A0A096MHH2_POEFO Loading...

Tryptophan 5-hydroxylase 2

AlphaFold DB , UniProt , Accession A0A096MHH2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 504 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	32	Very low	28.3	Very low	242 Å²	242	143.3 Å²	143.3	100%	1.192	86%	0.86	S	S	*	*				0	87.7	0	-72.7	178.4	168.7	0	0	106.5
2	A	26.1	Very low	28.2	Very low	105 Å²	105	142.2 Å²	142.2	87%	0.868	86%	0.859	S	S	*	*				84.4	128.6	101	0	0	0	0	0	110.7
3	S	25.4	Very low	28.1	Very low	125 Å²	125	145.1 Å²	145.1	87%	0.874	86%	0.858	S	S	*	*			cis	-156.5	158.6	15	-160.8	0	0	0	0	110.9
4	A	26.4	Very low	27.8	Very low	77 Å²	77	143.1 Å²	143.1	64%	0.636	85%	0.851	S	S	*	*			trans	-72.7	143.6	-172.9	0	0	0	0	0	114.6	V6	A4-V6 HydrophobicContact CB-CG2 4.19Å
5	H	28.4	Very low	27.7	Very low	202 Å²	202	143.9 Å²	143.9	94%	0.935	85%	0.847	S	S	*	*			trans	-88.4	102.4	156.4	-97.2	-16.5	0	0	0	108.8
6	V	29.7	Very low	27.4	Very low	119 Å²	119	142 Å²	142	72%	0.721	84%	0.84	S	S	*	*			trans	-96	123.2	171.1	171.8	0	0	0	0	108.1	A4	A4-V6 HydrophobicContact CB-CG2 4.19Å
7	M	30.3	Very low	27	Very low	189 Å²	189	148 Å²	148	93%	0.931	85%	0.845	S	S	*	*			trans	-58.2	131.7	165.2	-70.6	-170.3	163.9	0	0	109.6
8	K	28.3	Very low	26.8	Very low	204 Å²	204	149.4 Å²	149.4	89%	0.887	85%	0.846	S	S	*	*			trans	-109.6	124.8	170.5	-108.6	-177	177.2	-179.8	0	109.6
9	D	26.1	Very low	26.5	Very low	163 Å²	163	151.1 Å²	151.1	87%	0.872	85%	0.846	S	S	*	*			trans	-47.9	141.5	175.1	-70.8	-52.9	0	0	0	113.7	G11	D9-G11 PolarHBondContact O-N 3.37Å; D9-G11 VanDerWaalsContact O-N 3.16Å
10	G	30.8	Very low	26.2	Very low	87 Å²	87	149.7 Å²	149.7	90%	0.897	84%	0.843	S	S	*	*			trans	-69.7	101.2	169.1	0	0	0	0	0	111.1
11	G	27.8	Very low	26.2	Very low	63 Å²	63	146.2 Å²	146.2	65%	0.649	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-80	156.9	162.6	0	0	0	0	0	111.5	D9 E13	D9-G11 PolarHBondContact O-N 3.37Å; D9-G11 VanDerWaalsContact O-N 3.16Å; G11-E13 PolarHBondContact O-N 2.96Å
12	P	26.8	Very low	26	Very low	130 Å²	130	141.4 Å²	141.4	84%	0.844	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-63.7	135.5	179.6	26.7	-32.1	0	0	0	110.6
13	E	27.9	Very low	26	Very low	180 Å²	180	141.9 Å²	141.9	84%	0.841	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-51.1	141.3	173.6	-76	-170.7	150.2	0	0	111.2	G11 I15	G11-E13 PolarHBondContact O-N 2.96Å; E13-I15 PolarHBondContact O-N 3.43Å
14	P	23.4	Very low	26.1	Very low	117 Å²	117	139.4 Å²	139.4	76%	0.76	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-64.3	123.9	178.9	26.1	-31.5	0	0	0	109.8	P16	P14-P16 WeakPolarHBondContact O-CD 3.08Å
15	I	25.9	Very low	26.3	Very low	155 Å²	155	140.2 Å²	140.2	80%	0.795	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-51.2	121.4	169.2	-60.7	166.2	0	0	0	107.6	E13 R17	E13-I15 PolarHBondContact O-N 3.43Å; I15-R17 PolarHBondContact O-N 2.83Å; I15-R17 VanDerWaalsContact O-N 3.08Å
