WeakPolarHBondContact O-CB 3.43Å; K166-L170 PolarHBondContact O-N 3Å
167	V	88.1	Confident	83.7	Confident	4 Å²	4	66.4 Å²	66.4	2%	0.024	32%	0.323	C	S	.	.	H	α-helix	trans	-68.2	-40.5	176	-173.2	0	0	0	0	111.1	L163 V164 D169 L170 H171 M290 L294 V304	L163-V167 HydrophobicContact CD1-CG2 4.11Å; L163-V167 HydrophobicContact CG-CG2 4.44Å; L163-V167 VanDerWaalsContact O-CG2 3.27Å; L163-V167 WeakPolarHBondContact O-CG2 3.47Å; L163-V167 PolarHBondContact O-N 3.34Å; V164-V167 PolarHBondContact O-N 2.87Å; V167-D169 PolarHBondContact O-N 2.72Å; V167-L170 PolarHBondContact O-N 3.38Å; V167-H171 WeakPolarHBondContact O-CB 3.39Å; V167-H171 PolarHBondContact O-N 3.37Å; V167-M290 HydrophobicContact CG1-CB 4.19Å; V167-M290 HydrophobicContact CG2-CB 3.76Å; V167-M290 HydrophobicContact CG2-CG 4.3Å; V167-L294 HydrophobicContact CB-CD1 4Å; V167-L294 HydrophobicContact CG1-CD1 3.65Å; V167-L294 HydrophobicContact CG2-CD1 3.88Å; V167-L294 HydrophobicContact CG2-CD2 4.07Å; V167-L294 HydrophobicContact CG2-CG 3.97Å; V167-V304 HydrophobicContact CB-CG1 4.42Å; V167-V304 HydrophobicContact CG1-CG1 4.19Å
168	A	88.1	Confident	85	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-61.9	-42.2	175.9	0	0	0	0	0	112.3	V164 K165 L172 V304 L307 I308	V164-A168 WeakPolarHBondContact O-CB 3.38Å; V164-A168 PolarHBondContact O-N 2.92Å; K165-A168 PolarHBondContact O-N 3.49Å; A168-L172 WeakPolarHBondContact O-CB 3.32Å; A168-L172 PolarHBondContact O-N 3Å; A168-V304 HydrophobicContact CB-CG1 4.09Å; A168-L307 HydrophobicContact CB-CB 4.39Å; A168-L307 HydrophobicContact CB-CD2 3.76Å; A168-L307 HydrophobicContact CB-CG 4.07Å; A168-I308 HydrophobicContact CB-CG1 3.78Å
169	D	89.8	Confident	86.3	Confident	70 Å²	70	58.7 Å²	58.7	37%	0.374	28%	0.277	S	S	.	.	H	α-helix	trans	-64.4	-45.1	175.8	-74.9	-39.2	0	0	0	111.6	K165 K166 V167 L172 E173 K311	K165-D169 PolarHBondContact O-N 3.06Å; K165-D169 VanDerWaalsContact O-OD2 3.1Å; K166-D169 PolarHBondContact O-N 3.21Å; V167-D169 PolarHBondContact O-N 2.72Å; D169-L172 PolarHBondContact O-N 2.97Å; D169-E173 WeakPolarHBondContact O-CB 3.27Å; D169-E173 PolarHBondContact O-N 2.85Å; D169-K311 IonicContact OD1-NZ 3.04Å; D169-K311 PolarHBondContact OD1-NZ 2.64Å; D169-K311 IonicContact OD2-NZ 3.27Å; D169-K311 PolarHBondContact OD2-NZ 3.25Å
170	L	90.6	Very high	87.1	Confident	16 Å²	16	54 Å²	54	8%	0.084	26%	0.26	C	S	.	.	H	α-helix	trans	-62	-44.8	176.3	179.8	63.4	0	0	0	111.9	K166 V167 L172 E173 C174 L283 Q286 M290	K166-L170 WeakPolarHBondContact O-CB 3.43Å; K166-L170 PolarHBondContact O-N 3Å; V167-L170 PolarHBondContact O-N 3.38Å; L170-L172 VanDerWaalsContact C-N 3.31Å; L170-L172 PolarHBondContact O-N 3.44Å; L170-E173 PolarHBondContact O-N 2.91Å; L170-C174 PolarHBondContact O-N 3.15Å; L170-C174 PolarHBondContact O-SG 2.93Å; L170-L283 HydrophobicContact CD1-CD2 3.81Å; L170-Q286 HydrophobicContact CD1-CB 4.11Å; L170-Q286 HydrophobicContact CD2-CB 3.79Å; L170-M290 HydrophobicContact CD2-CB 4.27Å; L170-M290 HydrophobicContact CD2-CG 3.66Å
171	H	86.1	Confident	87.9	Confident	41 Å²	41	53.2 Å²	53.2	19%	0.19	25%	0.254	C	S	.	.	H	α-helix	trans	-62	-40.5	177.6	-175.4	-72.6	0	0	0	111.5	V167 E173 S175 Q287 I308	V167-H171 WeakPolarHBondContact O-CB 3.39Å; V167-H171 PolarHBondContact O-N 3.37Å; H171-E173 VanDerWaalsContact C-N 3.34Å; H171-S175 PolarHBondContact CE1-OG 3.16Å; H171-S175 VanDerWaalsContact CE1-OG 3.28Å; H171-S175 PolarHBondContact ND1-OG 2.9Å; H171-S175 VanDerWaalsContact O-CB 3.24Å; H171-S175 WeakPolarHBondContact O-CB 3.44Å; H171-S175 PolarHBondContact O-N 3.04Å; H171-S175 PolarHBondContact O-OG 3.14Å; H171-Q287 PolarHBondContact CD2-NE2 2.68Å; H171-Q287 VanDerWaalsContact CD2-NE2 3.29Å; H171-I308 HydrophobicContact CB-CD1 3.8Å
172	L	87.5	Confident	88.1	Confident	45 Å²	45	52.2 Å²	52.2	24%	0.236	25%	0.246	C	C	.	.	H	α-helix	trans	-64.1	-41.2	176.1	-174.7	67	0	0	0	111.2	A168 D169 L170 S175 R176 L312 L334 I338	A168-L172 WeakPolarHBondContact O-CB 3.32Å; A168-L172 PolarHBondContact O-N 3Å; D169-L172 PolarHBondContact O-N 2.97Å; L170-L172 VanDerWaalsContact C-N 3.31Å; L170-L172 PolarHBondContact O-N 3.44Å; L172-S175 PolarHBondContact O-N 3.29Å; L172-R176 WeakPolarHBondContact O-CB 3.49Å; L172-R176 PolarHBondContact O-N 3.33Å; L172-L312 HydrophobicContact CD1-CD2 3.71Å; L172-L312 HydrophobicContact CD1-CG 4.27Å; L172-L334 HydrophobicContact CD1-CD2 3.53Å; L172-L334 HydrophobicContact CD1-CG 4.2Å; L172-L334 HydrophobicContact CG-CD2 4.47Å; L172-I338 HydrophobicContact CD1-CD1 4.29Å
173	E	90.5	Very high	88.3	Confident	93 Å²	93	52.5 Å²	52.5	44%	0.435	24%	0.242	S	C	.	.	H	α-helix	trans	-65	-47.6	175.9	-174.8	169.2	-159.7	0	0	112.3	D169 L170 H171 S175 R176 K177 L283	D169-E173 WeakPolarHBondContact O-CB 3.27Å; D169-E173 PolarHBondContact O-N 2.85Å; L170-E173 PolarHBondContact O-N 2.91Å; H171-E173 VanDerWaalsContact C-N 3.34Å; E173-S175 PolarHBondContact O-N 2.89Å; E173-R176 PolarHBondContact O-N 3.41Å; E173-K177 WeakPolarHBondContact O-CB 3.34Å; E173-K177 PolarHBondContact O-N 2.97Å; E173-L283 HydrophobicContact CG-CD1 4.11Å; E173-L283 HydrophobicContact CG-CD2 3.98Å
174	C	89.5	Confident	88.6	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.007	24%	0.236	C	C	.	.	H	α-helix	trans	-54.4	-52.4	172.7	-68.9	0	0	0	0	110.6	L170 R176 K177 T178 L283	L170-C174 PolarHBondContact O-N 3.15Å; L170-C174 PolarHBondContact O-SG 2.93Å; C174-R176 VanDerWaalsContact C-N 3.32Å; C174-R176 PolarHBondContact O-N 2.87Å; C174-K177 PolarHBondContact O-N 3.49Å; C174-K177 VanDerWaalsContact O-N 3.16Å; C174-T178 WeakPolarHBondContact O-CB 3.43Å; C174-T178 PolarHBondContact O-N 3.01Å; C174-T178 PolarHBondContact O-OG1 3.3Å; C174-L283 PolarHBondContact SG-O 2.86Å
175	S	87.1	Confident	88.9	Confident	25 Å²	25	56 Å²	56	18%	0.175	25%	0.253	C	S	.	.	H	α-helix	trans	-61.6	-41	-176.4	-61.1	0	0	0	0	111.7	H171 L172 E173 L179	H171-S175 PolarHBondContact CE1-OG 3.16Å; H171-S175 VanDerWaalsContact CE1-OG 3.28Å; H171-S175 PolarHBondContact ND1-OG 2.9Å; H171-S175 VanDerWaalsContact O-CB 3.24Å; H171-S175 WeakPolarHBondContact O-CB 3.44Å; H171-S175 PolarHBondContact O-N 3.04Å; H171-S175 PolarHBondContact O-OG 3.14Å; L172-S175 PolarHBondContact O-N 3.29Å; E173-S175 PolarHBondContact O-N 2.89Å; S175-L179 WeakPolarHBondContact O-CB 3.3Å; S175-L179 PolarHBondContact O-N 3.47Å; S175-L179 VanDerWaalsContact O-N 3.09Å
176	R	88.6	Confident	89	Confident	130 Å²	130	56.3 Å²	56.3	49%	0.491	26%	0.257	S	S	.	.	H	α-helix	trans	-64.6	-45.9	175.2	-173.2	-179.8	62.9	141.5	-1.2	111.4	L172 E173 C174 L179 C180 E330 L334	L172-R176 WeakPolarHBondContact O-CB 3.49Å; L172-R176 PolarHBondContact O-N 3.33Å; E173-R176 PolarHBondContact O-N 3.41Å; C174-R176 VanDerWaalsContact C-N 3.32Å; C174-R176 PolarHBondContact O-N 2.87Å; R176-L179 PolarHBondContact O-N 2.93Å; R176-C180 PolarHBondContact O-N 3.03Å; R176-C180 PolarHBondContact O-SG 2.9Å; R176-E330 WeakPolarHBondContact CD-OE1 3.16Å; R176-E330 WeakPolarHBondContact CG-OE1 3.21Å; R176-L334 HydrophobicContact CB-CD2 4.34Å
177	K	88.6	Confident	89.2	Confident	44 Å²	44	54 Å²	54	19%	0.191	25%	0.248	C	C	.	.	H	α-helix	trans	-66.6	-39.7	-178.5	-164.4	65.6	167.4	-172.5	0	112	E173 C174 L179 C180 Y181 E279 L280 L283	E173-K177 WeakPolarHBondContact O-CB 3.34Å; E173-K177 PolarHBondContact O-N 2.97Å; C174-K177 PolarHBondContact O-N 3.49Å; C174-K177 VanDerWaalsContact O-N 3.16Å; K177-L179 VanDerWaalsContact C-N 3.34Å; K177-C180 PolarHBondContact O-N 3.05Å; K177-Y181 PolarHBondContact O-N 2.82Å; K177-E279 WeakPolarHBondContact CE-OE2 3.43Å; K177-E279 IonicContact NZ-OE2 2.58Å; K177-E279 PolarHBondContact NZ-OE2 3.07Å; K177-L280 HydrophobicContact CB-CD1 4.27Å; K177-L280 HydrophobicContact CG-CD1 4.25Å; K177-L283 HydrophobicContact CB-CD1 3.92Å; K177-L283 HydrophobicContact CG-CD1 4.03Å
178	T	87.5	Confident	89.5	Confident	39 Å²	39	55.4 Å²	55.4	24%	0.239	25%	0.254	C	S	.	.	H	α-helix	trans	-57.2	-48.1	171.8	-60	0	0	0	0	110.6	C174 C180 Y181 E182 L280	C174-T178 WeakPolarHBondContact O-CB 3.43Å; C174-T178 PolarHBondContact O-N 3.01Å; C174-T178 PolarHBondContact O-OG1 3.3Å; T178-C180 PolarHBondContact O-N 3.35Å; T178-Y181 WeakPolarHBondContact O-CB 3.3Å; T178-Y181 PolarHBondContact O-N 3.31Å; T178-Y181 VanDerWaalsContact O-N 3.14Å; T178-E182 HydrophobicContact CG2-CG 4.37Å; T178-E182 WeakPolarHBondContact O-CG 3.29Å; T178-E182 PolarHBondContact O-N 2.93Å; T178-L280 WeakPolarHBondContact OG1-CD1 3.41Å
179	L	86.9	Confident	89.7	Confident	9 Å²	9	59.1 Å²	59.1	5%	0.047	27%	0.271	C	S	.	.	H	α-helix	trans	-61.4	-42.1	178.1	179.1	64	0	0	0	112.6	S175 R176 K177 Y181 E182 R183 E330 M333	S175-L179 WeakPolarHBondContact O-CB 3.3Å; S175-L179 PolarHBondContact O-N 3.47Å; S175-L179 VanDerWaalsContact O-N 3.09Å; R176-L179 PolarHBondContact O-N 2.93Å; K177-L179 VanDerWaalsContact C-N 3.34Å; L179-Y181 VanDerWaalsContact C-N 3.31Å; L179-Y181 PolarHBondContact O-N 3.07Å; L179-E182 PolarHBondContact O-N 2.81Å; L179-R183 WeakPolarHBondContact O-CB 3.5Å; L179-R183 PolarHBondContact O-N 3.15Å; L179-E330 HydrophobicContact CD2-CG 3.8Å; L179-M333 HydrophobicContact CD1-CB 4.35Å; L179-M333 HydrophobicContact CD1-CE 3.77Å; L179-M333 HydrophobicContact CD1-SD 4.47Å; L179-M333 HydrophobicContact CD2-CB 3.83Å
180	C	88.4	Confident	90	Very high	24 Å²	24	61.3 Å²	61.3	16%	0.162	28%	0.279	C	S	.	.	H	α-helix	trans	-60.9	-41.8	174.7	-64.5	0	0	0	0	111.9	R176 K177 T178 A184 M276	R176-C180 PolarHBondContact O-N 3.03Å; R176-C180 PolarHBondContact O-SG 2.9Å; K177-C180 PolarHBondContact O-N 3.05Å; T178-C180 PolarHBondContact O-N 3.35Å; C180-A184 WeakPolarHBondContact O-CB 3.33Å; C180-A184 PolarHBondContact O-N 3.46Å; C180-A184 VanDerWaalsContact O-N 3.08Å; C180-M276 HydrophobicContact CB-SD 3.9Å
181	Y	91.1	Very high	90.2	Very high	56 Å²	56	61.4 Å²	61.4	22%	0.22	28%	0.279	C	S	.	.	H	α-helix	trans	-65.2	-46.6	177.8	-179.9	-90.9	0	0	0	111.8	K177 T178 L179 R183 A184 Y185 L273 M276 K277 L280	K177-Y181 PolarHBondContact O-N 2.82Å; T178-Y181 WeakPolarHBondContact O-CB 3.3Å; T178-Y181 PolarHBondContact O-N 3.31Å; T178-Y181 VanDerWaalsContact O-N 3.14Å; L179-Y181 VanDerWaalsContact C-N 3.31Å; L179-Y181 PolarHBondContact O-N 3.07Å; Y181-R183 PolarHBondContact O-N 3.34Å; Y181-A184 PolarHBondContact O-N 2.84Å; Y181-Y185 VanDerWaalsContact O-CB 3.3Å; Y181-Y185 WeakPolarHBondContact O-CB 3.33Å; Y181-Y185 PolarHBondContact O-N 2.91Å; Y181-L273 HydrophobicContact CD2-CD2 3.7Å; Y181-L273 HydrophobicContact CE2-CB 4.48Å; Y181-L273 HydrophobicContact CE2-CD2 3.55Å; Y181-L273 HydrophobicContact CG-CD2 4.34Å; Y181-M276 HydrophobicContact CD2-CB 4.3Å; Y181-K277 HydrophobicContact CE2-CG 3.73Å; Y181-K277 WeakPolarHBondContact OH-CE 3.45Å; Y181-L280 HydrophobicContact CD1-CD2 4.4Å; Y181-L280 HydrophobicContact CG-CD2 4.16Å
182	E	86.6	Confident	90.6	Very high	86 Å²	86	62.4 Å²	62.4	40%	0.402	29%	0.286	S	S	.	.	H	α-helix	trans	-58.3	-46.8	177	-73.8	174	170	0	0	111.4	T178 L179 A184 Y185 E186	T178-E182 HydrophobicContact CG2-CG 4.37Å; T178-E182 WeakPolarHBondContact O-CG 3.29Å; T178-E182 PolarHBondContact O-N 2.93Å; L179-E182 PolarHBondContact O-N 2.81Å; E182-A184 PolarHBondContact O-N 3.46Å; E182-Y185 WeakPolarHBondContact O-CB 3.34Å; E182-Y185 PolarHBondContact O-N 2.87Å; E182-Y185 VanDerWaalsContact O-N 3.16Å; E182-E186 WeakPolarHBondContact O-CG 3.43Å; E182-E186 PolarHBondContact O-N 3.45Å
183	R	89.7	Confident	90.8	Very high	128 Å²	128	66 Å²	66	48%	0.483	30%	0.301	S	S	.	.	H	α-helix	trans	-59.4	-48.7	177	-177.2	178.3	68.4	-155.3	-0.9	112.3	L179 Y181 Y185 E186 E187 E330	L179-R183 WeakPolarHBondContact O-CB 3.5Å; L179-R183 PolarHBondContact O-N 3.15Å; Y181-R183 PolarHBondContact O-N 3.34Å; R183-Y185 PolarHBondContact O-N 3.41Å; R183-E186 PolarHBondContact O-N 2.99Å; R183-E187 PolarHBondContact O-N 2.64Å; R183-E330 IonicContact NH1-OE2 3.92Å
184	A	90.7	Very high	90.7	Very high	5 Å²	5	64.5 Å²	64.5	4%	0.041	29%	0.294	C	S	.	.	H	α-helix	trans	-63.8	-34.2	177.8	0	0	0	0	0	111.4	C180 Y181 E182 E187 F188 V269 L273 M276	C180-A184 WeakPolarHBondContact O-CB 3.33Å; C180-A184 PolarHBondContact O-N 3.46Å; C180-A184 VanDerWaalsContact O-N 3.08Å; Y181-A184 PolarHBondContact O-N 2.84Å; E182-A184 PolarHBondContact O-N 3.46Å; A184-E187 PolarHBondContact O-N 2.83Å; A184-F188 WeakPolarHBondContact O-CB 3.4Å; A184-F188 PolarHBondContact O-N 2.59Å; A184-V269 HydrophobicContact CB-CG1 4.33Å; A184-V269 WeakPolarHBondContact O-CG1 3.45Å; A184-L273 HydrophobicContact CB-CD2 3.74Å; A184-L273 HydrophobicContact CB-CG 4.09Å; A184-M276 HydrophobicContact CB-CE 3.72Å
185	Y	93.3	Very high	90.9	Very high	109 Å²	109	65 Å²	65	43%	0.427	30%	0.296	S	S	.	.	H	α-helix	trans	-69.4	-41.6	177.4	-176.2	-100.5	0	0	0	111.9	Y181 E182 R183 F188 Q189	Y181-Y185 VanDerWaalsContact O-CB 3.3Å; Y181-Y185 WeakPolarHBondContact O-CB 3.33Å; Y181-Y185 PolarHBondContact O-N 2.91Å; E182-Y185 WeakPolarHBondContact O-CB 3.34Å; E182-Y185 PolarHBondContact O-N 2.87Å; E182-Y185 VanDerWaalsContact O-N 3.16Å; R183-Y185 PolarHBondContact O-N 3.41Å; Y185-F188 WeakPolarHBondContact O-CB 3.33Å; Y185-F188 PolarHBondContact O-N 3.41Å; Y185-Q189 HydrophobicContact CD1-CG 4.27Å; Y185-Q189 HydrophobicContact CE1-CG 3.92Å; Y185-Q189 VanDerWaalsContact CZ-NE2 3.28Å; Y185-Q189 WeakPolarHBondContact O-CG 3.49Å; Y185-Q189 PolarHBondContact O-N 3.2Å; Y185-Q189 PolarHBondContact OH-NE2 3.2Å
186	E	90.9	Very high	91.1	Very high	119 Å²	119	70.2 Å²	70.2	56%	0.556	32%	0.318	S	S	*	.	H	α-helix	trans	-60.4	-45.1	173	-74	179.1	-177.4	0	0	111.8	E182 R183 F188 Q189 Q190	E182-E186 WeakPolarHBondContact O-CG 3.43Å; E182-E186 PolarHBondContact O-N 3.45Å; R183-E186 PolarHBondContact O-N 2.99Å; E186-F188 VanDerWaalsContact C-N 3.33Å; E186-F188 PolarHBondContact O-N 3.43Å; E186-Q189 PolarHBondContact O-N 3.2Å; E186-Q190 WeakPolarHBondContact O-CG 3.13Å; E186-Q190 PolarHBondContact O-N 3.42Å
187	E	92.8	Very high	91.2	Very high	89 Å²	89	66 Å²	66	42%	0.416	32%	0.316	S	S	.	.	H	α-helix	trans	-60.8	-43.2	175.5	-176.4	173.9	-176.2	0	0	111.5	R183 A184 Q189 Q190 L191 V269	R183-E187 PolarHBondContact O-N 2.64Å; A184-E187 PolarHBondContact O-N 2.83Å; E187-Q189 VanDerWaalsContact C-N 3.34Å; E187-Q189 PolarHBondContact O-N 3.06Å; E187-Q190 PolarHBondContact O-N 2.97Å; E187-L191 HydrophobicContact CG-CD1 4.05Å; E187-L191 HydrophobicContact CG-CG 4.4Å; E187-L191 WeakPolarHBondContact O-CB 3.4Å; E187-L191 WeakPolarHBondContact O-CG 3.46Å; E187-L191 PolarHBondContact O-N 2.94Å; E187-V269 HydrophobicContact CG-CG2 4.15Å
188	F	94.9	Very high	91.3	Very high	35 Å²	35	67.4 Å²	67.4	15%	0.154	32%	0.32	C	S	.	.	H	α-helix	trans	-57.6	-45.1	174.8	176.2	-95.6	0	0	0	112	A184 Y185 E186 L191 L192 L266 V269 E270 L273	A184-F188 WeakPolarHBondContact O-CB 3.4Å; A184-F188 PolarHBondContact O-N 2.59Å; Y185-F188 WeakPolarHBondContact O-CB 3.33Å; Y185-F188 PolarHBondContact O-N 3.41Å; E186-F188 VanDerWaalsContact C-N 3.33Å; E186-F188 PolarHBondContact O-N 3.43Å; F188-L191 PolarHBondContact O-N 3.3Å; F188-L192 HydrophobicContact CD1-CD1 3.95Å; F188-L192 HydrophobicContact CD1-CG 4.49Å; F188-L192 HydrophobicContact CE1-CD1 3.37Å; F188-L192 HydrophobicContact CE1-CG 4.14Å; F188-L192 HydrophobicContact CZ-CD1 3.77Å; F188-L192 HydrophobicContact CZ-CG 4.23Å; F188-L192 WeakPolarHBondContact O-CG 3.5Å; F188-L192 PolarHBondContact O-N 3.48Å; F188-L266 HydrophobicContact CD2-CD1 3.46Å; F188-L266 VanDerWaalsContact CD2-CD1 3.46Å; F188-L266 HydrophobicContact CD2-CG 4.36Å; F188-L266 HydrophobicContact CE2-CD1 3.52Å; F188-L266 HydrophobicContact CE2-CG 4.11Å; F188-L266 HydrophobicContact CG-CD1 4.26Å; F188-L266 HydrophobicContact CZ-CD1 4.37Å; F188-V269 HydrophobicContact CB-CG1 3.86Å; F188-E270 HydrophobicContact CD2-CB 4.35Å; F188-E270 HydrophobicContact CE2-CB 4.08Å; F188-E270 HydrophobicContact CE2-CG 4.41Å; F188-L273 HydrophobicContact CB-CD1 3.79Å; F188-L273 HydrophobicContact CD2-CD1 4.18Å; F188-L273 HydrophobicContact CG-CD1 3.93Å
189	Q	93.3	Very high	91.6	Very high	78 Å²	78	72.3 Å²	72.3	36%	0.364	33%	0.334	S	S	.	.	H	α-helix	trans	-64.7	-41.9	177	-66.4	-58.7	-38.1	0	0	112.1	Y185 E186 E187 L192 H193	Y185-Q189 HydrophobicContact CD1-CG 4.27Å; Y185-Q189 HydrophobicContact CE1-CG 3.92Å; Y185-Q189 VanDerWaalsContact CZ-NE2 3.28Å; Y185-Q189 WeakPolarHBondContact O-CG 3.49Å; Y185-Q189 PolarHBondContact O-N 3.2Å; Y185-Q189 PolarHBondContact OH-NE2 3.2Å; E186-Q189 PolarHBondContact O-N 3.2Å; E187-Q189 VanDerWaalsContact C-N 3.34Å; E187-Q189 PolarHBondContact O-N 3.06Å; Q189-L192 PolarHBondContact O-N 3.03Å; Q189-H193 PolarHBondContact O-N 2.83Å
190	Q	94.7	Very high	91.9	Very high	115 Å²	115	75.9 Å²	75.9	54%	0.537	35%	0.353	S	S	.	.	H	α-helix	trans	-63	-44	176.2	-70.4	175.2	18.2	0	0	111.5	E186 E187 L192 H193 H194	E186-Q190 WeakPolarHBondContact O-CG 3.13Å; E186-Q190 PolarHBondContact O-N 3.42Å; E187-Q190 PolarHBondContact O-N 2.97Å; Q190-L192 VanDerWaalsContact C-N 3.34Å; Q190-L192 PolarHBondContact O-N 2.82Å; Q190-H193 PolarHBondContact O-N 3.24Å; Q190-H194 VanDerWaalsContact O-CB 3.32Å; Q190-H194 WeakPolarHBondContact O-CB 3.27Å; Q190-H194 PolarHBondContact O-CD2 3.41Å; Q190-H194 PolarHBondContact O-N 3.35Å
191	L	94.8	Very high	92	Very high	18 Å²	18	75.7 Å²	75.7	9%	0.094	35%	0.353	C	S	.	.	H	α-helix	trans	-62.4	-39.7	176.1	-74	171.2	0	0	0	112	E187 F188 H194 L195 C262 K265 L266 V269	E187-L191 HydrophobicContact CG-CD1 4.05Å; E187-L191 HydrophobicContact CG-CG 4.4Å; E187-L191 WeakPolarHBondContact O-CB 3.4Å; E187-L191 WeakPolarHBondContact O-CG 3.46Å; E187-L191 PolarHBondContact O-N 2.94Å; F188-L191 PolarHBondContact O-N 3.3Å; L191-H194 PolarHBondContact O-N 2.7Å; L191-L195 VanDerWaalsContact O-CB 3.29Å; L191-L195 WeakPolarHBondContact O-CB 3.42Å; L191-L195 PolarHBondContact O-N 3.16Å; L191-C262 PolarHBondContact O-SG 2.91Å; L191-K265 HydrophobicContact CD1-CB 4.03Å; L191-K265 HydrophobicContact CD2-CB 4.15Å; L191-K265 HydrophobicContact CD2-CD 4.4Å; L191-L266 HydrophobicContact CB-CD1 3.86Å; L191-V269 HydrophobicContact CD1-CB 4.49Å; L191-V269 HydrophobicContact CD1-CG2 3.9Å
192	L	94.3	Very high	91.9	Very high	62 Å²	62	74.9 Å²	74.9	33%	0.325	35%	0.352	S	S	.	.	H	α-helix	trans	-60.7	-48.9	173.6	-78.5	179.5	0	0	0	111.9	F188 Q189 Q190 H194 L195 E196 L266	F188-L192 HydrophobicContact CD1-CD1 3.95Å; F188-L192 HydrophobicContact CD1-CG 4.49Å; F188-L192 HydrophobicContact CE1-CD1 3.37Å; F188-L192 HydrophobicContact CE1-CG 4.14Å; F188-L192 HydrophobicContact CZ-CD1 3.77Å; F188-L192 HydrophobicContact CZ-CG 4.23Å; F188-L192 WeakPolarHBondContact O-CG 3.5Å; F188-L192 PolarHBondContact O-N 3.48Å; Q189-L192 PolarHBondContact O-N 3.03Å; Q190-L192 VanDerWaalsContact C-N 3.34Å; Q190-L192 PolarHBondContact O-N 2.82Å; L192-H194 VanDerWaalsContact C-N 3.33Å; L192-H194 PolarHBondContact O-N 3.42Å; L192-L195 WeakPolarHBondContact O-CB 3.38Å; L192-L195 PolarHBondContact O-N 2.88Å; L192-E196 PolarHBondContact O-N 3.35Å; L192-L266 HydrophobicContact CD2-CD1 3.98Å; L192-L266 HydrophobicContact CD2-CD2 3.71Å; L192-L266 HydrophobicContact CD2-CG 4.5Å; L192-L266 HydrophobicContact CG-CD1 3.95Å
193	H	91.8	Very high	92.2	Very high	120 Å²	120	75.9 Å²	75.9	56%	0.556	36%	0.36	S	S	*	.	H	α-helix	trans	-60.4	-44.2	178.2	-177.4	63.1	0	0	0	111.8	Q189 Q190 L195 E196 G197	Q189-H193 PolarHBondContact O-N 2.83Å; Q190-H193 PolarHBondContact O-N 3.24Å; H193-L195 VanDerWaalsContact C-N 3.34Å; H193-L195 PolarHBondContact O-N 3.29Å; H193-E196 PolarHBondContact O-N 3.03Å; H193-G197 PolarHBondContact O-N 3.33Å
194	H	90.1	Very high	92.3	Very high	63 Å²	63	71.1 Å²	71.1	29%	0.292	35%	0.347	S	S	.	.	H	α-helix	trans	-62.9	-36.5	175.7	-81.6	-41.1	0	0	0	113.6	Q190 L191 L192 R198	Q190-H194 VanDerWaalsContact O-CB 3.32Å; Q190-H194 WeakPolarHBondContact O-CB 3.27Å; Q190-H194 PolarHBondContact O-CD2 3.41Å; Q190-H194 PolarHBondContact O-N 3.35Å; L191-H194 PolarHBondContact O-N 2.7Å; L192-H194 VanDerWaalsContact C-N 3.33Å; L192-H194 PolarHBondContact O-N 3.42Å; H194-R198 WeakPolarHBondContact O-CG 3.36Å; H194-R198 PolarHBondContact O-N 2.91Å; H194-R198 PolarHBondContact O-NH1 3.36Å
195	L	92	Very high	92.4	Very high	10 Å²	10	72.9 Å²	72.9	5%	0.052	35%	0.354	C	S	.	.	H	α-helix	trans	-67.6	-43.7	175.8	-178.7	65.2	0	0	0	111	L191 L192 H193 R198 R199 I259 C262 L266	L191-L195 VanDerWaalsContact O-CB 3.29Å; L191-L195 WeakPolarHBondContact O-CB 3.42Å; L191-L195 PolarHBondContact O-N 3.16Å; L192-L195 WeakPolarHBondContact O-CB 3.38Å; L192-L195 PolarHBondContact O-N 2.88Å; H193-L195 VanDerWaalsContact C-N 3.34Å; H193-L195 PolarHBondContact O-N 3.29Å; L195-R198 PolarHBondContact O-N 3.33Å; L195-R199 WeakPolarHBondContact O-CG 3.43Å; L195-R199 PolarHBondContact O-N 3.42Å; L195-I259 HydrophobicContact CD1-CG2 3.89Å; L195-C262 HydrophobicContact CD1-CB 4.34Å; L195-L266 HydrophobicContact CD2-CD2 4.08Å
196	E	92.6	Very high	92.4	Very high	135 Å²	135	70.9 Å²	70.9	63%	0.631	35%	0.351	S	S	*	.	H	α-helix	trans	-63	-47.4	177.7	-173.3	169.4	-160.2	0	0	111.8	L192 H193 R198 R199 L200	L192-E196 PolarHBondContact O-N 3.35Å; H193-E196 PolarHBondContact O-N 3.03Å; E196-R198 VanDerWaalsContact C-N 3.31Å; E196-R198 PolarHBondContact O-N 3.46Å; E196-R199 PolarHBondContact O-N 2.87Å; E196-L200 PolarHBondContact O-N 3.41Å
197	G	89.5	Confident	92.5	Very high	43 Å²	43	69.2 Å²	69.2	44%	0.443	34%	0.343	S	S	.	.	H	α-helix	trans	-57.3	-41.2	175.9	0	0	0	0	0	113.1	H193 L200 A201	H193-G197 PolarHBondContact O-N 3.33Å; G197-L200 PolarHBondContact O-N 3.4Å; G197-A201 PolarHBondContact O-N 3.06Å
198	R	92.4	Very high	92.4	Very high	73 Å²	73	66.8 Å²	66.8	28%	0.275	33%	0.334	S	S	.	.	H	α-helix	trans	-70.3	-37.7	176.7	-73.4	-178.7	176	86.6	-1.4	113.3	H194 L195 E196 L200 A201 L202 T255 E258 I259	H194-R198 WeakPolarHBondContact O-CG 3.36Å; H194-R198 PolarHBondContact O-N 2.91Å; H194-R198 PolarHBondContact O-NH1 3.36Å; L195-R198 PolarHBondContact O-N 3.33Å; E196-R198 VanDerWaalsContact C-N 3.31Å; E196-R198 PolarHBondContact O-N 3.46Å; R198-L200 VanDerWaalsContact C-N 3.31Å; R198-L200 PolarHBondContact O-N 3.07Å; R198-A201 WeakPolarHBondContact O-CB 3.35Å; R198-A201 PolarHBondContact O-N 2.56Å; R198-L202 PolarHBondContact O-N 3.29Å; R198-T255 HydrophobicContact CB-CG2 4.41Å; R198-E258 IonicContact CZ-OE2 3.13Å; R198-E258 IonicContact NE-OE2 3.76Å; R198-E258 PolarHBondContact NE-OE2 3.12Å; R198-E258 IonicContact NH2-OE2 2.82Å; R198-E258 PolarHBondContact NH2-OE2 3.17Å; R198-I259 HydrophobicContact CB-CD1 4.16Å; R198-I259 HydrophobicContact CB-CG1 3.63Å
199	R	93	Very high	92.3	Very high	141 Å²	141	65.3 Å²	65.3	53%	0.532	33%	0.328	S	S	.	.	H	α-helix	trans	-62.6	-40.2	173.9	-76.8	175.4	172.6	176.1	-0.1	111.4	L195 E196 L202 L203 I259	L195-R199 WeakPolarHBondContact O-CG 3.43Å; L195-R199 PolarHBondContact O-N 3.42Å; E196-R199 PolarHBondContact O-N 2.87Å; R199-L202 WeakPolarHBondContact O-CB 2.93Å; R199-L202 PolarHBondContact O-N 3.04Å; R199-L203 PolarHBondContact O-N 2.9Å; R199-I259 HydrophobicContact CG-CD1 4.37Å
200	L	92	Very high	92.4	Very high	85 Å²	85	66.3 Å²	66.3	45%	0.445	33%	0.331	S	S	.	.	H	α-helix	trans	-64.7	-42.5	174.2	-175.5	63.4	0	0	0	111.6	E196 G197 R198 L202 L203 A204	E196-L200 PolarHBondContact O-N 3.41Å; G197-L200 PolarHBondContact O-N 3.4Å; R198-L200 VanDerWaalsContact C-N 3.31Å; R198-L200 PolarHBondContact O-N 3.07Å; L200-L202 VanDerWaalsContact C-N 3.28Å; L200-L202 PolarHBondContact O-N 3.29Å; L200-L203 PolarHBondContact O-N 3.26Å; L200-A204 PolarHBondContact O-N 3.13Å
201	A	90.6	Very high	92.3	Very high	19 Å²	19	63.2 Å²	63.2	16%	0.157	32%	0.318	C	S	.	.	H	α-helix	trans	-59.5	-38.7	174.7	0	0	0	0	0	112.2	G197 R198 L203 A204 F205	G197-A201 PolarHBondContact O-N 3.06Å; R198-A201 WeakPolarHBondContact O-CB 3.35Å; R198-A201 PolarHBondContact O-N 2.56Å; A201-L203 PolarHBondContact O-N 3.05Å; A201-A204 WeakPolarHBondContact O-CB 3.35Å; A201-A204 PolarHBondContact O-N 3.02Å; A201-A204 VanDerWaalsContact O-N 3.16Å; A201-F205 WeakPolarHBondContact O-CD2 3.48Å; A201-F205 PolarHBondContact O-N 2.97Å
202	L	90.9	Very high	92.2	Very high	39 Å²	39	64 Å²	64	20%	0.204	32%	0.321	C	S	.	.	H	α-helix	trans	-59.5	-45.5	175.4	-177.7	59.6	0	0	0	112.2	R198 R199 L200 A204 F205 D206 K252 I256 I259	R198-L202 PolarHBondContact O-N 3.29Å; R199-L202 WeakPolarHBondContact O-CB 2.93Å; R199-L202 PolarHBondContact O-N 3.04Å; L200-L202 VanDerWaalsContact C-N 3.28Å; L200-L202 PolarHBondContact O-N 3.29Å; L202-A204 VanDerWaalsContact C-N 3.29Å; L202-A204 PolarHBondContact O-N 3.4Å; L202-F205 PolarHBondContact O-N 3.33Å; L202-D206 PolarHBondContact O-N 3.36Å; L202-K252 HydrophobicContact CD1-CD 4.18Å; L202-K252 HydrophobicContact CD1-CG 3.61Å; L202-I256 HydrophobicContact CD1-CD1 4.05Å; L202-I256 HydrophobicContact CD1-CG1 3.75Å; L202-I256 HydrophobicContact CD2-CG1 4.27Å; L202-I259 HydrophobicContact CB-CD1 4.3Å; L202-I259 HydrophobicContact CD2-CD1 4.05Å
203	L	92.1	Very high	92.2	Very high	108 Å²	108	64.9 Å²	64.9	57%	0.565	32%	0.323	S	S	*	.	H	α-helix	trans	-63	-36.9	175.2	-63.3	175.1	0	0	0	111.9	R199 L200 A201 D206 E207	R199-L203 PolarHBondContact O-N 2.9Å; L200-L203 PolarHBondContact O-N 3.26Å; A201-L203 PolarHBondContact O-N 3.05Å; L203-D206 PolarHBondContact O-N 3.47Å; L203-E207 PolarHBondContact O-N 3.48Å; L203-E207 VanDerWaalsContact O-N 3.08Å
204	A	90.9	Very high	92.3	Very high	27 Å²	27	63.3 Å²	63.3	22%	0.223	32%	0.316	C	S	.	.	H	α-helix	trans	-66	-39.4	175.3	0	0	0	0	0	112	L200 A201 L202 D206 T208	L200-A204 PolarHBondContact O-N 3.13Å; A201-A204 WeakPolarHBondContact O-CB 3.35Å; A201-A204 PolarHBondContact O-N 3.02Å; A201-A204 VanDerWaalsContact O-N 3.16Å; L202-A204 VanDerWaalsContact C-N 3.29Å; L202-A204 PolarHBondContact O-N 3.4Å; A204-D206 VanDerWaalsContact C-N 3.34Å; A204-T208 VanDerWaalsContact O-CB 3.22Å; A204-T208 WeakPolarHBondContact O-CB 3.46Å; A204-T208 PolarHBondContact O-N 2.81Å; A204-T208 PolarHBondContact O-OG1 2.93Å
205	F	93.1	Very high	92.3	Very high	43 Å²	43	61.4 Å²	61.4	19%	0.189	31%	0.307	C	S	.	.	H	α-helix	trans	-61.2	-42.8	172.9	-75.3	-60.6	0	0	0	111.7	A201 L202 T208 L209 L248 K252 T255	A201-F205 WeakPolarHBondContact O-CD2 3.48Å; A201-F205 PolarHBondContact O-N 2.97Å; L202-F205 PolarHBondContact O-N 3.33Å; F205-T208 PolarHBondContact O-N 2.93Å; F205-L209 VanDerWaalsContact O-CB 3.27Å; F205-L209 WeakPolarHBondContact O-CB 3.42Å; F205-L209 VanDerWaalsContact O-CG 3.27Å; F205-L209 WeakPolarHBondContact O-CG 3.37Å; F205-L209 PolarHBondContact O-N 2.84Å; F205-L248 HydrophobicContact CD1-CD2 3.87Å; F205-L248 HydrophobicContact CE1-CD2 4.07Å; F205-K252 HydrophobicContact CB-CB 4.06Å; F205-K252 HydrophobicContact CB-CD 4.33Å; F205-K252 HydrophobicContact CB-CG 4.13Å; F205-K252 HydrophobicContact CD2-CB 4.3Å; F205-K252 HydrophobicContact CG-CB 4.09Å; F205-T255 HydrophobicContact CE2-CG2 4.37Å; F205-T255 VanDerWaalsContact CE2-OG1 3.31Å; F205-T255 WeakPolarHBondContact CE2-OG1 3.44Å
206	D	94	Very high	92.3	Very high	67 Å²	67	61.5 Å²	61.5	36%	0.358	31%	0.309	S	S	.	.	H	α-helix	trans	-60.7	-49.1	178.4	-77.3	-31.9	0	0	0	112.4	L202 L203 A204 T208 L209 K210 K252	L202-D206 PolarHBondContact O-N 3.36Å; L203-D206 PolarHBondContact O-N 3.47Å; A204-D206 VanDerWaalsContact C-N 3.34Å; D206-T208 VanDerWaalsContact C-N 3.34Å; D206-T208 PolarHBondContact O-N 2.96Å; D206-L209 PolarHBondContact O-N 2.59Å; D206-K210 WeakPolarHBondContact O-CB 3.24Å; D206-K210 PolarHBondContact O-N 2.84Å; D206-K252 VanDerWaalsContact OD1-CE 3.22Å; D206-K252 WeakPolarHBondContact OD1-CE 3.34Å; D206-K252 IonicContact OD1-NZ 3.44Å; D206-K252 PolarHBondContact OD1-NZ 2.97Å
207	E	92.1	Very high	92.3	Very high	84 Å²	84	60.4 Å²	60.4	39%	0.393	30%	0.304	S	S	.	.	H	α-helix	trans	-67.2	-37.5	179.2	-168.3	63.7	-164	0	0	111.8	L203 K210 L211 L523	L203-E207 PolarHBondContact O-N 3.48Å; L203-E207 VanDerWaalsContact O-N 3.08Å; E207-K210 PolarHBondContact O-N 3.16Å; E207-L211 PolarHBondContact O-N 2.75Å; E207-L523 HydrophobicContact CB-CD2 4.21Å; E207-L523 HydrophobicContact CG-CD2 4.12Å
208	T	91.4	Very high	92.3	Very high	37 Å²	37	60.7 Å²	60.7	23%	0.227	30%	0.295	C	S	.	.	H	α-helix	trans	-67.6	-42.9	177.9	-56.3	0	0	0	0	111.2	A204 F205 D206 K210 L211 F212 L248	A204-T208 VanDerWaalsContact O-CB 3.22Å; A204-T208 WeakPolarHBondContact O-CB 3.46Å; A204-T208 PolarHBondContact O-N 2.81Å; A204-T208 PolarHBondContact O-OG1 2.93Å; F205-T208 PolarHBondContact O-N 2.93Å; D206-T208 VanDerWaalsContact C-N 3.34Å; D206-T208 PolarHBondContact O-N 2.96Å; T208-K210 VanDerWaalsContact C-N 3.34Å; T208-K210 PolarHBondContact O-N 2.88Å; T208-L211 WeakPolarHBondContact O-CB 3.4Å; T208-L211 PolarHBondContact O-N 3.28Å; T208-F212 HydrophobicContact CG2-CD2 3.69Å; T208-F212 HydrophobicContact CG2-CE2 3.52Å; T208-F212 WeakPolarHBondContact O-CD2 3.35Å; T208-F212 PolarHBondContact O-N 2.9Å; T208-L248 HydrophobicContact CG2-CD1 3.74Å; T208-L248 HydrophobicContact CG2-CD2 4.14Å
209	L	93.9	Very high	92.2	Very high	5 Å²	5	57.2 Å²	57.2	3%	0.026	28%	0.282	C	S	.	.	H	α-helix	trans	-59.8	-45.8	175.3	-81.9	169.6	0	0	0	111.1	F205 D206 L211 F212 Q213 I245 L248 K252	F205-L209 VanDerWaalsContact O-CB 3.27Å; F205-L209 WeakPolarHBondContact O-CB 3.42Å; F205-L209 VanDerWaalsContact O-CG 3.27Å; F205-L209 WeakPolarHBondContact O-CG 3.37Å; F205-L209 PolarHBondContact O-N 2.84Å; D206-L209 PolarHBondContact O-N 2.59Å; L209-L211 VanDerWaalsContact C-N 3.34Å; L209-L211 PolarHBondContact O-N 3.43Å; L209-F212 PolarHBondContact O-N 2.95Å; L209-Q213 WeakPolarHBondContact O-CB 3.42Å; L209-Q213 WeakPolarHBondContact O-CG 3.2Å; L209-Q213 PolarHBondContact O-N 3.16Å; L209-I245 HydrophobicContact CD2-CG2 4.06Å; L209-L248 HydrophobicContact CD2-CB 3.52Å; L209-L248 HydrophobicContact CD2-CD1 4.24Å; L209-L248 HydrophobicContact CG-CB 3.99Å; L209-K252 HydrophobicContact CD1-CD 3.89Å
210	K	94.1	Very high	92	Very high	98 Å²	98	54.3 Å²	54.3	43%	0.426	28%	0.277	S	S	.	.	H	α-helix	trans	-56.7	-47.2	175.5	-177.9	-177.4	172.8	-168.8	0	111.5	D206 E207 T208 F212 Q213 E214	D206-K210 WeakPolarHBondContact O-CB 3.24Å; D206-K210 PolarHBondContact O-N 2.84Å; E207-K210 PolarHBondContact O-N 3.16Å; T208-K210 VanDerWaalsContact C-N 3.34Å; T208-K210 PolarHBondContact O-N 2.88Å; K210-F212 PolarHBondContact O-N 3.28Å; K210-Q213 PolarHBondContact O-N 3.43Å; K210-E214 WeakPolarHBondContact CE-OE1 3.39Å; K210-E214 WeakPolarHBondContact CG-OE1 3.47Å; K210-E214 WeakPolarHBondContact O-CB 3.36Å; K210-E214 WeakPolarHBondContact O-CG 2.95Å; K210-E214 PolarHBondContact O-N 2.93Å
211	L	92.6	Very high	91.9	Very high	50 Å²	50	55.6 Å²	55.6	26%	0.262	28%	0.281	S	S	.	.	H	α-helix	trans	-58.4	-47.4	176.6	-179	70.4	0	0	0	112.3	E207 T208 L209 Q213 E214 Q215	E207-L211 PolarHBondContact O-N 2.75Å; T208-L211 WeakPolarHBondContact O-CB 3.4Å; T208-L211 PolarHBondContact O-N 3.28Å; L209-L211 VanDerWaalsContact C-N 3.34Å; L209-L211 PolarHBondContact O-N 3.43Å; L211-Q213 VanDerWaalsContact C-N 3.35Å; L211-E214 PolarHBondContact O-N 2.89Å; L211-Q215 WeakPolarHBondContact O-CB 3.33Å; L211-Q215 PolarHBondContact O-N 2.99Å
212	F	92.1	Very high	91.6	Very high	36 Å²	36	57.7 Å²	57.7	16%	0.158	29%	0.286	C	S	.	.	H	α-helix	trans	-68.1	-34.6	179.5	-80.9	-72.3	0	0	0	112.7	T208 L209 K210 Q215 A216 L241 R244 I245 L248	T208-F212 HydrophobicContact CG2-CD2 3.69Å; T208-F212 HydrophobicContact CG2-CE2 3.52Å; T208-F212 WeakPolarHBondContact O-CD2 3.35Å; T208-F212 PolarHBondContact O-N 2.9Å; L209-F212 PolarHBondContact O-N 2.95Å; K210-F212 PolarHBondContact O-N 3.28Å; F212-Q215 PolarHBondContact O-N 2.78Å; F212-A216 WeakPolarHBondContact O-CB 3.47Å; F212-A216 PolarHBondContact O-N 2.93Å; F212-L241 HydrophobicContact CD1-CD2 3.68Å; F212-L241 HydrophobicContact CE1-CD2 4.17Å; F212-R244 HydrophobicContact CD1-CB 4.5Å; F212-R244 HydrophobicContact CD1-CG 4.14Å; F212-R244 HydrophobicContact CD2-CG 4.3Å; F212-R244 HydrophobicContact CE1-CB 4.38Å; F212-R244 HydrophobicContact CE1-CG 3.74Å; F212-R244 HydrophobicContact CE2-CG 3.92Å; F212-R244 HydrophobicContact CG-CG 4.43Å; F212-R244 HydrophobicContact CZ-CG 3.63Å; F212-I245 HydrophobicContact CB-CD1 4.15Å; F212-I245 HydrophobicContact CB-CG1 3.6Å; F212-L248 HydrophobicContact CD2-CD1 3.38Å; F212-L248 HydrophobicContact CE2-CD1 3.68Å; F212-L248 HydrophobicContact CG-CD1 4.31Å
213	Q	94.8	Very high	91.3	Very high	79 Å²	79	58 Å²	58	37%	0.369	29%	0.287	S	S	.	.	H	α-helix	trans	-64.5	-50	174.4	-74.4	168.6	-6.1	0	0	110.9	L209 K210 L211 Q215 A216 E217 I245	L209-Q213 WeakPolarHBondContact O-CB 3.42Å; L209-Q213 WeakPolarHBondContact O-CG 3.2Å; L209-Q213 PolarHBondContact O-N 3.16Å; K210-Q213 PolarHBondContact O-N 3.43Å; L211-Q213 VanDerWaalsContact C-N 3.35Å; Q213-Q215 VanDerWaalsContact C-N 3.27Å; Q213-Q215 PolarHBondContact O-N 3.13Å; Q213-A216 WeakPolarHBondContact O-CB 3.46Å; Q213-A216 PolarHBondContact O-N 3.44Å; Q213-A216 VanDerWaalsContact O-N 3.1Å; Q213-E217 WeakPolarHBondContact O-CG 3.4Å; Q213-E217 PolarHBondContact O-N 3.49Å; Q213-I245 HydrophobicContact CG-CD1 4.13Å
214	E	94.5	Very high	90.8	Very high	87 Å²	87	57.1 Å²	57.1	41%	0.407	29%	0.29	S	S	.	.	H	α-helix	trans	-57.4	-41.6	174.8	-72.2	174.4	-174.7	0	0	111.2	K210 L211 A216 E217 L218	K210-E214 WeakPolarHBondContact CE-OE1 3.39Å; K210-E214 WeakPolarHBondContact CG-OE1 3.47Å; K210-E214 WeakPolarHBondContact O-CB 3.36Å; K210-E214 WeakPolarHBondContact O-CG 2.95Å; K210-E214 PolarHBondContact O-N 2.93Å; L211-E214 PolarHBondContact O-N 2.89Å; E214-A216 PolarHBondContact O-N 3.38Å; E214-E217 PolarHBondContact O-N 2.93Å; E214-L218 WeakPolarHBondContact O-CB 3.42Å; E214-L218 WeakPolarHBondContact O-CG 3.29Å; E214-L218 PolarHBondContact O-N 3.03Å
215	Q	90.9	Very high	90.5	Very high	24 Å²	24	64 Å²	64	11%	0.112	31%	0.314	C	S	.	.	H	α-helix	trans	-65.8	-37.3	176.9	-169.6	58.2	40.9	0	0	112.7	L211 F212 Q213 N219 L241	L211-Q215 WeakPolarHBondContact O-CB 3.33Å; L211-Q215 PolarHBondContact O-N 2.99Å; F212-Q215 PolarHBondContact O-N 2.78Å; Q213-Q215 VanDerWaalsContact C-N 3.27Å; Q213-Q215 PolarHBondContact O-N 3.13Å; Q215-N219 WeakPolarHBondContact O-CB 3.17Å; Q215-N219 PolarHBondContact O-N 3.33Å; Q215-L241 HydrophobicContact CB-CD1 4.46Å; Q215-L241 HydrophobicContact CB-CD2 4.23Å; Q215-L241 HydrophobicContact CG-CD1 3.95Å; Q215-L241 HydrophobicContact CG-CD2 3.87Å
216	A	91.1	Very high	89.9	Confident	11 Å²	11	62.8 Å²	62.8	9%	0.091	31%	0.312	C	S	.	.	H	α-helix	trans	-68.7	-39.4	176.2	0	0	0	0	0	111.7	F212 Q213 E214 N219 L220 L238 L241 I245	F212-A216 WeakPolarHBondContact O-CB 3.47Å; F212-A216 PolarHBondContact O-N 2.93Å; Q213-A216 WeakPolarHBondContact O-CB 3.46Å; Q213-A216 PolarHBondContact O-N 3.44Å; Q213-A216 VanDerWaalsContact O-N 3.1Å; E214-A216 PolarHBondContact O-N 3.38Å; A216-N219 PolarHBondContact O-N 2.94Å; A216-L220 WeakPolarHBondContact O-CG 3.29Å; A216-L220 PolarHBondContact O-N 2.92Å; A216-L238 HydrophobicContact CB-CD1 4.05Å; A216-L241 HydrophobicContact CB-CB 4.32Å; A216-L241 HydrophobicContact CB-CD1 4.33Å; A216-I245 HydrophobicContact CB-CD1 4.29Å
217	E	93.3	Very high	89.5	Confident	113 Å²	113	66 Å²	66	53%	0.528	33%	0.325	S	S	.	.	H	α-helix	trans	-63.1	-45.7	173.5	-72.1	177.3	-167.8	0	0	111.6	Q213 E214 N219 L220 Q221	Q213-E217 WeakPolarHBondContact O-CG 3.4Å; Q213-E217 PolarHBondContact O-N 3.49Å; E214-E217 PolarHBondContact O-N 2.93Å; E217-N219 PolarHBondContact O-N 3.07Å; E217-L220 WeakPolarHBondContact O-CB 3.42Å; E217-L220 PolarHBondContact O-N 3.35Å; E217-Q221 WeakPolarHBondContact O-CG 3.34Å; E217-Q221 PolarHBondContact O-N 2.78Å
218	L	89.3	Confident	88.9	Confident	48 Å²	48	69.3 Å²	69.3	25%	0.251	34%	0.343	S	S	.	.	H	α-helix	trans	-59.3	-47.3	174.7	-74.4	171.9	0	0	0	111.1	E214 L220 Q221 F222	E214-L218 WeakPolarHBondContact O-CB 3.42Å; E214-L218 WeakPolarHBondContact O-CG 3.29Å; E214-L218 PolarHBondContact O-N 3.03Å; L218-L220 VanDerWaalsContact C-N 3.32Å; L218-L220 PolarHBondContact O-N 2.71Å; L218-Q221 PolarHBondContact O-N 3.22Å; L218-Q221 VanDerWaalsContact O-N 3.13Å; L218-F222 HydrophobicContact CD2-CE2 4.42Å; L218-F222 VanDerWaalsContact O-CD2 3.27Å; L218-F222 WeakPolarHBondContact O-CD2 3.4Å; L218-F222 PolarHBondContact O-N 3.31Å
219	N	89.2	Confident	88.3	Confident	0 Å²	0	73 Å²	73	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-55.1	-47.1	177.2	-176.7	-46.5	0	0	0	111.4	Q215 A216 E217 Q221 F222 Q223 M234 N237 L241	Q215-N219 WeakPolarHBondContact O-CB 3.17Å; Q215-N219 PolarHBondContact O-N 3.33Å; A216-N219 PolarHBondContact O-N 2.94Å; E217-N219 PolarHBondContact O-N 3.07Å; N219-Q221 PolarHBondContact O-N 3.27Å; N219-F222 PolarHBondContact O-N 3.43Å; N219-Q223 WeakPolarHBondContact O-CB 3.18Å; N219-Q223 PolarHBondContact O-N 3.3Å; N219-M234 PolarHBondContact ND2-O 2.99Å; N219-M234 VanDerWaalsContact ND2-O 3.1Å; N219-M234 PolarHBondContact OD1-O 3.3Å; N219-N237 PolarHBondContact ND2-ND2 3.49Å; N219-L241 HydrophobicContact CB-CD1 4.27Å
220	L	90.5	Very high	87.7	Confident	80 Å²	80	75.3 Å²	75.3	42%	0.419	37%	0.369	S	S	.	.	H	α-helix	trans	-59.3	-43.3	176.6	-76	168.5	0	0	0	112.9	A216 E217 L218 F222 Q223 L238	A216-L220 WeakPolarHBondContact O-CG 3.29Å; A216-L220 PolarHBondContact O-N 2.92Å; E217-L220 WeakPolarHBondContact O-CB 3.42Å; E217-L220 PolarHBondContact O-N 3.35Å; L218-L220 VanDerWaalsContact C-N 3.32Å; L218-L220 PolarHBondContact O-N 2.71Å; L220-F222 PolarHBondContact O-N 2.97Å; L220-Q223 PolarHBondContact O-N 3.49Å; L220-L238 HydrophobicContact CD2-CD1 4.5Å; L220-L238 HydrophobicContact CD2-CD2 3.56Å; L220-L238 HydrophobicContact CG-CD1 4.14Å; L220-L238 HydrophobicContact CG-CD2 4.11Å
221	Q	88.1	Confident	87.3	Confident	113 Å²	113	74.1 Å²	74.1	53%	0.528	36%	0.364	S	S	.	.	H	α-helix	trans	-61.7	-44.2	178.7	-70.3	175.5	25.3	0	0	111.6	E217 L218 N219 S224	E217-Q221 WeakPolarHBondContact O-CG 3.34Å; E217-Q221 PolarHBondContact O-N 2.78Å; L218-Q221 PolarHBondContact O-N 3.22Å; L218-Q221 VanDerWaalsContact O-N 3.13Å; N219-Q221 PolarHBondContact O-N 3.27Å; Q221-S224 PolarHBondContact O-OG 2.92Å
222	F	85.3	Confident	86.9	Confident	63 Å²	63	77.3 Å²	77.3	28%	0.276	38%	0.377	S	S	.	.	H	α-helix	trans	-76.1	-28.6	-179.9	-77.7	-80.4	0	0	0	113.4	L218 N219 L220 S224 K225 A226 M234 V489	L218-F222 HydrophobicContact CD2-CE2 4.42Å; L218-F222 VanDerWaalsContact O-CD2 3.27Å; L218-F222 WeakPolarHBondContact O-CD2 3.4Å; L218-F222 PolarHBondContact O-N 3.31Å; N219-F222 PolarHBondContact O-N 3.43Å; L220-F222 PolarHBondContact O-N 2.97Å; F222-S224 PolarHBondContact O-N 3.39Å; F222-K225 PolarHBondContact O-N 3.14Å; F222-A226 PolarHBondContact O-N 3.09Å; F222-M234 HydrophobicContact CB-CE 4.31Å; F222-M234 HydrophobicContact CB-SD 4.47Å; F222-V489 HydrophobicContact CD2-CG1 3.57Å; F222-V489 HydrophobicContact CE2-CG1 3.84Å; F222-V489 HydrophobicContact CG-CG1 3.97Å; F222-V489 HydrophobicContact CZ-CG1 4.44Å
223	Q	85	Confident	86.5	Confident	46 Å²	46	83.6 Å²	83.6	22%	0.215	40%	0.4	C	S	.	.	H	α-helix	trans	-59.6	-34	177	-168.8	177.1	36.1	0	0	112.6	N219 L220 K225 A226 K231 M234	N219-Q223 WeakPolarHBondContact O-CB 3.18Å; N219-Q223 PolarHBondContact O-N 3.3Å; L220-Q223 PolarHBondContact O-N 3.49Å; Q223-K225 PolarHBondContact O-N 3.09Å; Q223-A226 PolarHBondContact O-N 2.84Å; Q223-K231 HydrophobicContact CG-CG 4.42Å; Q223-K231 PolarHBondContact NE2-O 3.43Å; Q223-M234 VanDerWaalsContact CA-SD 3.59Å; Q223-M234 HydrophobicContact CB-CB 4.36Å; Q223-M234 HydrophobicContact CB-SD 4.16Å; Q223-M234 HydrophobicContact CG-CB 4.17Å
224	S	80.9	Confident	86.1	Confident	89 Å²	89	81.8 Å²	81.8	62%	0.622	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-29.3	175.6	71.8	0	0	0	0	113.4	Q221 F222	Q221-S224 PolarHBondContact O-OG 2.92Å; F222-S224 PolarHBondContact O-N 3.39Å
225	K	84.2	Confident	85.9	Confident	171 Å²	171	79.2 Å²	79.2	74%	0.743	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-9.5	-176	-60.1	177.7	-175.4	173.5	0	113.2	F222 Q223	F222-K225 PolarHBondContact O-N 3.14Å; Q223-K225 PolarHBondContact O-N 3.09Å
226	A	81.9	Confident	85.8	Confident	18 Å²	18	82.7 Å²	82.7	15%	0.149	40%	0.402	C	S	.	.	S	Bend	trans	-75.6	153.5	-174.4	0	0	0	0	0	112.9	F222 Q223 D230 K231 M234	F222-A226 PolarHBondContact O-N 3.09Å; Q223-A226 PolarHBondContact O-N 2.84Å; A226-D230 HydrophobicContact CB-CB 4.06Å; A226-K231 HydrophobicContact CB-CG 4.06Å; A226-K231 WeakPolarHBondContact O-CE 3.45Å; A226-M234 HydrophobicContact CB-CE 3.89Å; A226-M234 HydrophobicContact CB-SD 3.59Å; A226-M234 VanDerWaalsContact CB-SD 3.59Å
227	Q	84.7	Confident	85.6	Confident	133 Å²	133	82.8 Å²	82.8	62%	0.621	40%	0.401	S	S	*	.			trans	-69.5	160.4	170.4	-62.8	-168.7	3.8	0	0	111	H229 D230 K231	Q227-H229 VanDerWaalsContact C-N 3.3Å; Q227-H229 PolarHBondContact O-N 2.88Å; Q227-H229 PolarHBondContact OE1-CE1 3.49Å; Q227-D230 PolarHBondContact O-N 3.24Å; Q227-D230 VanDerWaalsContact O-N 3.09Å; Q227-K231 WeakPolarHBondContact O-CG 3.49Å; Q227-K231 PolarHBondContact O-N 3.32Å
228	M	79.2	Confident	85.5	Confident	155 Å²	155	77.8 Å²	77.8	76%	0.764	38%	0.378	S	S	*	.	H	α-helix	trans	-56.1	-37.6	-172	-73.4	-62.7	-168.5	0	0	114.4	K231	M228-K231 HydrophobicContact SD-CD 4.11Å
229	H	78.7	Confident	85.7	Confident	114 Å²	114	80.2 Å²	80.2	53%	0.528	39%	0.391	S	S	.	.	H	α-helix	trans	-73	-35.2	179.1	61.9	-90.7	0	0	0	112.7	Q227	Q227-H229 VanDerWaalsContact C-N 3.3Å; Q227-H229 PolarHBondContact O-N 2.88Å; Q227-H229 PolarHBondContact OE1-CE1 3.49Å
230	D	81.6	Confident	85.9	Confident	53 Å²	53	83.1 Å²	83.1	28%	0.283	41%	0.406	S	S	.	.	H	α-helix	trans	-72.4	-30	176.1	-70.2	-31.2	0	0	0	112.3	A226 Q227 H232 R233 M234	A226-D230 HydrophobicContact CB-CB 4.06Å; Q227-D230 PolarHBondContact O-N 3.24Å; Q227-D230 VanDerWaalsContact O-N 3.09Å; D230-H232 PolarHBondContact O-N 2.83Å; D230-R233 PolarHBondContact O-N 2.93Å; D230-M234 WeakPolarHBondContact O-CB 3.26Å; D230-M234 WeakPolarHBondContact O-CG 3.45Å; D230-M234 PolarHBondContact O-N 3.3Å
231	K	84.7	Confident	85.9	Confident	73 Å²	73	79.3 Å²	79.3	32%	0.317	39%	0.386	S	S	.	.	H	α-helix	trans	-56.5	-36.7	176.4	-75	-176.9	-176.5	-177.3	0	112.9	Q223 A226 Q227 M228 A235	Q223-K231 HydrophobicContact CG-CG 4.42Å; Q223-K231 PolarHBondContact NE2-O 3.43Å; A226-K231 HydrophobicContact CB-CG 4.06Å; A226-K231 WeakPolarHBondContact O-CE 3.45Å; Q227-K231 WeakPolarHBondContact O-CG 3.49Å; Q227-K231 PolarHBondContact O-N 3.32Å; M228-K231 HydrophobicContact SD-CD 4.11Å; K231-A235 WeakPolarHBondContact O-CB 3.36Å; K231-A235 PolarHBondContact O-N 2.98Å
232	H	85.2	Confident	86.2	Confident	117 Å²	117	80.1 Å²	80.1	54%	0.542	38%	0.384	S	S	.	.	H	α-helix	trans	-65.3	-52.5	176.7	-173.8	-83.2	0	0	0	111.2	D230 M234 A235 E236	D230-H232 PolarHBondContact O-N 2.83Å; H232-M234 VanDerWaalsContact C-N 3.28Å; H232-M234 PolarHBondContact O-N 3.4Å; H232-A235 WeakPolarHBondContact O-CA 3.15Å; H232-A235 WeakPolarHBondContact O-CB 3.27Å; H232-A235 PolarHBondContact O-N 3.18Å; H232-E236 IonicContact CE1-OE1 2.79Å; H232-E236 PolarHBondContact CE1-OE1 3.33Å; H232-E236 IonicContact CE1-OE2 2.99Å; H232-E236 VanDerWaalsContact ND1-CD 3.28Å; H232-E236 IonicContact ND1-OE1 3.48Å; H232-E236 PolarHBondContact ND1-OE1 3.45Å; H232-E236 IonicContact ND1-OE2 3.43Å; H232-E236 PolarHBondContact ND1-OE2 2.89Å; H232-E236 PolarHBondContact O-N 3.36Å
233	R	83.8	Confident	86.7	Confident	169 Å²	169	79.9 Å²	79.9	64%	0.638	39%	0.391	S	S	*	.	H	α-helix	trans	-59	-39.8	177.8	-67.4	179.5	175.9	171.4	-3.2	112.1	D230 E236 N237	D230-R233 PolarHBondContact O-N 2.93Å; R233-E236 PolarHBondContact O-N 3Å; R233-N237 WeakPolarHBondContact O-CB 3.41Å; R233-N237 PolarHBondContact O-N 3.38Å
234	M	86.7	Confident	87	Confident	40 Å²	40	81 Å²	81	20%	0.197	39%	0.393	C	S	.	.	H	α-helix	trans	-65.1	-39	175.1	-71.6	-175.9	178.9	0	0	112	N219 F222 Q223 A226 D230 H232 N237 L238	N219-M234 PolarHBondContact ND2-O 2.99Å; N219-M234 VanDerWaalsContact ND2-O 3.1Å; N219-M234 PolarHBondContact OD1-O 3.3Å; F222-M234 HydrophobicContact CB-CE 4.31Å; F222-M234 HydrophobicContact CB-SD 4.47Å; Q223-M234 VanDerWaalsContact CA-SD 3.59Å; Q223-M234 HydrophobicContact CB-CB 4.36Å; Q223-M234 HydrophobicContact CB-SD 4.16Å; Q223-M234 HydrophobicContact CG-CB 4.17Å; A226-M234 HydrophobicContact CB-CE 3.89Å; A226-M234 HydrophobicContact CB-SD 3.59Å; A226-M234 VanDerWaalsContact CB-SD 3.59Å; D230-M234 WeakPolarHBondContact O-CB 3.26Å; D230-M234 WeakPolarHBondContact O-CG 3.45Å; D230-M234 PolarHBondContact O-N 3.3Å; H232-M234 VanDerWaalsContact C-N 3.28Å; H232-M234 PolarHBondContact O-N 3.4Å; M234-N237 PolarHBondContact O-N 3.22Å; M234-L238 WeakPolarHBondContact O-CB 3.44Å; M234-L238 PolarHBondContact O-N 3.36Å
235	A	88.8	Confident	87.6	Confident	33 Å²	33	78.1 Å²	78.1	27%	0.273	37%	0.37	S	S	.	.	H	α-helix	trans	-64.5	-41.7	175	0	0	0	0	0	112.2	K231 H232 L238 N239	K231-A235 WeakPolarHBondContact O-CB 3.36Å; K231-A235 PolarHBondContact O-N 2.98Å; H232-A235 WeakPolarHBondContact O-CA 3.15Å; H232-A235 WeakPolarHBondContact O-CB 3.27Å; H232-A235 PolarHBondContact O-N 3.18Å; A235-L238 PolarHBondContact O-N 3.26Å; A235-N239 PolarHBondContact O-N 3.09Å; A235-N239 PolarHBondContact O-ND2 3.14Å
236	E	88.9	Confident	88.2	Confident	97 Å²	97	77.9 Å²	77.9	45%	0.453	36%	0.364	S	S	.	.	H	α-helix	trans	-62	-48.8	174	-69.3	172.4	139.1	0	0	111.2	H232 R233 L238 N239 I240	H232-E236 IonicContact CE1-OE1 2.79Å; H232-E236 PolarHBondContact CE1-OE1 3.33Å; H232-E236 IonicContact CE1-OE2 2.99Å; H232-E236 VanDerWaalsContact ND1-CD 3.28Å; H232-E236 IonicContact ND1-OE1 3.48Å; H232-E236 PolarHBondContact ND1-OE1 3.45Å; H232-E236 IonicContact ND1-OE2 3.43Å; H232-E236 PolarHBondContact ND1-OE2 2.89Å; H232-E236 PolarHBondContact O-N 3.36Å; R233-E236 PolarHBondContact O-N 3Å; E236-L238 VanDerWaalsContact C-N 3.29Å; E236-L238 PolarHBondContact O-N 3.3Å; E236-N239 WeakPolarHBondContact O-CB 3.37Å; E236-N239 PolarHBondContact O-N 2.87Å; E236-I240 WeakPolarHBondContact O-CG1 3.35Å; E236-I240 PolarHBondContact O-N 3.42Å
237	N	88.6	Confident	88.8	Confident	14 Å²	14	80.3 Å²	80.3	8%	0.075	38%	0.375	C	S	.	.	H	α-helix	trans	-58.5	-41.6	176.1	-173.9	30.2	0	0	0	111.6	N219 R233 M234 N239 I240 L241 P486 V487	N219-N237 PolarHBondContact ND2-ND2 3.49Å; R233-N237 WeakPolarHBondContact O-CB 3.41Å; R233-N237 PolarHBondContact O-N 3.38Å; M234-N237 PolarHBondContact O-N 3.22Å; N237-N239 VanDerWaalsContact C-N 3.32Å; N237-N239 PolarHBondContact O-N 3.09Å; N237-I240 PolarHBondContact O-N 2.86Å; N237-L241 VanDerWaalsContact O-CG 3.31Å; N237-L241 WeakPolarHBondContact O-CG 3.4Å; N237-L241 PolarHBondContact O-N 2.98Å; N237-P486 VanDerWaalsContact OD1-CA 3.25Å; N237-P486 WeakPolarHBondContact OD1-CA 3.41Å; N237-P486 WeakPolarHBondContact OD1-CB 3.27Å; N237-V487 PolarHBondContact ND2-O 3.08Å
238	L	91	Very high	89.2	Confident	8 Å²	8	74.6 Å²	74.6	4%	0.042	35%	0.348	C	S	.	.	H	α-helix	trans	-62	-38.3	175.4	-178.3	65	0	0	0	112.2	A216 L220 M234 A235 E236 L241 R242	A216-L238 HydrophobicContact CB-CD1 4.05Å; L220-L238 HydrophobicContact CD2-CD1 4.5Å; L220-L238 HydrophobicContact CD2-CD2 3.56Å; L220-L238 HydrophobicContact CG-CD1 4.14Å; L220-L238 HydrophobicContact CG-CD2 4.11Å; M234-L238 WeakPolarHBondContact O-CB 3.44Å; M234-L238 PolarHBondContact O-N 3.36Å; A235-L238 PolarHBondContact O-N 3.26Å; E236-L238 VanDerWaalsContact C-N 3.29Å; E236-L238 PolarHBondContact O-N 3.3Å; L238-L241 PolarHBondContact O-N 3.33Å; L238-R242 WeakPolarHBondContact O-CB 3.47Å; L238-R242 VanDerWaalsContact O-CG 3.28Å; L238-R242 WeakPolarHBondContact O-CG 3.49Å; L238-R242 PolarHBondContact O-N 2.88Å
239	N	93.8	Very high	90.1	Very high	98 Å²	98	70.4 Å²	70.4	52%	0.524	33%	0.327	S	S	.	.	H	α-helix	trans	-65.5	-40	175.2	-71.8	-28	0	0	0	111.8	A235 E236 N237 R242 S243	A235-N239 PolarHBondContact O-N 3.09Å; A235-N239 PolarHBondContact O-ND2 3.14Å; E236-N239 WeakPolarHBondContact O-CB 3.37Å; E236-N239 PolarHBondContact O-N 2.87Å; N237-N239 VanDerWaalsContact C-N 3.32Å; N237-N239 PolarHBondContact O-N 3.09Å; N239-R242 PolarHBondContact O-N 3.41Å; N239-S243 WeakPolarHBondContact O-CB 3.41Å; N239-S243 PolarHBondContact O-N 2.86Å
240	I	91.5	Very high	90.9	Very high	61 Å²	61	68.4 Å²	68.4	31%	0.313	32%	0.32	S	S	.	.	H	α-helix	trans	-62.2	-49.5	174.2	-64.5	169.7	0	0	0	110.4	E236 N237 R242 S243 R244	E236-I240 WeakPolarHBondContact O-CG1 3.35Å; E236-I240 PolarHBondContact O-N 3.42Å; N237-I240 PolarHBondContact O-N 2.86Å; I240-R242 VanDerWaalsContact C-N 3.34Å; I240-R242 PolarHBondContact O-N 2.91Å; I240-S243 WeakPolarHBondContact O-CB 3.24Å; I240-S243 PolarHBondContact O-N 3.27Å; I240-R244 WeakPolarHBondContact O-CB 2.96Å; I240-R244 PolarHBondContact O-N 2.94Å
241	L	91.1	Very high	91.5	Very high	1 Å²	1	67.5 Å²	67.5	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-57.2	-46.6	177.9	-68.8	169.4	0	0	0	111.3	F212 Q215 A216 N219 N237 L238 R244 I245 P486	F212-L241 HydrophobicContact CD1-CD2 3.68Å; F212-L241 HydrophobicContact CE1-CD2 4.17Å; Q215-L241 HydrophobicContact CB-CD1 4.46Å; Q215-L241 HydrophobicContact CB-CD2 4.23Å; Q215-L241 HydrophobicContact CG-CD1 3.95Å; Q215-L241 HydrophobicContact CG-CD2 3.87Å; A216-L241 HydrophobicContact CB-CB 4.32Å; A216-L241 HydrophobicContact CB-CD1 4.33Å; N219-L241 HydrophobicContact CB-CD1 4.27Å; N237-L241 VanDerWaalsContact O-CG 3.31Å; N237-L241 WeakPolarHBondContact O-CG 3.4Å; N237-L241 PolarHBondContact O-N 2.98Å; L238-L241 PolarHBondContact O-N 3.33Å; L241-R244 PolarHBondContact O-N 3.03Å; L241-I245 VanDerWaalsContact O-CG1 3.27Å; L241-I245 WeakPolarHBondContact O-CG1 3.44Å; L241-I245 PolarHBondContact O-N 3.43Å; L241-P486 HydrophobicContact CD2-CB 3.92Å; L241-P486 HydrophobicContact CD2-CG 4.16Å; L241-P486 HydrophobicContact CG-CB 4.35Å
242	R	95.6	Very high	92.1	Very high	129 Å²	129	66 Å²	66	49%	0.487	31%	0.311	S	S	.	.	H	α-helix	trans	-63	-43.2	177.3	-75.4	172.4	173.3	174.2	-2.2	112.8	L238 N239 I240 R244 I245 R246	L238-R242 WeakPolarHBondContact O-CB 3.47Å; L238-R242 VanDerWaalsContact O-CG 3.28Å; L238-R242 WeakPolarHBondContact O-CG 3.49Å; L238-R242 PolarHBondContact O-N 2.88Å; N239-R242 PolarHBondContact O-N 3.41Å; I240-R242 VanDerWaalsContact C-N 3.34Å; I240-R242 PolarHBondContact O-N 2.91Å; R242-R244 VanDerWaalsContact C-N 3.3Å; R242-R244 PolarHBondContact O-N 2.98Å; R242-I245 PolarHBondContact O-N 2.82Å; R242-R246 PolarHBondContact O-N 2.91Å
243	S	94.3	Very high	92.6	Very high	59 Å²	59	66.4 Å²	66.4	41%	0.413	31%	0.313	S	S	.	.	H	α-helix	trans	-59.4	-44.3	175	-173.9	0	0	0	0	110.7	N239 I240 R246 L247	N239-S243 WeakPolarHBondContact O-CB 3.41Å; N239-S243 PolarHBondContact O-N 2.86Å; I240-S243 WeakPolarHBondContact O-CB 3.24Å; I240-S243 PolarHBondContact O-N 3.27Å; S243-R246 WeakPolarHBondContact O-CB 3.27Å; S243-R246 PolarHBondContact O-N 3.46Å; S243-L247 WeakPolarHBondContact O-CG 3.5Å; S243-L247 PolarHBondContact O-N 3.36Å
244	R	91.1	Very high	93.2	Very high	69 Å²	69	64.8 Å²	64.8	26%	0.26	31%	0.311	S	S	.	.	H	α-helix	trans	-65.9	-41.8	179	-171.9	51.7	171	-111	14.3	113	F212 I240 L241 R242 R246 L247 L248 I481	F212-R244 HydrophobicContact CD1-CB 4.5Å; F212-R244 HydrophobicContact CD1-CG 4.14Å; F212-R244 HydrophobicContact CD2-CG 4.3Å; F212-R244 HydrophobicContact CE1-CB 4.38Å; F212-R244 HydrophobicContact CE1-CG 3.74Å; F212-R244 HydrophobicContact CE2-CG 3.92Å; F212-R244 HydrophobicContact CG-CG 4.43Å; F212-R244 HydrophobicContact CZ-CG 3.63Å; I240-R244 WeakPolarHBondContact O-CB 2.96Å; I240-R244 PolarHBondContact O-N 2.94Å; L241-R244 PolarHBondContact O-N 3.03Å; R242-R244 VanDerWaalsContact C-N 3.3Å; R242-R244 PolarHBondContact O-N 2.98Å; R244-R246 VanDerWaalsContact C-N 3.31Å; R244-R246 PolarHBondContact O-N 2.75Å; R244-L247 PolarHBondContact O-N 3.31Å; R244-L248 HydrophobicContact CG-CD1 4.2Å; R244-L248 WeakPolarHBondContact O-CB 3.48Å; R244-L248 WeakPolarHBondContact O-CG 3.11Å; R244-L248 PolarHBondContact O-N 3.24Å; R244-I481 VanDerWaalsContact CZ-CB 3.44Å
245	I	95.3	Very high	93.6	Very high	28 Å²	28	63.7 Å²	63.7	14%	0.144	31%	0.307	C	S	.	.	H	α-helix	trans	-58.2	-45	173.9	-70.9	166.1	0	0	0	110.5	L209 F212 Q213 A216 L241 R242 L248 H249	L209-I245 HydrophobicContact CD2-CG2 4.06Å; F212-I245 HydrophobicContact CB-CD1 4.15Å; F212-I245 HydrophobicContact CB-CG1 3.6Å; Q213-I245 HydrophobicContact CG-CD1 4.13Å; A216-I245 HydrophobicContact CB-CD1 4.29Å; L241-I245 VanDerWaalsContact O-CG1 3.27Å; L241-I245 WeakPolarHBondContact O-CG1 3.44Å; L241-I245 PolarHBondContact O-N 3.43Å; R242-I245 PolarHBondContact O-N 2.82Å; I245-L248 PolarHBondContact O-N 3.46Å; I245-H249 PolarHBondContact O-N 3.45Å
246	R	96.8	Very high	94	Very high	166 Å²	166	65.1 Å²	65.1	63%	0.626	31%	0.309	S	S	*	.	H	α-helix	trans	-60.6	-49.5	177.7	-172.5	-174.6	-61.4	152.4	1	111.6	R242 S243 R244 L248 H249 D250	R242-R246 PolarHBondContact O-N 2.91Å; S243-R246 WeakPolarHBondContact O-CB 3.27Å; S243-R246 PolarHBondContact O-N 3.46Å; R244-R246 VanDerWaalsContact C-N 3.31Å; R244-R246 PolarHBondContact O-N 2.75Å; R246-L248 VanDerWaalsContact C-N 3.3Å; R246-L248 PolarHBondContact O-N 2.89Å; R246-H249 WeakPolarHBondContact O-CB 3.38Å; R246-H249 PolarHBondContact O-N 3.41Å; R246-H249 VanDerWaalsContact O-N 3.13Å; R246-D250 PolarHBondContact O-N 3.31Å