16	P	22.8	Very low	26.3	Very low	114 Å²	114	132 Å²	132	74%	0.74	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-62.2	118.6	178.6	21.4	-28.9	0	0	0	108.8	P14 M18	P14-P16 WeakPolarHBondContact O-CD 3.08Å; P16-M18 PolarHBondContact O-N 3.37Å
17	R	21.1	Very low	26.3	Very low	244 Å²	244	130.9 Å²	130.9	92%	0.921	72%	0.723	S	S	*	*			trans	-55.4	110	171.6	-81.9	-178.5	172.5	178.7	-2.1	108.6	I15 Q19	I15-R17 PolarHBondContact O-N 2.83Å; I15-R17 VanDerWaalsContact O-N 3.08Å; R17-Q19 PolarHBondContact O-N 2.86Å
18	M	22.6	Very low	26.2	Very low	174 Å²	174	129.9 Å²	129.9	86%	0.857	71%	0.713	S	S	*	*			trans	-57.6	123.6	168.4	-81.1	177	67	0	0	108.8	P16	P16-M18 PolarHBondContact O-N 3.37Å
19	Q	21.4	Very low	26.6	Very low	181 Å²	181	123.5 Å²	123.5	85%	0.846	68%	0.684	S	S	*	*			trans	-68.9	139.6	170.3	-73.6	-168.8	-23.8	0	0	109.7	R17 A21	R17-Q19 PolarHBondContact O-N 2.86Å; Q19-A21 PolarHBondContact O-N 3.3Å
20	P	21.3	Very low	26.9	Very low	122 Å²	122	123.8 Å²	123.8	79%	0.792	67%	0.673	S	S	*	*			trans	-71.2	113.2	-174.7	25.9	-30	0	0	0	110.6
21	A	25.5	Very low	26.9	Very low	78 Å²	78	124.6 Å²	124.6	65%	0.645	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-69.8	131.5	170.1	0	0	0	0	0	109.8	Q19	Q19-A21 PolarHBondContact O-N 3.3Å
22	M	28	Very low	27	Very low	140 Å²	140	132.6 Å²	132.6	69%	0.69	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-70	147.8	-156.8	-78.9	-165.8	-77.4	0	0	116.3	Y29	M22-Y29 HydrophobicContact SD-CE2 4.09Å
23	M	25.7	Very low	27.3	Very low	116 Å²	116	133.6 Å²	133.6	57%	0.571	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-71.8	127.2	-167.6	-61.3	175.3	-175.8	0	0	114.2
24	M	29	Very low	27.2	Very low	72 Å²	72	128.6 Å²	128.6	36%	0.355	66%	0.66	S	S	.	*	S	Bend	trans	-92.8	-3.6	174.6	-72.7	-96.1	-78.6	0	0	113.5	M189 Y190 I425	M24-M189 HydrophobicContact CE-SD 3.78Å; M24-M189 HydrophobicContact SD-CE 4.29Å; M24-M189 HydrophobicContact SD-SD 3.52Å; M24-Y190 HydrophobicContact CE-CE2 4.13Å; M24-I425 HydrophobicContact CB-CD1 3.41Å; M24-I425 VanDerWaalsContact CB-CD1 3.41Å; M24-I425 HydrophobicContact CE-CD1 3.66Å; M24-I425 HydrophobicContact CG-CD1 3.76Å
25	F	30.5	Very low	27.4	Very low	95 Å²	95	129.9 Å²	129.9	42%	0.417	66%	0.658	S	S	.	*	S	Bend	trans	-136.9	8.1	-165.4	-59.5	-53.8	0	0	0	115.7	C423 I425	F25-C423 HydrophobicContact CD2-CB 4.33Å; F25-C423 WeakPolarHBondContact CD2-O 3.16Å; F25-C423 HydrophobicContact CE2-CB 3.81Å; F25-C423 WeakPolarHBondContact CE2-O 3.21Å; F25-C423 HydrophobicContact CZ-CB 4.32Å; F25-I425 HydrophobicContact CD2-CD1 3.99Å; F25-I425 HydrophobicContact CD2-CG1 3.9Å; F25-I425 HydrophobicContact CE1-CD1 3.87Å; F25-I425 HydrophobicContact CE1-CG1 4.47Å; F25-I425 HydrophobicContact CE2-CB 4.43Å; F25-I425 HydrophobicContact CE2-CD1 3.19Å; F25-I425 HydrophobicContact CE2-CG1 2.95Å; F25-I425 HydrophobicContact CZ-CD1 3.09Å; F25-I425 HydrophobicContact CZ-CG1 3.32Å
26	S	28.6	Very low	27.4	Very low	29 Å²	29	125.4 Å²	125.4	20%	0.203	64%	0.64	C	S	.	*			trans	-102.4	132.1	-179.2	179.1	0	0	0	0	112.1	K28 Y29	S26-K28 PolarHBondContact O-N 2.97Å; S26-K28 PolarHBondContact OG-N 3.39Å; S26-Y29 PolarHBondContact O-N 3.2Å