247	L	94.1	Very high	94.3	Very high	69 Å²	69	63.3 Å²	63.3	36%	0.361	31%	0.31	S	S	.	.	H	α-helix	trans	-59.7	-40.3	178.1	-69.4	172.9	0	0	0	112.5	S243 R244 D250 S251 I481	S243-L247 WeakPolarHBondContact O-CG 3.5Å; S243-L247 PolarHBondContact O-N 3.36Å; R244-L247 PolarHBondContact O-N 3.31Å; L247-D250 PolarHBondContact O-N 3.31Å; L247-S251 WeakPolarHBondContact O-CB 3.29Å; L247-S251 PolarHBondContact O-N 3.45Å; L247-S251 PolarHBondContact O-OG 2.95Å; L247-I481 HydrophobicContact CB-CD1 4.26Å; L247-I481 HydrophobicContact CD1-CD1 4.09Å; L247-I481 HydrophobicContact CD1-CG1 4.46Å; L247-I481 HydrophobicContact CD1-CG2 4.44Å
248	L	93.2	Very high	94.6	Very high	14 Å²	14	66.8 Å²	66.8	7%	0.073	33%	0.326	C	S	.	.	H	α-helix	trans	-65.6	-39	176.1	-75	167.1	0	0	0	112	F205 T208 L209 F212 R244 I245 R246 K252	F205-L248 HydrophobicContact CD1-CD2 3.87Å; F205-L248 HydrophobicContact CE1-CD2 4.07Å; T208-L248 HydrophobicContact CG2-CD1 3.74Å; T208-L248 HydrophobicContact CG2-CD2 4.14Å; L209-L248 HydrophobicContact CD2-CB 3.52Å; L209-L248 HydrophobicContact CD2-CD1 4.24Å; L209-L248 HydrophobicContact CG-CB 3.99Å; F212-L248 HydrophobicContact CD2-CD1 3.38Å; F212-L248 HydrophobicContact CE2-CD1 3.68Å; F212-L248 HydrophobicContact CG-CD1 4.31Å; R244-L248 HydrophobicContact CG-CD1 4.2Å; R244-L248 WeakPolarHBondContact O-CB 3.48Å; R244-L248 WeakPolarHBondContact O-CG 3.11Å; R244-L248 PolarHBondContact O-N 3.24Å; I245-L248 PolarHBondContact O-N 3.46Å; R246-L248 VanDerWaalsContact C-N 3.3Å; R246-L248 PolarHBondContact O-N 2.89Å; L248-K252 WeakPolarHBondContact O-CB 3.3Å; L248-K252 PolarHBondContact O-N 2.89Å
249	H	97.3	Very high	94.8	Very high	67 Å²	67	67.2 Å²	67.2	31%	0.31	33%	0.329	S	S	.	.	H	α-helix	trans	-61.5	-48.7	172.6	-98.4	-69.9	0	0	0	111.8	I245 R246 S251 K252 E253	I245-H249 PolarHBondContact O-N 3.45Å; R246-H249 WeakPolarHBondContact O-CB 3.38Å; R246-H249 PolarHBondContact O-N 3.41Å; R246-H249 VanDerWaalsContact O-N 3.13Å; H249-S251 VanDerWaalsContact C-N 3.34Å; H249-S251 PolarHBondContact O-N 3.19Å; H249-K252 WeakPolarHBondContact O-CB 3.41Å; H249-K252 PolarHBondContact O-N 3.49Å; H249-E253 PolarHBondContact O-N 3.38Å
250	D	96.3	Very high	95	Very high	72 Å²	72	67 Å²	67	39%	0.385	33%	0.327	S	S	.	.	H	α-helix	trans	-60.4	-43.5	179.5	-63.2	-14.5	0	0	0	111.3	R246 L247 E253 K254	R246-D250 PolarHBondContact O-N 3.31Å; L247-D250 PolarHBondContact O-N 3.31Å; D250-E253 PolarHBondContact O-N 3.36Å; D250-K254 WeakPolarHBondContact O-CG 3.35Å; D250-K254 PolarHBondContact O-N 3.06Å; D250-K254 VanDerWaalsContact O-N 3.08Å
251	S	94	Very high	95.2	Very high	34 Å²	34	67.5 Å²	67.5	24%	0.238	33%	0.33	C	S	.	.	H	α-helix	trans	-68.4	-35.4	176.8	-68.5	0	0	0	0	113	L247 H249 K254 T255	L247-S251 WeakPolarHBondContact O-CB 3.29Å; L247-S251 PolarHBondContact O-N 3.45Å; L247-S251 PolarHBondContact O-OG 2.95Å; H249-S251 VanDerWaalsContact C-N 3.34Å; H249-S251 PolarHBondContact O-N 3.19Å; S251-K254 PolarHBondContact O-N 2.96Å; S251-T255 PolarHBondContact O-N 2.6Å; S251-T255 PolarHBondContact O-OG1 3.18Å
252	K	95.8	Very high	95.4	Very high	41 Å²	41	67.9 Å²	67.9	18%	0.178	33%	0.333	C	S	.	.	H	α-helix	trans	-62	-47.5	172.9	179.5	-176.6	171.1	-175.7	0	110.9	L202 F205 D206 L209 L248 H249 K254 T255 I256	L202-K252 HydrophobicContact CD1-CD 4.18Å; L202-K252 HydrophobicContact CD1-CG 3.61Å; F205-K252 HydrophobicContact CB-CB 4.06Å; F205-K252 HydrophobicContact CB-CD 4.33Å; F205-K252 HydrophobicContact CB-CG 4.13Å; F205-K252 HydrophobicContact CD2-CB 4.3Å; F205-K252 HydrophobicContact CG-CB 4.09Å; D206-K252 VanDerWaalsContact OD1-CE 3.22Å; D206-K252 WeakPolarHBondContact OD1-CE 3.34Å; D206-K252 IonicContact OD1-NZ 3.44Å; D206-K252 PolarHBondContact OD1-NZ 2.97Å; L209-K252 HydrophobicContact CD1-CD 3.89Å; L248-K252 WeakPolarHBondContact O-CB 3.3Å; L248-K252 PolarHBondContact O-N 2.89Å; H249-K252 WeakPolarHBondContact O-CB 3.41Å; H249-K252 PolarHBondContact O-N 3.49Å; K252-K254 PolarHBondContact O-N 3.41Å; K252-T255 WeakPolarHBondContact O-CB 3.5Å; K252-T255 PolarHBondContact O-N 3.4Å; K252-T255 VanDerWaalsContact O-N 3.16Å; K252-I256 HydrophobicContact CG-CD1 4.11Å; K252-I256 WeakPolarHBondContact O-CG1 3.45Å; K252-I256 PolarHBondContact O-N 2.85Å
253	E	97.4	Very high	95.4	Very high	125 Å²	125	63.1 Å²	63.1	58%	0.584	32%	0.32	S	S	*	.	H	α-helix	trans	-61.8	-41.8	178.4	-73.7	-177.1	-179.7	0	0	112.2	H249 D250 T255 I256 A257	H249-E253 PolarHBondContact O-N 3.38Å; D250-E253 PolarHBondContact O-N 3.36Å; E253-T255 VanDerWaalsContact C-N 3.33Å; E253-T255 PolarHBondContact O-N 2.77Å; E253-I256 PolarHBondContact O-N 2.62Å; E253-A257 PolarHBondContact O-N 2.77Å
254	K	96.4	Very high	95.6	Very high	135 Å²	135	65.7 Å²	65.7	59%	0.587	32%	0.32	S	S	*	.	H	α-helix	trans	-58.1	-45.4	172	-71	172.2	-174.1	173.4	0	111.8	D250 S251 K252 I256 A257 E258	D250-K254 WeakPolarHBondContact O-CG 3.35Å; D250-K254 PolarHBondContact O-N 3.06Å; D250-K254 VanDerWaalsContact O-N 3.08Å; S251-K254 PolarHBondContact O-N 2.96Å; K252-K254 PolarHBondContact O-N 3.41Å; K254-I256 VanDerWaalsContact C-N 3.32Å; K254-I256 PolarHBondContact O-N 3.12Å; K254-A257 WeakPolarHBondContact O-CB 3.32Å; K254-A257 PolarHBondContact O-N 2.85Å; K254-E258 WeakPolarHBondContact O-CG 3.32Å; K254-E258 PolarHBondContact O-N 3.27Å
255	T	93.6	Very high	95.8	Very high	18 Å²	18	66.9 Å²	66.9	11%	0.11	33%	0.327	C	S	.	.	H	α-helix	trans	-63.6	-38.3	179	-56.2	0	0	0	0	111.8	R198 F205 S251 K252 E253 E258 I259	R198-T255 HydrophobicContact CB-CG2 4.41Å; F205-T255 HydrophobicContact CE2-CG2 4.37Å; F205-T255 VanDerWaalsContact CE2-OG1 3.31Å; F205-T255 WeakPolarHBondContact CE2-OG1 3.44Å; S251-T255 PolarHBondContact O-N 2.6Å; S251-T255 PolarHBondContact O-OG1 3.18Å; K252-T255 WeakPolarHBondContact O-CB 3.5Å; K252-T255 PolarHBondContact O-N 3.4Å; K252-T255 VanDerWaalsContact O-N 3.16Å; E253-T255 VanDerWaalsContact C-N 3.33Å; E253-T255 PolarHBondContact O-N 2.77Å; T255-E258 PolarHBondContact O-N 2.83Å; T255-I259 HydrophobicContact CG2-CD1 4.4Å; T255-I259 WeakPolarHBondContact O-CG1 3.37Å; T255-I259 PolarHBondContact O-N 3.43Å
256	I	97.4	Very high	95.9	Very high	63 Å²	63	66.6 Å²	66.6	32%	0.323	33%	0.326	S	S	.	.	H	α-helix	trans	-61.5	-47.4	173.9	-68.2	165.9	0	0	0	110.4	L202 K252 E253 K254 E258 I259 D260	L202-I256 HydrophobicContact CD1-CD1 4.05Å; L202-I256 HydrophobicContact CD1-CG1 3.75Å; L202-I256 HydrophobicContact CD2-CG1 4.27Å; K252-I256 HydrophobicContact CG-CD1 4.11Å; K252-I256 WeakPolarHBondContact O-CG1 3.45Å; K252-I256 PolarHBondContact O-N 2.85Å; E253-I256 PolarHBondContact O-N 2.62Å; K254-I256 VanDerWaalsContact C-N 3.32Å; K254-I256 PolarHBondContact O-N 3.12Å; I256-E258 VanDerWaalsContact C-N 3.26Å; I256-E258 PolarHBondContact O-N 3.21Å; I256-I259 WeakPolarHBondContact O-CB 3.48Å; I256-I259 PolarHBondContact O-N 3.17Å; I256-I259 VanDerWaalsContact O-N 3.1Å; I256-D260 PolarHBondContact O-N 2.96Å
257	A	96.8	Very high	95.9	Very high	58 Å²	58	66.5 Å²	66.5	48%	0.479	33%	0.326	S	S	.	.	H	α-helix	trans	-60.6	-36.4	177	0	0	0	0	0	112.4	E253 K254 D260 L261	E253-A257 PolarHBondContact O-N 2.77Å; K254-A257 WeakPolarHBondContact O-CB 3.32Å; K254-A257 PolarHBondContact O-N 2.85Å; A257-D260 PolarHBondContact O-N 3.46Å; A257-L261 PolarHBondContact O-N 3.02Å
258	E	94.8	Very high	96.1	Very high	87 Å²	87	68.6 Å²	68.6	41%	0.407	33%	0.333	S	S	.	.	H	α-helix	trans	-67.6	-38	173.3	-71.5	-175.7	-163.8	0	0	113.3	R198 K254 T255 I256 D260 L261 C262	R198-E258 IonicContact CZ-OE2 3.13Å; R198-E258 IonicContact NE-OE2 3.76Å; R198-E258 PolarHBondContact NE-OE2 3.12Å; R198-E258 IonicContact NH2-OE2 2.82Å; R198-E258 PolarHBondContact NH2-OE2 3.17Å; K254-E258 WeakPolarHBondContact O-CG 3.32Å; K254-E258 PolarHBondContact O-N 3.27Å; T255-E258 PolarHBondContact O-N 2.83Å; I256-E258 VanDerWaalsContact C-N 3.26Å; I256-E258 PolarHBondContact O-N 3.21Å; E258-D260 VanDerWaalsContact C-N 3.31Å; E258-D260 PolarHBondContact O-N 3.44Å; E258-L261 PolarHBondContact O-N 3.4Å; E258-C262 WeakPolarHBondContact O-CB 3.33Å; E258-C262 PolarHBondContact O-N 3.01Å
259	I	95.4	Very high	96.2	Very high	18 Å²	18	68.2 Å²	68.2	9%	0.092	33%	0.332	C	S	.	.	H	α-helix	trans	-60.1	-43.7	173.5	-73	167.9	0	0	0	110.1	L195 R198 R199 L202 T255 I256 L261 C262 S263	L195-I259 HydrophobicContact CD1-CG2 3.89Å; R198-I259 HydrophobicContact CB-CD1 4.16Å; R198-I259 HydrophobicContact CB-CG1 3.63Å; R199-I259 HydrophobicContact CG-CD1 4.37Å; L202-I259 HydrophobicContact CB-CD1 4.3Å; L202-I259 HydrophobicContact CD2-CD1 4.05Å; T255-I259 HydrophobicContact CG2-CD1 4.4Å; T255-I259 WeakPolarHBondContact O-CG1 3.37Å; T255-I259 PolarHBondContact O-N 3.43Å; I256-I259 WeakPolarHBondContact O-CB 3.48Å; I256-I259 PolarHBondContact O-N 3.17Å; I256-I259 VanDerWaalsContact O-N 3.1Å; I259-L261 VanDerWaalsContact C-N 3.35Å; I259-C262 PolarHBondContact O-N 3.14Å; I259-S263 VanDerWaalsContact O-CB 3.3Å; I259-S263 WeakPolarHBondContact O-CB 3.48Å; I259-S263 PolarHBondContact O-N 3.23Å; I259-S263 PolarHBondContact O-OG 3.47Å
260	D	96.7	Very high	96.1	Very high	92 Å²	92	69.2 Å²	69.2	49%	0.492	34%	0.336	S	S	.	.	H	α-helix	trans	-65	-39.2	177.5	-72	-25.5	0	0	0	111.9	I256 A257 E258 R264	I256-D260 PolarHBondContact O-N 2.96Å; A257-D260 PolarHBondContact O-N 3.46Å; E258-D260 VanDerWaalsContact C-N 3.31Å; E258-D260 PolarHBondContact O-N 3.44Å; D260-R264 WeakPolarHBondContact O-CG 3.18Å; D260-R264 PolarHBondContact O-N 3.47Å; D260-R264 PolarHBondContact O-NE 2.69Å
261	L	96.1	Very high	96.1	Very high	73 Å²	73	69.5 Å²	69.5	38%	0.382	34%	0.344	S	S	.	.	H	α-helix	trans	-63.4	-48.4	173.6	178	60.9	0	0	0	112.2	A257 E258 I259 S263 R264 K265	A257-L261 PolarHBondContact O-N 3.02Å; E258-L261 PolarHBondContact O-N 3.4Å; I259-L261 VanDerWaalsContact C-N 3.35Å; L261-S263 VanDerWaalsContact C-N 3.31Å; L261-S263 PolarHBondContact O-N 3.03Å; L261-R264 VanDerWaalsContact CA-NH2 3.29Å; L261-R264 VanDerWaalsContact CD1-NH1 3.25Å; L261-R264 PolarHBondContact O-N 2.91Å; L261-K265 PolarHBondContact O-N 3.12Å; L261-K265 VanDerWaalsContact O-N 3.08Å
262	C	94.7	Very high	96.2	Very high	8 Å²	8	73 Å²	73	5%	0.054	36%	0.357	C	S	.	.	H	α-helix	trans	-61.1	-42.3	177.8	-165.7	0	0	0	0	111.1	L191 L195 E258 I259 R264 K265 L266	L191-C262 PolarHBondContact O-SG 2.91Å; L195-C262 HydrophobicContact CD1-CB 4.34Å; E258-C262 WeakPolarHBondContact O-CB 3.33Å; E258-C262 PolarHBondContact O-N 3.01Å; I259-C262 PolarHBondContact O-N 3.14Å; C262-R264 VanDerWaalsContact C-N 3.3Å; C262-R264 PolarHBondContact O-N 3.35Å; C262-K265 PolarHBondContact O-N 3.04Å; C262-L266 WeakPolarHBondContact O-CB 3.24Å; C262-L266 PolarHBondContact O-N 3.28Å
263	S	96	Very high	96.2	Very high	30 Å²	30	71.3 Å²	71.3	21%	0.21	35%	0.35	C	S	.	.	H	α-helix	trans	-66.6	-28.7	178.4	-57.4	0	0	0	0	113.2	I259 L261 R267	I259-S263 VanDerWaalsContact O-CB 3.3Å; I259-S263 WeakPolarHBondContact O-CB 3.48Å; I259-S263 PolarHBondContact O-N 3.23Å; I259-S263 PolarHBondContact O-OG 3.47Å; L261-S263 VanDerWaalsContact C-N 3.31Å; L261-S263 PolarHBondContact O-N 3.03Å; S263-R267 WeakPolarHBondContact O-CG 3.16Å; S263-R267 PolarHBondContact O-N 3.42Å; S263-R267 PolarHBondContact O-NE 3.22Å
264	R	97.9	Very high	96	Very high	112 Å²	112	69 Å²	69	42%	0.423	34%	0.341	S	S	.	.	H	α-helix	trans	-70.7	-51.6	170.8	-79.4	-179.4	-74.2	104	-8.1	111.4	D260 L261 C262 L266 R267 E268	D260-R264 WeakPolarHBondContact O-CG 3.18Å; D260-R264 PolarHBondContact O-N 3.47Å; D260-R264 PolarHBondContact O-NE 2.69Å; L261-R264 VanDerWaalsContact CA-NH2 3.29Å; L261-R264 VanDerWaalsContact CD1-NH1 3.25Å; L261-R264 PolarHBondContact O-N 2.91Å; C262-R264 VanDerWaalsContact C-N 3.3Å; C262-R264 PolarHBondContact O-N 3.35Å; R264-L266 VanDerWaalsContact C-N 3.27Å; R264-L266 PolarHBondContact O-N 3.34Å; R264-R267 PolarHBondContact O-N 3.41Å; R264-R267 VanDerWaalsContact O-N 3.09Å; R264-E268 PolarHBondContact O-N 3Å; R264-E268 VanDerWaalsContact O-N 3.11Å
265	K	97.1	Very high	95.9	Very high	95 Å²	95	65.1 Å²	65.1	41%	0.413	34%	0.335	S	S	.	.	H	α-helix	trans	-56.3	-42	176.4	-69.6	-174.1	174.5	-168.2	0	112.4	L191 L261 C262 R267 E268 V269	L191-K265 HydrophobicContact CD1-CB 4.03Å; L191-K265 HydrophobicContact CD2-CB 4.15Å; L191-K265 HydrophobicContact CD2-CD 4.4Å; L261-K265 PolarHBondContact O-N 3.12Å; L261-K265 VanDerWaalsContact O-N 3.08Å; C262-K265 PolarHBondContact O-N 3.04Å; K265-R267 VanDerWaalsContact C-N 3.3Å; K265-R267 PolarHBondContact O-N 2.95Å; K265-E268 WeakPolarHBondContact O-CB 3.31Å; K265-E268 PolarHBondContact O-N 3.25Å; K265-E268 VanDerWaalsContact O-N 3.15Å; K265-V269 WeakPolarHBondContact O-CG2 3.24Å; K265-V269 PolarHBondContact O-N 3.46Å
266	L	96.1	Very high	95.9	Very high	22 Å²	22	65.3 Å²	65.3	12%	0.115	33%	0.334	C	S	.	.	H	α-helix	trans	-58.7	-42	177.9	-173.9	70.1	0	0	0	111.9	F188 L191 L192 L195 C262 R264 E270	F188-L266 HydrophobicContact CD2-CD1 3.46Å; F188-L266 VanDerWaalsContact CD2-CD1 3.46Å; F188-L266 HydrophobicContact CD2-CG 4.36Å; F188-L266 HydrophobicContact CE2-CD1 3.52Å; F188-L266 HydrophobicContact CE2-CG 4.11Å; F188-L266 HydrophobicContact CG-CD1 4.26Å; F188-L266 HydrophobicContact CZ-CD1 4.37Å; L191-L266 HydrophobicContact CB-CD1 3.86Å; L192-L266 HydrophobicContact CD2-CD1 3.98Å; L192-L266 HydrophobicContact CD2-CD2 3.71Å; L192-L266 HydrophobicContact CD2-CG 4.5Å; L192-L266 HydrophobicContact CG-CD1 3.95Å; L195-L266 HydrophobicContact CD2-CD2 4.08Å; C262-L266 WeakPolarHBondContact O-CB 3.24Å; C262-L266 PolarHBondContact O-N 3.28Å; R264-L266 VanDerWaalsContact C-N 3.27Å; R264-L266 PolarHBondContact O-N 3.34Å; L266-E270 WeakPolarHBondContact O-CB 3.42Å; L266-E270 PolarHBondContact O-N 3.08Å
267	R	97.3	Very high	95.7	Very high	164 Å²	164	66.4 Å²	66.4	62%	0.619	34%	0.337	S	S	*	.	H	α-helix	trans	-68.1	-35.1	176.7	-75	-176.2	-70.3	173.5	-2.2	112.7	S263 R264 K265 S271	S263-R267 WeakPolarHBondContact O-CG 3.16Å; S263-R267 PolarHBondContact O-N 3.42Å; S263-R267 PolarHBondContact O-NE 3.22Å; R264-R267 PolarHBondContact O-N 3.41Å; R264-R267 VanDerWaalsContact O-N 3.09Å; K265-R267 VanDerWaalsContact C-N 3.3Å; K265-R267 PolarHBondContact O-N 2.95Å; R267-S271 WeakPolarHBondContact O-CB 3.41Å; R267-S271 PolarHBondContact O-N 3.14Å
268	E	97.8	Very high	95.5	Very high	113 Å²	113	67.2 Å²	67.2	53%	0.528	34%	0.337	S	S	.	.	H	α-helix	trans	-62.8	-54.2	175.5	-69.2	164.1	-170.8	0	0	110.2	R264 K265 E270 S271 E272	R264-E268 PolarHBondContact O-N 3Å; R264-E268 VanDerWaalsContact O-N 3.11Å; K265-E268 WeakPolarHBondContact O-CB 3.31Å; K265-E268 PolarHBondContact O-N 3.25Å; K265-E268 VanDerWaalsContact O-N 3.15Å; E268-E270 VanDerWaalsContact C-N 3.35Å; E268-E270 PolarHBondContact O-N 3.01Å; E268-S271 WeakPolarHBondContact O-CB 3.38Å; E268-S271 PolarHBondContact O-N 3.47Å; E268-S271 VanDerWaalsContact O-N 3.09Å; E268-E272 PolarHBondContact O-N 3.38Å
269	V	95.7	Very high	95.4	Very high	6 Å²	6	67.6 Å²	67.6	4%	0.036	34%	0.339	C	S	.	.	H	α-helix	trans	-63.2	-39.6	178.8	-179.8	0	0	0	0	111.7	A184 E187 F188 L191 K265 S271 E272 L273	A184-V269 HydrophobicContact CB-CG1 4.33Å; A184-V269 WeakPolarHBondContact O-CG1 3.45Å; E187-V269 HydrophobicContact CG-CG2 4.15Å; F188-V269 HydrophobicContact CB-CG1 3.86Å; L191-V269 HydrophobicContact CD1-CB 4.49Å; L191-V269 HydrophobicContact CD1-CG2 3.9Å; K265-V269 WeakPolarHBondContact O-CG2 3.24Å; K265-V269 PolarHBondContact O-N 3.46Å; V269-S271 VanDerWaalsContact C-N 3.3Å; V269-S271 PolarHBondContact O-N 2.64Å; V269-E272 PolarHBondContact O-N 2.84Å; V269-L273 HydrophobicContact CG1-CD1 4.3Å; V269-L273 WeakPolarHBondContact O-CG 3.33Å; V269-L273 PolarHBondContact O-N 3.48Å
270	E	95.6	Very high	95.1	Very high	87 Å²	87	67.8 Å²	67.8	41%	0.407	34%	0.34	S	S	.	.	H	α-helix	trans	-61.1	-39.7	174.2	-177.2	175.7	-167.7	0	0	111.8	F188 L266 E268 L273 N274	F188-E270 HydrophobicContact CD2-CB 4.35Å; F188-E270 HydrophobicContact CE2-CB 4.08Å; F188-E270 HydrophobicContact CE2-CG 4.41Å; L266-E270 WeakPolarHBondContact O-CB 3.42Å; L266-E270 PolarHBondContact O-N 3.08Å; E268-E270 VanDerWaalsContact C-N 3.35Å; E268-E270 PolarHBondContact O-N 3.01Å; E270-L273 PolarHBondContact O-N 2.92Å; E270-N274 WeakPolarHBondContact O-CB 3.43Å; E270-N274 VanDerWaalsContact O-CG 3.25Å; E270-N274 PolarHBondContact O-N 3.4Å; E270-N274 PolarHBondContact O-ND2 3.44Å; E270-N274 VanDerWaalsContact O-ND2 3.11Å
271	S	96.7	Very high	94.7	Very high	78 Å²	78	67.5 Å²	67.5	55%	0.545	34%	0.344	S	S	.	.	H	α-helix	trans	-65.9	-40.4	175.7	-167.8	0	0	0	0	112	R267 E268 V269 N274 A275	R267-S271 WeakPolarHBondContact O-CB 3.41Å; R267-S271 PolarHBondContact O-N 3.14Å; E268-S271 WeakPolarHBondContact O-CB 3.38Å; E268-S271 PolarHBondContact O-N 3.47Å; E268-S271 VanDerWaalsContact O-N 3.09Å; V269-S271 VanDerWaalsContact C-N 3.3Å; V269-S271 PolarHBondContact O-N 2.64Å; S271-N274 PolarHBondContact O-N 3.03Å; S271-A275 WeakPolarHBondContact O-CB 3.39Å; S271-A275 PolarHBondContact O-N 3.43Å
272	E	95.8	Very high	94.5	Very high	108 Å²	108	67.9 Å²	67.9	51%	0.505	35%	0.35	S	S	.	.	H	α-helix	trans	-62.6	-45.7	174.6	-69.8	-177.7	-167.6	0	0	111.7	E268 V269 N274 A275 M276	E268-E272 PolarHBondContact O-N 3.38Å; V269-E272 PolarHBondContact O-N 2.84Å; E272-N274 VanDerWaalsContact C-N 3.32Å; E272-N274 PolarHBondContact O-N 3.32Å; E272-A275 PolarHBondContact O-N 2.93Å; E272-M276 HydrophobicContact CB-CE 4.37Å; E272-M276 WeakPolarHBondContact O-CG 3.48Å; E272-M276 PolarHBondContact O-N 3.13Å
273	L	94.3	Very high	94.3	Very high	6 Å²	6	68.2 Å²	68.2	3%	0.031	35%	0.351	C	S	.	.	H	α-helix	trans	-57.6	-46.5	174.9	-75.6	170.5	0	0	0	111.2	Y181 A184 F188 V269 E270 A275 M276 K277	Y181-L273 HydrophobicContact CD2-CD2 3.7Å; Y181-L273 HydrophobicContact CE2-CB 4.48Å; Y181-L273 HydrophobicContact CE2-CD2 3.55Å; Y181-L273 HydrophobicContact CG-CD2 4.34Å; A184-L273 HydrophobicContact CB-CD2 3.74Å; A184-L273 HydrophobicContact CB-CG 4.09Å; F188-L273 HydrophobicContact CB-CD1 3.79Å; F188-L273 HydrophobicContact CD2-CD1 4.18Å; F188-L273 HydrophobicContact CG-CD1 3.93Å; V269-L273 HydrophobicContact CG1-CD1 4.3Å; V269-L273 WeakPolarHBondContact O-CG 3.33Å; V269-L273 PolarHBondContact O-N 3.48Å; E270-L273 PolarHBondContact O-N 2.92Å; L273-A275 VanDerWaalsContact C-N 3.32Å; L273-A275 PolarHBondContact O-N 3.39Å; L273-M276 PolarHBondContact O-N 2.95Å; L273-K277 VanDerWaalsContact O-CG 3.3Å; L273-K277 WeakPolarHBondContact O-CG 3.32Å; L273-K277 PolarHBondContact O-N 3Å
274	N	93.3	Very high	93.9	Very high	76 Å²	76	70.6 Å²	70.6	41%	0.406	36%	0.361	S	S	.	.	H	α-helix	trans	-68.9	-29.2	-179.8	-70.8	-31.7	0	0	0	113.1	E270 S271 E272 K277 P278	E270-N274 WeakPolarHBondContact O-CB 3.43Å; E270-N274 VanDerWaalsContact O-CG 3.25Å; E270-N274 PolarHBondContact O-N 3.4Å; E270-N274 PolarHBondContact O-ND2 3.44Å; E270-N274 VanDerWaalsContact O-ND2 3.11Å; S271-N274 PolarHBondContact O-N 3.03Å; E272-N274 VanDerWaalsContact C-N 3.32Å; E272-N274 PolarHBondContact O-N 3.32Å; N274-K277 PolarHBondContact OD1-NZ 2.9Å; N274-P278 WeakPolarHBondContact O-CD 3.4Å
275	A	95.9	Very high	93.4	Very high	54 Å²	54	67.8 Å²	67.8	45%	0.446	36%	0.358	S	S	.	.	H	α-helix	trans	-70.9	-39	171.4	0	0	0	0	0	112.3	S271 E272 L273 P278	S271-A275 WeakPolarHBondContact O-CB 3.39Å; S271-A275 PolarHBondContact O-N 3.43Å; E272-A275 PolarHBondContact O-N 2.93Å; L273-A275 VanDerWaalsContact C-N 3.32Å; L273-A275 PolarHBondContact O-N 3.39Å; A275-P278 WeakPolarHBondContact O-CD 3.44Å; A275-P278 WeakPolarHBondContact O-CG 3.3Å
276	M	93.3	Very high	92.9	Very high	22 Å²	22	67.7 Å²	67.7	11%	0.108	36%	0.36	C	S	.	.	H	α-helix	trans	-76.2	-30.5	-178.5	-70.1	-168.7	-78	0	0	114.2	C180 Y181 A184 E272 L273 E279 L280	C180-M276 HydrophobicContact CB-SD 3.9Å; Y181-M276 HydrophobicContact CD2-CB 4.3Å; A184-M276 HydrophobicContact CB-CE 3.72Å; E272-M276 HydrophobicContact CB-CE 4.37Å; E272-M276 WeakPolarHBondContact O-CG 3.48Å; E272-M276 PolarHBondContact O-N 3.13Å; L273-M276 PolarHBondContact O-N 2.95Å; M276-E279 PolarHBondContact O-N 3.42Å; M276-L280 WeakPolarHBondContact O-CB 3.32Å; M276-L280 PolarHBondContact O-N 2.88Å
277	K	91.7	Very high	92.3	Very high	86 Å²	86	68.1 Å²	68.1	37%	0.374	36%	0.361	S	S	.	.	H	α-helix	trans	-50.2	-55.8	179.9	-80.5	170.4	-168	167.5	0	114.3	Y181 L273 N274 E279 L280 C281	Y181-K277 HydrophobicContact CE2-CG 3.73Å; Y181-K277 WeakPolarHBondContact OH-CE 3.45Å; L273-K277 VanDerWaalsContact O-CG 3.3Å; L273-K277 WeakPolarHBondContact O-CG 3.32Å; L273-K277 PolarHBondContact O-N 3Å; N274-K277 PolarHBondContact OD1-NZ 2.9Å; K277-E279 VanDerWaalsContact C-N 3.34Å; K277-E279 PolarHBondContact O-N 2.97Å; K277-L280 PolarHBondContact O-N 3.32Å; K277-C281 PolarHBondContact O-N 3.4Å; K277-C281 PolarHBondContact O-SG 3.45Å; K277-C281 VanDerWaalsContact O-SG 3.35Å
278	P	93.1	Very high	91.6	Very high	75 Å²	75	64 Å²	64	49%	0.487	35%	0.351	S	S	.	.	H	α-helix	trans	-62.7	-40.8	-178.2	24.2	-34.4	0	0	0	112.1	N274 A275 L280 C281 T282	N274-P278 WeakPolarHBondContact O-CD 3.4Å; A275-P278 WeakPolarHBondContact O-CD 3.44Å; A275-P278 WeakPolarHBondContact O-CG 3.3Å; P278-L280 PolarHBondContact O-N 2.92Å; P278-C281 PolarHBondContact O-N 3.26Å; P278-T282 WeakPolarHBondContact O-CG2 3.31Å; P278-T282 PolarHBondContact O-N 2.94Å
279	E	92.6	Very high	91	Very high	94 Å²	94	63.5 Å²	63.5	44%	0.439	35%	0.347	S	S	.	.	H	α-helix	trans	-60.5	-46.7	177.1	-64	178	-166.3	0	0	110.9	K177 M276 K277 C281 T282 L283	K177-E279 WeakPolarHBondContact CE-OE2 3.43Å; K177-E279 IonicContact NZ-OE2 2.58Å; K177-E279 PolarHBondContact NZ-OE2 3.07Å; M276-E279 PolarHBondContact O-N 3.42Å; K277-E279 VanDerWaalsContact C-N 3.34Å; K277-E279 PolarHBondContact O-N 2.97Å; E279-C281 PolarHBondContact O-N 3.11Å; E279-T282 PolarHBondContact O-N 2.87Å; E279-T282 VanDerWaalsContact O-N 3.16Å; E279-T282 PolarHBondContact O-OG1 3.13Å; E279-L283 WeakPolarHBondContact O-CB 3.4Å; E279-L283 WeakPolarHBondContact O-CG 3.26Å; E279-L283 PolarHBondContact O-N 3.45Å
280	L	88.8	Confident	90.3	Very high	22 Å²	22	64.8 Å²	64.8	12%	0.115	35%	0.353	C	S	.	.	H	α-helix	trans	-60.7	-43.2	177.2	-172	64.6	0	0	0	111.9	K177 T178 Y181 M276 K277 P278 T282 L283 L284	K177-L280 HydrophobicContact CB-CD1 4.27Å; K177-L280 HydrophobicContact CG-CD1 4.25Å; T178-L280 WeakPolarHBondContact OG1-CD1 3.41Å; Y181-L280 HydrophobicContact CD1-CD2 4.4Å; Y181-L280 HydrophobicContact CG-CD2 4.16Å; M276-L280 WeakPolarHBondContact O-CB 3.32Å; M276-L280 PolarHBondContact O-N 2.88Å; K277-L280 PolarHBondContact O-N 3.32Å; P278-L280 PolarHBondContact O-N 2.92Å; L280-T282 VanDerWaalsContact C-N 3.32Å; L280-T282 PolarHBondContact O-N 3.49Å; L280-L283 PolarHBondContact O-N 3.06Å; L280-L284 HydrophobicContact CD1-CD1 4.38Å; L280-L284 HydrophobicContact CD1-CG 4.34Å; L280-L284 HydrophobicContact CG-CD1 4.02Å; L280-L284 HydrophobicContact CG-CG 4.39Å; L280-L284 WeakPolarHBondContact O-CB 3.44Å; L280-L284 VanDerWaalsContact O-CG 3.29Å; L280-L284 WeakPolarHBondContact O-CG 3.39Å; L280-L284 PolarHBondContact O-N 2.83Å
281	C	89.2	Confident	89.5	Confident	87 Å²	87	64.1 Å²	64.1	59%	0.588	35%	0.35	S	S	*	.	H	α-helix	trans	-59.7	-41.2	175	-69.2	0	0	0	0	112.4	K277 P278 E279 S285	K277-C281 PolarHBondContact O-N 3.4Å; K277-C281 PolarHBondContact O-SG 3.45Å; K277-C281 VanDerWaalsContact O-SG 3.35Å; P278-C281 PolarHBondContact O-N 3.26Å; E279-C281 PolarHBondContact O-N 3.11Å; C281-S285 WeakPolarHBondContact O-CB 3.32Å; C281-S285 PolarHBondContact O-N 2.97Å
282	T	92.4	Very high	88.6	Confident	81 Å²	81	66.3 Å²	66.3	50%	0.497	35%	0.346	S	S	.	.	H	α-helix	trans	-67.6	-42.9	178	60.2	0	0	0	0	112.2	P278 E279 L280 S285 Q286	P278-T282 WeakPolarHBondContact O-CG2 3.31Å; P278-T282 PolarHBondContact O-N 2.94Å; E279-T282 PolarHBondContact O-N 2.87Å; E279-T282 VanDerWaalsContact O-N 3.16Å; E279-T282 PolarHBondContact O-OG1 3.13Å; L280-T282 VanDerWaalsContact C-N 3.32Å; L280-T282 PolarHBondContact O-N 3.49Å; T282-S285 PolarHBondContact O-N 3.05Å; T282-Q286 VanDerWaalsContact O-CG 3.3Å; T282-Q286 WeakPolarHBondContact O-CG 3.38Å; T282-Q286 PolarHBondContact O-N 2.87Å
283	L	89.9	Confident	87.7	Confident	14 Å²	14	63.9 Å²	63.9	7%	0.073	34%	0.337	C	S	.	.	H	α-helix	trans	-63.9	-47.1	178.8	-75.7	173.4	0	0	0	111.5	L170 E173 C174 K177 E279 L280 S285 Q286 Q287	L170-L283 HydrophobicContact CD1-CD2 3.81Å; E173-L283 HydrophobicContact CG-CD1 4.11Å; E173-L283 HydrophobicContact CG-CD2 3.98Å; C174-L283 PolarHBondContact SG-O 2.86Å; K177-L283 HydrophobicContact CB-CD1 3.92Å; K177-L283 HydrophobicContact CG-CD1 4.03Å; E279-L283 WeakPolarHBondContact O-CB 3.4Å; E279-L283 WeakPolarHBondContact O-CG 3.26Å; E279-L283 PolarHBondContact O-N 3.45Å; L280-L283 PolarHBondContact O-N 3.06Å; L283-S285 VanDerWaalsContact C-N 3.33Å; L283-S285 PolarHBondContact O-N 2.83Å; L283-Q286 PolarHBondContact O-N 2.83Å; L283-Q286 VanDerWaalsContact O-N 3.16Å; L283-Q287 WeakPolarHBondContact O-CB 3.42Å; L283-Q287 PolarHBondContact O-N 3.49Å
284	L	86.7	Confident	86.9	Confident	80 Å²	80	63.8 Å²	63.8	42%	0.419	34%	0.336	S	S	.	.	H	α-helix	trans	-62.6	-38.7	176.2	-68.6	174.7	0	0	0	112.1	L280 Q287 D288	L280-L284 HydrophobicContact CD1-CD1 4.38Å; L280-L284 HydrophobicContact CD1-CG 4.34Å; L280-L284 HydrophobicContact CG-CD1 4.02Å; L280-L284 HydrophobicContact CG-CG 4.39Å; L280-L284 WeakPolarHBondContact O-CB 3.44Å; L280-L284 VanDerWaalsContact O-CG 3.29Å; L280-L284 WeakPolarHBondContact O-CG 3.39Å; L280-L284 PolarHBondContact O-N 2.83Å; L284-Q287 PolarHBondContact O-N 3.38Å; L284-D288 PolarHBondContact O-N 2.79Å
285	S	87.2	Confident	85.9	Confident	53 Å²	53	62.5 Å²	62.5	37%	0.371	34%	0.336	S	S	.	.	H	α-helix	trans	-66.5	-37.7	174.5	-177.3	0	0	0	0	112.5	C281 T282 L283 K289	C281-S285 WeakPolarHBondContact O-CB 3.32Å; C281-S285 PolarHBondContact O-N 2.97Å; T282-S285 PolarHBondContact O-N 3.05Å; L283-S285 VanDerWaalsContact C-N 3.33Å; L283-S285 PolarHBondContact O-N 2.83Å; S285-K289 VanDerWaalsContact O-CG 3.27Å; S285-K289 WeakPolarHBondContact O-CG 3.47Å; S285-K289 PolarHBondContact O-N 3.23Å; S285-K289 VanDerWaalsContact O-N 3.15Å
286	Q	87.4	Confident	84.7	Confident	94 Å²	94	65.9 Å²	65.9	44%	0.439	34%	0.343	S	S	.	.	H	α-helix	trans	-66.9	-41.7	174.3	-73.3	177.5	-2.8	0	0	110.9	L170 T282 L283 K289 M290	L170-Q286 HydrophobicContact CD1-CB 4.11Å; L170-Q286 HydrophobicContact CD2-CB 3.79Å; T282-Q286 VanDerWaalsContact O-CG 3.3Å; T282-Q286 WeakPolarHBondContact O-CG 3.38Å; T282-Q286 PolarHBondContact O-N 2.87Å; L283-Q286 PolarHBondContact O-N 2.83Å; L283-Q286 VanDerWaalsContact O-N 3.16Å; Q286-K289 PolarHBondContact O-N 3.39Å; Q286-M290 VanDerWaalsContact O-CG 3.29Å; Q286-M290 WeakPolarHBondContact O-CG 3.4Å; Q286-M290 PolarHBondContact O-N 2.83Å
287	Q	84.6	Confident	83.6	Confident	30 Å²	30	68.5 Å²	68.5	14%	0.14	35%	0.354	C	S	.	.	H	α-helix	trans	-58.7	-51.4	176.9	178.6	178.5	5.8	0	0	110.8	H171 L283 L284 K289 M290 E291	H171-Q287 PolarHBondContact CD2-NE2 2.68Å; H171-Q287 VanDerWaalsContact CD2-NE2 3.29Å; L283-Q287 WeakPolarHBondContact O-CB 3.42Å; L283-Q287 PolarHBondContact O-N 3.49Å; L284-Q287 PolarHBondContact O-N 3.38Å; Q287-K289 VanDerWaalsContact C-N 3.32Å; Q287-K289 PolarHBondContact O-N 2.78Å; Q287-M290 PolarHBondContact O-N 3.04Å; Q287-M290 VanDerWaalsContact O-N 3.07Å; Q287-E291 HydrophobicContact CG-CG 4.31Å; Q287-E291 VanDerWaalsContact CG-OE1 3.27Å; Q287-E291 WeakPolarHBondContact CG-OE1 3.47Å; Q287-E291 PolarHBondContact NE2-OE1 2.74Å; Q287-E291 WeakPolarHBondContact O-CB 3.3Å; Q287-E291 WeakPolarHBondContact O-CG 3.47Å; Q287-E291 PolarHBondContact O-N 3.49Å
288	D	82.8	Confident	82.4	Confident	77 Å²	77	64.9 Å²	64.9	41%	0.412	34%	0.341	S	S	.	.	H	α-helix	trans	-57.2	-43.1	177.2	171.6	76.4	0	0	0	112.3	L284 M290 E291 R292	L284-D288 PolarHBondContact O-N 2.79Å; D288-M290 VanDerWaalsContact C-N 3.35Å; D288-M290 PolarHBondContact O-N 2.79Å; D288-E291 PolarHBondContact O-N 3.01Å; D288-R292 WeakPolarHBondContact O-CG 3.24Å; D288-R292 PolarHBondContact O-N 2.92Å; D288-R292 PolarHBondContact O-NE 3.06Å; D288-R292 IonicContact OD1-NE 3.91Å; D288-R292 IonicContact OD2-CZ 3.27Å; D288-R292 VanDerWaalsContact OD2-CZ 3.27Å; D288-R292 IonicContact OD2-NE 2.97Å; D288-R292 PolarHBondContact OD2-NE 3.13Å; D288-R292 IonicContact OD2-NH2 2.72Å; D288-R292 PolarHBondContact OD2-NH2 3.15Å
289	K	84	Confident	81.6	Confident	103 Å²	103	62 Å²	62	45%	0.448	32%	0.322	S	S	.	.	H	α-helix	trans	-61.7	-42.7	175.4	-73.2	168.9	-174.3	171.7	0	112	S285 Q286 Q287 L293	S285-K289 VanDerWaalsContact O-CG 3.27Å; S285-K289 WeakPolarHBondContact O-CG 3.47Å; S285-K289 PolarHBondContact O-N 3.23Å; S285-K289 VanDerWaalsContact O-N 3.15Å; Q286-K289 PolarHBondContact O-N 3.39Å; Q287-K289 VanDerWaalsContact C-N 3.32Å; Q287-K289 PolarHBondContact O-N 2.78Å; K289-L293 WeakPolarHBondContact O-CG 3.4Å; K289-L293 PolarHBondContact O-N 3.15Å
290	M	81.3	Confident	80.5	Confident	34 Å²	34	60.7 Å²	60.7	17%	0.167	32%	0.321	C	S	.	.	H	α-helix	trans	-72.9	-36.8	-179.1	-68.4	-57.6	99.7	0	0	112	L163 V167 L170 Q286 Q287 D288 R292 L293 L294	L163-M290 HydrophobicContact CD1-SD 4.49Å; V167-M290 HydrophobicContact CG1-CB 4.19Å; V167-M290 HydrophobicContact CG2-CB 3.76Å; V167-M290 HydrophobicContact CG2-CG 4.3Å; L170-M290 HydrophobicContact CD2-CB 4.27Å; L170-M290 HydrophobicContact CD2-CG 3.66Å; Q286-M290 VanDerWaalsContact O-CG 3.29Å; Q286-M290 WeakPolarHBondContact O-CG 3.4Å; Q286-M290 PolarHBondContact O-N 2.83Å; Q287-M290 PolarHBondContact O-N 3.04Å; Q287-M290 VanDerWaalsContact O-N 3.07Å; D288-M290 VanDerWaalsContact C-N 3.35Å; D288-M290 PolarHBondContact O-N 2.79Å; M290-R292 VanDerWaalsContact C-N 3.3Å; M290-R292 PolarHBondContact O-N 3.13Å; M290-L293 HydrophobicContact CE-CD1 3.38Å; M290-L293 HydrophobicContact CE-CG 4.41Å; M290-L293 PolarHBondContact O-N 3.32Å; M290-L293 HydrophobicContact SD-CD1 3.97Å; M290-L294 WeakPolarHBondContact O-CG 3.26Å; M290-L294 PolarHBondContact O-N 3.2Å
291	E	79.2	Confident	79.8	Confident	73 Å²	73	63.6 Å²	63.6	34%	0.341	34%	0.336	S	S	.	.	H	α-helix	trans	-61.9	-39.9	173.3	-75	176.4	-174.3	0	0	111.2	Q287 D288 L294 A295	Q287-E291 HydrophobicContact CG-CG 4.31Å; Q287-E291 VanDerWaalsContact CG-OE1 3.27Å; Q287-E291 WeakPolarHBondContact CG-OE1 3.47Å; Q287-E291 PolarHBondContact NE2-OE1 2.74Å; Q287-E291 WeakPolarHBondContact O-CB 3.3Å; Q287-E291 WeakPolarHBondContact O-CG 3.47Å; Q287-E291 PolarHBondContact O-N 3.49Å; D288-E291 PolarHBondContact O-N 3.01Å; E291-L294 PolarHBondContact O-N 3.02Å; E291-A295 PolarHBondContact O-N 3.09Å
292	R	77.8	Confident	79	Confident	124 Å²	124	63.2 Å²	63.2	47%	0.468	34%	0.335	S	S	.	.	H	α-helix	trans	-62	-44.8	170.5	-73.9	-175.7	-78	136.6	-11.6	112.5	D288 M290 L294 A295 E296	D288-R292 WeakPolarHBondContact O-CG 3.24Å; D288-R292 PolarHBondContact O-N 2.92Å; D288-R292 PolarHBondContact O-NE 3.06Å; D288-R292 IonicContact OD1-NE 3.91Å; D288-R292 IonicContact OD2-CZ 3.27Å; D288-R292 VanDerWaalsContact OD2-CZ 3.27Å; D288-R292 IonicContact OD2-NE 2.97Å; D288-R292 PolarHBondContact OD2-NE 3.13Å; D288-R292 IonicContact OD2-NH2 2.72Å; D288-R292 PolarHBondContact OD2-NH2 3.15Å; M290-R292 VanDerWaalsContact C-N 3.3Å; M290-R292 PolarHBondContact O-N 3.13Å; R292-L294 VanDerWaalsContact C-N 3.33Å; R292-L294 PolarHBondContact O-N 3.37Å; R292-A295 PolarHBondContact O-N 3.49Å; R292-E296 WeakPolarHBondContact O-CG 3.37Å; R292-E296 PolarHBondContact O-N 3.35Å
293	L	76.6	Confident	78.4	Confident	57 Å²	57	61.3 Å²	61.3	30%	0.298	32%	0.323	S	S	.	.	H	α-helix	trans	-62	-38.6	175.5	-71.5	179.6	0	0	0	112.5	K289 M290 A295 E296 H297	K289-L293 WeakPolarHBondContact O-CG 3.4Å; K289-L293 PolarHBondContact O-N 3.15Å; M290-L293 HydrophobicContact CE-CD1 3.38Å; M290-L293 HydrophobicContact CE-CG 4.41Å; M290-L293 PolarHBondContact O-N 3.32Å; M290-L293 HydrophobicContact SD-CD1 3.97Å; L293-A295 VanDerWaalsContact C-N 3.35Å; L293-E296 PolarHBondContact O-N 3.34Å; L293-H297 PolarHBondContact O-N 3.05Å; L293-H297 PolarHBondContact O-ND1 2.66Å
294	L	76.4	Confident	78.1	Confident	4 Å²	4	60.7 Å²	60.7	2%	0.021	32%	0.32	C	S	.	.	H	α-helix	trans	-63.6	-42.6	175.1	-70.7	173.5	0	0	0	111.5	L163 V167 M290 E291 R292 E296 H297 G298 I299 V304	L163-L294 HydrophobicContact CD2-CD2 4.21Å; L163-L294 HydrophobicContact CG-CD2 4.13Å; V167-L294 HydrophobicContact CB-CD1 4Å; V167-L294 HydrophobicContact CG1-CD1 3.65Å; V167-L294 HydrophobicContact CG2-CD1 3.88Å; V167-L294 HydrophobicContact CG2-CD2 4.07Å; V167-L294 HydrophobicContact CG2-CG 3.97Å; M290-L294 WeakPolarHBondContact O-CG 3.26Å; M290-L294 PolarHBondContact O-N 3.2Å; E291-L294 PolarHBondContact O-N 3.02Å; R292-L294 VanDerWaalsContact C-N 3.33Å; R292-L294 PolarHBondContact O-N 3.37Å; L294-E296 VanDerWaalsContact C-N 3.32Å; L294-E296 PolarHBondContact O-N 3.04Å; L294-H297 PolarHBondContact O-N 3.35Å; L294-G298 PolarHBondContact O-N 2.77Å; L294-I299 HydrophobicContact CD2-CB 3.86Å; L294-I299 HydrophobicContact CD2-CD1 3.89Å; L294-I299 HydrophobicContact CD2-CG1 4.48Å; L294-I299 HydrophobicContact CD2-CG2 3.92Å; L294-I299 PolarHBondContact O-N 3.41Å; L294-V304 HydrophobicContact CD1-CG2 3.62Å; L294-V304 HydrophobicContact CD2-CG2 4.3Å
295	A	72.9	Confident	77.7	Confident	49 Å²	49	58 Å²	58	41%	0.405	31%	0.306	S	S	.	.	H	α-helix	trans	-63.9	-36.6	176.4	0	0	0	0	0	112.5	E291 R292 L293 G298	E291-A295 PolarHBondContact O-N 3.09Å; R292-A295 PolarHBondContact O-N 3.49Å; L293-A295 VanDerWaalsContact C-N 3.35Å; A295-G298 PolarHBondContact O-N 2.81Å
296	E	70.5	Confident	77.3	Confident	125 Å²	125	63.9 Å²	63.9	58%	0.584	32%	0.321	S	S	*	.	H	α-helix	trans	-67.8	-40.2	174.8	-74.3	172.1	-169.9	0	0	112.5	R292 L293 L294 G298	R292-E296 WeakPolarHBondContact O-CG 3.37Å; R292-E296 PolarHBondContact O-N 3.35Å; L293-E296 PolarHBondContact O-N 3.34Å; L294-E296 VanDerWaalsContact C-N 3.32Å; L294-E296 PolarHBondContact O-N 3.04Å; E296-G298 VanDerWaalsContact C-N 3.27Å
297	H	70.9	Confident	77.1	Confident	77 Å²	77	61.7 Å²	61.7	36%	0.356	31%	0.311	S	S	.	.	H	α-helix	trans	-82	-8.2	177.2	-69	76.1	0	0	0	113	L293 L294 I299	L293-H297 PolarHBondContact O-N 3.05Å; L293-H297 PolarHBondContact O-ND1 2.66Å; L294-H297 PolarHBondContact O-N 3.35Å; H297-I299 VanDerWaalsContact C-N 3.31Å; H297-I299 HydrophobicContact CB-CD1 4.07Å; H297-I299 HydrophobicContact CB-CG1 4.21Å; H297-I299 PolarHBondContact O-N 3.4Å
298	G	67	Low	77	Confident	9 Å²	9	60.4 Å²	60.4	9%	0.093	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	22	178.6	0	0	0	0	0	116.1	L294 A295 E296 P300	L294-G298 PolarHBondContact O-N 2.77Å; A295-G298 PolarHBondContact O-N 2.81Å; E296-G298 VanDerWaalsContact C-N 3.27Å; G298-P300 WeakPolarHBondContact O-CD 3.49Å
299	I	75	Confident	76.8	Confident	16 Å²	16	60.1 Å²	60.1	8%	0.082	31%	0.307	C	S	.	.			trans	-83	113.7	176.1	-61.3	166.5	0	0	0	106.6	E160 L163 V164 L294 H297 L301 T303	E160-I299 HydrophobicContact CB-CD1 4.39Å; E160-I299 HydrophobicContact CG-CD1 4.45Å; L163-I299 HydrophobicContact CD2-CD1 4.03Å; V164-I299 HydrophobicContact CG2-CD1 4.15Å; V164-I299 HydrophobicContact CG2-CG2 3.74Å; L294-I299 HydrophobicContact CD2-CB 3.86Å; L294-I299 HydrophobicContact CD2-CD1 3.89Å; L294-I299 HydrophobicContact CD2-CG1 4.48Å; L294-I299 HydrophobicContact CD2-CG2 3.92Å; L294-I299 PolarHBondContact O-N 3.41Å; H297-I299 VanDerWaalsContact C-N 3.31Å; H297-I299 HydrophobicContact CB-CD1 4.07Å; H297-I299 HydrophobicContact CB-CG1 4.21Å; H297-I299 PolarHBondContact O-N 3.4Å; I299-L301 PolarHBondContact O-N 3.11Å; I299-T303 HydrophobicContact CG2-CG2 4.44Å
300	P	70.8	Confident	76.7	Confident	65 Å²	65	57.7 Å²	57.7	42%	0.422	30%	0.303	S	S	.	.			trans	-67.2	139.8	-178.5	26.4	-31.1	0	0	0	109.7	G298 S302 T303	G298-P300 WeakPolarHBondContact O-CD 3.49Å; P300-S302 PolarHBondContact O-N 3.15Å; P300-T303 WeakPolarHBondContact CG-OG1 3.46Å; P300-T303 VanDerWaalsContact O-CB 3.3Å; P300-T303 WeakPolarHBondContact O-CB 3.21Å; P300-T303 PolarHBondContact O-N 3.49Å; P300-T303 PolarHBondContact O-OG1 3.29Å
301	L	73.4	Confident	76.7	Confident	84 Å²	84	58.1 Å²	58.1	44%	0.44	30%	0.304	S	S	.	.	H	α-helix	trans	-52.4	-32.6	179.8	-176.4	62.3	0	0	0	112	I299 T303 V304 T305	I299-L301 PolarHBondContact O-N 3.11Å; L301-T303 PolarHBondContact O-N 2.88Å; L301-T303 VanDerWaalsContact O-N 3.16Å; L301-V304 WeakPolarHBondContact O-CB 3.22Å; L301-V304 PolarHBondContact O-N 2.97Å; L301-T305 PolarHBondContact O-N 2.9Å; L301-T305 PolarHBondContact O-OG1 3.01Å
302	S	73.1	Confident	76.4	Confident	79 Å²	79	55.2 Å²	55.2	55%	0.552	29%	0.29	S	S	*	.	H	α-helix	trans	-55.5	-30.6	174.9	61.2	0	0	0	0	114.1	P300 R306	P300-S302 PolarHBondContact O-N 3.15Å; S302-R306 WeakPolarHBondContact O-CB 3.15Å; S302-R306 PolarHBondContact O-N 2.93Å
303	T	79.5	Confident	76.1	Confident	40 Å²	40	52.3 Å²	52.3	25%	0.245	29%	0.293	C	S	.	.	H	α-helix	trans	-65.7	-44.5	175.3	-55.4	0	0	0	0	110.9	V164 I299 P300 L301 L307	V164-T303 HydrophobicContact CG1-CG2 4.24Å; V164-T303 HydrophobicContact CG2-CG2 4.38Å; I299-T303 HydrophobicContact CG2-CG2 4.44Å; P300-T303 WeakPolarHBondContact CG-OG1 3.46Å; P300-T303 VanDerWaalsContact O-CB 3.3Å; P300-T303 WeakPolarHBondContact O-CB 3.21Å; P300-T303 PolarHBondContact O-N 3.49Å; P300-T303 PolarHBondContact O-OG1 3.29Å; L301-T303 PolarHBondContact O-N 2.88Å; L301-T303 VanDerWaalsContact O-N 3.16Å; T303-L307 PolarHBondContact O-N 3.27Å
304	V	82.8	Confident	75.8	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.006	31%	0.307	C	S	.	.	H	α-helix	trans	-67.8	-45.8	177	-179.5	0	0	0	0	110	V164 V167 A168 L294 L301 R306 L307 I308	V164-V304 HydrophobicContact CG1-CG2 4.27Å; V167-V304 HydrophobicContact CB-CG1 4.42Å; V167-V304 HydrophobicContact CG1-CG1 4.19Å; A168-V304 HydrophobicContact CB-CG1 4.09Å; L294-V304 HydrophobicContact CD1-CG2 3.62Å; L294-V304 HydrophobicContact CD2-CG2 4.3Å; L301-V304 WeakPolarHBondContact O-CB 3.22Å; L301-V304 PolarHBondContact O-N 2.97Å; V304-R306 VanDerWaalsContact C-N 3.3Å; V304-R306 PolarHBondContact O-N 3.16Å; V304-L307 WeakPolarHBondContact O-CB 3.36Å; V304-L307 PolarHBondContact O-N 3.1Å; V304-I308 HydrophobicContact CG1-CD1 3.79Å; V304-I308 HydrophobicContact CG1-CG1 4.3Å; V304-I308 WeakPolarHBondContact O-CG1 3.31Å; V304-I308 PolarHBondContact O-N 3.18Å
305	T	77.9	Confident	75.1	Confident	23 Å²	23	63.1 Å²	63.1	14%	0.141	34%	0.339	C	S	.	.	H	α-helix	trans	-57.2	-41.8	176.9	-54.7	0	0	0	0	112.5	L301 I308 T309 T342	L301-T305 PolarHBondContact O-N 2.9Å; L301-T305 PolarHBondContact O-OG1 3.01Å; T305-I308 PolarHBondContact O-N 2.73Å; T305-T309 WeakPolarHBondContact O-CB 3.34Å; T305-T309 PolarHBondContact O-N 3.21Å; T305-T309 PolarHBondContact O-OG1 3.39Å; T305-T342 HydrophobicContact CG2-CG2 3.51Å; T305-T342 WeakPolarHBondContact CG2-OG1 3.37Å
306	R	80.3	Confident	74.1	Confident	178 Å²	178	64.2 Å²	64.2	67%	0.672	34%	0.344	S	S	*	.	H	α-helix	trans	-62.6	-42	175.5	-176.9	174.6	62.5	-167.4	-2.1	111.6	S302 V304 T309 S310	S302-R306 WeakPolarHBondContact O-CB 3.15Å; S302-R306 PolarHBondContact O-N 2.93Å; V304-R306 VanDerWaalsContact C-N 3.3Å; V304-R306 PolarHBondContact O-N 3.16Å; R306-T309 PolarHBondContact O-N 2.98Å; R306-S310 PolarHBondContact O-N 3.45Å
307	L	83.4	Confident	72.8	Confident	47 Å²	47	62.4 Å²	62.4	25%	0.246	34%	0.343	C	S	.	.	H	α-helix	trans	-66.5	-43	176.8	-177.7	60.6	0	0	0	112.1	V164 K165 A168 T303 V304 T309 S310 K311	V164-L307 HydrophobicContact CG1-CD2 3.81Å; K165-L307 HydrophobicContact CB-CD2 4.4Å; A168-L307 HydrophobicContact CB-CB 4.39Å; A168-L307 HydrophobicContact CB-CD2 3.76Å; A168-L307 HydrophobicContact CB-CG 4.07Å; T303-L307 PolarHBondContact O-N 3.27Å; V304-L307 WeakPolarHBondContact O-CB 3.36Å; V304-L307 PolarHBondContact O-N 3.1Å; L307-T309 VanDerWaalsContact C-N 3.31Å; L307-T309 PolarHBondContact O-N 2.83Å; L307-S310 WeakPolarHBondContact O-CB 3.42Å; L307-S310 PolarHBondContact O-N 3.05Å; L307-K311 HydrophobicContact CD1-CG 4.49Å; L307-K311 PolarHBondContact O-N 3.44Å
308	I	82.6	Confident	71.6	Confident	4 Å²	4	64.1 Å²	64.1	2%	0.021	36%	0.364	C	S	.	.	H	α-helix	trans	-58.9	-46.6	175.5	-65.8	163.7	0	0	0	110	A168 H171 V304 T305 S310 K311 L312 I338	A168-I308 HydrophobicContact CB-CG1 3.78Å; H171-I308 HydrophobicContact CB-CD1 3.8Å; V304-I308 HydrophobicContact CG1-CD1 3.79Å; V304-I308 HydrophobicContact CG1-CG1 4.3Å; V304-I308 WeakPolarHBondContact O-CG1 3.31Å; V304-I308 PolarHBondContact O-N 3.18Å; T305-I308 PolarHBondContact O-N 2.73Å; I308-S310 VanDerWaalsContact C-N 3.3Å; I308-S310 PolarHBondContact O-N 2.77Å; I308-K311 PolarHBondContact O-N 2.71Å; I308-L312 HydrophobicContact CG2-CD1 3.85Å; I308-L312 WeakPolarHBondContact O-CG 3.48Å; I308-L312 PolarHBondContact O-N 3.27Å; I308-I338 HydrophobicContact CG2-CD1 3.84Å; I308-I338 HydrophobicContact CG2-CG2 3.86Å
309	T	76.9	Confident	70.4	Confident	70 Å²	70	71.4 Å²	71.4	43%	0.429	40%	0.397	S	S	.	.	H	α-helix	trans	-61.3	-39.7	178	-54.5	0	0	0	0	111.4	T305 R306 L307 A313	T305-T309 WeakPolarHBondContact O-CB 3.34Å; T305-T309 PolarHBondContact O-N 3.21Å; T305-T309 PolarHBondContact O-OG1 3.39Å; R306-T309 PolarHBondContact O-N 2.98Å; L307-T309 VanDerWaalsContact C-N 3.31Å; L307-T309 PolarHBondContact O-N 2.83Å; T309-A313 WeakPolarHBondContact O-CB 3.38Å; T309-A313 PolarHBondContact O-N 3.02Å
310	S	81.8	Confident	69	Low	52 Å²	52	79.5 Å²	79.5	36%	0.364	44%	0.435	S	S	.	.	H	α-helix	trans	-62.2	-51.1	174.3	-161.9	0	0	0	0	111.8	R306 L307 I308 L312 A313 E314	R306-S310 PolarHBondContact O-N 3.45Å; L307-S310 WeakPolarHBondContact O-CB 3.42Å; L307-S310 PolarHBondContact O-N 3.05Å; I308-S310 VanDerWaalsContact C-N 3.3Å; I308-S310 PolarHBondContact O-N 2.77Å; S310-L312 VanDerWaalsContact C-N 3.25Å; S310-L312 PolarHBondContact O-N 2.82Å; S310-A313 PolarHBondContact O-N 3.25Å; S310-A313 VanDerWaalsContact O-N 3.13Å; S310-E314 WeakPolarHBondContact O-CB 3.36Å; S310-E314 WeakPolarHBondContact O-CG 3.39Å; S310-E314 PolarHBondContact O-N 2.93Å; S310-E314 PolarHBondContact OG-OE1 3.34Å
311	K	81.9	Confident	67.6	Low	44 Å²	44	84.8 Å²	84.8	19%	0.191	45%	0.454	C	S	.	.	H	α-helix	trans	-58.9	-36.3	-179.6	-76.9	-175.8	172.1	-178.6	0	112.9	D169 L307 I308 K315	D169-K311 IonicContact OD1-NZ 3.04Å; D169-K311 PolarHBondContact OD1-NZ 2.64Å; D169-K311 IonicContact OD2-NZ 3.27Å; D169-K311 PolarHBondContact OD2-NZ 3.25Å; L307-K311 HydrophobicContact CD1-CG 4.49Å; L307-K311 PolarHBondContact O-N 3.44Å; I308-K311 PolarHBondContact O-N 2.71Å; K311-K315 PolarHBondContact O-N 3.09Å
312	L	74	Confident	66.3	Low	12 Å²	12	85.2 Å²	85.2	6%	0.063	46%	0.464	C	S	.	.	H	α-helix	trans	-72.5	-44	176.6	-70.7	167.4	0	0	0	111.5	L172 I308 S310 E314 K315 S316 L334 E335 I338	L172-L312 HydrophobicContact CD1-CD2 3.71Å; L172-L312 HydrophobicContact CD1-CG 4.27Å; I308-L312 HydrophobicContact CG2-CD1 3.85Å; I308-L312 WeakPolarHBondContact O-CG 3.48Å; I308-L312 PolarHBondContact O-N 3.27Å; S310-L312 VanDerWaalsContact C-N 3.25Å; S310-L312 PolarHBondContact O-N 2.82Å; L312-E314 VanDerWaalsContact C-N 3.33Å; L312-E314 PolarHBondContact O-N 3.19Å; L312-K315 PolarHBondContact O-N 3.43Å; L312-K315 VanDerWaalsContact O-N 3.17Å; L312-S316 PolarHBondContact O-N 3.08Å; L312-S316 PolarHBondContact O-OG 3.32Å; L312-L334 HydrophobicContact CD2-CD2 4.28Å; L312-L334 HydrophobicContact CD2-CG 4.5Å; L312-E335 HydrophobicContact CB-CG 3.7Å; L312-E335 HydrophobicContact CD1-CG 4Å; L312-E335 HydrophobicContact CD2-CG 4.09Å; L312-E335 HydrophobicContact CG-CG 4.14Å; L312-I338 HydrophobicContact CD1-CD1 3.63Å
313	A	71	Confident	65.1	Low	63 Å²	63	88.5 Å²	88.5	52%	0.521	48%	0.481	S	S	.	.	H	α-helix	trans	-62.4	-38.4	176.3	0	0	0	0	0	112.8	T309 S310 K315 S316	T309-A313 WeakPolarHBondContact O-CB 3.38Å; T309-A313 PolarHBondContact O-N 3.02Å; S310-A313 PolarHBondContact O-N 3.25Å; S310-A313 VanDerWaalsContact O-N 3.13Å; A313-K315 VanDerWaalsContact C-N 3.27Å; A313-K315 PolarHBondContact O-N 3.36Å; A313-S316 PolarHBondContact O-N 3.3Å
314	E	70.2	Confident	63.9	Low	126 Å²	126	89.6 Å²	89.6	59%	0.589	49%	0.49	S	S	*	.	H	α-helix	trans	-66.4	-26	176.2	-75.6	167	-142	0	0	113.4	S310 L312 S316 P317	S310-E314 WeakPolarHBondContact O-CB 3.36Å; S310-E314 WeakPolarHBondContact O-CG 3.39Å; S310-E314 PolarHBondContact O-N 2.93Å; S310-E314 PolarHBondContact OG-OE1 3.34Å; L312-E314 VanDerWaalsContact C-N 3.33Å; L312-E314 PolarHBondContact O-N 3.19Å; E314-S316 VanDerWaalsContact C-N 3.29Å; E314-P317 WeakPolarHBondContact O-CD 3.48Å; E314-P317 WeakPolarHBondContact O-CG 3.44Å
315	K	60.9	Low	62.6	Low	162 Å²	162	96.6 Å²	96.6	70%	0.704	53%	0.527	S	S	*	.	H	α-helix	trans	-83.2	-10.4	176.1	-153.8	167.5	-173.7	177.8	0	112.8	K311 L312 A313	K311-K315 PolarHBondContact O-N 3.09Å; L312-K315 PolarHBondContact O-N 3.43Å; L312-K315 VanDerWaalsContact O-N 3.17Å; A313-K315 VanDerWaalsContact C-N 3.27Å; A313-K315 PolarHBondContact O-N 3.36Å
316	S	52.4	Low	61.5	Low	72 Å²	72	102.9 Å²	102.9	50%	0.503	56%	0.555	S	S	.	*	S	Bend	trans	-96.1	9.1	-176.9	-69.4	0	0	0	0	117.9	L312 A313 E314 E335	L312-S316 PolarHBondContact O-N 3.08Å; L312-S316 PolarHBondContact O-OG 3.32Å; A313-S316 PolarHBondContact O-N 3.3Å; E314-S316 VanDerWaalsContact C-N 3.29Å; S316-E335 PolarHBondContact OG-OE1 2.86Å
317	P	43.3	Very low	60.5	Low	87 Å²	87	98.3 Å²	98.3	57%	0.565	55%	0.547	S	S	*	.			trans	-97.3	144.5	178.9	36.4	-30.7	0	0	0	115.7	E314	E314-P317 WeakPolarHBondContact O-CD 3.48Å; E314-P317 WeakPolarHBondContact O-CG 3.44Å
318	S	45.8	Very low	59.7	Low	113 Å²	113	98.1 Å²	98.1	79%	0.79	55%	0.549	S	S	*	.	S	Bend	trans	64.7	102.2	164.9	59.7	0	0	0	0	119.9	E320	S318-E320 PolarHBondContact O-N 2.87Å; S318-E320 VanDerWaalsContact O-N 3.14Å
319	M	42.5	Very low	59.3	Low	161 Å²	161	102.5 Å²	102.5	79%	0.793	57%	0.572	S	S	*	*			trans	18	81.2	138.5	-79.5	-157.9	79	0	0	116.9
320	E	44.4	Very low	59.1	Low	186 Å²	186	101 Å²	101	87%	0.869	56%	0.56	S	S	*	*			trans	-127	96.7	144.5	-72.3	-168.7	178.1	0	0	106.9	S318 S322	S318-E320 PolarHBondContact O-N 2.87Å; S318-E320 VanDerWaalsContact O-N 3.14Å; E320-S322 PolarHBondContact O-N 3.41Å
321	E	41.9	Very low	58.5	Low	176 Å²	176	100 Å²	100	82%	0.822	55%	0.553	S	S	*	*			trans	-76.2	33.9	-168.6	-124.6	173.1	-162.8	0	0	112.9
322	S	45.1	Very low	58.3	Low	94 Å²	94	105.8 Å²	105.8	66%	0.657	57%	0.574	S	S	*	*	S	Bend	trans	-142.5	106.3	-169.8	-64.6	0	0	0	0	111.1	E320	E320-S322 PolarHBondContact O-N 3.41Å
323	T	48.7	Very low	58.5	Low	147 Å²	147	109.2 Å²	109.2	90%	0.902	59%	0.591	S	S	*	*	S	Bend	trans	103.7	8.6	153.3	75.9	0	0	0	0	121.2
324	S	53.5	Low	58.7	Low	64 Å²	64	106.7 Å²	106.7	45%	0.448	57%	0.568	S	S	.	*			trans	-141.1	52.6	174.9	75.2	0	0	0	0	116.5	H326 T327 S328	S324-H326 PolarHBondContact O-N 3.42Å; S324-H326 VanDerWaalsContact O-N 3.15Å; S324-T327 PolarHBondContact O-N 3.46Å; S324-T327 VanDerWaalsContact O-N 3.15Å; S324-S328 WeakPolarHBondContact O-CB 3.25Å; S324-S328 PolarHBondContact O-N 2.95Å
325	D	56.9	Low	59	Low	147 Å²	147	102.7 Å²	102.7	79%	0.786	55%	0.55	S	S	*	.	H	α-helix	trans	-52.3	-38.5	174.1	-73.7	-22.5	0	0	0	112.6	L329	D325-L329 WeakPolarHBondContact O-CB 3.42Å; D325-L329 PolarHBondContact O-N 3.17Å
326	H	53.9	Low	60	Low	156 Å²	156	100.3 Å²	100.3	72%	0.722	54%	0.536	S	S	*	.	H	α-helix	trans	-68.6	-44.9	177.7	-72.2	-63.2	0	0	0	113.5	S324 L329 E330	S324-H326 PolarHBondContact O-N 3.42Å; S324-H326 VanDerWaalsContact O-N 3.15Å; H326-L329 PolarHBondContact O-N 3.25Å; H326-E330 PolarHBondContact O-N 3.2Å
327	T	59.4	Low	61.3	Low	81 Å²	81	98.5 Å²	98.5	50%	0.497	52%	0.521	S	S	.	.	H	α-helix	trans	-67.7	-39.8	-180	-50.5	0	0	0	0	111	S324 E330 C331	S324-T327 PolarHBondContact O-N 3.46Å; S324-T327 VanDerWaalsContact O-N 3.15Å; T327-E330 PolarHBondContact O-N 3.08Å; T327-C331 PolarHBondContact O-N 3.33Å; T327-C331 PolarHBondContact O-SG 3.37Å
328	S	67.6	Low	62.9	Low	43 Å²	43	94.9 Å²	94.9	30%	0.301	50%	0.497	S	S	.	.	H	α-helix	trans	-61.2	-42.9	173.9	173.3	0	0	0	0	111.9	S324 C331 R332	S324-S328 WeakPolarHBondContact O-CB 3.25Å; S324-S328 PolarHBondContact O-N 2.95Å; S328-C331 PolarHBondContact O-N 3.02Å; S328-R332 WeakPolarHBondContact O-CG 3.31Å; S328-R332 PolarHBondContact O-N 3.23Å
329	L	73.7	Confident	64.4	Low	96 Å²	96	97.3 Å²	97.3	50%	0.503	49%	0.488	S	S	.	.	H	α-helix	trans	-64.1	-45.2	176.7	-175.2	64.1	0	0	0	112.1	D325 H326 C331 R332 M333	D325-L329 WeakPolarHBondContact O-CB 3.42Å; D325-L329 PolarHBondContact O-N 3.17Å; H326-L329 PolarHBondContact O-N 3.25Å; L329-C331 PolarHBondContact O-N 3.4Å; L329-R332 PolarHBondContact O-N 3.12Å; L329-M333 HydrophobicContact CG-SD 4.16Å; L329-M333 VanDerWaalsContact O-CG 3.32Å; L329-M333 WeakPolarHBondContact O-CG 3.41Å; L329-M333 PolarHBondContact O-N 3.18Å
330	E	71.4	Confident	66.2	Low	38 Å²	38	89.8 Å²	89.8	18%	0.178	45%	0.452	C	S	.	.	H	α-helix	trans	-59.8	-44.6	177.3	-168.6	178.8	141.9	0	0	111.5	R176 L179 R183 H326 T327 R332 M333 L334	R176-E330 WeakPolarHBondContact CD-OE1 3.16Å; R176-E330 WeakPolarHBondContact CG-OE1 3.21Å; L179-E330 HydrophobicContact CD2-CG 3.8Å; R183-E330 IonicContact NH1-OE2 3.92Å; H326-E330 PolarHBondContact O-N 3.2Å; T327-E330 PolarHBondContact O-N 3.08Å; E330-R332 PolarHBondContact O-N 3.45Å; E330-M333 PolarHBondContact O-N 2.8Å; E330-L334 VanDerWaalsContact O-CB 3.26Å; E330-L334 WeakPolarHBondContact O-CB 3.49Å; E330-L334 PolarHBondContact O-N 2.97Å
331	C	69.6	Low	67.7	Low	32 Å²	32	81.9 Å²	81.9	22%	0.216	42%	0.421	C	S	.	.	H	α-helix	trans	-60.8	-43.4	175.2	-74.2	0	0	0	0	112.5	T327 S328 L329 L334 E335	T327-C331 PolarHBondContact O-N 3.33Å; T327-C331 PolarHBondContact O-SG 3.37Å; S328-C331 PolarHBondContact O-N 3.02Å; L329-C331 PolarHBondContact O-N 3.4Å; C331-L334 WeakPolarHBondContact O-CB 3.35Å; C331-L334 PolarHBondContact O-N 3.23Å; C331-E335 WeakPolarHBondContact O-CG 3.35Å; C331-E335 PolarHBondContact O-N 3.06Å
332	R	77.2	Confident	69.3	Low	166 Å²	166	76.2 Å²	76.2	63%	0.626	40%	0.398	S	S	*	.	H	α-helix	trans	-65.6	-39.7	177.7	-72.2	176.3	-174.7	172.8	3.9	112.6	S328 L329 E330 R336	S328-R332 WeakPolarHBondContact O-CG 3.31Å; S328-R332 PolarHBondContact O-N 3.23Å; L329-R332 PolarHBondContact O-N 3.12Å; E330-R332 PolarHBondContact O-N 3.45Å; R332-R336 WeakPolarHBondContact O-CB 3.42Å; R332-R336 PolarHBondContact O-N 3.03Å; R332-R336 VanDerWaalsContact O-N 3.08Å
333	M	78.2	Confident	70.9	Confident	83 Å²	83	72.5 Å²	72.5	41%	0.409	37%	0.371	S	S	.	.	H	α-helix	trans	-65	-42.6	175.2	-70.8	178.2	79	0	0	110.9	L179 L329 E330 R336 N337	L179-M333 HydrophobicContact CD1-CB 4.35Å; L179-M333 HydrophobicContact CD1-CE 3.77Å; L179-M333 HydrophobicContact CD1-SD 4.47Å; L179-M333 HydrophobicContact CD2-CB 3.83Å; L329-M333 HydrophobicContact CG-SD 4.16Å; L329-M333 VanDerWaalsContact O-CG 3.32Å; L329-M333 WeakPolarHBondContact O-CG 3.41Å; L329-M333 PolarHBondContact O-N 3.18Å; E330-M333 PolarHBondContact O-N 2.8Å; M333-R336 WeakPolarHBondContact O-CB 3.35Å; M333-R336 PolarHBondContact O-N 3.3Å; M333-N337 PolarHBondContact O-N 3.45Å; M333-N337 PolarHBondContact O-OD1 2.87Å
334	L	76.1	Confident	72.3	Confident	10 Å²	10	65.7 Å²	65.7	5%	0.052	33%	0.329	C	S	.	.	H	α-helix	trans	-62.2	-47.1	178	-171.9	60.4	0	0	0	112.2	L172 R176 L312 E330 C331 R336 N337 I338	L172-L334 HydrophobicContact CD1-CD2 3.53Å; L172-L334 HydrophobicContact CD1-CG 4.2Å; L172-L334 HydrophobicContact CG-CD2 4.47Å; R176-L334 HydrophobicContact CB-CD2 4.34Å; L312-L334 HydrophobicContact CD2-CD2 4.28Å; L312-L334 HydrophobicContact CD2-CG 4.5Å; E330-L334 VanDerWaalsContact O-CB 3.26Å; E330-L334 WeakPolarHBondContact O-CB 3.49Å; E330-L334 PolarHBondContact O-N 2.97Å; C331-L334 WeakPolarHBondContact O-CB 3.35Å; C331-L334 PolarHBondContact O-N 3.23Å; L334-R336 VanDerWaalsContact C-N 3.28Å; L334-R336 PolarHBondContact O-N 2.74Å; L334-N337 PolarHBondContact O-N 2.84Å; L334-I338 HydrophobicContact CD1-CD1 3.98Å; L334-I338 HydrophobicContact CG-CD1 3.92Å; L334-I338 WeakPolarHBondContact O-CG1 3.48Å; L334-I338 PolarHBondContact O-N 3.3Å
335	E	77.4	Confident	73.3	Confident	43 Å²	43	67.1 Å²	67.1	20%	0.201	34%	0.335	C	S	.	.	H	α-helix	trans	-55.5	-44.1	172.8	-81.4	-179.2	-173.4	0	0	112.3	L312 S316 C331 R339	L312-E335 HydrophobicContact CB-CG 3.7Å; L312-E335 HydrophobicContact CD1-CG 4Å; L312-E335 HydrophobicContact CD2-CG 4.09Å; L312-E335 HydrophobicContact CG-CG 4.14Å; S316-E335 PolarHBondContact OG-OE1 2.86Å; C331-E335 WeakPolarHBondContact O-CG 3.35Å; C331-E335 PolarHBondContact O-N 3.06Å; E335-R339 WeakPolarHBondContact O-CB 3.2Å; E335-R339 PolarHBondContact O-N 3.44Å; E335-R339 VanDerWaalsContact O-N 3.09Å
336	R	81.6	Confident	74.3	Confident	111 Å²	111	63.4 Å²	63.4	42%	0.419	32%	0.315	S	S	.	.	H	α-helix	trans	-64.2	-47.6	178.8	-173.1	-178.7	-177.4	176	1.6	111.6	R332 M333 L334 R339 A340 S426 I427	R332-R336 WeakPolarHBondContact O-CB 3.42Å; R332-R336 PolarHBondContact O-N 3.03Å; R332-R336 VanDerWaalsContact O-N 3.08Å; M333-R336 WeakPolarHBondContact O-CB 3.35Å; M333-R336 PolarHBondContact O-N 3.3Å; L334-R336 VanDerWaalsContact C-N 3.28Å; L334-R336 PolarHBondContact O-N 2.74Å; R336-R339 PolarHBondContact O-N 3.34Å; R336-A340 VanDerWaalsContact O-CB 3.27Å; R336-A340 WeakPolarHBondContact O-CB 3.33Å; R336-A340 PolarHBondContact O-N 3.38Å; R336-S426 PolarHBondContact NH2-O 3.19Å; R336-I427 VanDerWaalsContact NH2-C 3.34Å; R336-I427 PolarHBondContact NH2-O 3.24Å