27	S	28.8	Very low	27.8	Very low	96 Å²	96	125.9 Å²	125.9	67%	0.671	64%	0.635	S	S	*	*	H	α-helix	trans	-58.8	-27.2	172.7	79.6	0	0	0	0	112.2	Y29 W30	S27-Y29 VanDerWaalsContact C-N 3.28Å; S27-Y29 PolarHBondContact O-N 2.83Å; S27-W30 PolarHBondContact O-N 3Å
28	K	29.2	Very low	28.1	Very low	167 Å²	167	118.9 Å²	118.9	73%	0.726	62%	0.616	S	S	*	*	H	α-helix	trans	-68.9	-20	-179.4	-67.4	-179.7	178	175.6	0	114.1	S26	S26-K28 PolarHBondContact O-N 2.97Å; S26-K28 PolarHBondContact OG-N 3.39Å
29	Y	35.1	Very low	28.4	Very low	70 Å²	70	114.3 Å²	114.3	28%	0.275	60%	0.601	S	S	.	*	H	α-helix	trans	-74.2	-31.6	178.2	-178.2	-108.8	0	0	0	112.2	M22 S26 S27 R33	M22-Y29 HydrophobicContact SD-CE2 4.09Å; S26-Y29 PolarHBondContact O-N 3.2Å; S27-Y29 VanDerWaalsContact C-N 3.28Å; S27-Y29 PolarHBondContact O-N 2.83Å; Y29-R33 VanDerWaalsContact CE1-NH2 3.26Å; Y29-R33 PolarHBondContact OH-NH2 2.83Å
30	W	33.6	Very low	28.8	Very low	169 Å²	169	110 Å²	110	64%	0.64	60%	0.597	S	S	*	*	H	α-helix	trans	-73.3	-32.8	-176.3	-59.5	95.3	0	0	0	113	S27 R32	S27-W30 PolarHBondContact O-N 3Å; W30-R32 VanDerWaalsContact C-N 3.31Å; W30-R32 PolarHBondContact O-N 3.06Å
31	S	30.1	Very low	29.4	Very low	105 Å²	105	110.2 Å²	110.2	73%	0.734	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-70.5	-22.7	178.4	-46.6	0	0	0	0	113.9
32	R	30.4	Very low	29.4	Very low	231 Å²	231	114.8 Å²	114.8	87%	0.872	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-84.4	-17.3	-176	-89.2	-173.9	175.3	-155	-1	114.8	W30	W30-R32 VanDerWaalsContact C-N 3.31Å; W30-R32 PolarHBondContact O-N 3.06Å
33	R	32.7	Very low	29.3	Very low	150 Å²	150	116 Å²	116	57%	0.566	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-90.7	3.5	-177.1	-83	-152	-85	-170.6	-2.4	115.1	Y29 M35	Y29-R33 VanDerWaalsContact CE1-NH2 3.26Å; Y29-R33 PolarHBondContact OH-NH2 2.83Å; R33-M35 PolarHBondContact O-N 2.98Å
34	G	25.7	Very low	29.4	Very low	76 Å²	76	119.1 Å²	119.1	78%	0.784	62%	0.617	S	S	*	*			trans	60.5	4.9	173.1	0	0	0	0	0	116
35	M	27.3	Very low	29.4	Very low	144 Å²	144	124.4 Å²	124.4	71%	0.709	64%	0.64	S	S	*	*			trans	-92.4	105.4	178.7	-68.9	-100.3	-75.7	0	0	108.1	R33	R33-M35 PolarHBondContact O-N 2.98Å
36	S	27.2	Very low	29.3	Very low	61 Å²	61	127 Å²	127	43%	0.427	66%	0.659	S	S	.	*			trans	-61.8	144.5	162.9	174.1	0	0	0	0	108.9	D38 S39	S36-D38 PolarHBondContact O-N 3.27Å; S36-D38 PolarHBondContact OG-N 3.39Å; S36-D38 PolarHBondContact OG-OD2 3.44Å; S36-S39 PolarHBondContact O-N 2.97Å
37	L	29.9	Very low	29.1	Very low	123 Å²	123	135.2 Å²	135.2	64%	0.644	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.7	-16.3	173.9	-135.6	103.4	0	0	0	112.9
38	D	28.3	Very low	28.9	Very low	97 Å²	97	139 Å²	139	52%	0.519	70%	0.701	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.5	-28.5	-178.8	-60.6	-39.4	0	0	0	113.5	S36 A40 M41	S36-D38 PolarHBondContact O-N 3.27Å; S36-D38 PolarHBondContact OG-N 3.39Å; S36-D38 PolarHBondContact OG-OD2 3.44Å; D38-A40 PolarHBondContact O-N 2.79Å; D38-M41 PolarHBondContact O-N 3.36Å