337	N	78.9	Confident	75.8	Confident	34 Å²	34	57.3 Å²	57.3	18%	0.182	29%	0.291	C	S	.	.	H	α-helix	trans	-65.4	-39.7	-178	-72.2	5.9	0	0	0	112.1	M333 L334 A340 G341 I427	M333-N337 PolarHBondContact O-N 3.45Å; M333-N337 PolarHBondContact O-OD1 2.87Å; L334-N337 PolarHBondContact O-N 2.84Å; N337-A340 WeakPolarHBondContact O-CB 3.42Å; N337-A340 PolarHBondContact O-N 3.12Å; N337-G341 PolarHBondContact O-N 2.91Å; N337-I427 WeakPolarHBondContact OD1-CD1 3.48Å
338	I	76.9	Confident	76.9	Confident	11 Å²	11	56.1 Å²	56.1	6%	0.056	29%	0.285	C	S	.	.	H	α-helix	trans	-68.3	-40.9	178	-69.8	164.3	0	0	0	110.9	L172 I308 L312 L334 G341 T342	L172-I338 HydrophobicContact CD1-CD1 4.29Å; I308-I338 HydrophobicContact CG2-CD1 3.84Å; I308-I338 HydrophobicContact CG2-CG2 3.86Å; L312-I338 HydrophobicContact CD1-CD1 3.63Å; L334-I338 HydrophobicContact CD1-CD1 3.98Å; L334-I338 HydrophobicContact CG-CD1 3.92Å; L334-I338 WeakPolarHBondContact O-CG1 3.48Å; L334-I338 PolarHBondContact O-N 3.3Å; I338-G341 PolarHBondContact O-N 3.47Å; I338-T342 WeakPolarHBondContact O-CB 3.48Å; I338-T342 PolarHBondContact O-N 3.2Å; I338-T342 PolarHBondContact O-OG1 3.44Å
339	R	76.8	Confident	77.7	Confident	164 Å²	164	56.2 Å²	56.2	62%	0.619	28%	0.282	S	S	*	.	H	α-helix	trans	-63.8	-44.3	174.7	-174.2	-179.6	-62.8	155.8	6.1	111.5	E335 R336 T342 M343	E335-R339 WeakPolarHBondContact O-CB 3.2Å; E335-R339 PolarHBondContact O-N 3.44Å; E335-R339 VanDerWaalsContact O-N 3.09Å; R336-R339 PolarHBondContact O-N 3.34Å; R339-T342 PolarHBondContact O-N 2.87Å; R339-M343 VanDerWaalsContact O-CB 3.27Å; R339-M343 WeakPolarHBondContact O-CB 3.39Å; R339-M343 PolarHBondContact O-N 2.97Å
340	A	82	Confident	78.7	Confident	4 Å²	4	51.7 Å²	51.7	3%	0.033	26%	0.258	C	S	.	.	H	α-helix	trans	-55.6	-51.4	174.2	0	0	0	0	0	111.6	R336 N337 M343 A344 F423 S426 I427	R336-A340 VanDerWaalsContact O-CB 3.27Å; R336-A340 WeakPolarHBondContact O-CB 3.33Å; R336-A340 PolarHBondContact O-N 3.38Å; N337-A340 WeakPolarHBondContact O-CB 3.42Å; N337-A340 PolarHBondContact O-N 3.12Å; A340-M343 PolarHBondContact O-N 3.14Å; A340-A344 VanDerWaalsContact O-CB 3.24Å; A340-A344 WeakPolarHBondContact O-CB 3.47Å; A340-A344 PolarHBondContact O-N 3.01Å; A340-F423 HydrophobicContact CB-CD2 3.94Å; A340-F423 HydrophobicContact CB-CE2 3.91Å; A340-S426 WeakPolarHBondContact CB-OG 2.96Å; A340-I427 HydrophobicContact CB-CD1 4Å; A340-I427 HydrophobicContact CB-CG1 3.87Å
341	G	75.9	Confident	79.7	Confident	20 Å²	20	52.1 Å²	52.1	21%	0.206	26%	0.262	C	S	.	.	H	α-helix	trans	-58.2	-51.7	177.2	0	0	0	0	0	111.9	N337 I338 M343 A344 T345	N337-G341 PolarHBondContact O-N 2.91Å; I338-G341 PolarHBondContact O-N 3.47Å; G341-M343 VanDerWaalsContact C-N 3.33Å; G341-M343 PolarHBondContact O-N 3.02Å; G341-A344 PolarHBondContact O-N 3.32Å; G341-A344 VanDerWaalsContact O-N 3.13Å; G341-T345 PolarHBondContact O-N 2.98Å; G341-T345 PolarHBondContact O-OG1 3.44Å
342	T	74.3	Confident	80.8	Confident	56 Å²	56	51.3 Å²	51.3	34%	0.344	26%	0.255	S	S	.	.	H	α-helix	trans	-55.1	-47.7	178.5	-58.6	0	0	0	0	112.3	T305 I338 R339 A344 T345	T305-T342 HydrophobicContact CG2-CG2 3.51Å; T305-T342 WeakPolarHBondContact CG2-OG1 3.37Å; I338-T342 WeakPolarHBondContact O-CB 3.48Å; I338-T342 PolarHBondContact O-N 3.2Å; I338-T342 PolarHBondContact O-OG1 3.44Å; R339-T342 PolarHBondContact O-N 2.87Å; T342-A344 VanDerWaalsContact C-N 3.34Å; T342-T345 PolarHBondContact O-N 3.43Å
343	M	79.6	Confident	81.1	Confident	17 Å²	17	47.1 Å²	47.1	8%	0.084	25%	0.251	C	S	.	.	H	α-helix	trans	-66.7	-37.9	-179.4	-174.6	-173.4	71.8	0	0	111.7	R339 A340 G341 W350 F372 V422 S426 L441 P444	R339-M343 VanDerWaalsContact O-CB 3.27Å; R339-M343 WeakPolarHBondContact O-CB 3.39Å; R339-M343 PolarHBondContact O-N 2.97Å; A340-M343 PolarHBondContact O-N 3.14Å; G341-M343 VanDerWaalsContact C-N 3.33Å; G341-M343 PolarHBondContact O-N 3.02Å; M343-W350 PolarHBondContact O-NE1 3.06Å; M343-F372 HydrophobicContact CE-CE1 3.77Å; M343-F372 HydrophobicContact CE-CZ 3.83Å; M343-F372 HydrophobicContact CG-CZ 4.43Å; M343-F372 HydrophobicContact SD-CE1 3.68Å; M343-F372 HydrophobicContact SD-CZ 4.03Å; M343-V422 HydrophobicContact CE-CG1 4.01Å; M343-S426 VanDerWaalsContact CE-CB 3.47Å; M343-L441 HydrophobicContact CE-CB 4.23Å; M343-L441 WeakPolarHBondContact CE-O 3.47Å; M343-P444 HydrophobicContact CG-CB 4.4Å; M343-P444 HydrophobicContact CG-CG 3.87Å; M343-P444 HydrophobicContact SD-CG 4.45Å
344	A	78.4	Confident	81.4	Confident	4 Å²	4	49.6 Å²	49.6	3%	0.033	27%	0.266	C	S	.	.	H	α-helix	trans	-71.5	-35.5	178.8	0	0	0	0	0	112.5	A340 G341 T342 N419 V422 F423	A340-A344 VanDerWaalsContact O-CB 3.24Å; A340-A344 WeakPolarHBondContact O-CB 3.47Å; A340-A344 PolarHBondContact O-N 3.01Å; G341-A344 PolarHBondContact O-N 3.32Å; G341-A344 VanDerWaalsContact O-N 3.13Å; T342-A344 VanDerWaalsContact C-N 3.34Å; A344-N419 WeakPolarHBondContact CB-O 3.35Å; A344-N419 PolarHBondContact O-ND2 3.32Å; A344-V422 HydrophobicContact CB-CB 4.34Å; A344-V422 HydrophobicContact CB-CG1 4.08Å; A344-F423 HydrophobicContact CB-CB 3.75Å
345	T	74.5	Confident	82.1	Confident	93 Å²	93	49.5 Å²	49.5	57%	0.571	27%	0.266	S	S	*	.	H	α-helix	trans	-67.1	-38.5	-179	-54.7	0	0	0	0	112.5	G341 T342 S347 N419	G341-T345 PolarHBondContact O-N 2.98Å; G341-T345 PolarHBondContact O-OG1 3.44Å; T342-T345 PolarHBondContact O-N 3.43Å; T345-S347 PolarHBondContact O-N 3.05Å; T345-N419 PolarHBondContact O-ND2 3.43Å
346	D	77.2	Confident	82.8	Confident	69 Å²	69	48.7 Å²	48.7	37%	0.369	27%	0.265	S	S	.	.			trans	-86.8	79.1	-177.6	-164.9	-9.8	0	0	0	111.7	S348 L349 W350	D346-S348 PolarHBondContact O-N 3.03Å; D346-S348 VanDerWaalsContact O-N 3.12Å; D346-S348 WeakPolarHBondContact OD1-CB 3.36Å; D346-S348 PolarHBondContact OD1-N 3.49Å; D346-S348 PolarHBondContact OD1-OG 3.1Å; D346-L349 HydrophobicContact CB-CD1 3.93Å; D346-L349 HydrophobicContact CB-CG 4.07Å; D346-L349 PolarHBondContact O-N 2.94Å; D346-L349 VanDerWaalsContact O-N 3.09Å; D346-W350 PolarHBondContact O-NE1 2.79Å
347	S	84.8	Confident	83.4	Confident	29 Å²	29	48.5 Å²	48.5	20%	0.203	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-55.2	-27.3	177.7	-59.8	0	0	0	0	113	T345 L349 W350 L351 N419	T345-S347 PolarHBondContact O-N 3.05Å; S347-L349 PolarHBondContact O-N 3.32Å; S347-L349 VanDerWaalsContact O-N 3.14Å; S347-W350 PolarHBondContact O-N 3.29Å; S347-W350 WeakPolarHBondContact OG-CZ2 3.39Å; S347-L351 WeakPolarHBondContact O-CA 3.35Å; S347-L351 WeakPolarHBondContact O-CB 3.44Å; S347-L351 PolarHBondContact O-N 3.27Å; S347-N419 PolarHBondContact OG-ND2 3.35Å; S347-N419 PolarHBondContact OG-OD1 2.95Å
348	S	82.2	Confident	84.1	Confident	56 Å²	56	53 Å²	53	39%	0.392	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-61.2	-24.9	179.6	79.5	0	0	0	0	112.6	D346 L446	D346-S348 PolarHBondContact O-N 3.03Å; D346-S348 VanDerWaalsContact O-N 3.12Å; D346-S348 WeakPolarHBondContact OD1-CB 3.36Å; D346-S348 PolarHBondContact OD1-N 3.49Å; D346-S348 PolarHBondContact OD1-OG 3.1Å; S348-L446 WeakPolarHBondContact O-CD1 3.35Å
349	L	85.7	Confident	85	Confident	45 Å²	45	56 Å²	56	24%	0.236	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-79	-24	-176.2	-61.4	179.8	0	0	0	113.8	D346 S347 P444 L446	D346-L349 HydrophobicContact CB-CD1 3.93Å; D346-L349 HydrophobicContact CB-CG 4.07Å; D346-L349 PolarHBondContact O-N 2.94Å; D346-L349 VanDerWaalsContact O-N 3.09Å; S347-L349 PolarHBondContact O-N 3.32Å; S347-L349 VanDerWaalsContact O-N 3.14Å; L349-P444 HydrophobicContact CB-CB 3.76Å; L349-P444 HydrophobicContact CB-CG 3.72Å; L349-P444 HydrophobicContact CD1-CG 4.14Å; L349-P444 WeakPolarHBondContact O-CB 3.43Å; L349-L446 HydrophobicContact CD2-CB 4.41Å; L349-L446 WeakPolarHBondContact O-CB 3.48Å; L349-L446 PolarHBondContact O-N 3.38Å
350	W	93.5	Very high	85.8	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.3	-20.3	-172.9	49.4	-95.9	0	0	0	114.5	M343 D346 S347 L352 F372 L373 I374 L418 V422 P444	M343-W350 PolarHBondContact O-NE1 3.06Å; D346-W350 PolarHBondContact O-NE1 2.79Å; S347-W350 PolarHBondContact O-N 3.29Å; S347-W350 WeakPolarHBondContact OG-CZ2 3.39Å; W350-L352 WeakPolarHBondContact O-CD1 3.45Å; W350-F372 HydrophobicContact CB-CD2 4.21Å; W350-F372 HydrophobicContact CB-CE2 3.57Å; W350-F372 HydrophobicContact CB-CZ 4.04Å; W350-F372 HydrophobicContact CD2-CE2 4.32Å; W350-F372 AromaticContact CG-CE2 3.79Å; W350-F372 HydrophobicContact CG-CE2 3.79Å; W350-F372 HydrophobicContact CG-CZ 4.12Å; W350-L373 CarbonylContact O-C 3.55Å; W350-L373 WeakPolarHBondContact O-CA 3.47Å; W350-I374 HydrophobicContact CE3-CB 3.94Å; W350-I374 HydrophobicContact CE3-CD1 3.87Å; W350-I374 HydrophobicContact CE3-CG1 4.01Å; W350-I374 HydrophobicContact CZ3-CB 4.15Å; W350-I374 HydrophobicContact CZ3-CD1 3.74Å; W350-I374 HydrophobicContact CZ3-CG1 4.28Å; W350-I374 PolarHBondContact O-N 2.97Å; W350-L418 HydrophobicContact CH2-CB 3.86Å; W350-L418 HydrophobicContact CZ3-CB 4.11Å; W350-V422 HydrophobicContact CD2-CG2 4.11Å; W350-V422 HydrophobicContact CE3-CG2 4.1Å; W350-V422 HydrophobicContact CH2-CG2 4.04Å; W350-V422 HydrophobicContact CZ2-CB 4.43Å; W350-V422 HydrophobicContact CZ2-CG2 4.02Å; W350-V422 HydrophobicContact CZ3-CG2 4.07Å; W350-P444 HydrophobicContact CB-CB 3.64Å; W350-P444 HydrophobicContact CG-CB 4.2Å
351	L	93.4	Very high	86.5	Confident	48 Å²	48	50.1 Å²	50.1	25%	0.251	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-90.9	111.3	177.4	-174.2	60.1	0	0	0	110.2	S347 I374 Y384 L418	S347-L351 WeakPolarHBondContact O-CA 3.35Å; S347-L351 WeakPolarHBondContact O-CB 3.44Å; S347-L351 PolarHBondContact O-N 3.27Å; L351-I374 WeakPolarHBondContact CA-O 3.48Å; L351-I374 HydrophobicContact CD1-CB 4.15Å; L351-I374 HydrophobicContact CD1-CG2 3.87Å; L351-Y384 HydrophobicContact CD1-CD1 4.2Å; L351-Y384 HydrophobicContact CD1-CE1 4.03Å; L351-L418 HydrophobicContact CD1-CD1 4.2Å
352	L	91.5	Very high	87.4	Confident	14 Å²	14	53.9 Å²	53.9	7%	0.073	31%	0.305	C	S	.	.			trans	-113.5	107.2	-178.9	-74.6	63.5	0	0	0	109.6	W350 D354 C355 R363 L373 I374 P376 V445 L446	W350-L352 WeakPolarHBondContact O-CD1 3.45Å; L352-D354 PolarHBondContact O-N 2.98Å; L352-C355 HydrophobicContact CB-CB 3.62Å; L352-C355 HydrophobicContact CD2-CB 4.12Å; L352-R363 VanDerWaalsContact CD2-NH1 3.27Å; L352-L373 HydrophobicContact CD1-CB 4.15Å; L352-L373 HydrophobicContact CD2-CD2 4.28Å; L352-I374 PolarHBondContact N-O 3.37Å; L352-P376 WeakPolarHBondContact O-CD 3.42Å; L352-V445 HydrophobicContact CD1-CG1 3.89Å; L352-V445 HydrophobicContact CD2-CG1 4.27Å; L352-L446 HydrophobicContact CD1-CD1 4.46Å
353	S	85.3	Confident	88.2	Confident	78 Å²	78	56.5 Å²	56.5	55%	0.545	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-39.2	-178.3	-56.5	0	0	0	0	113.1	P376	S353-P376 WeakPolarHBondContact O-CD 3.48Å; S353-P376 VanDerWaalsContact O-CG 3.29Å; S353-P376 WeakPolarHBondContact O-CG 3.48Å
354	D	83.6	Confident	89	Confident	135 Å²	135	55.8 Å²	55.8	72%	0.722	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	66.7	-178.6	-60	-32.7	0	0	0	110.5	L352	L352-D354 PolarHBondContact O-N 2.98Å
355	C	90	Very high	89.7	Confident	8 Å²	8	57.9 Å²	57.9	5%	0.054	32%	0.322	C	S	.	.			trans	-135	113.6	178.9	-175.3	0	0	0	0	110.9	L352 R375	L352-C355 HydrophobicContact CB-CB 3.62Å; L352-C355 HydrophobicContact CD2-CB 4.12Å; C355-R375 HydrophobicContact CB-CB 3.91Å; C355-R375 WeakPolarHBondContact O-CB 3.5Å; C355-R375 VanDerWaalsContact O-CD 3.32Å; C355-R375 WeakPolarHBondContact O-CD 3.35Å
356	S	93.1	Very high	90.3	Very high	26 Å²	26	61.8 Å²	61.8	18%	0.182	34%	0.339	C	S	.	.			trans	-74.3	169.3	171.7	68.7	0	0	0	0	111.5	Q358 D359 S360 E378	S356-Q358 PolarHBondContact O-N 3.19Å; S356-Q358 PolarHBondContact OG-N 3.22Å; S356-D359 WeakPolarHBondContact CB-OD2 3.32Å; S356-D359 PolarHBondContact N-OD2 2.99Å; S356-D359 PolarHBondContact O-N 3.4Å; S356-D359 PolarHBondContact OG-N 2.96Å; S356-D359 PolarHBondContact OG-OD2 3.43Å; S356-S360 WeakPolarHBondContact O-CB 3.47Å; S356-S360 PolarHBondContact O-N 3.42Å; S356-E378 WeakPolarHBondContact CB-OE1 3.37Å
357	K	94.2	Very high	91	Very high	107 Å²	107	63.4 Å²	63.4	47%	0.465	34%	0.34	S	S	.	.	H	α-helix	trans	-56.5	-44	170.1	-174.5	177.4	177.4	-175.2	0	110.2	S360 T361 R375 E378 H396	K357-S360 PolarHBondContact O-N 3.23Å; K357-S360 PolarHBondContact O-OG 3.49Å; K357-T361 PolarHBondContact O-N 3.02Å; K357-T361 PolarHBondContact O-OG1 3.01Å; K357-T361 VanDerWaalsContact O-OG1 3.05Å; K357-R375 VanDerWaalsContact N-NH1 3.13Å; K357-E378 WeakPolarHBondContact CB-OE2 3.3Å; K357-E378 PolarHBondContact N-OE2 3.33Å; K357-H396 WeakPolarHBondContact CE-CD2 3.44Å
358	Q	94.2	Very high	91.4	Very high	130 Å²	130	65.9 Å²	65.9	61%	0.607	36%	0.356	S	S	*	.	H	α-helix	trans	-65.3	-45.3	-179.2	-168.6	61.6	19.9	0	0	111.5	S356 S360 T361 V362	S356-Q358 PolarHBondContact O-N 3.19Å; S356-Q358 PolarHBondContact OG-N 3.22Å; Q358-S360 VanDerWaalsContact C-N 3.27Å; Q358-S360 PolarHBondContact O-N 2.94Å; Q358-T361 WeakPolarHBondContact O-CB 3.42Å; Q358-T361 PolarHBondContact O-N 3.45Å; Q358-T361 VanDerWaalsContact O-N 3.13Å; Q358-V362 WeakPolarHBondContact O-CG2 3.37Å; Q358-V362 PolarHBondContact O-N 3.16Å
359	D	94	Very high	92	Very high	73 Å²	73	67 Å²	67	39%	0.39	36%	0.357	S	S	.	.	H	α-helix	trans	-61.4	-38.8	176.5	-59.2	-39.4	0	0	0	111.4	S356 T361 V362 R363	S356-D359 WeakPolarHBondContact CB-OD2 3.32Å; S356-D359 PolarHBondContact N-OD2 2.99Å; S356-D359 PolarHBondContact O-N 3.4Å; S356-D359 PolarHBondContact OG-N 2.96Å; S356-D359 PolarHBondContact OG-OD2 3.43Å; D359-T361 VanDerWaalsContact C-N 3.31Å; D359-T361 PolarHBondContact O-N 2.9Å; D359-V362 PolarHBondContact O-N 2.94Å; D359-R363 WeakPolarHBondContact O-CG 3.29Å; D359-R363 PolarHBondContact O-N 3.43Å
360	S	95.3	Very high	92.3	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-63.5	-39.2	177.1	76.6	0	0	0	0	111.8	S356 K357 Q358 V362 R363 L364 R375 S387 H396	S356-S360 WeakPolarHBondContact O-CB 3.47Å; S356-S360 PolarHBondContact O-N 3.42Å; K357-S360 PolarHBondContact O-N 3.23Å; K357-S360 PolarHBondContact O-OG 3.49Å; Q358-S360 VanDerWaalsContact C-N 3.27Å; Q358-S360 PolarHBondContact O-N 2.94Å; S360-V362 VanDerWaalsContact C-N 3.34Å; S360-V362 PolarHBondContact O-N 3.47Å; S360-R363 PolarHBondContact O-N 3.27Å; S360-L364 VanDerWaalsContact O-CB 3.26Å; S360-L364 WeakPolarHBondContact O-CB 3.47Å; S360-L364 VanDerWaalsContact O-CG 3.24Å; S360-L364 WeakPolarHBondContact O-CG 3.36Å; S360-L364 PolarHBondContact O-N 2.85Å; S360-R375 PolarHBondContact OG-NE 3.47Å; S360-S387 WeakPolarHBondContact CB-OG 3.31Å; S360-S387 PolarHBondContact OG-OG 2.93Å; S360-H396 PolarHBondContact OG-CE1 3.21Å
361	T	95.6	Very high	92.4	Very high	44 Å²	44	65 Å²	65	27%	0.27	35%	0.347	S	S	.	.	H	α-helix	trans	-62	-43.1	174.9	-55.3	0	0	0	0	111	K357 Q358 D359 A365 I394	K357-T361 PolarHBondContact O-N 3.02Å; K357-T361 PolarHBondContact O-OG1 3.01Å; K357-T361 VanDerWaalsContact O-OG1 3.05Å; Q358-T361 WeakPolarHBondContact O-CB 3.42Å; Q358-T361 PolarHBondContact O-N 3.45Å; Q358-T361 VanDerWaalsContact O-N 3.13Å; D359-T361 VanDerWaalsContact C-N 3.31Å; D359-T361 PolarHBondContact O-N 2.9Å; T361-A365 PolarHBondContact O-N 2.79Å; T361-I394 HydrophobicContact CG2-CD1 3.84Å; T361-I394 WeakPolarHBondContact O-CD1 3.48Å
362	V	94.5	Very high	92.6	Very high	100 Å²	100	62.8 Å²	62.8	61%	0.606	34%	0.335	S	S	*	.	H	α-helix	trans	-65.9	-44.1	178.2	174.8	0	0	0	0	111.6	Q358 D359 S360 L364 A365	Q358-V362 WeakPolarHBondContact O-CG2 3.37Å; Q358-V362 PolarHBondContact O-N 3.16Å; D359-V362 PolarHBondContact O-N 2.94Å; S360-V362 VanDerWaalsContact C-N 3.34Å; S360-V362 PolarHBondContact O-N 3.47Å; V362-L364 VanDerWaalsContact C-N 3.31Å; V362-L364 PolarHBondContact O-N 2.75Å; V362-A365 WeakPolarHBondContact O-CB 3.37Å; V362-A365 PolarHBondContact O-N 2.94Å
363	R	92.6	Very high	92.8	Very high	111 Å²	111	62.1 Å²	62.1	42%	0.419	33%	0.332	S	S	.	.	H	α-helix	trans	-68.6	-30.1	-179.4	-71.2	178	-178.9	-129.1	4.8	113.4	L352 D359 S360 L373 V445	L352-R363 VanDerWaalsContact CD2-NH1 3.27Å; D359-R363 WeakPolarHBondContact O-CG 3.29Å; D359-R363 PolarHBondContact O-N 3.43Å; S360-R363 PolarHBondContact O-N 3.27Å; R363-L373 HydrophobicContact CB-CD2 4.42Å; R363-V445 HydrophobicContact CB-CG2 4.18Å
364	L	95.3	Very high	93.4	Very high	1 Å²	1	58.4 Å²	58.4	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-93.4	-6.9	-179.7	-66.5	175.5	0	0	0	113.4	S360 V362 D366 R367 T371 L373 V389 I394 V445	S360-L364 VanDerWaalsContact O-CB 3.26Å; S360-L364 WeakPolarHBondContact O-CB 3.47Å; S360-L364 VanDerWaalsContact O-CG 3.24Å; S360-L364 WeakPolarHBondContact O-CG 3.36Å; S360-L364 PolarHBondContact O-N 2.85Å; V362-L364 VanDerWaalsContact C-N 3.31Å; V362-L364 PolarHBondContact O-N 2.75Å; L364-D366 PolarHBondContact O-N 2.94Å; L364-R367 WeakPolarHBondContact O-CB 3.33Å; L364-R367 PolarHBondContact O-N 3.5Å; L364-T371 HydrophobicContact CD2-CG2 3.75Å; L364-L373 HydrophobicContact CD1-CD2 4.17Å; L364-L373 HydrophobicContact CD1-CG 4.37Å; L364-L373 HydrophobicContact CD2-CD2 4.27Å; L364-L373 HydrophobicContact CG-CD2 4.01Å; L364-V389 HydrophobicContact CB-CG2 3.76Å; L364-V389 HydrophobicContact CD2-CG2 4.19Å; L364-V389 HydrophobicContact CG-CG2 4.39Å; L364-V389 WeakPolarHBondContact O-CG2 3.41Å; L364-I394 HydrophobicContact CB-CD1 3.83Å; L364-I394 HydrophobicContact CB-CG1 4.25Å; L364-I394 HydrophobicContact CD1-CG2 4.1Å; L364-V445 HydrophobicContact CD2-CB 4.36Å; L364-V445 HydrophobicContact CD2-CG2 3.98Å
365	A	92.2	Very high	94	Very high	49 Å²	49	52.4 Å²	52.4	41%	0.405	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	135.1	174.1	0	0	0	0	0	110.4	T361 V362 R367	T361-A365 PolarHBondContact O-N 2.79Å; V362-A365 WeakPolarHBondContact O-CB 3.37Å; V362-A365 PolarHBondContact O-N 2.94Å; A365-R367 PolarHBondContact O-N 3.27Å
366	D	88.8	Confident	94.2	Very high	174 Å²	174	54.4 Å²	54.4	93%	0.93	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	22.6	179.1	-53.1	-43.5	0	0	0	115.2	L364	L364-D366 PolarHBondContact O-N 2.94Å
367	R	91.9	Very high	94.1	Very high	103 Å²	103	53.9 Å²	53.9	39%	0.389	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-88.4	154.6	173.7	-65.4	-63.3	-171.5	168.9	-3.4	111.8	L364 A365 T371 V389	L364-R367 WeakPolarHBondContact O-CB 3.33Å; L364-R367 PolarHBondContact O-N 3.5Å; A365-R367 PolarHBondContact O-N 3.27Å; R367-T371 HydrophobicContact CB-CG2 3.97Å; R367-T371 HydrophobicContact CG-CG2 4.24Å; R367-V389 HydrophobicContact CB-CG2 4.24Å
368	P	93.3	Very high	93.9	Very high	82 Å²	82	54.7 Å²	54.7	53%	0.532	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-58.8	153.2	175	-23.5	33.4	0	0	0	113.2	T371	P368-T371 VanDerWaalsContact O-CB 3.3Å; P368-T371 WeakPolarHBondContact O-CB 3.49Å; P368-T371 PolarHBondContact O-N 3.01Å; P368-T371 VanDerWaalsContact O-N 3.12Å; P368-T371 PolarHBondContact O-OG1 3.32Å
369	N	93.2	Very high	93.6	Very high	78 Å²	78	53.4 Å²	53.4	42%	0.417	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	139	172.5	-69.5	-13.3	0	0	0	111.3	T371 N391 G392	N369-T371 VanDerWaalsContact C-N 3.3Å; N369-N391 PolarHBondContact OD1-N 3.44Å; N369-G392 PolarHBondContact OD1-N 3.22Å
370	G	93.3	Very high	93.3	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	0.1	-175.9	0	0	0	0	0	114.6	F372 V389 T440 V442 Q443	G370-F372 PolarHBondContact O-N 3.48Å; G370-V389 PolarHBondContact N-O 3.23Å; G370-T440 WeakPolarHBondContact CA-O 3.41Å; G370-V442 PolarHBondContact O-N 2.9Å; G370-Q443 PolarHBondContact O-N 3.45Å
371	T	95.5	Very high	92.9	Very high	5 Å²	5	64 Å²	64	3%	0.031	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	129.2	170.2	-52.5	0	0	0	0	109.5	L364 R367 P368 N369 I388 V389 Q443	L364-T371 HydrophobicContact CD2-CG2 3.75Å; R367-T371 HydrophobicContact CB-CG2 3.97Å; R367-T371 HydrophobicContact CG-CG2 4.24Å; P368-T371 VanDerWaalsContact O-CB 3.3Å; P368-T371 WeakPolarHBondContact O-CB 3.49Å; P368-T371 PolarHBondContact O-N 3.01Å; P368-T371 VanDerWaalsContact O-N 3.12Å; P368-T371 PolarHBondContact O-OG1 3.32Å; N369-T371 VanDerWaalsContact C-N 3.3Å; T371-I388 WeakPolarHBondContact O-CA 3.47Å; T371-V389 PolarHBondContact O-N 3.38Å; T371-Q443 VanDerWaalsContact CA-O 3.29Å; T371-Q443 WeakPolarHBondContact CA-O 3.39Å
372	F	97	Very high	92.4	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	162.6	-172.2	75.9	-80.3	0	0	0	113.8	M343 W350 G370 L386 S387 I388 V422 L441 Q443 P444 V445	M343-F372 HydrophobicContact CE-CE1 3.77Å; M343-F372 HydrophobicContact CE-CZ 3.83Å; M343-F372 HydrophobicContact CG-CZ 4.43Å; M343-F372 HydrophobicContact SD-CE1 3.68Å; M343-F372 HydrophobicContact SD-CZ 4.03Å; W350-F372 HydrophobicContact CB-CD2 4.21Å; W350-F372 HydrophobicContact CB-CE2 3.57Å; W350-F372 HydrophobicContact CB-CZ 4.04Å; W350-F372 HydrophobicContact CD2-CE2 4.32Å; W350-F372 AromaticContact CG-CE2 3.79Å; W350-F372 HydrophobicContact CG-CE2 3.79Å; W350-F372 HydrophobicContact CG-CZ 4.12Å; G370-F372 PolarHBondContact O-N 3.48Å; F372-L386 HydrophobicContact CB-CD1 4.01Å; F372-L386 HydrophobicContact CD2-CD1 3.92Å; F372-L386 HydrophobicContact CG-CD1 4.37Å; F372-S387 CarbonylContact C-O 3.6Å; F372-S387 VanDerWaalsContact CA-O 3.26Å; F372-S387 WeakPolarHBondContact CA-O 3.4Å; F372-I388 HydrophobicContact CB-CB 4.06Å; F372-I388 HydrophobicContact CB-CD1 4.35Å; F372-I388 HydrophobicContact CB-CG1 4Å; F372-V422 HydrophobicContact CE2-CG1 3.94Å; F372-V422 HydrophobicContact CE2-CG2 4.12Å; F372-V422 HydrophobicContact CZ-CG1 3.73Å; F372-L441 HydrophobicContact CB-CD2 4.02Å; F372-L441 HydrophobicContact CD1-CB 3.74Å; F372-L441 HydrophobicContact CD1-CD2 4.21Å; F372-L441 HydrophobicContact CD1-CG 4.44Å; F372-L441 HydrophobicContact CD2-CD1 4.21Å; F372-L441 HydrophobicContact CD2-CD2 4.15Å; F372-L441 HydrophobicContact CE1-CB 3.67Å; F372-L441 HydrophobicContact CE2-CB 4.48Å; F372-L441 HydrophobicContact CE2-CD1 4.08Å; F372-L441 HydrophobicContact CG-CB 4.2Å; F372-L441 HydrophobicContact CG-CD2 3.86Å; F372-L441 HydrophobicContact CG-CG 4.42Å; F372-L441 HydrophobicContact CZ-CB 4.07Å; F372-L441 HydrophobicContact CZ-CD1 4.35Å; F372-Q443 WeakPolarHBondContact CD1-O 3.33Å; F372-Q443 VanDerWaalsContact CE1-C 3.43Å; F372-Q443 WeakPolarHBondContact CE1-O 3.47Å; F372-Q443 PolarHBondContact N-O 2.94Å; F372-P444 HydrophobicContact CE1-CB 4.21Å; F372-P444 HydrophobicContact CZ-CB 4.1Å; F372-V445 PolarHBondContact O-N 2.83Å
373	L	97	Very high	92.3	Very high	0 Å²	0	63 Å²	63	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	154.2	166.7	65.7	89.3	0	0	0	110.3	W350 L352 R363 L364 R375 S387 V445	W350-L373 CarbonylContact O-C 3.55Å; W350-L373 WeakPolarHBondContact O-CA 3.47Å; L352-L373 HydrophobicContact CD1-CB 4.15Å; L352-L373 HydrophobicContact CD2-CD2 4.28Å; R363-L373 HydrophobicContact CB-CD2 4.42Å; L364-L373 HydrophobicContact CD1-CD2 4.17Å; L364-L373 HydrophobicContact CD1-CG 4.37Å; L364-L373 HydrophobicContact CD2-CD2 4.27Å; L364-L373 HydrophobicContact CG-CD2 4.01Å; L373-R375 HydrophobicContact CD1-CB 4.02Å; L373-R375 HydrophobicContact CD1-CG 4.16Å; L373-S387 PolarHBondContact N-O 3.04Å; L373-S387 PolarHBondContact O-N 3.43Å; L373-V445 HydrophobicContact CB-CB 4.11Å; L373-V445 HydrophobicContact CB-CG1 3.69Å; L373-V445 HydrophobicContact CD2-CB 4.19Å; L373-V445 HydrophobicContact CD2-CG1 3.98Å; L373-V445 HydrophobicContact CD2-CG2 4.2Å; L373-V445 HydrophobicContact CG-CG1 4.5Å
374	I	97.5	Very high	92.4	Very high	0 Å²	0	61 Å²	61	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	136.7	170.3	-61.9	-177.9	0	0	0	108.1	W350 L351 L352 Y384 A385 L386 I399 L418 L421 V422	W350-I374 HydrophobicContact CE3-CB 3.94Å; W350-I374 HydrophobicContact CE3-CD1 3.87Å; W350-I374 HydrophobicContact CE3-CG1 4.01Å; W350-I374 HydrophobicContact CZ3-CB 4.15Å; W350-I374 HydrophobicContact CZ3-CD1 3.74Å; W350-I374 HydrophobicContact CZ3-CG1 4.28Å; W350-I374 PolarHBondContact O-N 2.97Å; L351-I374 WeakPolarHBondContact CA-O 3.48Å; L351-I374 HydrophobicContact CD1-CB 4.15Å; L351-I374 HydrophobicContact CD1-CG2 3.87Å; L352-I374 PolarHBondContact N-O 3.37Å; I374-Y384 HydrophobicContact CG2-CD1 4Å; I374-Y384 HydrophobicContact CG2-CG 4.22Å; I374-A385 WeakPolarHBondContact CA-O 3.21Å; I374-L386 HydrophobicContact CG1-CD1 3.93Å; I374-I399 HydrophobicContact CD1-CD1 3.94Å; I374-I399 HydrophobicContact CG1-CD1 4.31Å; I374-I399 HydrophobicContact CG2-CD1 4.12Å; I374-L418 HydrophobicContact CG2-CD1 4.29Å; I374-L421 HydrophobicContact CD1-CD2 4.46Å; I374-V422 HydrophobicContact CD1-CG2 3.66Å
375	R	95.4	Very high	92.4	Very high	10 Å²	10	61.2 Å²	61.2	4%	0.038	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	160.3	-178.2	62.7	-174.5	-179.5	85.1	0.8	110.7	C355 K357 S360 L373 E378 Y384 A385 S387	C355-R375 HydrophobicContact CB-CB 3.91Å; C355-R375 WeakPolarHBondContact O-CB 3.5Å; C355-R375 VanDerWaalsContact O-CD 3.32Å; C355-R375 WeakPolarHBondContact O-CD 3.35Å; K357-R375 VanDerWaalsContact N-NH1 3.13Å; S360-R375 PolarHBondContact OG-NE 3.47Å; L373-R375 HydrophobicContact CD1-CB 4.02Å; L373-R375 HydrophobicContact CD1-CG 4.16Å; R375-E378 IonicContact NH1-OE2 2.59Å; R375-E378 PolarHBondContact NH1-OE2 2.91Å; R375-E378 VanDerWaalsContact NH1-OE2 3.13Å; R375-Y384 CarbonylContact O-C 3.47Å; R375-Y384 VanDerWaalsContact O-CA 3.31Å; R375-Y384 WeakPolarHBondContact O-CA 3.42Å; R375-A385 HydrophobicContact CG-CB 4.28Å; R375-A385 PolarHBondContact N-O 2.92Å; R375-A385 PolarHBondContact O-N 3.41Å; R375-S387 PolarHBondContact NE-OG 2.72Å
376	P	93.8	Very high	92.6	Very high	50 Å²	50	58.9 Å²	58.9	33%	0.325	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	146.4	168.5	-26.2	37.2	0	0	0	112.4	L352 S353	L352-P376 WeakPolarHBondContact O-CD 3.42Å; S353-P376 WeakPolarHBondContact O-CD 3.48Å; S353-P376 VanDerWaalsContact O-CG 3.29Å; S353-P376 WeakPolarHBondContact O-CG 3.48Å
377	S	91.3	Very high	93	Very high	15 Å²	15	50.6 Å²	50.6	11%	0.105	27%	0.265	C	S	.	.			trans	-79.9	124.3	175.1	-179	0	0	0	0	110.9	S379 R380 Y383	S377-S379 VanDerWaalsContact C-N 3.32Å; S377-S379 PolarHBondContact OG-N 3.44Å; S377-S379 PolarHBondContact OG-OG 3.46Å; S377-R380 WeakPolarHBondContact CB-O 3.31Å; S377-R380 PolarHBondContact OG-N 2.89Å; S377-Y383 WeakPolarHBondContact CB-O 3.49Å; S377-Y383 PolarHBondContact N-O 3.41Å
378	E	90	Very high	93.3	Very high	124 Å²	124	45.7 Å²	45.7	58%	0.579	25%	0.246	S	C	*	.	S	Bend	trans	-71.9	-28.8	175.3	-67.5	160.6	107.9	0	0	112.4	S356 K357 R375	S356-E378 WeakPolarHBondContact CB-OE1 3.37Å; K357-E378 WeakPolarHBondContact CB-OE2 3.3Å; K357-E378 PolarHBondContact N-OE2 3.33Å; R375-E378 IonicContact NH1-OE2 2.59Å; R375-E378 PolarHBondContact NH1-OE2 2.91Å; R375-E378 VanDerWaalsContact NH1-OE2 3.13Å