39	S	27.9	Very low	28.7	Very low	78 Å²	78	139.1 Å²	139.1	55%	0.545	70%	0.703	S	S	.	*	G	3₁₀ helix	trans	-71.1	-20.2	-176.4	-54.3	0	0	0	0	113.2	S36 M41	S36-S39 PolarHBondContact O-N 2.97Å; S39-M41 VanDerWaalsContact C-N 3.33Å
40	A	30.2	Very low	28.2	Very low	91 Å²	91	144.8 Å²	144.8	75%	0.752	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-87	-0.2	177.7	0	0	0	0	0	113.7	D38	D38-A40 PolarHBondContact O-N 2.79Å
41	M	32.9	Very low	27.7	Very low	126 Å²	126	145.6 Å²	145.6	62%	0.621	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-96.2	-4.5	-177	-66.9	-87.4	-116.3	0	0	113.7	D38 S39	D38-M41 PolarHBondContact O-N 3.36Å; S39-M41 VanDerWaalsContact C-N 3.33Å
42	F	26.3	Very low	27.4	Very low	174 Å²	174	151.1 Å²	151.1	76%	0.763	75%	0.748	S	S	*	*			trans	-106.8	-8.1	-168.5	-94.2	-80.8	0	0	0	117.4	Q44	F42-Q44 VanDerWaalsContact C-N 3.31Å; F42-Q44 PolarHBondContact O-N 2.94Å; F42-Q44 VanDerWaalsContact O-N 3.07Å
43	D	26.4	Very low	27	Very low	165 Å²	165	149.2 Å²	149.2	88%	0.882	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	53.2	-177	-80.7	-21.6	0	0	0	113.9
44	Q	27.7	Very low	26.5	Very low	183 Å²	183	148.5 Å²	148.5	86%	0.855	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.4	5	168.7	-116.9	-175.2	-7.6	0	0	115.2	F42	F42-Q44 VanDerWaalsContact C-N 3.31Å; F42-Q44 PolarHBondContact O-N 2.94Å; F42-Q44 VanDerWaalsContact O-N 3.07Å
45	H	28.2	Very low	26.3	Very low	182 Å²	182	149 Å²	149	84%	0.843	77%	0.766	S	S	*	*	S	Bend	trans	-130.2	69.6	174	-82.6	-0.4	0	0	0	112.1
46	N	28.1	Very low	26	Very low	150 Å²	150	145.9 Å²	145.9	80%	0.802	77%	0.771	S	S	*	*			trans	-174.4	90.9	146.1	-108.2	-15.5	0	0	0	110.1
47	H	24.8	Very low	25.7	Very low	201 Å²	201	152 Å²	152	93%	0.931	79%	0.793	S	S	*	*			trans	-165.2	77	148.5	-87.2	-37.5	0	0	0	109.4
48	Q	24.1	Very low	25.4	Very low	177 Å²	177	155.2 Å²	155.2	83%	0.827	81%	0.807	S	S	*	*			trans	-118.5	124.8	151.6	-97.9	-176	-9.3	0	0	108.9
49	H	25.8	Very low	25.1	Very low	169 Å²	169	156.4 Å²	156.4	78%	0.782	82%	0.817	S	S	*	*			trans	68.1	107.8	163.4	-72.7	-66.6	0	0	0	120.3
50	Q	23.6	Very low	24.8	Very low	188 Å²	188	163.9 Å²	163.9	88%	0.879	83%	0.834	S	S	*	*			trans	-145.7	91.6	132.3	-103.8	177.3	16.8	0	0	109.6
51	Q	24.3	Very low	24.5	Very low	186 Å²	186	163.6 Å²	163.6	87%	0.869	83%	0.831	S	S	*	*			trans	-105.8	120	153.4	-82	-171.2	-6.2	0	0	107.2
52	R	22.5	Very low	23.9	Very low	221 Å²	221	162 Å²	162	83%	0.834	83%	0.831	S	S	*	*			trans	-84.8	126.8	170.8	-73.3	177	174.5	176.5	-2.1	108.3
53	H	22.5	Very low	23.7	Very low	192 Å²	192	165.6 Å²	165.6	89%	0.889	84%	0.84	S	S	*	*			trans	-146.5	149.8	142.2	-91.7	-67.9	0	0	0	110.1
54	T	22.3	Very low	23.5	Very low	135 Å²	135	165.7 Å²	165.7	83%	0.828	83%	0.833	S	S	*	*			trans	-89.1	146.1	-154.8	40.2	0	0	0	0	114.9
55	G	20.9	Very low	23.3	Very low	85 Å²	85	161.9 Å²	161.9	88%	0.876	83%	0.825	S	S	*	*			trans	94.9	126.9	136	0	0	0	0	0	118
56	G	21.9	Very low	23.2	Very low	80 Å²	80	158.6 Å²	158.6	83%	0.825	82%	0.82	S	S	*	*			trans	135.4	85.1	155.8	0	0	0	0	0	115.1