379	S	88	Confident	93.4	Very high	102 Å²	102	42 Å²	42	71%	0.713	22%	0.222	S	C	*	.	S	Bend	trans	-84.5	-26.4	-178.1	60.6	0	0	0	0	113	S377	S377-S379 VanDerWaalsContact C-N 3.32Å; S377-S379 PolarHBondContact OG-N 3.44Å; S377-S379 PolarHBondContact OG-OG 3.46Å
380	R	88.9	Confident	93.5	Very high	89 Å²	89	38.3 Å²	38.3	34%	0.336	20%	0.203	S	C	.	.	S	Bend	trans	-136.7	108.2	-175	-65.8	177.6	72.9	179.3	2.4	110.9	S377 G382 Y383 E400	S377-R380 WeakPolarHBondContact CB-O 3.31Å; S377-R380 PolarHBondContact OG-N 2.89Å; R380-G382 PolarHBondContact O-N 3.19Å; R380-Y383 HydrophobicContact CB-CD2 3.67Å; R380-Y383 HydrophobicContact CB-CE2 4.37Å; R380-Y383 HydrophobicContact CB-CG 3.83Å; R380-Y383 VanDerWaalsContact CZ-CE1 3.43Å; R380-Y383 VanDerWaalsContact NH2-CE1 3.26Å; R380-Y383 PolarHBondContact NH2-OH 3.32Å; R380-Y383 WeakPolarHBondContact O-CB 3.47Å; R380-Y383 PolarHBondContact O-N 2.92Å; R380-E400 IonicContact CZ-OE1 3.65Å; R380-E400 IonicContact NH1-OE1 3.19Å; R380-E400 PolarHBondContact NH1-OE1 2.95Å; R380-E400 IonicContact NH2-OE1 2.75Å; R380-E400 PolarHBondContact NH2-OE1 3.43Å
381	K	86.3	Confident	93.4	Very high	208 Å²	208	43.7 Å²	43.7	90%	0.904	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	133	176.9	-70.3	-171.3	176.4	-175.6	0	111.4	Y383	K381-Y383 VanDerWaalsContact C-N 3.32Å; K381-Y383 WeakPolarHBondContact O-CD2 3.35Å
382	G	84.5	Confident	93.2	Very high	62 Å²	62	46.9 Å²	46.9	64%	0.639	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.6	1.9	-179.2	0	0	0	0	0	115	R380	R380-G382 PolarHBondContact O-N 3.19Å
383	Y	91.8	Very high	93.1	Very high	59 Å²	59	55.6 Å²	55.6	23%	0.231	30%	0.298	C	S	.	.			trans	-104.5	160.1	175.5	-69.2	-113.4	0	0	0	110	S377 R380 K381 L398 E400	S377-Y383 WeakPolarHBondContact CB-O 3.49Å; S377-Y383 PolarHBondContact N-O 3.41Å; R380-Y383 HydrophobicContact CB-CD2 3.67Å; R380-Y383 HydrophobicContact CB-CE2 4.37Å; R380-Y383 HydrophobicContact CB-CG 3.83Å; R380-Y383 VanDerWaalsContact CZ-CE1 3.43Å; R380-Y383 VanDerWaalsContact NH2-CE1 3.26Å; R380-Y383 PolarHBondContact NH2-OH 3.32Å; R380-Y383 WeakPolarHBondContact O-CB 3.47Å; R380-Y383 PolarHBondContact O-N 2.92Å; K381-Y383 VanDerWaalsContact C-N 3.32Å; K381-Y383 WeakPolarHBondContact O-CD2 3.35Å; Y383-L398 HydrophobicContact CD1-CD2 4.4Å; Y383-E400 HydrophobicContact CD1-CB 4Å; Y383-E400 HydrophobicContact CD1-CG 3.94Å; Y383-E400 HydrophobicContact CE1-CB 3.65Å; Y383-E400 HydrophobicContact CE1-CG 3.7Å
384	Y	95.3	Very high	93	Very high	70 Å²	70	58 Å²	58	28%	0.275	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	163.5	173.2	-65.2	-88.2	0	0	0	110.4	L351 I374 R375 I399 F406 L418	L351-Y384 HydrophobicContact CD1-CD1 4.2Å; L351-Y384 HydrophobicContact CD1-CE1 4.03Å; I374-Y384 HydrophobicContact CG2-CD1 4Å; I374-Y384 HydrophobicContact CG2-CG 4.22Å; R375-Y384 CarbonylContact O-C 3.47Å; R375-Y384 VanDerWaalsContact O-CA 3.31Å; R375-Y384 WeakPolarHBondContact O-CA 3.42Å; Y384-I399 PolarHBondContact N-O 3.49Å; Y384-I399 PolarHBondContact O-N 2.67Å; Y384-F406 HydrophobicContact CD2-CD1 4.36Å; Y384-F406 HydrophobicContact CD2-CE1 4.05Å; Y384-F406 AromaticContact CE2-CE1 3.88Å; Y384-F406 HydrophobicContact CE2-CE1 3.88Å; Y384-L418 HydrophobicContact CD1-CD1 4.13Å; Y384-L418 HydrophobicContact CD2-CD1 4.02Å; Y384-L418 HydrophobicContact CD2-CD2 4.36Å; Y384-L418 HydrophobicContact CE1-CD1 4.11Å; Y384-L418 HydrophobicContact CE2-CD1 4Å; Y384-L418 HydrophobicContact CG-CD1 4.08Å
385	A	95.5	Very high	92.9	Very high	6 Å²	6	60 Å²	60	5%	0.05	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	129.2	170	0	0	0	0	0	109	I374 R375 C397	I374-A385 WeakPolarHBondContact CA-O 3.21Å; R375-A385 HydrophobicContact CG-CB 4.28Å; R375-A385 PolarHBondContact N-O 2.92Å; R375-A385 PolarHBondContact O-N 3.41Å; A385-C397 CarbonylContact C-O 3.56Å; A385-C397 WeakPolarHBondContact CA-O 3.3Å
386	L	96.4	Very high	92.8	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	127.1	165.3	172.4	67.6	0	0	0	108.2	F372 I374 H396 C397 I399 F408 L441	F372-L386 HydrophobicContact CB-CD1 4.01Å; F372-L386 HydrophobicContact CD2-CD1 3.92Å; F372-L386 HydrophobicContact CG-CD1 4.37Å; I374-L386 HydrophobicContact CG1-CD1 3.93Å; L386-H396 CarbonylContact O-C 3.54Å; L386-H396 WeakPolarHBondContact O-CA 3.34Å; L386-C397 HydrophobicContact CB-CB 4.26Å; L386-C397 PolarHBondContact N-O 3.08Å; L386-C397 PolarHBondContact O-N 3.47Å; L386-I399 HydrophobicContact CB-CD1 4.13Å; L386-F408 HydrophobicContact CB-CE1 4.2Å; L386-F408 HydrophobicContact CD2-CE1 4.12Å; L386-F408 HydrophobicContact CD2-CZ 3.7Å; L386-L441 HydrophobicContact CD1-CD2 4.03Å; L386-L441 HydrophobicContact CD2-CD2 3.99Å
387	S	97.4	Very high	92.8	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	127.8	167.2	-64.9	0	0	0	0	108.7	S360 F372 L373 R375 F395 H396	S360-S387 WeakPolarHBondContact CB-OG 3.31Å; S360-S387 PolarHBondContact OG-OG 2.93Å; F372-S387 CarbonylContact C-O 3.6Å; F372-S387 VanDerWaalsContact CA-O 3.26Å; F372-S387 WeakPolarHBondContact CA-O 3.4Å; L373-S387 PolarHBondContact N-O 3.04Å; L373-S387 PolarHBondContact O-N 3.43Å; R375-S387 PolarHBondContact NE-OG 2.72Å; S387-F395 CarbonylContact C-O 3.55Å; S387-F395 WeakPolarHBondContact CA-O 3.36Å; S387-H396 PolarHBondContact OG-CE1 3.18Å; S387-H396 PolarHBondContact OG-ND1 2.86Å
388	I	97	Very high	93	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	143.1	-174	-175.6	172.5	0	0	0	112.3	T371 F372 I394 F395 L437 T439 L441	T371-I388 WeakPolarHBondContact O-CA 3.47Å; F372-I388 HydrophobicContact CB-CB 4.06Å; F372-I388 HydrophobicContact CB-CD1 4.35Å; F372-I388 HydrophobicContact CB-CG1 4Å; I388-I394 WeakPolarHBondContact O-CA 3.27Å; I388-F395 HydrophobicContact CG2-CB 4.01Å; I388-F395 PolarHBondContact N-O 2.88Å; I388-F395 PolarHBondContact O-N 2.91Å; I388-L437 HydrophobicContact CG2-CD1 3.84Å; I388-L437 HydrophobicContact CG2-CD2 4.38Å; I388-T439 HydrophobicContact CD1-CG2 3.65Å; I388-T439 HydrophobicContact CG1-CG2 4.32Å; I388-L441 HydrophobicContact CD1-CD2 3.57Å
389	V	96.8	Very high	93.2	Very high	4 Å²	4	57 Å²	57	2%	0.024	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	127.3	172.4	-174.4	0	0	0	0	110.6	L364 R367 G370 T371 R393 I394	L364-V389 HydrophobicContact CB-CG2 3.76Å; L364-V389 HydrophobicContact CD2-CG2 4.19Å; L364-V389 HydrophobicContact CG-CG2 4.39Å; L364-V389 WeakPolarHBondContact O-CG2 3.41Å; R367-V389 HydrophobicContact CB-CG2 4.24Å; G370-V389 PolarHBondContact N-O 3.23Å; T371-V389 PolarHBondContact O-N 3.38Å; V389-R393 CarbonylContact C-O 3.6Å; V389-R393 WeakPolarHBondContact CA-O 3.37Å; V389-I394 HydrophobicContact CG2-CG1 4.33Å
390	C	95.2	Very high	93.4	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.007	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	124.5	171.2	179.1	0	0	0	0	109.4	G392 R393 F395 L437 T439	C390-G392 VanDerWaalsContact C-N 3.27Å; C390-G392 PolarHBondContact O-N 3.34Å; C390-R393 PolarHBondContact N-O 3.22Å; C390-R393 PolarHBondContact O-N 2.58Å; C390-R393 VanDerWaalsContact O-O 3.12Å; C390-F395 HydrophobicContact CB-CD2 3.79Å; C390-F395 HydrophobicContact CB-CE2 3.76Å; C390-L437 HydrophobicContact CB-CD1 3.61Å; C390-T439 HydrophobicContact CB-CG2 3.83Å
391	N	91.7	Very high	93.2	Very high	113 Å²	113	56.1 Å²	56.1	60%	0.604	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	45.5	178.9	-61.5	-37.3	0	0	0	113.2	N369 R393	N369-N391 PolarHBondContact OD1-N 3.44Å; N391-R393 PolarHBondContact O-N 3.07Å
392	G	90.6	Very high	93.1	Very high	71 Å²	71	50 Å²	50	73%	0.732	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	6	-179	0	0	0	0	0	115.2	N369 C390	N369-G392 PolarHBondContact OD1-N 3.22Å; C390-G392 VanDerWaalsContact C-N 3.27Å; C390-G392 PolarHBondContact O-N 3.34Å
393	R	93.8	Very high	93.1	Very high	184 Å²	184	54.8 Å²	54.8	69%	0.694	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.2	150.9	176	-62.5	-178	-178.7	-171.1	0.1	110.4	V389 C390 N391 F395	V389-R393 CarbonylContact C-O 3.6Å; V389-R393 WeakPolarHBondContact CA-O 3.37Å; C390-R393 PolarHBondContact N-O 3.22Å; C390-R393 PolarHBondContact O-N 2.58Å; C390-R393 VanDerWaalsContact O-O 3.12Å; N391-R393 PolarHBondContact O-N 3.07Å; R393-F395 HydrophobicContact CB-CD2 4.43Å; R393-F395 HydrophobicContact CB-CE2 3.89Å
394	I	95.3	Very high	92.6	Very high	49 Å²	49	53.9 Å²	53.9	25%	0.251	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	121	178.4	-60.3	169.6	0	0	0	108.2	T361 L364 I388 V389	T361-I394 HydrophobicContact CG2-CD1 3.84Å; T361-I394 WeakPolarHBondContact O-CD1 3.48Å; L364-I394 HydrophobicContact CB-CD1 3.83Å; L364-I394 HydrophobicContact CB-CG1 4.25Å; L364-I394 HydrophobicContact CD1-CG2 4.1Å; I388-I394 WeakPolarHBondContact O-CA 3.27Å; V389-I394 HydrophobicContact CG2-CG1 4.33Å
395	F	95.6	Very high	92.3	Very high	44 Å²	44	52.3 Å²	52.3	19%	0.193	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	147.1	176.1	-70.5	-98.9	0	0	0	109.7	S387 I388 C390 R393 N436 L437	S387-F395 CarbonylContact C-O 3.55Å; S387-F395 WeakPolarHBondContact CA-O 3.36Å; I388-F395 HydrophobicContact CG2-CB 4.01Å; I388-F395 PolarHBondContact N-O 2.88Å; I388-F395 PolarHBondContact O-N 2.91Å; C390-F395 HydrophobicContact CB-CD2 3.79Å; C390-F395 HydrophobicContact CB-CE2 3.76Å; R393-F395 HydrophobicContact CB-CD2 4.43Å; R393-F395 HydrophobicContact CB-CE2 3.89Å; F395-N436 HydrophobicContact CE1-CB 4.3Å; F395-N436 HydrophobicContact CZ-CB 4.24Å; F395-L437 HydrophobicContact CB-CD1 3.92Å; F395-L437 HydrophobicContact CB-CD2 4.45Å; F395-L437 HydrophobicContact CD1-CD1 4.4Å; F395-L437 HydrophobicContact CD2-CD1 3.79Å; F395-L437 HydrophobicContact CE2-CD1 4.39Å; F395-L437 HydrophobicContact CG-CD1 3.79Å
396	H	94.6	Very high	92.1	Very high	60 Å²	60	53.4 Å²	53.4	28%	0.278	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	121.5	174.9	-54	-79.5	0	0	0	109.8	K357 S360 L386 S387	K357-H396 WeakPolarHBondContact CE-CD2 3.44Å; S360-H396 PolarHBondContact OG-CE1 3.21Å; L386-H396 CarbonylContact O-C 3.54Å; L386-H396 WeakPolarHBondContact O-CA 3.34Å; S387-H396 PolarHBondContact OG-CE1 3.18Å; S387-H396 PolarHBondContact OG-ND1 2.86Å
397	C	93.4	Very high	91.9	Very high	26 Å²	26	53.5 Å²	53.5	18%	0.176	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	124	-178.7	-58.8	0	0	0	0	109.3	A385 L386 F408	A385-C397 CarbonylContact C-O 3.56Å; A385-C397 WeakPolarHBondContact CA-O 3.3Å; L386-C397 HydrophobicContact CB-CB 4.26Å; L386-C397 PolarHBondContact N-O 3.08Å; L386-C397 PolarHBondContact O-N 3.47Å; C397-F408 HydrophobicContact CB-CD1 3.75Å; C397-F408 HydrophobicContact CB-CE1 3.51Å; C397-F408 HydrophobicContact CB-CZ 4.38Å
398	L	94	Very high	91.6	Very high	48 Å²	48	54 Å²	54	25%	0.251	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	127.1	177.8	-175.4	76.2	0	0	0	110.2	Y383 E400	Y383-L398 HydrophobicContact CD1-CD2 4.4Å; L398-E400 HydrophobicContact CD2-CG 4.25Å
399	I	94.7	Very high	91	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	117.2	173.9	-56.6	169.4	0	0	0	108.1	I374 Y384 L386 F406 F408 L418 L421	I374-I399 HydrophobicContact CD1-CD1 3.94Å; I374-I399 HydrophobicContact CG1-CD1 4.31Å; I374-I399 HydrophobicContact CG2-CD1 4.12Å; Y384-I399 PolarHBondContact N-O 3.49Å; Y384-I399 PolarHBondContact O-N 2.67Å; L386-I399 HydrophobicContact CB-CD1 4.13Å; I399-F406 HydrophobicContact CG2-CB 3.94Å; I399-F406 HydrophobicContact CG2-CD1 4.27Å; I399-F408 HydrophobicContact CD1-CE1 4.41Å; I399-F408 HydrophobicContact CG1-CD1 4.07Å; I399-F408 HydrophobicContact CG1-CE1 3.65Å; I399-L418 HydrophobicContact CD1-CD2 4.18Å; I399-L418 HydrophobicContact CG2-CD2 4.04Å; I399-L421 HydrophobicContact CD1-CD1 4.3Å; I399-L421 HydrophobicContact CD1-CD2 4.45Å; I399-L421 HydrophobicContact CG1-CD1 4.39Å; I399-L421 HydrophobicContact CG2-CD1 4.01Å
400	E	92.4	Very high	90.1	Very high	22 Å²	22	60.3 Å²	60.3	10%	0.103	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	146.1	179.3	-55.5	-163	130.7	0	0	112	R380 Y383 L398 K402 F406 G407 A409	R380-E400 IonicContact CZ-OE1 3.65Å; R380-E400 IonicContact NH1-OE1 3.19Å; R380-E400 PolarHBondContact NH1-OE1 2.95Å; R380-E400 IonicContact NH2-OE1 2.75Å; R380-E400 PolarHBondContact NH2-OE1 3.43Å; Y383-E400 HydrophobicContact CD1-CB 4Å; Y383-E400 HydrophobicContact CD1-CG 3.94Å; Y383-E400 HydrophobicContact CE1-CB 3.65Å; Y383-E400 HydrophobicContact CE1-CG 3.7Å; L398-E400 HydrophobicContact CD2-CG 4.25Å; E400-K402 WeakPolarHBondContact OE2-CE 3.4Å; E400-K402 IonicContact OE2-NZ 2.59Å; E400-K402 PolarHBondContact OE2-NZ 3.16Å; E400-F406 CarbonylContact O-C 3.27Å; E400-F406 VanDerWaalsContact O-CA 3.31Å; E400-F406 WeakPolarHBondContact O-CA 3.22Å; E400-G407 PolarHBondContact N-O 2.89Å; E400-G407 PolarHBondContact O-N 3.38Å; E400-A409 HydrophobicContact CG-CB 4.07Å
401	R	85.4	Confident	89.6	Confident	152 Å²	152	61.3 Å²	61.3	57%	0.574	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.5	115.1	168	-166.9	176.9	-179.3	-167.6	-1.7	109.6	C405 F406	R401-C405 CarbonylContact C-O 3.57Å; R401-C405 VanDerWaalsContact CA-O 3.24Å; R401-C405 WeakPolarHBondContact CA-O 3.22Å; R401-F406 HydrophobicContact CG-CE1 4.33Å
402	K	84.4	Confident	89.1	Confident	79 Å²	79	64 Å²	64	34%	0.343	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	123.9	177.9	-71.8	179.6	-179.2	158.8	0	109.6	E400 G404 C405 L414	E400-K402 WeakPolarHBondContact OE2-CE 3.4Å; E400-K402 IonicContact OE2-NZ 2.59Å; E400-K402 PolarHBondContact OE2-NZ 3.16Å; K402-G404 PolarHBondContact O-N 3.08Å; K402-G404 VanDerWaalsContact O-N 3.17Å; K402-C405 PolarHBondContact N-O 3.15Å; K402-C405 WeakPolarHBondContact O-CA 3.19Å; K402-C405 WeakPolarHBondContact O-CB 3.15Å; K402-C405 PolarHBondContact O-N 2.89Å; K402-L414 HydrophobicContact CB-CD1 4.49Å; K402-L414 HydrophobicContact CB-CD2 4.27Å
403	N	82.9	Confident	89	Confident	162 Å²	162	62.1 Å²	62.1	87%	0.866	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	38.1	179.2	-57.2	-21.3	0	0	0	113.7	C405	N403-C405 PolarHBondContact O-N 3.45Å
404	G	82.6	Confident	88.9	Confident	41 Å²	41	56.9 Å²	56.9	42%	0.423	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	-10.5	-176.2	0	0	0	0	0	115.1	K402	K402-G404 PolarHBondContact O-N 3.08Å; K402-G404 VanDerWaalsContact O-N 3.17Å
405	C	89.3	Confident	88.7	Confident	37 Å²	37	55.7 Å²	55.7	25%	0.25	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	164	178.3	-57.9	0	0	0	0	112.1	R401 K402 N403 L414 F415	R401-C405 CarbonylContact C-O 3.57Å; R401-C405 VanDerWaalsContact CA-O 3.24Å; R401-C405 WeakPolarHBondContact CA-O 3.22Å; K402-C405 PolarHBondContact N-O 3.15Å; K402-C405 WeakPolarHBondContact O-CA 3.19Å; K402-C405 WeakPolarHBondContact O-CB 3.15Å; K402-C405 PolarHBondContact O-N 2.89Å; N403-C405 PolarHBondContact O-N 3.45Å; C405-L414 HydrophobicContact CB-CB 3.83Å; C405-F415 CarbonylContact C-O 3.51Å; C405-F415 WeakPolarHBondContact CA-O 3.43Å; C405-F415 VanDerWaalsContact CB-O 3.24Å; C405-F415 WeakPolarHBondContact CB-O 3.35Å
406	F	90.9	Very high	88.4	Confident	29 Å²	29	58 Å²	58	13%	0.127	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	140.8	179.3	-60.2	-87	0	0	0	110.7	Y384 I399 E400 R401 F415 L418 L421	Y384-F406 HydrophobicContact CD2-CD1 4.36Å; Y384-F406 HydrophobicContact CD2-CE1 4.05Å; Y384-F406 AromaticContact CE2-CE1 3.88Å; Y384-F406 HydrophobicContact CE2-CE1 3.88Å; I399-F406 HydrophobicContact CG2-CB 3.94Å; I399-F406 HydrophobicContact CG2-CD1 4.27Å; E400-F406 CarbonylContact O-C 3.27Å; E400-F406 VanDerWaalsContact O-CA 3.31Å; E400-F406 WeakPolarHBondContact O-CA 3.22Å; R401-F406 HydrophobicContact CG-CE1 4.33Å; F406-F415 PolarHBondContact N-O 3.4Å; F406-F415 WeakPolarHBondContact O-CD2 3.26Å; F406-F415 PolarHBondContact O-N 3.4Å; F406-L418 HydrophobicContact CB-CD2 4.13Å; F406-L418 HydrophobicContact CD1-CD2 3.8Å; F406-L418 HydrophobicContact CD1-CG 4.24Å; F406-L418 HydrophobicContact CE1-CD2 4.38Å; F406-L418 HydrophobicContact CE1-CG 4.41Å; F406-L418 HydrophobicContact CG-CD2 3.92Å; F406-L418 HydrophobicContact CG-CG 4.32Å; F406-L421 HydrophobicContact CB-CD1 4.48Å
407	G	91.8	Very high	88.2	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.01	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.7	166.7	175.9	0	0	0	0	0	112.7	E400	E400-G407 PolarHBondContact N-O 2.89Å; E400-G407 PolarHBondContact O-N 3.38Å
408	F	92	Very high	88.1	Confident	11 Å²	11	56 Å²	56	5%	0.048	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	145.5	177.2	-62.7	-61.3	0	0	0	111.2	L386 C397 I399 G410 T411 L421 Y425 M430 H433	L386-F408 HydrophobicContact CB-CE1 4.2Å; L386-F408 HydrophobicContact CD2-CE1 4.12Å; L386-F408 HydrophobicContact CD2-CZ 3.7Å; C397-F408 HydrophobicContact CB-CD1 3.75Å; C397-F408 HydrophobicContact CB-CE1 3.51Å; C397-F408 HydrophobicContact CB-CZ 4.38Å; I399-F408 HydrophobicContact CD1-CE1 4.41Å; I399-F408 HydrophobicContact CG1-CD1 4.07Å; I399-F408 HydrophobicContact CG1-CE1 3.65Å; F408-G410 PolarHBondContact O-N 3.34Å; F408-T411 HydrophobicContact CB-CG2 4.09Å; F408-T411 PolarHBondContact O-N 2.99Å; F408-T411 PolarHBondContact O-OG1 3.45Å; F408-L421 HydrophobicContact CZ-CD2 4.23Å; F408-Y425 AromaticContact CD2-CE2 3.87Å; F408-Y425 HydrophobicContact CD2-CE2 3.87Å; F408-Y425 AromaticContact CD2-CZ 3.83Å; F408-Y425 AromaticContact CE2-CD2 3.76Å; F408-Y425 HydrophobicContact CE2-CD2 3.76Å; F408-Y425 HydrophobicContact CE2-CE1 4.32Å; F408-Y425 AromaticContact CE2-CE2 3.3Å; F408-Y425 HydrophobicContact CE2-CE2 3.3Å; F408-Y425 HydrophobicContact CE2-CG 4.45Å; F408-Y425 AromaticContact CE2-CZ 3.59Å; F408-Y425 HydrophobicContact CZ-CD2 4.44Å; F408-Y425 HydrophobicContact CZ-CE2 4.3Å; F408-M430 HydrophobicContact CD2-CE 3.84Å; F408-M430 HydrophobicContact CD2-SD 4.37Å; F408-M430 HydrophobicContact CE1-CE 4.32Å; F408-M430 HydrophobicContact CE2-CE 3.28Å; F408-M430 HydrophobicContact CE2-SD 3.56Å; F408-M430 VanDerWaalsContact CE2-SD 3.56Å; F408-M430 HydrophobicContact CZ-CE 3.58Å; F408-M430 HydrophobicContact CZ-SD 4.12Å; F408-H433 AromaticContact CD2-CD2 3.92Å
409	A	83.3	Confident	87.8	Confident	55 Å²	55	56 Å²	56	46%	0.455	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	134.1	178.8	0	0	0	0	0	111.3	E400 T411	E400-A409 HydrophobicContact CG-CB 4.07Å; A409-T411 VanDerWaalsContact C-N 3.34Å
410	G	79.2	Confident	87.5	Confident	82 Å²	82	59 Å²	59	85%	0.845	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.5	8	-179.8	0	0	0	0	0	115.4	F408	F408-G410 PolarHBondContact O-N 3.34Å
411	T	83.1	Confident	87.6	Confident	22 Å²	22	58 Å²	58	14%	0.135	35%	0.346	C	S	.	.			trans	-114.4	150.2	178.2	72.9	0	0	0	0	111.2	F408 A409 A413 H433	F408-T411 HydrophobicContact CB-CG2 4.09Å; F408-T411 PolarHBondContact O-N 2.99Å; F408-T411 PolarHBondContact O-OG1 3.45Å; A409-T411 VanDerWaalsContact C-N 3.34Å; T411-A413 VanDerWaalsContact C-N 3.32Å; T411-H433 VanDerWaalsContact CG2-CE1 3.48Å; T411-H433 WeakPolarHBondContact CG2-CE1 3.06Å; T411-H433 WeakPolarHBondContact CG2-ND1 3.48Å
412	D	82.8	Confident	88	Confident	168 Å²	168	50.7 Å²	50.7	90%	0.898	32%	0.319	S	S	*	.			trans	-88.9	-3.3	172.2	-64.3	-32.2	0	0	0	112.3	L414	D412-L414 PolarHBondContact O-N 2.97Å
413	A	88.3	Confident	88.2	Confident	33 Å²	33	50.7 Å²	50.7	27%	0.273	32%	0.319	S	S	.	.			trans	-74.5	94.2	175.8	0	0	0	0	0	110.3	T411 F415	T411-A413 VanDerWaalsContact C-N 3.32Å; A413-F415 HydrophobicContact CB-CE2 4.13Å; A413-F415 HydrophobicContact CB-CZ 4.23Å
414	L	90.8	Very high	88.6	Confident	74 Å²	74	45.4 Å²	45.4	39%	0.387	29%	0.289	S	S	.	.			trans	-109.7	133.6	179	-64.5	179.6	0	0	0	110.9	K402 C405 D412	K402-L414 HydrophobicContact CB-CD1 4.49Å; K402-L414 HydrophobicContact CB-CD2 4.27Å; C405-L414 HydrophobicContact CB-CB 3.83Å; D412-L414 PolarHBondContact O-N 2.97Å
415	F	91.9	Very high	89.2	Confident	24 Å²	24	43.5 Å²	43.5	11%	0.105	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-116.7	143.9	-175.3	-58.3	-80.8	0	0	0	110.9	C405 F406 A413 S417 D420 L421 H424 Y425	C405-F415 CarbonylContact C-O 3.51Å; C405-F415 WeakPolarHBondContact CA-O 3.43Å; C405-F415 VanDerWaalsContact CB-O 3.24Å; C405-F415 WeakPolarHBondContact CB-O 3.35Å; F406-F415 PolarHBondContact N-O 3.4Å; F406-F415 WeakPolarHBondContact O-CD2 3.26Å; F406-F415 PolarHBondContact O-N 3.4Å; A413-F415 HydrophobicContact CB-CE2 4.13Å; A413-F415 HydrophobicContact CB-CZ 4.23Å; F415-S417 VanDerWaalsContact C-N 3.28Å; F415-S417 PolarHBondContact O-N 2.93Å; F415-D420 HydrophobicContact CB-CB 4.05Å; F415-D420 HydrophobicContact CD1-CB 4.22Å; F415-L421 HydrophobicContact CB-CB 4.04Å; F415-L421 HydrophobicContact CD2-CB 3.71Å; F415-L421 HydrophobicContact CD2-CD1 3.92Å; F415-L421 HydrophobicContact CD2-CG 3.85Å; F415-L421 HydrophobicContact CE2-CB 4.34Å; F415-L421 HydrophobicContact CE2-CD1 4.39Å; F415-L421 HydrophobicContact CE2-CG 4.13Å; F415-L421 HydrophobicContact CG-CB 3.82Å; F415-L421 HydrophobicContact CG-CG 4.46Å; F415-H424 HydrophobicContact CD1-CB 4.31Å; F415-H424 HydrophobicContact CE1-CB 3.43Å; F415-H424 VanDerWaalsContact CE1-CB 3.43Å; F415-H424 AromaticContact CE1-CD2 3.89Å; F415-H424 AromaticContact CE1-CG 3.51Å; F415-H424 HydrophobicContact CZ-CB 3.82Å; F415-H424 AromaticContact CZ-CG 3.58Å; F415-H424 AromaticContact CZ-ND1 3.61Å; F415-Y425 AromaticContact CE2-CE2 3.58Å; F415-Y425 HydrophobicContact CE2-CE2 3.58Å; F415-Y425 AromaticContact CZ-CE2 3.78Å; F415-Y425 HydrophobicContact CZ-CE2 3.78Å
416	S	89	Confident	89.3	Confident	92 Å²	92	42.1 Å²	42.1	64%	0.643	26%	0.26	S	S	*	.	S	Bend	trans	-70.5	-27.8	-176.8	84.9	0	0	0	0	112.8	D420	S416-D420 PolarHBondContact OG-OD2 3.42Å
417	S	89.2	Confident	89.2	Confident	31 Å²	31	42.5 Å²	42.5	22%	0.217	26%	0.263	C	S	.	.	S	Bend	trans	-140	166.3	177.6	69.3	0	0	0	0	111.8	F415 N419 D420 L421	F415-S417 VanDerWaalsContact C-N 3.28Å; F415-S417 PolarHBondContact O-N 2.93Å; S417-N419 PolarHBondContact O-N 2.74Å; S417-N419 PolarHBondContact OG-N 3.23Å; S417-D420 PolarHBondContact N-OD2 3.39Å; S417-D420 VanDerWaalsContact N-OD2 3.12Å; S417-D420 PolarHBondContact O-N 2.82Å; S417-D420 PolarHBondContact OG-N 3.13Å; S417-D420 VanDerWaalsContact OG-N 3.09Å; S417-D420 PolarHBondContact OG-OD1 3.36Å; S417-D420 PolarHBondContact OG-OD2 2.67Å; S417-L421 PolarHBondContact O-N 3.01Å
418	L	91.2	Very high	89.1	Confident	12 Å²	12	45.7 Å²	45.7	6%	0.063	28%	0.279	C	S	.	.	H	α-helix	trans	-65.7	-30.8	170	-69.1	176.4	0	0	0	111.8	W350 L351 I374 Y384 I399 F406 L421 V422	W350-L418 HydrophobicContact CH2-CB 3.86Å; W350-L418 HydrophobicContact CZ3-CB 4.11Å; L351-L418 HydrophobicContact CD1-CD1 4.2Å; I374-L418 HydrophobicContact CG2-CD1 4.29Å; Y384-L418 HydrophobicContact CD1-CD1 4.13Å; Y384-L418 HydrophobicContact CD2-CD1 4.02Å; Y384-L418 HydrophobicContact CD2-CD2 4.36Å; Y384-L418 HydrophobicContact CE1-CD1 4.11Å; Y384-L418 HydrophobicContact CE2-CD1 4Å; Y384-L418 HydrophobicContact CG-CD1 4.08Å; I399-L418 HydrophobicContact CD1-CD2 4.18Å; I399-L418 HydrophobicContact CG2-CD2 4.04Å; F406-L418 HydrophobicContact CB-CD2 4.13Å; F406-L418 HydrophobicContact CD1-CD2 3.8Å; F406-L418 HydrophobicContact CD1-CG 4.24Å; F406-L418 HydrophobicContact CE1-CD2 4.38Å; F406-L418 HydrophobicContact CE1-CG 4.41Å; F406-L418 HydrophobicContact CG-CD2 3.92Å; F406-L418 HydrophobicContact CG-CG 4.32Å; L418-L421 WeakPolarHBondContact O-CB 3.34Å; L418-L421 PolarHBondContact O-N 3.27Å; L418-V422 WeakPolarHBondContact O-CG2 3.41Å; L418-V422 PolarHBondContact O-N 3.02Å
419	N	89.1	Confident	89.1	Confident	48 Å²	48	46.4 Å²	46.4	26%	0.257	29%	0.286	S	S	.	.	H	α-helix	trans	-62.6	-44.4	176.9	-58.5	64.9	0	0	0	110.6	A344 T345 S347 S417 L421 V422 F423	A344-N419 WeakPolarHBondContact CB-O 3.35Å; A344-N419 PolarHBondContact O-ND2 3.32Å; T345-N419 PolarHBondContact O-ND2 3.43Å; S347-N419 PolarHBondContact OG-ND2 3.35Å; S347-N419 PolarHBondContact OG-OD1 2.95Å; S417-N419 PolarHBondContact O-N 2.74Å; S417-N419 PolarHBondContact OG-N 3.23Å; N419-L421 VanDerWaalsContact C-N 3.33Å; N419-L421 PolarHBondContact O-N 3.49Å; N419-V422 PolarHBondContact O-N 2.96Å; N419-F423 WeakPolarHBondContact O-CB 3.44Å; N419-F423 PolarHBondContact O-N 3.44Å
420	D	88.6	Confident	89.4	Confident	64 Å²	64	43.9 Å²	43.9	34%	0.342	26%	0.264	S	S	.	.	H	α-helix	trans	-63.3	-40	176.4	-58.5	-34.9	0	0	0	111.8	F415 S416 S417 F423 H424	F415-D420 HydrophobicContact CB-CB 4.05Å; F415-D420 HydrophobicContact CD1-CB 4.22Å; S416-D420 PolarHBondContact OG-OD2 3.42Å; S417-D420 PolarHBondContact N-OD2 3.39Å; S417-D420 VanDerWaalsContact N-OD2 3.12Å; S417-D420 PolarHBondContact O-N 2.82Å; S417-D420 PolarHBondContact OG-N 3.13Å; S417-D420 VanDerWaalsContact OG-N 3.09Å; S417-D420 PolarHBondContact OG-OD1 3.36Å; S417-D420 PolarHBondContact OG-OD2 2.67Å; D420-F423 PolarHBondContact O-N 3.47Å; D420-H424 WeakPolarHBondContact O-CB 3.35Å; D420-H424 PolarHBondContact O-N 2.86Å
421	L	93.8	Very high	89.9	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.3	-47.3	173.8	-177.6	155.1	0	0	0	110.5	I374 I399 F406 F408 F415 S417 L418 N419 H424 Y425	I374-L421 HydrophobicContact CD1-CD2 4.46Å; I399-L421 HydrophobicContact CD1-CD1 4.3Å; I399-L421 HydrophobicContact CD1-CD2 4.45Å; I399-L421 HydrophobicContact CG1-CD1 4.39Å; I399-L421 HydrophobicContact CG2-CD1 4.01Å; F406-L421 HydrophobicContact CB-CD1 4.48Å; F408-L421 HydrophobicContact CZ-CD2 4.23Å; F415-L421 HydrophobicContact CB-CB 4.04Å; F415-L421 HydrophobicContact CD2-CB 3.71Å; F415-L421 HydrophobicContact CD2-CD1 3.92Å; F415-L421 HydrophobicContact CD2-CG 3.85Å; F415-L421 HydrophobicContact CE2-CB 4.34Å; F415-L421 HydrophobicContact CE2-CD1 4.39Å; F415-L421 HydrophobicContact CE2-CG 4.13Å; F415-L421 HydrophobicContact CG-CB 3.82Å; F415-L421 HydrophobicContact CG-CG 4.46Å; S417-L421 PolarHBondContact O-N 3.01Å; L418-L421 WeakPolarHBondContact O-CB 3.34Å; L418-L421 PolarHBondContact O-N 3.27Å; N419-L421 VanDerWaalsContact C-N 3.33Å; N419-L421 PolarHBondContact O-N 3.49Å; L421-H424 PolarHBondContact O-N 3.47Å; L421-Y425 HydrophobicContact CD2-CD2 3.89Å; L421-Y425 HydrophobicContact CD2-CE2 4.32Å; L421-Y425 HydrophobicContact CG-CD2 3.9Å; L421-Y425 HydrophobicContact CG-CE2 3.93Å; L421-Y425 WeakPolarHBondContact O-CD2 3.27Å; L421-Y425 PolarHBondContact O-N 3.23Å; L421-Y425 VanDerWaalsContact O-N 3.07Å