57	Q	21.8	Very low	23.2	Very low	188 Å²	188	157 Å²	157	88%	0.879	82%	0.818	S	S	*	*			trans	-56	144	165	-70	170.1	-35.4	0	0	111.4
58	M	22.9	Very low	23.2	Very low	192 Å²	192	155.4 Å²	155.4	95%	0.946	81%	0.814	S	S	*	*			trans	-155.9	133	130.2	-99.6	-171.5	98.5	0	0	110.9
59	V	22.2	Very low	23.2	Very low	121 Å²	121	153.9 Å²	153.9	73%	0.733	81%	0.812	S	S	*	*			trans	-95.2	146.6	-173.5	167.9	0	0	0	0	109.9
60	R	22	Very low	23.1	Very low	236 Å²	236	154.3 Å²	154.3	89%	0.891	81%	0.814	S	S	*	*			trans	177.6	101	131.6	-97	164.8	-179	-177	0.6	108.5
61	A	22.4	Very low	23.3	Very low	85 Å²	85	153.9 Å²	153.9	70%	0.702	81%	0.81	S	S	*	*				79.6	140.7	84.2	0	0	0	0	0	111
62	C	21.9	Very low	23.5	Very low	91 Å²	91	151 Å²	151	62%	0.615	81%	0.807	S	S	*	*			cis	-177.3	149.1	-5.7	-110.7	0	0	0	0	105.3	F64	C62-F64 HydrophobicContact CB-CD2 4.34Å
63	W	21.3	Very low	23.6	Very low	250 Å²	250	148.2 Å²	148.2	95%	0.947	81%	0.808	S	S	*	*			trans	-178.5	92	137.8	-101.4	20.4	0	0	0	106.4
64	F	21.5	Very low	23.7	Very low	168 Å²	168	142.2 Å²	142.2	74%	0.737	80%	0.799	S	S	*	*				48.3	125.9	88.8	-83.1	-92.8	0	0	0	112.7	C62	C62-F64 HydrophobicContact CB-CD2 4.34Å
65	C	23.8	Very low	24.2	Very low	102 Å²	102	144.6 Å²	144.6	69%	0.689	80%	0.8	S	S	*	*			cis	179.5	-179.9	-1.2	-109.2	0	0	0	0	106
66	P	27.2	Very low	24.4	Very low	114 Å²	114	147.5 Å²	147.5	74%	0.74	80%	0.796	S	S	*	*			cis	-131.2	177.2	-16.5	32.5	-10.8	0	0	0	113.9
67	P	26.5	Very low	24.7	Very low	117 Å²	117	149 Å²	149	76%	0.76	80%	0.8	S	S	*	*			trans	-94.1	152	-179.5	36.1	-29.9	0	0	0	112.6
68	I	25.1	Very low	25.2	Very low	166 Å²	166	148.1 Å²	148.1	85%	0.851	80%	0.797	S	S	*	*			trans	-120.6	122.9	158.3	-62.4	177.5	0	0	0	107.8
69	N	25	Very low	25.8	Very low	146 Å²	146	144.2 Å²	144.2	78%	0.781	78%	0.779	S	S	*	*			trans	-93.6	115.7	-179.1	-175.5	29.7	0	0	0	107.7
70	E	24.3	Very low	26.6	Very low	178 Å²	178	144.3 Å²	144.3	83%	0.832	79%	0.785	S	S	*	*			trans	-128.8	139.7	157.9	-76.2	-169.3	163.4	0	0	109.6
71	K	26	Very low	27.8	Very low	179 Å²	179	134.6 Å²	134.6	78%	0.778	76%	0.759	S	S	*	*			trans	-67.7	163.6	-163.5	-73.7	174	176.7	175	0	113.1	D73	K71-D73 PolarHBondContact O-N 3.41Å
72	P	29.9	Very low	29.5	Very low	125 Å²	125	139.3 Å²	139.3	81%	0.812	76%	0.763	S	S	*	*			trans	-82.8	104.3	-179.2	33.3	-28.5	0	0	0	109.8
73	D	23.8	Very low	31.9	Very low	162 Å²	162	135.9 Å²	135.9	87%	0.866	74%	0.74	S	S	*	*			trans	-94.6	112.8	152.9	-65.3	-29.8	0	0	0	104.9	K71	K71-D73 PolarHBondContact O-N 3.41Å
74	G	24.9	Very low	34.6	Very low	67 Å²	67	124.4 Å²	124.4	69%	0.691	70%	0.698	S	S	*	*				104.4	105.5	81.6	0	0	0	0	0	107.6
75	E	32.1	Very low	37.3	Very low	184 Å²	184	116.4 Å²	116.4	86%	0.86	66%	0.663	S	S	*	*			trans	47.1	101.3	151.7	-61	-179.1	162.7	0	0	118.2
76	N	24.9	Very low	39.9	Very low	146 Å²	146	112 Å²	112	78%	0.781	63%	0.632	S	S	*	*			trans	177	69.8	135.2	-85.1	-26.5	0	0	0	109.7	E78	N76-E78 PolarHBondContact O-N 3.18Å; N76-E78 VanDerWaalsContact O-N 3.1Å