422	V	93.1	Very high	89.9	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-63.8	-43.7	179.4	170.6	0	0	0	0	111.1	M343 A344 W350 F372 I374 L418 N419 S426 L441	M343-V422 HydrophobicContact CE-CG1 4.01Å; A344-V422 HydrophobicContact CB-CB 4.34Å; A344-V422 HydrophobicContact CB-CG1 4.08Å; W350-V422 HydrophobicContact CD2-CG2 4.11Å; W350-V422 HydrophobicContact CE3-CG2 4.1Å; W350-V422 HydrophobicContact CH2-CG2 4.04Å; W350-V422 HydrophobicContact CZ2-CB 4.43Å; W350-V422 HydrophobicContact CZ2-CG2 4.02Å; W350-V422 HydrophobicContact CZ3-CG2 4.07Å; F372-V422 HydrophobicContact CE2-CG1 3.94Å; F372-V422 HydrophobicContact CE2-CG2 4.12Å; F372-V422 HydrophobicContact CZ-CG1 3.73Å; I374-V422 HydrophobicContact CD1-CG2 3.66Å; L418-V422 WeakPolarHBondContact O-CG2 3.41Å; L418-V422 PolarHBondContact O-N 3.02Å; N419-V422 PolarHBondContact O-N 2.96Å; V422-S426 VanDerWaalsContact O-CB 3.31Å; V422-S426 WeakPolarHBondContact O-CB 3.27Å; V422-S426 PolarHBondContact O-N 3.31Å; V422-L441 HydrophobicContact CB-CD1 4.16Å; V422-L441 HydrophobicContact CG1-CD1 4.05Å; V422-L441 HydrophobicContact CG2-CD1 4.12Å
423	F	89.8	Confident	90	Very high	79 Å²	79	45.1 Å²	45.1	35%	0.346	24%	0.24	S	C	.	.	H	α-helix	trans	-57	-52.1	175.7	178.3	-101.4	0	0	0	110.9	A340 A344 N419 D420 Y425 S426 I427	A340-F423 HydrophobicContact CB-CD2 3.94Å; A340-F423 HydrophobicContact CB-CE2 3.91Å; A344-F423 HydrophobicContact CB-CB 3.75Å; N419-F423 WeakPolarHBondContact O-CB 3.44Å; N419-F423 PolarHBondContact O-N 3.44Å; D420-F423 PolarHBondContact O-N 3.47Å; F423-Y425 PolarHBondContact O-N 2.85Å; F423-S426 PolarHBondContact O-N 3.02Å; F423-S426 PolarHBondContact O-OG 2.94Å; F423-I427 HydrophobicContact CE1-CD1 4.16Å; F423-I427 HydrophobicContact CE2-CD1 4.17Å; F423-I427 HydrophobicContact CZ-CD1 3.86Å
424	H	91.1	Very high	89.8	Confident	51 Å²	51	46 Å²	46	24%	0.236	24%	0.24	C	C	.	.	H	α-helix	trans	-56	-54.3	180	178.8	-91	0	0	0	112.2	F415 D420 L421 S426 I427 N428	F415-H424 HydrophobicContact CD1-CB 4.31Å; F415-H424 HydrophobicContact CE1-CB 3.43Å; F415-H424 VanDerWaalsContact CE1-CB 3.43Å; F415-H424 AromaticContact CE1-CD2 3.89Å; F415-H424 AromaticContact CE1-CG 3.51Å; F415-H424 HydrophobicContact CZ-CB 3.82Å; F415-H424 AromaticContact CZ-CG 3.58Å; F415-H424 AromaticContact CZ-ND1 3.61Å; D420-H424 WeakPolarHBondContact O-CB 3.35Å; D420-H424 PolarHBondContact O-N 2.86Å; L421-H424 PolarHBondContact O-N 3.47Å; H424-S426 VanDerWaalsContact C-N 3.27Å; H424-S426 PolarHBondContact O-N 3.5Å; H424-I427 PolarHBondContact O-N 2.94Å; H424-I427 VanDerWaalsContact O-N 3.14Å; H424-N428 PolarHBondContact CD2-ND2 3.03Å; H424-N428 VanDerWaalsContact CD2-ND2 3.27Å; H424-N428 PolarHBondContact CE1-ND2 3.35Å; H424-N428 PolarHBondContact NE2-ND2 3.27Å; H424-N428 WeakPolarHBondContact O-CB 3.48Å; H424-N428 PolarHBondContact O-N 2.88Å
425	Y	94.8	Very high	89.7	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-80.2	-4	-175.8	-65	-66.4	0	0	0	114.4	F408 F415 L421 F423 I427 N428 M430 H433 T440 L441	F408-Y425 AromaticContact CD2-CE2 3.87Å; F408-Y425 HydrophobicContact CD2-CE2 3.87Å; F408-Y425 AromaticContact CD2-CZ 3.83Å; F408-Y425 AromaticContact CE2-CD2 3.76Å; F408-Y425 HydrophobicContact CE2-CD2 3.76Å; F408-Y425 HydrophobicContact CE2-CE1 4.32Å; F408-Y425 AromaticContact CE2-CE2 3.3Å; F408-Y425 HydrophobicContact CE2-CE2 3.3Å; F408-Y425 HydrophobicContact CE2-CG 4.45Å; F408-Y425 AromaticContact CE2-CZ 3.59Å; F408-Y425 HydrophobicContact CZ-CD2 4.44Å; F408-Y425 HydrophobicContact CZ-CE2 4.3Å; F415-Y425 AromaticContact CE2-CE2 3.58Å; F415-Y425 HydrophobicContact CE2-CE2 3.58Å; F415-Y425 AromaticContact CZ-CE2 3.78Å; F415-Y425 HydrophobicContact CZ-CE2 3.78Å; L421-Y425 HydrophobicContact CD2-CD2 3.89Å; L421-Y425 HydrophobicContact CD2-CE2 4.32Å; L421-Y425 HydrophobicContact CG-CD2 3.9Å; L421-Y425 HydrophobicContact CG-CE2 3.93Å; L421-Y425 WeakPolarHBondContact O-CD2 3.27Å; L421-Y425 PolarHBondContact O-N 3.23Å; L421-Y425 VanDerWaalsContact O-N 3.07Å; F423-Y425 PolarHBondContact O-N 2.85Å; Y425-I427 VanDerWaalsContact C-N 3.27Å; Y425-N428 WeakPolarHBondContact CA-O 3.34Å; Y425-M430 HydrophobicContact CD1-CG 4.12Å; Y425-M430 HydrophobicContact CD1-SD 3.2Å; Y425-M430 WeakPolarHBondContact CD1-SD 3.46Å; Y425-M430 HydrophobicContact CD2-SD 4.09Å; Y425-M430 HydrophobicContact CE1-SD 3.48Å; Y425-M430 WeakPolarHBondContact CE1-SD 3.47Å; Y425-M430 HydrophobicContact CE2-SD 4.34Å; Y425-M430 HydrophobicContact CG-CG 4.47Å; Y425-M430 HydrophobicContact CG-SD 3.52Å; Y425-M430 VanDerWaalsContact CG-SD 3.52Å; Y425-H433 AromaticContact CE1-CD2 3.91Å; Y425-H433 AromaticContact CE1-NE2 3.53Å; Y425-H433 AromaticContact CZ-NE2 3.48Å; Y425-H433 PolarHBondContact OH-NE2 3.26Å; Y425-T440 CarbonylContact O-C 3.32Å; Y425-T440 VanDerWaalsContact O-CA 3.31Å; Y425-T440 WeakPolarHBondContact O-CA 3.2Å; Y425-T440 VanDerWaalsContact O-CB 3.25Å; Y425-T440 WeakPolarHBondContact O-CB 3.37Å; Y425-L441 PolarHBondContact O-N 3.48Å
426	S	92.1	Very high	89.6	Confident	9 Å²	9	52.1 Å²	52.1	6%	0.063	28%	0.279	C	S	.	.	H	α-helix	trans	-73.9	-23.6	165.7	75	0	0	0	0	112.4	R336 A340 M343 V422 F423 H424 T440 L441	R336-S426 PolarHBondContact NH2-O 3.19Å; A340-S426 WeakPolarHBondContact CB-OG 2.96Å; M343-S426 VanDerWaalsContact CE-CB 3.47Å; V422-S426 VanDerWaalsContact O-CB 3.31Å; V422-S426 WeakPolarHBondContact O-CB 3.27Å; V422-S426 PolarHBondContact O-N 3.31Å; F423-S426 PolarHBondContact O-N 3.02Å; F423-S426 PolarHBondContact O-OG 2.94Å; H424-S426 VanDerWaalsContact C-N 3.27Å; H424-S426 PolarHBondContact O-N 3.5Å; S426-T440 WeakPolarHBondContact O-CB 3.22Å; S426-L441 WeakPolarHBondContact CA-O 3.48Å; S426-L441 WeakPolarHBondContact CB-O 3.25Å
427	I	87.5	Confident	89.7	Confident	37 Å²	37	47.8 Å²	47.8	19%	0.19	25%	0.249	C	C	.	.	H	α-helix	trans	-102.7	-40.7	178.7	-57	167	0	0	0	110.4	R336 N337 A340 F423 H424 Y425	R336-I427 VanDerWaalsContact NH2-C 3.34Å; R336-I427 PolarHBondContact NH2-O 3.24Å; N337-I427 WeakPolarHBondContact OD1-CD1 3.48Å; A340-I427 HydrophobicContact CB-CD1 4Å; A340-I427 HydrophobicContact CB-CG1 3.87Å; F423-I427 HydrophobicContact CE1-CD1 4.16Å; F423-I427 HydrophobicContact CE2-CD1 4.17Å; F423-I427 HydrophobicContact CZ-CD1 3.86Å; H424-I427 PolarHBondContact O-N 2.94Å; H424-I427 VanDerWaalsContact O-N 3.14Å; Y425-I427 VanDerWaalsContact C-N 3.27Å
428	N	89.6	Confident	89.9	Confident	67 Å²	67	50.5 Å²	50.5	36%	0.358	26%	0.261	S	S	.	.	S	Bend	trans	-99.3	129.1	-174.4	-62	-32.5	0	0	0	111.5	H424 Y425	H424-N428 PolarHBondContact CD2-ND2 3.03Å; H424-N428 VanDerWaalsContact CD2-ND2 3.27Å; H424-N428 PolarHBondContact CE1-ND2 3.35Å; H424-N428 PolarHBondContact NE2-ND2 3.27Å; H424-N428 WeakPolarHBondContact O-CB 3.48Å; H424-N428 PolarHBondContact O-N 2.88Å; Y425-N428 WeakPolarHBondContact CA-O 3.34Å
429	S	92.1	Very high	90	Very high	26 Å²	26	50.8 Å²	50.8	18%	0.182	26%	0.263	C	S	.	.			trans	-67.8	137.5	-179.8	174.8	0	0	0	0	110.7	K431 D438	S429-K431 PolarHBondContact O-N 3.05Å; S429-K431 VanDerWaalsContact O-N 3.12Å; S429-K431 WeakPolarHBondContact OG-CG 3.29Å; S429-K431 PolarHBondContact OG-N 2.71Å; S429-D438 PolarHBondContact OG-OD1 3.04Å
430	M	90.4	Very high	90.2	Very high	2 Å²	2	49.7 Å²	49.7	1%	0.01	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-69.9	-1.3	176.6	-72.9	-70.5	-63.3	0	0	114	F408 Y425 E432 H433 N434 L437 T439	F408-M430 HydrophobicContact CD2-CE 3.84Å; F408-M430 HydrophobicContact CD2-SD 4.37Å; F408-M430 HydrophobicContact CE1-CE 4.32Å; F408-M430 HydrophobicContact CE2-CE 3.28Å; F408-M430 HydrophobicContact CE2-SD 3.56Å; F408-M430 VanDerWaalsContact CE2-SD 3.56Å; F408-M430 HydrophobicContact CZ-CE 3.58Å; F408-M430 HydrophobicContact CZ-SD 4.12Å; Y425-M430 HydrophobicContact CD1-CG 4.12Å; Y425-M430 HydrophobicContact CD1-SD 3.2Å; Y425-M430 WeakPolarHBondContact CD1-SD 3.46Å; Y425-M430 HydrophobicContact CD2-SD 4.09Å; Y425-M430 HydrophobicContact CE1-SD 3.48Å; Y425-M430 WeakPolarHBondContact CE1-SD 3.47Å; Y425-M430 HydrophobicContact CE2-SD 4.34Å; Y425-M430 HydrophobicContact CG-CG 4.47Å; Y425-M430 HydrophobicContact CG-SD 3.52Å; Y425-M430 VanDerWaalsContact CG-SD 3.52Å; M430-E432 PolarHBondContact O-N 2.86Å; M430-E432 VanDerWaalsContact O-N 3.17Å; M430-H433 PolarHBondContact O-N 2.95Å; M430-H433 VanDerWaalsContact O-N 3.08Å; M430-N434 PolarHBondContact O-N 3.46Å; M430-L437 CarbonylContact C-O 3.59Å; M430-L437 VanDerWaalsContact C-O 3.27Å; M430-L437 HydrophobicContact CB-CB 4.43Å; M430-L437 HydrophobicContact CB-CD2 3.87Å; M430-L437 HydrophobicContact CB-CG 3.78Å; M430-L437 WeakPolarHBondContact CB-O 3.48Å; M430-L437 HydrophobicContact CE-CD2 3.97Å; M430-L437 HydrophobicContact CG-CD2 4.38Å; M430-T439 PolarHBondContact N-O 3.34Å; M430-T439 VanDerWaalsContact N-O 3.1Å
431	K	90	Very high	90.5	Very high	114 Å²	114	46.7 Å²	46.7	50%	0.496	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-59.2	-26.6	-179.6	68.8	178.4	170.9	-168.6	0	114.2	S429 H433 N434 L437 D438	S429-K431 PolarHBondContact O-N 3.05Å; S429-K431 VanDerWaalsContact O-N 3.12Å; S429-K431 WeakPolarHBondContact OG-CG 3.29Å; S429-K431 PolarHBondContact OG-N 2.71Å; K431-H433 PolarHBondContact O-N 2.89Å; K431-N434 WeakPolarHBondContact CA-O 3.36Å; K431-N434 CarbonylContact O-C 3.46Å; K431-N434 PolarHBondContact O-N 3.48Å; K431-L437 PolarHBondContact N-O 3.42Å; K431-D438 HydrophobicContact CB-CB 3.98Å; K431-D438 WeakPolarHBondContact CD-OD1 3.44Å
432	E	83.3	Confident	90.3	Very high	118 Å²	118	50.5 Å²	50.5	55%	0.551	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-63	-29.1	177.9	62.4	177.6	-169.3	0	0	112.4	M430	M430-E432 PolarHBondContact O-N 2.86Å; M430-E432 VanDerWaalsContact O-N 3.17Å
433	H	84.4	Confident	90.2	Very high	67 Å²	67	53.2 Å²	53.2	31%	0.31	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-33.8	178	-57.6	-39.7	0	0	0	112.1	F408 T411 Y425 M430 K431	F408-H433 AromaticContact CD2-CD2 3.92Å; T411-H433 VanDerWaalsContact CG2-CE1 3.48Å; T411-H433 WeakPolarHBondContact CG2-CE1 3.06Å; T411-H433 WeakPolarHBondContact CG2-ND1 3.48Å; Y425-H433 AromaticContact CE1-CD2 3.91Å; Y425-H433 AromaticContact CE1-NE2 3.53Å; Y425-H433 AromaticContact CZ-NE2 3.48Å; Y425-H433 PolarHBondContact OH-NE2 3.26Å; M430-H433 PolarHBondContact O-N 2.95Å; M430-H433 VanDerWaalsContact O-N 3.08Å; K431-H433 PolarHBondContact O-N 2.89Å
434	N	84.9	Confident	90.3	Very high	52 Å²	52	49.9 Å²	49.9	28%	0.278	27%	0.265	S	S	.	.			trans	-148.1	110.7	177.9	-178.5	-10.1	0	0	0	109.6	M430 K431 N436 L437	M430-N434 PolarHBondContact O-N 3.46Å; K431-N434 WeakPolarHBondContact CA-O 3.36Å; K431-N434 CarbonylContact O-C 3.46Å; K431-N434 PolarHBondContact O-N 3.48Å; N434-N436 PolarHBondContact O-N 3.44Å; N434-N436 WeakPolarHBondContact OD1-CB 3.31Å; N434-N436 PolarHBondContact OD1-N 3.31Å; N434-L437 HydrophobicContact CB-CB 3.97Å; N434-L437 WeakPolarHBondContact O-CA 3.49Å; N434-L437 WeakPolarHBondContact O-CB 3.43Å; N434-L437 PolarHBondContact O-N 2.86Å
435	P	87.6	Confident	90.3	Very high	107 Å²	107	48 Å²	48	70%	0.695	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-23.5	-179.9	-27.9	35.1	0	0	0	114.8	L437	P435-L437 VanDerWaalsContact C-N 3.29Å
436	N	90.1	Very high	89.9	Confident	118 Å²	118	51.7 Å²	51.7	63%	0.631	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-9.4	175.9	-61.2	-55.8	0	0	0	113.4	F395 N434	F395-N436 HydrophobicContact CE1-CB 4.3Å; F395-N436 HydrophobicContact CZ-CB 4.24Å; N434-N436 PolarHBondContact O-N 3.44Å; N434-N436 WeakPolarHBondContact OD1-CB 3.31Å; N434-N436 PolarHBondContact OD1-N 3.31Å
437	L	90.7	Very high	89	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	29%	0.286	C	S	.	.			trans	-108.3	54	178.2	-169.8	59.1	0	0	0	110.2	I388 C390 F395 M430 K431 N434 P435 T439	I388-L437 HydrophobicContact CG2-CD1 3.84Å; I388-L437 HydrophobicContact CG2-CD2 4.38Å; C390-L437 HydrophobicContact CB-CD1 3.61Å; F395-L437 HydrophobicContact CB-CD1 3.92Å; F395-L437 HydrophobicContact CB-CD2 4.45Å; F395-L437 HydrophobicContact CD1-CD1 4.4Å; F395-L437 HydrophobicContact CD2-CD1 3.79Å; F395-L437 HydrophobicContact CE2-CD1 4.39Å; F395-L437 HydrophobicContact CG-CD1 3.79Å; M430-L437 CarbonylContact C-O 3.59Å; M430-L437 VanDerWaalsContact C-O 3.27Å; M430-L437 HydrophobicContact CB-CB 4.43Å; M430-L437 HydrophobicContact CB-CD2 3.87Å; M430-L437 HydrophobicContact CB-CG 3.78Å; M430-L437 WeakPolarHBondContact CB-O 3.48Å; M430-L437 HydrophobicContact CE-CD2 3.97Å; M430-L437 HydrophobicContact CG-CD2 4.38Å; K431-L437 PolarHBondContact N-O 3.42Å; N434-L437 HydrophobicContact CB-CB 3.97Å; N434-L437 WeakPolarHBondContact O-CA 3.49Å; N434-L437 WeakPolarHBondContact O-CB 3.43Å; N434-L437 PolarHBondContact O-N 2.86Å; P435-L437 VanDerWaalsContact C-N 3.29Å; L437-T439 VanDerWaalsContact C-N 3.28Å; L437-T439 HydrophobicContact CD1-CG2 3.95Å; L437-T439 PolarHBondContact O-N 3.46Å
438	D	93.2	Very high	87.6	Confident	88 Å²	88	56.3 Å²	56.3	47%	0.471	30%	0.303	S	S	.	.			trans	-82.4	75	174.9	-166.3	9.1	0	0	0	111.2	S429 K431	S429-D438 PolarHBondContact OG-OD1 3.04Å; K431-D438 HydrophobicContact CB-CB 3.98Å; K431-D438 WeakPolarHBondContact CD-OD1 3.44Å
439	T	93.7	Very high	85.5	Confident	18 Å²	18	62.3 Å²	62.3	11%	0.11	32%	0.32	C	S	.	.			trans	-151.7	159.1	172.4	-171.7	0	0	0	0	109.7	I388 C390 M430 L437	I388-T439 HydrophobicContact CD1-CG2 3.65Å; I388-T439 HydrophobicContact CG1-CG2 4.32Å; C390-T439 HydrophobicContact CB-CG2 3.83Å; M430-T439 PolarHBondContact N-O 3.34Å; M430-T439 VanDerWaalsContact N-O 3.1Å; L437-T439 VanDerWaalsContact C-N 3.28Å; L437-T439 HydrophobicContact CD1-CG2 3.95Å; L437-T439 PolarHBondContact O-N 3.46Å
440	T	94.2	Very high	82.5	Confident	25 Å²	25	71.5 Å²	71.5	15%	0.153	35%	0.351	C	S	.	.			trans	-97.6	169.8	166.5	59	0	0	0	0	110.8	G370 Y425 S426 V442	G370-T440 WeakPolarHBondContact CA-O 3.41Å; Y425-T440 CarbonylContact O-C 3.32Å; Y425-T440 VanDerWaalsContact O-CA 3.31Å; Y425-T440 WeakPolarHBondContact O-CA 3.2Å; Y425-T440 VanDerWaalsContact O-CB 3.25Å; Y425-T440 WeakPolarHBondContact O-CB 3.37Å; S426-T440 WeakPolarHBondContact O-CB 3.22Å; T440-V442 PolarHBondContact O-N 3.28Å; T440-V442 VanDerWaalsContact O-N 3.13Å
441	L	94.4	Very high	79.9	Confident	2 Å²	2	78.1 Å²	78.1	1%	0.01	38%	0.382	C	S	.	.			trans	-71.7	97.6	166.3	-54.1	-172.2	0	0	0	108.1	M343 F372 L386 I388 V422 Y425 S426	M343-L441 HydrophobicContact CE-CB 4.23Å; M343-L441 WeakPolarHBondContact CE-O 3.47Å; F372-L441 HydrophobicContact CB-CD2 4.02Å; F372-L441 HydrophobicContact CD1-CB 3.74Å; F372-L441 HydrophobicContact CD1-CD2 4.21Å; F372-L441 HydrophobicContact CD1-CG 4.44Å; F372-L441 HydrophobicContact CD2-CD1 4.21Å; F372-L441 HydrophobicContact CD2-CD2 4.15Å; F372-L441 HydrophobicContact CE1-CB 3.67Å; F372-L441 HydrophobicContact CE2-CB 4.48Å; F372-L441 HydrophobicContact CE2-CD1 4.08Å; F372-L441 HydrophobicContact CG-CB 4.2Å; F372-L441 HydrophobicContact CG-CD2 3.86Å; F372-L441 HydrophobicContact CG-CG 4.42Å; F372-L441 HydrophobicContact CZ-CB 4.07Å; F372-L441 HydrophobicContact CZ-CD1 4.35Å; L386-L441 HydrophobicContact CD1-CD2 4.03Å; L386-L441 HydrophobicContact CD2-CD2 3.99Å; I388-L441 HydrophobicContact CD1-CD2 3.57Å; V422-L441 HydrophobicContact CB-CD1 4.16Å; V422-L441 HydrophobicContact CG1-CD1 4.05Å; V422-L441 HydrophobicContact CG2-CD1 4.12Å; Y425-L441 PolarHBondContact O-N 3.48Å; S426-L441 WeakPolarHBondContact CA-O 3.48Å; S426-L441 WeakPolarHBondContact CB-O 3.25Å
442	V	90.5	Very high	77	Confident	80 Å²	80	81.1 Å²	81.1	49%	0.485	40%	0.397	S	S	.	.			trans	-91	-44.8	-171.8	176.5	0	0	0	0	111.5	G370 T440	G370-V442 PolarHBondContact O-N 2.9Å; T440-V442 PolarHBondContact O-N 3.28Å; T440-V442 VanDerWaalsContact O-N 3.13Å
443	Q	89.3	Confident	74.1	Confident	57 Å²	57	82 Å²	82	27%	0.266	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	132.6	-174.3	-171.3	178.6	-2	0	0	111.3	G370 T371 F372 G447	G370-Q443 PolarHBondContact O-N 3.45Å; T371-Q443 VanDerWaalsContact CA-O 3.29Å; T371-Q443 WeakPolarHBondContact CA-O 3.39Å; F372-Q443 WeakPolarHBondContact CD1-O 3.33Å; F372-Q443 VanDerWaalsContact CE1-C 3.43Å; F372-Q443 WeakPolarHBondContact CE1-O 3.47Å; F372-Q443 PolarHBondContact N-O 2.94Å; Q443-G447 PolarHBondContact NE2-O 3.23Å
444	P	92.1	Very high	71.4	Confident	9 Å²	9	84.3 Å²	84.3	6%	0.058	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	144.9	176.4	34.5	-33.3	0	0	0	109.2	M343 L349 W350 F372 L446 G447	M343-P444 HydrophobicContact CG-CB 4.4Å; M343-P444 HydrophobicContact CG-CG 3.87Å; M343-P444 HydrophobicContact SD-CG 4.45Å; L349-P444 HydrophobicContact CB-CB 3.76Å; L349-P444 HydrophobicContact CB-CG 3.72Å; L349-P444 HydrophobicContact CD1-CG 4.14Å; L349-P444 WeakPolarHBondContact O-CB 3.43Å; W350-P444 HydrophobicContact CB-CB 3.64Å; W350-P444 HydrophobicContact CG-CB 4.2Å; F372-P444 HydrophobicContact CE1-CB 4.21Å; F372-P444 HydrophobicContact CZ-CB 4.1Å; P444-L446 PolarHBondContact O-N 3.25Å; P444-G447 PolarHBondContact O-N 2.88Å
445	V	91.5	Very high	68.5	Low	10 Å²	10	86.9 Å²	86.9	6%	0.061	46%	0.457	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-30.6	-171.5	72.6	0	0	0	0	113.8	L352 R363 L364 F372 L373	L352-V445 HydrophobicContact CD1-CG1 3.89Å; L352-V445 HydrophobicContact CD2-CG1 4.27Å; R363-V445 HydrophobicContact CB-CG2 4.18Å; L364-V445 HydrophobicContact CD2-CB 4.36Å; L364-V445 HydrophobicContact CD2-CG2 3.98Å; F372-V445 PolarHBondContact O-N 2.83Å; L373-V445 HydrophobicContact CB-CB 4.11Å; L373-V445 HydrophobicContact CB-CG1 3.69Å; L373-V445 HydrophobicContact CD2-CB 4.19Å; L373-V445 HydrophobicContact CD2-CG1 3.98Å; L373-V445 HydrophobicContact CD2-CG2 4.2Å; L373-V445 HydrophobicContact CG-CG1 4.5Å
446	L	87.3	Confident	65.6	Low	79 Å²	79	90.3 Å²	90.3	41%	0.414	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-4.2	178.4	-53.3	-177.5	0	0	0	113.9	S348 L349 L352 P444 Q448	S348-L446 WeakPolarHBondContact O-CD1 3.35Å; L349-L446 HydrophobicContact CD2-CB 4.41Å; L349-L446 WeakPolarHBondContact O-CB 3.48Å; L349-L446 PolarHBondContact O-N 3.38Å; L352-L446 HydrophobicContact CD1-CD1 4.46Å; P444-L446 PolarHBondContact O-N 3.25Å; L446-Q448 PolarHBondContact O-N 2.92Å
447	G	72.5	Confident	62.5	Low	26 Å²	26	92.4 Å²	92.4	27%	0.268	47%	0.473	S	S	.	.			trans	-76.1	43.8	-178.2	0	0	0	0	0	114.4	Q443 P444 R449	Q443-G447 PolarHBondContact NE2-O 3.23Å; P444-G447 PolarHBondContact O-N 2.88Å; G447-R449 PolarHBondContact O-N 3.4Å
448	Q	57.6	Low	59.5	Low	117 Å²	117	98.1 Å²	98.1	55%	0.547	51%	0.508	S	S	.	.			trans	-54.4	127.6	-167	-71.5	-175.5	-2.8	0	0	114.1	L446	L446-Q448 PolarHBondContact O-N 2.92Å
449	R	45	Very low	56.2	Low	193 Å²	193	97.1 Å²	97.1	73%	0.728	52%	0.518	S	S	*	.			trans	-80.4	110.5	142.8	-82.4	-81.9	-156.1	160.7	-3.3	107.1	G447 H451	G447-R449 PolarHBondContact O-N 3.4Å; R449-H451 VanDerWaalsContact C-N 3.25Å; R449-H451 PolarHBondContact NH1-NE2 3.47Å; R449-H451 PolarHBondContact O-N 2.94Å
450	R	29.9	Very low	53	Low	219 Å²	219	106 Å²	106	83%	0.826	56%	0.555	S	S	*	*			trans	-68.4	88.9	158.9	-69.6	-178.1	-178.5	164.2	0.6	107.4
451	H	35.8	Very low	49.8	Very low	141 Å²	141	114.4 Å²	114.4	65%	0.653	59%	0.593	S	S	*	*			trans	-107.3	120.8	161.8	-86.3	-67.8	0	0	0	109.1	R449	R449-H451 VanDerWaalsContact C-N 3.25Å; R449-H451 PolarHBondContact NH1-NE2 3.47Å; R449-H451 PolarHBondContact O-N 2.94Å
452	H	28.1	Very low	46.6	Very low	176 Å²	176	117 Å²	117	82%	0.815	62%	0.62	S	S	*	*			trans	-50.8	143.1	168.9	-74.4	26.9	0	0	0	110.5	S454	H452-S454 PolarHBondContact O-N 3.45Å
453	T	23.6	Very low	43.7	Very low	136 Å²	136	119.8 Å²	119.8	83%	0.834	64%	0.641	S	S	*	*			trans	-50.6	115.5	164.5	48.5	0	0	0	0	110.7
454	S	27.4	Very low	40.7	Very low	116 Å²	116	126.5 Å²	126.5	81%	0.811	67%	0.67	S	S	*	*			trans	-151.7	115.9	151.5	-76.6	0	0	0	0	108.1	H452 E456	H452-S454 PolarHBondContact O-N 3.45Å; S454-E456 PolarHBondContact O-N 2.9Å
455	S	24.1	Very low	37.6	Very low	107 Å²	107	134.1 Å²	134.1	75%	0.748	71%	0.709	S	S	*	*			trans	-55.7	123.4	174.7	-166.8	0	0	0	0	110.2
456	E	26.5	Very low	34.9	Very low	179 Å²	179	142.8 Å²	142.8	84%	0.836	75%	0.749	S	S	*	*			trans	-144.1	94	153.4	-111.5	172.7	-156.5	0	0	108.9	S454 V458	S454-E456 PolarHBondContact O-N 2.9Å; E456-V458 VanDerWaalsContact C-N 3.33Å; E456-V458 HydrophobicContact CG-CG2 4.47Å; E456-V458 PolarHBondContact O-N 3.32Å; E456-V458 VanDerWaalsContact O-N 3.13Å
457	I	24.7	Very low	32	Very low	161 Å²	161	147.4 Å²	147.4	83%	0.826	77%	0.773	S	S	*	*			trans	-69	91.9	162.4	-60.7	168.4	0	0	0	105.8
458	V	27.3	Very low	29.8	Very low	122 Å²	122	155.3 Å²	155.3	74%	0.739	80%	0.803	S	S	*	*			trans	-129.5	120.3	165.9	-176.6	0	0	0	0	108.5	E456	E456-V458 VanDerWaalsContact C-N 3.33Å; E456-V458 HydrophobicContact CG-CG2 4.47Å; E456-V458 PolarHBondContact O-N 3.32Å; E456-V458 VanDerWaalsContact O-N 3.13Å
459	G	25	Very low	28.4	Very low	66 Å²	66	158.3 Å²	158.3	68%	0.68	82%	0.817	S	S	*	*			trans	-64.9	147.2	-162.6	0	0	0	0	0	115.2
460	K	27.1	Very low	27.6	Very low	204 Å²	204	159.4 Å²	159.4	89%	0.887	83%	0.827	S	S	*	*			trans	-133.2	80.3	147.6	-80	-172.4	175.5	179.6	0	108.2
461	Q	26.7	Very low	27.4	Very low	203 Å²	203	153.5 Å²	153.5	95%	0.949	83%	0.825	S	S	*	*			trans	-78.2	121	149.6	-71.2	-162.8	-5.6	0	0	106.8
462	G	25.9	Very low	27.2	Very low	57 Å²	57	150.7 Å²	150.7	59%	0.588	83%	0.827	S	S	*	*			trans	118.9	94.6	-170.5	0	0	0	0	0	107.3
463	C	29.4	Very low	27.5	Very low	138 Å²	138	147.5 Å²	147.5	93%	0.932	82%	0.82	S	S	*	*				-138	113.1	59	-57.1	0	0	0	0	110.6
464	K	27.4	Very low	28	Very low	198 Å²	198	147.8 Å²	147.8	86%	0.861	82%	0.816	S	S	*	*			trans	-111.4	131.7	162.9	-151.3	175.9	-174.1	180	0	104.1
465	L	27	Very low	28.1	Very low	168 Å²	168	144.9 Å²	144.9	88%	0.88	80%	0.804	S	S	*	*			trans	103.8	72.7	-176	-57.4	166.8	0	0	0	114.9
466	Q	33.6	Very low	28.4	Very low	193 Å²	193	146.8 Å²	146.8	90%	0.902	81%	0.806	S	S	*	*			trans	-152.1	65.7	150.4	-109.1	173.4	-9.5	0	0	107.5
467	L	26.5	Very low	28.4	Very low	176 Å²	176	146 Å²	146	92%	0.921	80%	0.802	S	S	*	*			trans	-134.2	23.2	-179.9	-122.1	154.2	0	0	0	112.6
468	Q	28.1	Very low	28.6	Very low	191 Å²	191	141.6 Å²	141.6	89%	0.893	79%	0.79	S	S	*	*			trans	-144.8	47.6	-174.8	-149.6	170	9.8	0	0	114.9
469	Q	27.9	Very low	28.7	Very low	180 Å²	180	140.6 Å²	140.6	84%	0.841	78%	0.78	S	S	*	*			trans	-130.2	11.5	167.6	-100.7	175	-19	0	0	115.4	A471	Q469-A471 PolarHBondContact O-N 2.75Å
470	F	26.8	Very low	29	Very low	216 Å²	216	142.4 Å²	142.4	95%	0.947	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	24	-177.6	-123	-87.9	0	0	0	115.8
471	A	25.8	Very low	29.3	Very low	95 Å²	95	135.2 Å²	135.2	79%	0.785	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.4	11.1	-177.7	0	0	0	0	0	114.9	Q469	Q469-A471 PolarHBondContact O-N 2.75Å
472	A	31.6	Very low	29.4	Very low	83 Å²	83	134.3 Å²	134.3	69%	0.686	74%	0.744	S	S	*	*	S	Bend	trans	-96.6	-11.6	-172.5	0	0	0	0	0	116.3
473	T	35.7	Very low	29.8	Very low	109 Å²	109	134 Å²	134	67%	0.669	74%	0.741	S	S	*	*	S	Bend	trans	-99.7	-9.5	-175.8	28.1	0	0	0	0	115.9	G475	T473-G475 VanDerWaalsContact C-N 3.34Å
474	N	34.1	Very low	29.9	Very low	141 Å²	141	135.5 Å²	135.5	75%	0.754	73%	0.734	S	S	*	*	S	Bend	trans	-99.8	16.9	165.7	-72.6	-18.2	0	0	0	112.4	L476	N474-L476 PolarHBondContact O-N 3.45Å
475	G	28.5	Very low	30.4	Very low	55 Å²	55	128.4 Å²	128.4	57%	0.567	71%	0.713	S	S	*	*			trans	-67.1	68.9	165.6	0	0	0	0	0	110.2	T473 Q477	T473-G475 VanDerWaalsContact C-N 3.34Å; G475-Q477 PolarHBondContact O-N 2.93Å
476	L	31.9	Very low	31	Very low	148 Å²	148	122 Å²	122	78%	0.775	68%	0.682	S	S	*	*			trans	-55.6	87.9	133.5	-75.3	167	0	0	0	104.1	N474 A478	N474-L476 PolarHBondContact O-N 3.45Å; L476-A478 PolarHBondContact O-N 3.26Å
477	Q	26.6	Very low	31.6	Very low	161 Å²	161	117.7 Å²	117.7	75%	0.752	67%	0.668	S	S	*	*			trans	-60.3	73.4	148.8	-164.6	108.7	4.4	0	0	103.9	G475 D479	G475-Q477 PolarHBondContact O-N 2.93Å; Q477-D479 PolarHBondContact O-N 2.94Å
478	A	28	Very low	32.4	Very low	70 Å²	70	111.6 Å²	111.6	58%	0.579	64%	0.638	S	S	*	*			trans	-55.3	99.8	143.7	0	0	0	0	0	101.1	L476 V480	L476-A478 PolarHBondContact O-N 3.26Å; A478-V480 PolarHBondContact O-N 3.2Å
479	D	28.4	Very low	33	Very low	100 Å²	100	103.8 Å²	103.8	54%	0.535	60%	0.603	S	S	.	*			trans	-50	95.9	154.7	-79.2	-31.8	0	0	0	103.1	Q477 I481	Q477-D479 PolarHBondContact O-N 2.94Å; D479-I481 HydrophobicContact CB-CG1 4.37Å; D479-I481 WeakPolarHBondContact O-CG1 3.28Å; D479-I481 PolarHBondContact O-N 3.49Å
480	V	31.4	Very low	33.3	Very low	104 Å²	104	98.8 Å²	98.8	63%	0.63	59%	0.593	S	S	*	*			trans	-66.2	88.4	168.6	175.7	0	0	0	0	100.7	A478 H482	A478-V480 PolarHBondContact O-N 3.2Å; V480-H482 PolarHBondContact O-CD2 3.28Å; V480-H482 VanDerWaalsContact O-CD2 3.24Å; V480-H482 PolarHBondContact O-N 3.37Å
481	I	33.5	Very low	33.5	Very low	53 Å²	53	93 Å²	93	27%	0.272	58%	0.577	S	S	.	*			trans	-60.9	96.7	-178.3	-71.9	159.3	0	0	0	104.5	R244 L247 D479 G483	R244-I481 VanDerWaalsContact CZ-CB 3.44Å; L247-I481 HydrophobicContact CB-CD1 4.26Å; L247-I481 HydrophobicContact CD1-CD1 4.09Å; L247-I481 HydrophobicContact CD1-CG1 4.46Å; L247-I481 HydrophobicContact CD1-CG2 4.44Å; D479-I481 HydrophobicContact CB-CG1 4.37Å; D479-I481 WeakPolarHBondContact O-CG1 3.28Å; D479-I481 PolarHBondContact O-N 3.49Å; I481-G483 PolarHBondContact O-N 3.46Å
482	H	29.9	Very low	33.7	Very low	184 Å²	184	93 Å²	93	85%	0.852	57%	0.569	S	S	*	*			trans	-65.3	90.4	168.4	-72	-73.3	0	0	0	105.9	V480	V480-H482 PolarHBondContact O-CD2 3.28Å; V480-H482 VanDerWaalsContact O-CD2 3.24Å; V480-H482 PolarHBondContact O-N 3.37Å
483	G	33.1	Very low	33.4	Very low	52 Å²	52	94.8 Å²	94.8	54%	0.536	58%	0.575	S	S	.	*			trans	-145.8	142.1	173.4	0	0	0	0	0	107.6	I481 A485	I481-G483 PolarHBondContact O-N 3.46Å; G483-A485 PolarHBondContact O-N 2.89Å
484	E	32.2	Very low	33.1	Very low	168 Å²	168	97.9 Å²	97.9	79%	0.785	58%	0.579	S	S	*	*			trans	-43	131	175.7	-79.1	175	136.5	0	0	111
485	A	38	Very low	32.7	Very low	50 Å²	50	97.7 Å²	97.7	41%	0.413	58%	0.578	S	S	.	*	P	Polyproline II helix	trans	-62.1	129.4	-177.4	0	0	0	0	0	110	G483 V487	G483-A485 PolarHBondContact O-N 2.89Å; A485-V487 PolarHBondContact O-N 3.44Å
486	P	40.2	Very low	32.7	Very low	34 Å²	34	103.2 Å²	103.2	22%	0.221	59%	0.589	C	S	.	*	P	Polyproline II helix	trans	-66.8	135.6	171.8	27	-31.6	0	0	0	109.5	N237 L241 V488	N237-P486 VanDerWaalsContact OD1-CA 3.25Å; N237-P486 WeakPolarHBondContact OD1-CA 3.41Å; N237-P486 WeakPolarHBondContact OD1-CB 3.27Å; L241-P486 HydrophobicContact CD2-CB 3.92Å; L241-P486 HydrophobicContact CD2-CG 4.16Å; L241-P486 HydrophobicContact CG-CB 4.35Å; P486-V488 PolarHBondContact O-N 3.35Å
487	V	44.7	Very low	32.4	Very low	101 Å²	101	105.2 Å²	105.2	61%	0.612	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-66.3	117	171.4	178.9	0	0	0	0	108	N237 A485 V489	N237-V487 PolarHBondContact ND2-O 3.08Å; A485-V487 PolarHBondContact O-N 3.44Å; V487-V489 PolarHBondContact O-N 2.91Å