77	A	29.9	Very low	42.6	Very low	111 Å²	111	106.6 Å²	106.6	92%	0.917	60%	0.597	S	S	*	*			trans	-81.3	71	163.1	0	0	0	0	0	108.7	D79	A77-D79 PolarHBondContact O-N 3.28Å
78	E	30.9	Very low	45.3	Very low	171 Å²	171	101.1 Å²	101.1	80%	0.799	56%	0.562	S	S	*	*			trans	-79	99.3	170.2	-76.9	-167.2	154.4	0	0	110	N76 S80	N76-E78 PolarHBondContact O-N 3.18Å; N76-E78 VanDerWaalsContact O-N 3.1Å; E78-S80 PolarHBondContact O-N 2.63Å
79	D	35.2	Very low	48.1	Very low	109 Å²	109	94.2 Å²	94.2	58%	0.583	53%	0.527	S	S	*	.			trans	45	73.5	140.9	-155.1	10.4	0	0	0	117.4	A77 G81 K135	A77-D79 PolarHBondContact O-N 3.28Å; D79-G81 PolarHBondContact O-N 3.34Å; D79-K135 IonicContact OD2-NZ 3.77Å; D79-K135 PolarHBondContact OD2-NZ 3.27Å
80	S	39.6	Very low	50.8	Low	123 Å²	123	93 Å²	93	86%	0.86	52%	0.515	S	S	*	.			trans	-73.7	73.2	167.2	70.9	0	0	0	0	110.6	E78	E78-S80 PolarHBondContact O-N 2.63Å
81	G	48	Very low	53.4	Low	32 Å²	32	89.2 Å²	89.2	33%	0.33	50%	0.5	S	S	.	.			trans	-59.1	137.5	169.3	0	0	0	0	0	110.7	D79 T83	D79-G81 PolarHBondContact O-N 3.34Å; G81-T83 PolarHBondContact O-N 3.35Å
82	K	57	Low	56	Low	185 Å²	185	86.4 Å²	86.4	80%	0.804	49%	0.49	S	S	*	.			trans	-54.7	125.6	170.1	-64.3	178.8	-179.3	178.5	0	108.2	N155	K82-N155 PolarHBondContact O-OD1 2.95Å
83	T	72.3	Confident	58.1	Low	19 Å²	19	88.1 Å²	88.1	12%	0.117	50%	0.497	C	S	.	.			trans	-118.2	69.1	-175.1	28.7	0	0	0	0	109.4	G81 C131 F138	G81-T83 PolarHBondContact O-N 3.35Å; T83-C131 WeakPolarHBondContact O-CA 3.2Å; T83-C131 WeakPolarHBondContact O-CB 3.25Å; T83-C131 PolarHBondContact O-N 2.91Å; T83-C131 PolarHBondContact OG1-O 3.45Å; T83-F138 HydrophobicContact CG2-CB 4.17Å; T83-F138 HydrophobicContact CG2-CD1 3.98Å; T83-F138 HydrophobicContact CG2-CD2 3.93Å; T83-F138 HydrophobicContact CG2-CE1 4.32Å; T83-F138 HydrophobicContact CG2-CE2 4.29Å; T83-F138 HydrophobicContact CG2-CG 3.76Å; T83-F138 HydrophobicContact CG2-CZ 4.47Å
84	A	77.9	Confident	60.6	Low	8 Å²	8	81.8 Å²	81.8	7%	0.066	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	139	176.8	0	0	0	0	0	110.6	F128 A129 F154 N155	A84-F128 HydrophobicContact CB-CD2 4.38Å; A84-F128 HydrophobicContact CB-CE2 3.71Å; A84-F128 HydrophobicContact CB-CZ 4.01Å; A84-A129 WeakPolarHBondContact CA-O 3.23Å; A84-F154 CarbonylContact O-C 3.56Å; A84-F154 WeakPolarHBondContact O-CA 3Å; A84-N155 PolarHBondContact O-N 2.71Å
85	V	78.9	Confident	63.2	Low	0 Å²	0	79.8 Å²	79.8	0%	0	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	134.5	176.3	64.4	0	0	0	0	110.3	F87 F103 F128 A129 F138 L142 L145 I152 S153	V85-F87 HydrophobicContact CG1-CD1 4.2Å; V85-F87 HydrophobicContact CG1-CE1 4.46Å; V85-F87 HydrophobicContact CG2-CD1 4.37Å; V85-F103 HydrophobicContact CG1-CE1 4.1Å; V85-F103 HydrophobicContact CG1-CZ 3.97Å; V85-F128 VanDerWaalsContact O-CA 3.24Å; V85-F128 WeakPolarHBondContact O-CA 3.35Å; V85-A129 HydrophobicContact CG1-CB 3.88Å; V85-A129 PolarHBondContact N-O 3.21Å; V85-A129 PolarHBondContact O-N 3.17Å; V85-F138 HydrophobicContact CB-CE2 4.3Å; V85-F138 HydrophobicContact CB-CZ 4.24Å; V85-L142 HydrophobicContact CB-CD2 4.33Å; V85-L142 HydrophobicContact CG2-CD2 3.62Å; V85-L145 HydrophobicContact CG2-CD1 4.44Å; V85-I152 HydrophobicContact CG2-CD1 4.3Å; V85-I152 HydrophobicContact CG2-CG1 3.95Å; V85-S153 CarbonylContact C-O 3.53Å; V85-S153 WeakPolarHBondContact CA-O 3.39Å; V85-S153 WeakPolarHBondContact CG2-O 3.39Å
86	V	79.1	Confident	65.5	Low	9 Å²	9	74.3 Å²	74.3	6%	0.055	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	128.8	168.5	-178.6	0	0	0	0	107.4	I127 F128 I152 S153 W161	V86-I127 CarbonylContact C-O 3.52Å; V86-I127 VanDerWaalsContact CA-O 3.24Å; V86-I127 WeakPolarHBondContact CA-O 3.36Å; V86-F128 HydrophobicContact CB-CB 4.39Å; V86-F128 HydrophobicContact CG2-CB 3.77Å; V86-F128 HydrophobicContact CG2-CD2 3.78Å; V86-F128 HydrophobicContact CG2-CG 4.35Å; V86-I152 CarbonylContact O-C 3.56Å; V86-I152 WeakPolarHBondContact O-CA 3.38Å; V86-S153 PolarHBondContact N-O 2.8Å; V86-S153 PolarHBondContact O-N 3.34Å; V86-W161 VanDerWaalsContact CG1-CD1 3.43Å; V86-W161 HydrophobicContact CG1-CG 4.4Å; V86-W161 HydrophobicContact CG2-CB 4.43Å; V86-W161 HydrophobicContact CG2-CG 4.06Å
87	F	82.4	Confident	68.3	Low	1 Å²	1	71.1 Å²	71.1	0%	0.004	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	146.5	177.3	66.1	-87.4	0	0	0	111.9	V85 L89 A99 F103 I127 A129 V149 I151 I152	V85-F87 HydrophobicContact CG1-CD1 4.2Å; V85-F87 HydrophobicContact CG1-CE1 4.46Å; V85-F87 HydrophobicContact CG2-CD1 4.37Å; F87-L89 HydrophobicContact CD2-CD2 4.12Å; F87-L89 HydrophobicContact CD2-CG 4.03Å; F87-L89 HydrophobicContact CE2-CD1 3.91Å; F87-L89 HydrophobicContact CE2-CD2 4.09Å; F87-L89 HydrophobicContact CE2-CG 3.86Å; F87-A99 HydrophobicContact CE2-CB 3.75Å; F87-A99 HydrophobicContact CZ-CB 4.14Å; F87-F103 HydrophobicContact CD1-CZ 4.46Å; F87-F103 AromaticContact CE1-CE2 3.95Å; F87-F103 HydrophobicContact CE1-CE2 3.95Å; F87-F103 AromaticContact CE1-CZ 3.7Å; F87-F103 HydrophobicContact CE1-CZ 3.7Å; F87-F103 AromaticContact CZ-CE2 3.96Å; F87-F103 HydrophobicContact CZ-CE2 3.96Å; F87-F103 HydrophobicContact CZ-CZ 4.19Å; F87-I127 HydrophobicContact CE1-CB 4.11Å; F87-I127 HydrophobicContact CE1-CG2 3.78Å; F87-I127 HydrophobicContact CE2-CB 4.19Å; F87-I127 HydrophobicContact CE2-CD1 3.85Å; F87-I127 HydrophobicContact CE2-CG2 4.41Å; F87-I127 HydrophobicContact CZ-CB 3.94Å; F87-I127 HydrophobicContact CZ-CD1 4.14Å; F87-I127 HydrophobicContact CZ-CG2 3.69Å; F87-I127 PolarHBondContact N-O 3.26Å; F87-I127 PolarHBondContact O-N 3.12Å; F87-A129 HydrophobicContact CE1-CB 4.31Å; F87-V149 HydrophobicContact CB-CG1 4Å; F87-V149 HydrophobicContact CB-CG2 4.44Å; F87-V149 HydrophobicContact CD2-CG2 4.06Å; F87-I151 CarbonylContact C-O 3.53Å; F87-I151 WeakPolarHBondContact CA-O 3.46Å; F87-I152 HydrophobicContact CB-CG1 4.42Å