488	V	44.2	Very low	32.4	Very low	48 Å²	48	103 Å²	103	29%	0.291	59%	0.594	S	S	.	*			trans	-73.5	112.8	175.2	179.7	0	0	0	0	108.1	P486 A490 I534	P486-V488 PolarHBondContact O-N 3.35Å; V488-A490 PolarHBondContact O-N 2.91Å; V488-I534 HydrophobicContact CG2-CG2 4.3Å
489	V	41	Very low	32.3	Very low	27 Å²	27	108 Å²	108	16%	0.164	61%	0.605	C	S	.	*			trans	-74.4	95.1	171.9	-175	0	0	0	0	107.7	F222 V487	F222-V489 HydrophobicContact CD2-CG1 3.57Å; F222-V489 HydrophobicContact CE2-CG1 3.84Å; F222-V489 HydrophobicContact CG-CG1 3.97Å; F222-V489 HydrophobicContact CZ-CG1 4.44Å; V487-V489 PolarHBondContact O-N 2.91Å
490	A	33.7	Very low	32.4	Very low	75 Å²	75	108.7 Å²	108.7	62%	0.62	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-63	131	175.7	0	0	0	0	0	110.1	V488	V488-A490 PolarHBondContact O-N 2.91Å
491	P	31.8	Very low	32.2	Very low	94 Å²	94	114.8 Å²	114.8	61%	0.61	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-65.2	144.8	168.4	26.5	-30.9	0	0	0	109.5	C493	P491-C493 PolarHBondContact O-N 3.47Å
492	P	30.4	Very low	31.7	Very low	96 Å²	96	123.9 Å²	123.9	62%	0.623	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-62.2	128.4	174.1	24.4	-30.8	0	0	0	109.5	K494	P492-K494 PolarHBondContact O-N 3.1Å
493	C	23.9	Very low	31.8	Very low	121 Å²	121	121.4 Å²	121.4	82%	0.818	66%	0.658	S	S	*	*			trans	-50.3	108.7	167.6	-94.9	0	0	0	0	108.6	P491	P491-C493 PolarHBondContact O-N 3.47Å
494	K	30.2	Very low	31.5	Very low	173 Å²	173	127.8 Å²	127.8	75%	0.752	67%	0.673	S	S	*	*			trans	-90.7	98.9	161.8	-74.7	-169.1	173.3	-169.6	0	107	P492 E496	P492-K494 PolarHBondContact O-N 3.1Å; K494-E496 PolarHBondContact O-N 2.96Å
495	D	25.8	Very low	31.2	Very low	138 Å²	138	131.4 Å²	131.4	74%	0.738	68%	0.68	S	S	*	*			trans	-66.3	83.7	164.1	-70.2	-39.5	0	0	0	108.7
496	E	29	Very low	31	Very low	170 Å²	170	138.6 Å²	138.6	79%	0.794	70%	0.702	S	S	*	*			trans	-125.9	98.4	166.9	-76.1	-177.9	-177.5	0	0	109.5	K494	K494-E496 PolarHBondContact O-N 2.96Å
497	F	25.6	Very low	30.6	Very low	191 Å²	191	143.1 Å²	143.1	84%	0.838	73%	0.731	S	S	*	*			trans	-62.1	160.7	166.7	-83.1	-101.6	0	0	0	112.1
498	S	26.7	Very low	30.2	Very low	114 Å²	114	148.7 Å²	148.7	80%	0.797	74%	0.741	S	S	*	*			trans	81.6	133.4	168.5	79.6	0	0	0	0	115.8
499	E	25.9	Very low	30.2	Very low	174 Å²	174	153.7 Å²	153.7	81%	0.813	76%	0.759	S	S	*	*			cis	-163.2	163.8	3.3	-120.9	-175.5	153.3	0	0	107.6
500	P	29.5	Very low	30.3	Very low	116 Å²	116	161.4 Å²	161.4	75%	0.753	79%	0.79	S	S	*	*			trans	-92.8	128.2	-159.8	34.9	-32.1	0	0	0	114.3	R502	P500-R502 PolarHBondContact O-N 3.34Å
501	Y	26.9	Very low	30.6	Very low	232 Å²	232	164.6 Å²	164.6	91%	0.91	80%	0.796	S	S	*	*			trans	-80.6	116.9	169.3	-86.1	-89.6	0	0	0	112.1	V503	Y501-V503 PolarHBondContact O-N 2.87Å
502	R	23	Very low	31.2	Very low	243 Å²	243	163.2 Å²	163.2	92%	0.917	79%	0.786	S	S	*	*			trans	-74.5	98.1	176.9	-175	-179.4	-172.3	165.7	1.5	110.7	P500	P500-R502 PolarHBondContact O-N 3.34Å
503	V	31.6	Very low	32.1	Very low	133 Å²	133	163.5 Å²	163.5	81%	0.806	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-97.3	126.1	173.1	-177.4	0	0	0	0	110.7	Y501	Y501-V503 PolarHBondContact O-N 2.87Å
504	Q	26.4	Very low	33.3	Very low	185 Å²	185	161.5 Å²	161.5	86%	0.864	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-68.7	135.5	-173.7	-66.7	-173.7	2.2	0	0	112.9
505	R	27	Very low	34.2	Very low	245 Å²	245	158.5 Å²	158.5	93%	0.925	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-74.2	125.7	-179.7	-62.8	176.3	176.4	-177.3	-2.4	111.1
506	K	32.7	Very low	35.5	Very low	200 Å²	200	157.5 Å²	157.5	87%	0.87	75%	0.748	S	S	*	*			trans	-115.7	134.9	156.5	-89.1	-176.5	177.7	176.2	0	109.5	R508	K506-R508 PolarHBondContact O-N 2.96Å
507	P	33.4	Very low	36.8	Very low	130 Å²	130	151.6 Å²	151.6	84%	0.844	73%	0.728	S	S	*	*			trans	-87	105.2	-169.6	33.7	-30.2	0	0	0	109.7
508	R	36.5	Very low	38.5	Very low	218 Å²	218	147.6 Å²	147.6	82%	0.823	71%	0.712	S	S	*	*			trans	-130.7	118.7	164.5	-79.8	-172.2	170.4	178.3	-2.3	109.5	K506	K506-R508 PolarHBondContact O-N 2.96Å
509	K	42.5	Very low	39.9	Very low	153 Å²	153	144.5 Å²	144.5	67%	0.665	69%	0.693	S	S	*	*			trans	64.7	84	154.1	-54.9	-177.7	179.8	-174.6	0	116.2	L511 T512	K509-L511 PolarHBondContact O-N 3.37Å; K509-T512 PolarHBondContact O-N 3.01Å; K509-T512 VanDerWaalsContact O-N 3.14Å
510	K	44	Very low	41.8	Very low	188 Å²	188	141.8 Å²	141.8	82%	0.817	68%	0.684	S	S	*	*	H	α-helix	trans	-49.3	-29.2	168.9	-85.6	-177	173.6	-177.8	0	114	V514	K510-V514 WeakPolarHBondContact O-CG2 3.31Å; K510-V514 PolarHBondContact O-N 3.41Å
511	L	40.3	Very low	43.7	Very low	142 Å²	142	142.8 Å²	142.8	74%	0.743	68%	0.679	S	S	*	*	H	α-helix	trans	-74.8	-33	-178.1	-156.8	70.9	0	0	0	113.3	K509	K509-L511 PolarHBondContact O-N 3.37Å
512	T	43.2	Very low	45.5	Very low	66 Å²	66	135.4 Å²	135.4	41%	0.405	65%	0.654	S	S	.	*	H	α-helix	trans	-72.3	-35	177.8	-42.7	0	0	0	0	111	K509 V514 L515 E516	K509-T512 PolarHBondContact O-N 3.01Å; K509-T512 VanDerWaalsContact O-N 3.14Å; T512-V514 VanDerWaalsContact C-N 3.32Å; T512-V514 PolarHBondContact O-N 3.21Å; T512-L515 PolarHBondContact O-N 3.05Å; T512-E516 WeakPolarHBondContact O-CB 3.49Å; T512-E516 WeakPolarHBondContact O-CG 3.24Å; T512-E516 PolarHBondContact O-N 3.01Å
513	I	49.1	Very low	47.3	Very low	102 Å²	102	126.9 Å²	126.9	52%	0.523	63%	0.626	S	S	.	*	H	α-helix	trans	-66.2	-33.9	179.2	-58.8	172	0	0	0	111.6	A517	I513-A517 WeakPolarHBondContact O-CB 3.36Å; I513-A517 PolarHBondContact O-N 2.86Å
514	V	50.7	Low	48.9	Very low	78 Å²	78	123.3 Å²	123.3	47%	0.473	61%	0.611	S	S	.	*	H	α-helix	trans	-69.2	-47	178.2	178.6	0	0	0	0	110.8	K510 T512 E516 A517 E518	K510-V514 WeakPolarHBondContact O-CG2 3.31Å; K510-V514 PolarHBondContact O-N 3.41Å; T512-V514 VanDerWaalsContact C-N 3.32Å; T512-V514 PolarHBondContact O-N 3.21Å; V514-E516 PolarHBondContact O-N 3.5Å; V514-A517 PolarHBondContact O-N 3.18Å; V514-E518 WeakPolarHBondContact O-CG 3.44Å; V514-E518 PolarHBondContact O-N 3.1Å
515	L	48.5	Very low	50.9	Low	111 Å²	111	118.2 Å²	118.2	58%	0.581	59%	0.592	S	S	*	*	H	α-helix	trans	-64.9	-39.1	178.1	-69.6	172.4	0	0	0	112.2	T512 A519	T512-L515 PolarHBondContact O-N 3.05Å; L515-A519 WeakPolarHBondContact O-CB 3.4Å; L515-A519 PolarHBondContact O-N 3.35Å
516	E	52.2	Low	52.4	Low	116 Å²	116	109.1 Å²	109.1	54%	0.542	56%	0.561	S	S	.	*	H	α-helix	trans	-65.5	-40.4	174	-77.7	177.4	174.4	0	0	111.9	T512 V514 A519 L520	T512-E516 WeakPolarHBondContact O-CB 3.49Å; T512-E516 WeakPolarHBondContact O-CG 3.24Å; T512-E516 PolarHBondContact O-N 3.01Å; V514-E516 PolarHBondContact O-N 3.5Å; E516-A519 PolarHBondContact O-N 3.1Å; E516-L520 WeakPolarHBondContact O-CB 3.34Å; E516-L520 VanDerWaalsContact O-CG 3.27Å; E516-L520 WeakPolarHBondContact O-CG 3.4Å; E516-L520 PolarHBondContact O-N 3.39Å
517	A	58	Low	53.7	Low	47 Å²	47	106.2 Å²	106.2	39%	0.388	55%	0.545	S	S	.	.	H	α-helix	trans	-65	-43.3	176.7	0	0	0	0	0	111.7	I513 V514 L520 Q521	I513-A517 WeakPolarHBondContact O-CB 3.36Å; I513-A517 PolarHBondContact O-N 2.86Å; V514-A517 PolarHBondContact O-N 3.18Å; A517-L520 PolarHBondContact O-N 3.25Å; A517-Q521 VanDerWaalsContact O-CB 3.31Å; A517-Q521 WeakPolarHBondContact O-CB 3.49Å; A517-Q521 PolarHBondContact O-N 3.22Å
518	E	60.2	Low	55.3	Low	107 Å²	107	108.6 Å²	108.6	50%	0.5	54%	0.537	S	S	.	.	H	α-helix	trans	-63.2	-44.6	175.6	-75.9	178.3	169.1	0	0	111.6	V514 L520 Q521 I522	V514-E518 WeakPolarHBondContact O-CG 3.44Å; V514-E518 PolarHBondContact O-N 3.1Å; E518-L520 PolarHBondContact O-N 2.77Å; E518-Q521 PolarHBondContact O-N 3.02Å; E518-I522 VanDerWaalsContact O-CG1 3.3Å; E518-I522 WeakPolarHBondContact O-CG1 3.5Å; E518-I522 PolarHBondContact O-N 3.47Å
519	A	57.2	Low	56.2	Low	48 Å²	48	104.1 Å²	104.1	40%	0.397	53%	0.525	S	S	.	.	H	α-helix	trans	-61.4	-43.9	176.2	0	0	0	0	0	112.1	L515 E516 Q521 I522 L523	L515-A519 WeakPolarHBondContact O-CB 3.4Å; L515-A519 PolarHBondContact O-N 3.35Å; E516-A519 PolarHBondContact O-N 3.1Å; A519-Q521 VanDerWaalsContact C-N 3.3Å; A519-Q521 PolarHBondContact O-N 3.04Å; A519-I522 PolarHBondContact O-N 3.19Å; A519-L523 WeakPolarHBondContact O-CB 3.41Å; A519-L523 WeakPolarHBondContact O-CG 3.49Å; A519-L523 PolarHBondContact O-N 3.27Å
520	L	64.6	Low	56.7	Low	117 Å²	117	99.6 Å²	99.6	61%	0.613	51%	0.51	S	S	*	.	H	α-helix	trans	-64.1	-35.7	175.6	-75.5	171.3	0	0	0	112.1	E516 A517 E518 A524	E516-L520 WeakPolarHBondContact O-CB 3.34Å; E516-L520 VanDerWaalsContact O-CG 3.27Å; E516-L520 WeakPolarHBondContact O-CG 3.4Å; E516-L520 PolarHBondContact O-N 3.39Å; A517-L520 PolarHBondContact O-N 3.25Å; E518-L520 PolarHBondContact O-N 2.77Å; L520-A524 WeakPolarHBondContact O-CB 3.29Å; L520-A524 PolarHBondContact O-N 2.85Å
521	Q	69.8	Low	57.1	Low	138 Å²	138	95.4 Å²	95.4	65%	0.645	49%	0.49	S	S	*	.	H	α-helix	trans	-71.9	-39.8	178.8	-160.1	143	11	0	0	111.7	A517 E518 A519 A524 V525	A517-Q521 VanDerWaalsContact O-CB 3.31Å; A517-Q521 WeakPolarHBondContact O-CB 3.49Å; A517-Q521 PolarHBondContact O-N 3.22Å; E518-Q521 PolarHBondContact O-N 3.02Å; A519-Q521 VanDerWaalsContact C-N 3.3Å; A519-Q521 PolarHBondContact O-N 3.04Å; Q521-A524 PolarHBondContact O-N 3.06Å; Q521-V525 WeakPolarHBondContact O-CG2 3.01Å; Q521-V525 PolarHBondContact O-N 3.07Å
522	I	63.8	Low	57.5	Low	77 Å²	77	93.5 Å²	93.5	40%	0.395	48%	0.478	S	S	.	.	H	α-helix	trans	-62	-47.2	171.5	-67.9	165.4	0	0	0	110.3	E518 A519 A524 V525 I526	E518-I522 VanDerWaalsContact O-CG1 3.3Å; E518-I522 WeakPolarHBondContact O-CG1 3.5Å; E518-I522 PolarHBondContact O-N 3.47Å; A519-I522 PolarHBondContact O-N 3.19Å; I522-A524 VanDerWaalsContact C-N 3.31Å; I522-A524 PolarHBondContact O-N 2.93Å; I522-V525 PolarHBondContact O-N 3.37Å; I522-V525 VanDerWaalsContact O-N 3.15Å; I522-I526 HydrophobicContact CG2-CD1 3.79Å; I522-I526 HydrophobicContact CG2-CG1 4.39Å; I522-I526 WeakPolarHBondContact O-CG1 3.39Å; I522-I526 PolarHBondContact O-N 3.01Å
523	L	61	Low	57.7	Low	63 Å²	63	94.1 Å²	94.1	33%	0.33	49%	0.485	S	S	.	.	H	α-helix	trans	-59.3	-40.8	176	-78.2	166.3	0	0	0	112	E207 A519 I526 R527	E207-L523 HydrophobicContact CB-CD2 4.21Å; E207-L523 HydrophobicContact CG-CD2 4.12Å; A519-L523 WeakPolarHBondContact O-CB 3.41Å; A519-L523 WeakPolarHBondContact O-CG 3.49Å; A519-L523 PolarHBondContact O-N 3.27Å; L523-I526 PolarHBondContact O-N 3.13Å; L523-R527 VanDerWaalsContact O-CB 3.26Å; L523-R527 WeakPolarHBondContact O-CB 3.34Å; L523-R527 PolarHBondContact O-N 3.41Å
524	A	66	Low	57.5	Low	58 Å²	58	91.7 Å²	91.7	48%	0.479	47%	0.472	S	S	.	.	H	α-helix	trans	-64.4	-39.7	175.9	0	0	0	0	0	112.3	L520 Q521 I522 R528	L520-A524 WeakPolarHBondContact O-CB 3.29Å; L520-A524 PolarHBondContact O-N 2.85Å; Q521-A524 PolarHBondContact O-N 3.06Å; I522-A524 VanDerWaalsContact C-N 3.31Å; I522-A524 PolarHBondContact O-N 2.93Å; A524-R528 VanDerWaalsContact O-CB 3.31Å; A524-R528 WeakPolarHBondContact O-CB 3.43Å; A524-R528 PolarHBondContact O-N 3.34Å
525	V	68	Low	57.2	Low	78 Å²	78	92 Å²	92	47%	0.473	47%	0.47	S	S	.	.	H	α-helix	trans	-65.6	-47	175.6	171.1	0	0	0	0	111	Q521 I522 R527 R528 Q529	Q521-V525 WeakPolarHBondContact O-CG2 3.01Å; Q521-V525 PolarHBondContact O-N 3.07Å; I522-V525 PolarHBondContact O-N 3.37Å; I522-V525 VanDerWaalsContact O-N 3.15Å; V525-R527 VanDerWaalsContact C-N 3.35Å; V525-R527 PolarHBondContact O-N 3.29Å; V525-R528 PolarHBondContact O-N 3.49Å; V525-Q529 HydrophobicContact CG1-CG 4.47Å; V525-Q529 PolarHBondContact O-N 2.87Å
526	I	58.3	Low	57.1	Low	54 Å²	54	91.5 Å²	91.5	28%	0.277	47%	0.468	S	S	.	.	H	α-helix	trans	-59	-49.1	176.8	-67.5	169	0	0	0	109.7	I522 L523 R528 Q529 V530	I522-I526 HydrophobicContact CG2-CD1 3.79Å; I522-I526 HydrophobicContact CG2-CG1 4.39Å; I522-I526 WeakPolarHBondContact O-CG1 3.39Å; I522-I526 PolarHBondContact O-N 3.01Å; L523-I526 PolarHBondContact O-N 3.13Å; I526-R528 VanDerWaalsContact C-N 3.28Å; I526-R528 PolarHBondContact O-N 3.41Å; I526-Q529 PolarHBondContact O-N 3.29Å; I526-V530 HydrophobicContact CG2-CG2 4.33Å; I526-V530 WeakPolarHBondContact O-CB 3.25Å; I526-V530 VanDerWaalsContact O-CG2 3.29Å; I526-V530 WeakPolarHBondContact O-CG2 3.27Å; I526-V530 PolarHBondContact O-N 3.02Å
527	R	61.3	Low	56.6	Low	139 Å²	139	90 Å²	90	53%	0.525	46%	0.461	S	S	.	.	H	α-helix	trans	-57.4	-42.8	177.7	-168.1	175.2	-171.7	175.8	4.6	111.3	L523 V525 V530 Y531	L523-R527 VanDerWaalsContact O-CB 3.26Å; L523-R527 WeakPolarHBondContact O-CB 3.34Å; L523-R527 PolarHBondContact O-N 3.41Å; V525-R527 VanDerWaalsContact C-N 3.35Å; V525-R527 PolarHBondContact O-N 3.29Å; R527-V530 PolarHBondContact O-N 3.04Å; R527-Y531 HydrophobicContact CG-CD2 4.09Å; R527-Y531 HydrophobicContact CG-CE2 4.25Å; R527-Y531 WeakPolarHBondContact O-CB 3.48Å; R527-Y531 WeakPolarHBondContact O-CD2 3.4Å; R527-Y531 PolarHBondContact O-N 3.06Å
528	R	66.2	Low	55.7	Low	181 Å²	181	92 Å²	92	68%	0.683	46%	0.462	S	S	*	.	H	α-helix	trans	-68.4	-40.7	179.1	-156.4	178.5	-157.9	180	4.9	112.6	A524 V525 I526 Y531 Q532	A524-R528 VanDerWaalsContact O-CB 3.31Å; A524-R528 WeakPolarHBondContact O-CB 3.43Å; A524-R528 PolarHBondContact O-N 3.34Å; V525-R528 PolarHBondContact O-N 3.49Å; I526-R528 VanDerWaalsContact C-N 3.28Å; I526-R528 PolarHBondContact O-N 3.41Å; R528-Y531 PolarHBondContact O-N 3.42Å; R528-Q532 WeakPolarHBondContact O-CB 3.5Å; R528-Q532 PolarHBondContact O-N 2.93Å
529	Q	56.1	Low	54.8	Low	124 Å²	124	90.6 Å²	90.6	58%	0.579	46%	0.461	S	S	*	.	H	α-helix	trans	-65	-42.1	175.4	-78.7	-175.4	-26.4	0	0	111.7	V525 I526 Q532 S533	V525-Q529 HydrophobicContact CG1-CG 4.47Å; V525-Q529 PolarHBondContact O-N 2.87Å; I526-Q529 PolarHBondContact O-N 3.29Å; Q529-Q532 PolarHBondContact O-N 3.3Å; Q529-S533 WeakPolarHBondContact O-CB 3.4Å; Q529-S533 PolarHBondContact O-N 3.4Å
530	V	52.4	Low	53.9	Low	58 Å²	58	94 Å²	94	35%	0.352	47%	0.467	S	S	.	.	H	α-helix	trans	-61.3	-47.3	174.1	171.8	0	0	0	0	110.1	I526 R527 Q532 S533 I534	I526-V530 HydrophobicContact CG2-CG2 4.33Å; I526-V530 WeakPolarHBondContact O-CB 3.25Å; I526-V530 VanDerWaalsContact O-CG2 3.29Å; I526-V530 WeakPolarHBondContact O-CG2 3.27Å; I526-V530 PolarHBondContact O-N 3.02Å; R527-V530 PolarHBondContact O-N 3.04Å; V530-Q532 PolarHBondContact O-N 3.3Å; V530-S533 PolarHBondContact O-N 3.37Å; V530-I534 HydrophobicContact CG1-CD1 3.93Å; V530-I534 WeakPolarHBondContact O-CD1 3.37Å; V530-I534 VanDerWaalsContact O-CG1 3.25Å; V530-I534 WeakPolarHBondContact O-CG1 3.34Å; V530-I534 PolarHBondContact O-N 2.95Å
531	Y	51.6	Low	52.4	Low	99 Å²	99	93.2 Å²	93.2	39%	0.388	46%	0.463	S	S	.	.	H	α-helix	trans	-60.1	-44.4	175.2	-99.2	-79.2	0	0	0	112.9	R527 R528 I534 I535	R527-Y531 HydrophobicContact CG-CD2 4.09Å; R527-Y531 HydrophobicContact CG-CE2 4.25Å; R527-Y531 WeakPolarHBondContact O-CB 3.48Å; R527-Y531 WeakPolarHBondContact O-CD2 3.4Å; R527-Y531 PolarHBondContact O-N 3.06Å; R528-Y531 PolarHBondContact O-N 3.42Å; Y531-I534 PolarHBondContact O-N 3.04Å; Y531-I535 VanDerWaalsContact O-CG1 3.29Å; Y531-I535 WeakPolarHBondContact O-CG1 3.35Å; Y531-I535 PolarHBondContact O-N 3.08Å
532	Q	50.4	Low	50.9	Low	103 Å²	103	90.2 Å²	90.2	48%	0.481	45%	0.454	S	S	.	.	H	α-helix	trans	-66.8	-35.8	178.3	-87.2	171.3	-36.7	0	0	112.6	R528 Q529 V530 I534 I535 N536	R528-Q532 WeakPolarHBondContact O-CB 3.5Å; R528-Q532 PolarHBondContact O-N 2.93Å; Q529-Q532 PolarHBondContact O-N 3.3Å; V530-Q532 PolarHBondContact O-N 3.3Å; Q532-I534 VanDerWaalsContact C-N 3.27Å; Q532-I534 PolarHBondContact O-N 3.33Å; Q532-I535 PolarHBondContact O-N 2.95Å; Q532-N536 VanDerWaalsContact O-CB 3.24Å; Q532-N536 WeakPolarHBondContact O-CB 3.42Å; Q532-N536 VanDerWaalsContact O-CG 3.28Å; Q532-N536 PolarHBondContact O-N 3.42Å
533	S	45.9	Very low	49.5	Very low	79 Å²	79	93.8 Å²	93.8	55%	0.552	47%	0.467	S	S	*	.	H	α-helix	trans	-65.3	-33.6	173.4	-166	0	0	0	0	111.7	Q529 V530	Q529-S533 WeakPolarHBondContact O-CB 3.4Å; Q529-S533 PolarHBondContact O-N 3.4Å; V530-S533 PolarHBondContact O-N 3.37Å
534	I	45	Very low	48.1	Very low	51 Å²	51	98.4 Å²	98.4	26%	0.262	49%	0.485	S	S	.	.	H	α-helix	trans	-71.5	-48.4	174.8	-65.3	163.9	0	0	0	110.3	V488 V530 Y531 Q532 N536 E537 E538	V488-I534 HydrophobicContact CG2-CG2 4.3Å; V530-I534 HydrophobicContact CG1-CD1 3.93Å; V530-I534 WeakPolarHBondContact O-CD1 3.37Å; V530-I534 VanDerWaalsContact O-CG1 3.25Å; V530-I534 WeakPolarHBondContact O-CG1 3.34Å; V530-I534 PolarHBondContact O-N 2.95Å; Y531-I534 PolarHBondContact O-N 3.04Å; Q532-I534 VanDerWaalsContact C-N 3.27Å; Q532-I534 PolarHBondContact O-N 3.33Å; I534-N536 PolarHBondContact O-N 3.19Å; I534-E537 PolarHBondContact O-N 3.02Å; I534-E538 PolarHBondContact O-N 3.43Å
535	I	45.5	Very low	46.8	Very low	83 Å²	83	99.3 Å²	99.3	43%	0.426	48%	0.484	S	S	.	.	H	α-helix	trans	-65.1	-40.8	-178.4	-66.8	165.2	0	0	0	112.1	Y531 Q532 E537 E538 T539	Y531-I535 VanDerWaalsContact O-CG1 3.29Å; Y531-I535 WeakPolarHBondContact O-CG1 3.35Å; Y531-I535 PolarHBondContact O-N 3.08Å; Q532-I535 PolarHBondContact O-N 2.95Å; I535-E537 PolarHBondContact O-N 2.98Å; I535-E538 PolarHBondContact O-N 3.35Å; I535-T539 PolarHBondContact O-N 3.49Å; I535-T539 PolarHBondContact O-OG1 2.99Å
536	N	46.2	Very low	45.4	Very low	102 Å²	102	101.7 Å²	101.7	55%	0.545	49%	0.49	S	S	.	.	H	α-helix	trans	-66.5	-27.2	178.8	-77.8	-12.7	0	0	0	112.4	Q532 I534 T539	Q532-N536 VanDerWaalsContact O-CB 3.24Å; Q532-N536 WeakPolarHBondContact O-CB 3.42Å; Q532-N536 VanDerWaalsContact O-CG 3.28Å; Q532-N536 PolarHBondContact O-N 3.42Å; I534-N536 PolarHBondContact O-N 3.19Å; N536-T539 WeakPolarHBondContact CA-OG1 3.49Å; N536-T539 PolarHBondContact O-OG1 3.21Å
537	E	41.2	Very low	44.5	Very low	85 Å²	85	101.5 Å²	101.5	40%	0.397	50%	0.497	S	S	.	.	H	α-helix	trans	-84.2	-33.1	173.2	-73.1	-63.5	145.8	0	0	111.7	I534 I535 T539 K540 L541	I534-E537 PolarHBondContact O-N 3.02Å; I535-E537 PolarHBondContact O-N 2.98Å; E537-T539 VanDerWaalsContact C-N 3.34Å; E537-T539 PolarHBondContact O-N 2.78Å; E537-K540 WeakPolarHBondContact O-CB 3.38Å; E537-K540 PolarHBondContact O-N 3.43Å; E537-K540 IonicContact OE1-NZ 2.71Å; E537-K540 PolarHBondContact OE1-NZ 3.28Å; E537-K540 IonicContact OE2-NZ 3.51Å; E537-L541 PolarHBondContact O-N 2.87Å; E537-L541 VanDerWaalsContact O-N 3.07Å
538	E	38.9	Very low	43.3	Very low	87 Å²	87	102.2 Å²	102.2	41%	0.407	50%	0.504	S	S	.	.	H	α-helix	trans	-60.3	-41.7	169	-83.4	-173.9	158.5	0	0	112.1	I534 I535 K540 L541 T542	I534-E538 PolarHBondContact O-N 3.43Å; I535-E538 PolarHBondContact O-N 3.35Å; E538-K540 VanDerWaalsContact C-N 3.29Å; E538-K540 PolarHBondContact O-N 3.07Å; E538-L541 CarbonylContact O-C 3.06Å; E538-L541 PolarHBondContact O-N 2.89Å; E538-T542 PolarHBondContact O-N 3.25Å; E538-T542 PolarHBondContact O-OG1 3.43Å
539	T	41.9	Very low	42.1	Very low	79 Å²	79	99.1 Å²	99.1	49%	0.485	50%	0.501	S	S	.	.	H	α-helix	trans	-65.6	-31.4	177.6	21.4	0	0	0	0	112.6	I535 N536 E537 T542 F543	I535-T539 PolarHBondContact O-N 3.49Å; I535-T539 PolarHBondContact O-OG1 2.99Å; N536-T539 WeakPolarHBondContact CA-OG1 3.49Å; N536-T539 PolarHBondContact O-OG1 3.21Å; E537-T539 VanDerWaalsContact C-N 3.34Å; E537-T539 PolarHBondContact O-N 2.78Å; T539-T542 WeakPolarHBondContact CA-OG1 3.5Å; T539-T542 PolarHBondContact O-OG1 3.04Å; T539-F543 WeakPolarHBondContact O-CB 3.45Å; T539-F543 PolarHBondContact O-N 2.99Å
540	K	37.5	Very low	41.5	Very low	118 Å²	118	100.4 Å²	100.4	51%	0.513	51%	0.507	S	S	.	.	H	α-helix	trans	-67	-39.3	170.2	-75.5	179.6	-174.1	166.4	0	111.5	E537 E538 F543 F544	E537-K540 WeakPolarHBondContact O-CB 3.38Å; E537-K540 PolarHBondContact O-N 3.43Å; E537-K540 IonicContact OE1-NZ 2.71Å; E537-K540 PolarHBondContact OE1-NZ 3.28Å; E537-K540 IonicContact OE2-NZ 3.51Å; E538-K540 VanDerWaalsContact C-N 3.29Å; E538-K540 PolarHBondContact O-N 3.07Å; K540-F543 WeakPolarHBondContact O-CB 3.33Å; K540-F543 PolarHBondContact O-N 3.29Å; K540-F544 WeakPolarHBondContact O-CD2 3.1Å; K540-F544 PolarHBondContact O-N 3.02Å
541	L	33.4	Very low	40.8	Very low	102 Å²	102	105.5 Å²	105.5	53%	0.534	53%	0.525	S	S	.	.	H	α-helix	trans	-70.2	-41.4	179.1	-99.4	145.1	0	0	0	112.6	E537 E538 F543 F544 T545	E537-L541 PolarHBondContact O-N 2.87Å; E537-L541 VanDerWaalsContact O-N 3.07Å; E538-L541 CarbonylContact O-C 3.06Å; E538-L541 PolarHBondContact O-N 2.89Å; L541-F543 VanDerWaalsContact C-N 3.25Å; L541-F543 PolarHBondContact O-N 2.89Å; L541-F544 PolarHBondContact O-N 3.21Å; L541-F544 VanDerWaalsContact O-N 3.08Å; L541-T545 PolarHBondContact O-N 3.01Å; L541-T545 PolarHBondContact O-OG1 3.27Å
542	T	37.8	Very low	40.3	Very low	74 Å²	74	105.1 Å²	105.1	45%	0.454	54%	0.535	S	S	.	.	H	α-helix	trans	-58.9	-41.2	173.3	50.7	0	0	0	0	110.9	E538 T539 F544 T545 E546	E538-T542 PolarHBondContact O-N 3.25Å; E538-T542 PolarHBondContact O-OG1 3.43Å; T539-T542 WeakPolarHBondContact CA-OG1 3.5Å; T539-T542 PolarHBondContact O-OG1 3.04Å; T542-F544 VanDerWaalsContact C-N 3.33Å; T542-F544 PolarHBondContact O-N 3.24Å; T542-T545 WeakPolarHBondContact CA-OG1 3.33Å; T542-T545 PolarHBondContact O-N 3.09Å; T542-T545 PolarHBondContact O-OG1 2.91Å; T542-T545 VanDerWaalsContact O-OG1 3.05Å; T542-E546 PolarHBondContact O-N 3.05Å
543	F	34.3	Very low	39.9	Very low	153 Å²	153	104.4 Å²	104.4	67%	0.671	54%	0.542	S	S	*	.	H	α-helix	trans	-62.9	-37.7	175.5	-147.3	-89.3	0	0	0	112.4	T539 K540 L541 A547	T539-F543 WeakPolarHBondContact O-CB 3.45Å; T539-F543 PolarHBondContact O-N 2.99Å; K540-F543 WeakPolarHBondContact O-CB 3.33Å; K540-F543 PolarHBondContact O-N 3.29Å; L541-F543 VanDerWaalsContact C-N 3.25Å; L541-F543 PolarHBondContact O-N 2.89Å; F543-A547 WeakPolarHBondContact O-CB 3.46Å; F543-A547 PolarHBondContact O-N 3.47Å
544	F	31.6	Very low	39.5	Very low	159 Å²	159	104.9 Å²	104.9	70%	0.697	55%	0.545	S	S	*	.	H	α-helix	trans	-71.1	-36.8	175.4	-98.1	-79.9	0	0	0	113.3	K540 L541 T542 K548	K540-F544 WeakPolarHBondContact O-CD2 3.1Å; K540-F544 PolarHBondContact O-N 3.02Å; L541-F544 PolarHBondContact O-N 3.21Å; L541-F544 VanDerWaalsContact O-N 3.08Å; T542-F544 VanDerWaalsContact C-N 3.33Å; T542-F544 PolarHBondContact O-N 3.24Å; F544-K548 PolarHBondContact O-N 3.35Å
545	T	40	Very low	39.1	Very low	77 Å²	77	107.9 Å²	107.9	47%	0.472	57%	0.566	S	S	.	*	H	α-helix	trans	-71	-37.4	174.5	26.5	0	0	0	0	112.8	L541 T542 K548 N549	L541-T545 PolarHBondContact O-N 3.01Å; L541-T545 PolarHBondContact O-OG1 3.27Å; T542-T545 WeakPolarHBondContact CA-OG1 3.33Å; T542-T545 PolarHBondContact O-N 3.09Å; T542-T545 PolarHBondContact O-OG1 2.91Å; T542-T545 VanDerWaalsContact O-OG1 3.05Å; T545-K548 PolarHBondContact O-N 3.01Å; T545-N549 PolarHBondContact O-N 3.26Å
546	E	39.1	Very low	38.5	Very low	128 Å²	128	109 Å²	109	60%	0.598	58%	0.581	S	S	*	*	H	α-helix	trans	-65	-43.6	173.4	-77.1	-179.5	164.6	0	0	111	T542 K548 N549 E550	T542-E546 PolarHBondContact O-N 3.05Å; E546-K548 VanDerWaalsContact C-N 3.26Å; E546-K548 PolarHBondContact O-N 3.12Å; E546-N549 PolarHBondContact O-N 3.49Å; E546-N549 VanDerWaalsContact O-N 3.12Å; E546-E550 PolarHBondContact O-N 3.18Å
547	A	37.3	Very low	37.7	Very low	50 Å²	50	110.2 Å²	110.2	41%	0.413	59%	0.592	S	S	.	*	H	α-helix	trans	-60.3	-34.5	174.3	0	0	0	0	0	112.8	F543 F551	F543-A547 WeakPolarHBondContact O-CB 3.46Å; F543-A547 PolarHBondContact O-N 3.47Å; A547-F551 PolarHBondContact O-N 3.37Å
548	K	36.6	Very low	37.6	Very low	154 Å²	154	115.8 Å²	115.8	67%	0.67	64%	0.636	S	S	*	*	H	α-helix	trans	-70.7	-38.4	175.1	-119.2	179.7	179.9	177.9	0	112.5	F544 T545 E546 F551 C552	F544-K548 PolarHBondContact O-N 3.35Å; T545-K548 PolarHBondContact O-N 3.01Å; E546-K548 VanDerWaalsContact C-N 3.26Å; E546-K548 PolarHBondContact O-N 3.12Å; K548-F551 PolarHBondContact O-N 3.13Å; K548-C552 PolarHBondContact O-N 3.33Å; K548-C552 VanDerWaalsContact O-N 3.13Å
549	N	41.5	Very low	37.5	Very low	116 Å²	116	117.3 Å²	117.3	62%	0.62	65%	0.648	S	S	*	*	H	α-helix	trans	-73.1	-33.4	178.8	-80.2	-12.2	0	0	0	112.6	T545 E546 F551 C552 S553	T545-N549 PolarHBondContact O-N 3.26Å; E546-N549 PolarHBondContact O-N 3.49Å; E546-N549 VanDerWaalsContact O-N 3.12Å; N549-F551 VanDerWaalsContact C-N 3.29Å; N549-F551 PolarHBondContact O-N 3.47Å; N549-C552 PolarHBondContact O-N 3.32Å; N549-S553 PolarHBondContact O-N 3.2Å; N549-S553 VanDerWaalsContact O-N 3.08Å; N549-S553 PolarHBondContact O-OG 2.94Å; N549-S553 VanDerWaalsContact O-OG 3.13Å
550	E	43.1	Very low	37.3	Very low	152 Å²	152	119.3 Å²	119.3	71%	0.71	66%	0.656	S	S	*	*	H	α-helix	trans	-65.7	-32.4	170.2	-77.9	-169.1	158.5	0	0	112.4	E546 S553	E546-E550 PolarHBondContact O-N 3.18Å; E550-S553 PolarHBondContact O-OG 3.2Å
551	F	37.4	Very low	37.3	Very low	165 Å²	165	119.3 Å²	119.3	72%	0.724	66%	0.664	S	S	*	*	H	α-helix	trans	-69.6	-38.1	174.3	-134.1	-91.1	0	0	0	111.9	A547 K548 N549 S554	A547-F551 PolarHBondContact O-N 3.37Å; K548-F551 PolarHBondContact O-N 3.13Å; N549-F551 VanDerWaalsContact C-N 3.29Å; N549-F551 PolarHBondContact O-N 3.47Å; F551-S554 PolarHBondContact O-OG 3.13Å
552	C	42.3	Very low	37.5	Very low	90 Å²	90	120.4 Å²	120.4	61%	0.608	67%	0.672	S	S	*	*	H	α-helix	trans	-75.2	-23.7	179.7	-73.8	0	0	0	0	114.4	K548 N549 S554 T555	K548-C552 PolarHBondContact O-N 3.33Å; K548-C552 VanDerWaalsContact O-N 3.13Å; N549-C552 PolarHBondContact O-N 3.32Å; C552-S554 VanDerWaalsContact C-N 3.29Å; C552-S554 PolarHBondContact O-N 2.92Å; C552-T555 PolarHBondContact O-OG1 3.08Å
553	S	41.5	Very low	37.5	Very low	89 Å²	89	123.3 Å²	123.3	62%	0.622	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	-7.9	176.4	50	0	0	0	0	114	N549 E550	N549-S553 PolarHBondContact O-N 3.2Å; N549-S553 VanDerWaalsContact O-N 3.08Å; N549-S553 PolarHBondContact O-OG 2.94Å; N549-S553 VanDerWaalsContact O-OG 3.13Å; E550-S553 PolarHBondContact O-OG 3.2Å
554	S	38.7	Very low	37.7	Very low	89 Å²	89	121.3 Å²	121.3	62%	0.622	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-5.2	176.7	71.1	0	0	0	0	115	F551 C552	F551-S554 PolarHBondContact O-OG 3.13Å; C552-S554 VanDerWaalsContact C-N 3.29Å; C552-S554 PolarHBondContact O-N 2.92Å
555	T	36.3	Very low	38.1	Very low	113 Å²	113	118.6 Å²	118.6	69%	0.693	69%	0.686	S	S	*	*			trans	-109.6	69.7	177.1	51.5	0	0	0	0	111	C552	C552-T555 PolarHBondContact O-OG1 3.08Å
556	S	32.2	Very low	38	Very low	106 Å²	106	121.8 Å²	121.8	74%	0.741	70%	0.702	S	S	*	*			trans	-111.9	79.1	162.8	72.9	0	0	0	0	109.6
557	T	29.8	Very low	37.9	Very low	128 Å²	128	121.3 Å²	121.3	79%	0.785	71%	0.711	S	S	*	*			trans	-142.6	123.8	162.7	39.4	0	0	0	0	107.5
558	P	38	Very low	37.9	Very low	203 Å²	203	127.7 Å²	127.7	100%	1.318	74%	0.738	S	S	*	*				-116.4	0	97	33	-28.5	0	0	0	113.8

Retrieved 558 of 558 residues in 181 ms (Link to these results)

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