88	S	83.8	Confident	70.8	Confident	2 Å²	2	72.9 Å²	72.9	1%	0.014	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	146.2	178.3	76.6	0	0	0	0	113	E124 V125 V149 I151	S88-E124 WeakPolarHBondContact CB-OE2 3.23Å; S88-E124 PolarHBondContact OG-OE2 2.8Å; S88-V125 CarbonylContact C-O 3.51Å; S88-V125 WeakPolarHBondContact CA-O 3.16Å; S88-V149 WeakPolarHBondContact O-CG1 3.46Å; S88-I151 PolarHBondContact N-O 2.9Å; S88-I151 PolarHBondContact OG-N 2.94Å
89	L	84.2	Confident	73.2	Confident	21 Å²	21	65 Å²	65	11%	0.11	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	148.8	172.6	-65.6	-178.2	0	0	0	109.9	F87 N91 L96 A99 E124 V125 I127 V149	F87-L89 HydrophobicContact CD2-CD2 4.12Å; F87-L89 HydrophobicContact CD2-CG 4.03Å; F87-L89 HydrophobicContact CE2-CD1 3.91Å; F87-L89 HydrophobicContact CE2-CD2 4.09Å; F87-L89 HydrophobicContact CE2-CG 3.86Å; L89-N91 PolarHBondContact O-N 3.12Å; L89-L96 HydrophobicContact CD1-CB 4.25Å; L89-L96 HydrophobicContact CD1-CD1 4.42Å; L89-A99 HydrophobicContact CD1-CB 3.8Å; L89-A99 HydrophobicContact CD2-CB 4.23Å; L89-E124 CarbonylContact O-C 3.49Å; L89-E124 VanDerWaalsContact O-CA 3.25Å; L89-E124 WeakPolarHBondContact O-CA 3.42Å; L89-E124 WeakPolarHBondContact O-CB 3.29Å; L89-V125 PolarHBondContact N-O 3.06Å; L89-V125 PolarHBondContact O-N 2.81Å; L89-I127 HydrophobicContact CB-CD1 4.24Å; L89-I127 HydrophobicContact CD1-CD1 3.22Å; L89-I127 HydrophobicContact CG-CD1 3.7Å; L89-V149 HydrophobicContact CD2-CG2 3.95Å
90	K	81.8	Confident	75.5	Confident	122 Å²	122	62.5 Å²	62.5	53%	0.53	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	136.9	166.8	-67.7	-175.3	178.8	-178.3	0	110.1	E92	K90-E92 HydrophobicContact CB-CG 4.39Å; K90-E92 PolarHBondContact O-N 2.97Å
91	N	78.7	Confident	77.5	Confident	98 Å²	98	63.9 Å²	63.9	52%	0.524	33%	0.331	S	S	.	.	S	Bend	trans	-75.1	62.5	178.3	-166.6	20.8	0	0	0	111.6	L89 N123 V125	L89-N91 PolarHBondContact O-N 3.12Å; N91-N123 VanDerWaalsContact CB-O 3.28Å; N91-N123 WeakPolarHBondContact CB-O 3.41Å; N91-N123 PolarHBondContact N-O 2.77Å; N91-V125 HydrophobicContact CB-CG2 3.88Å
92	E	79.8	Confident	79.1	Confident	120 Å²	120	63.9 Å²	63.9	56%	0.561	32%	0.324	S	S	*	.	S	Bend	trans	-121.9	146.7	179.3	-69.3	175.8	-164.5	0	0	110.4	K90 G94 C95	K90-E92 HydrophobicContact CB-CG 4.39Å; K90-E92 PolarHBondContact O-N 2.97Å; E92-G94 PolarHBondContact O-N 3.34Å; E92-C95 PolarHBondContact O-N 3.49Å
93	V	74.6	Confident	80.4	Confident	160 Å²	160	55.3 Å²	55.3	97%	0.97	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	122.4	-178.8	-178.2	0	0	0	0	109.9
94	G	76.5	Confident	80.9	Confident	30 Å²	30	61.8 Å²	61.8	31%	0.309	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.2	-8.4	176.9	0	0	0	0	0	115.7	E92 V97 K98	E92-G94 PolarHBondContact O-N 3.34Å; G94-V97 PolarHBondContact O-N 2.9Å; G94-K98 WeakPolarHBondContact O-CG 3.09Å; G94-K98 PolarHBondContact O-N 3.35Å
95	C	79.9	Confident	81.1	Confident	24 Å²	24	67.3 Å²	67.3	16%	0.162	34%	0.34	C	S	.	.	H	α-helix	trans	-64.8	-44.3	176.5	-75.6	0	0	0	0	112.6	E92 V97 K98 A99	E92-C95 PolarHBondContact O-N 3.49Å; C95-V97 VanDerWaalsContact C-N 3.3Å; C95-V97 PolarHBondContact O-N 2.65Å; C95-K98 PolarHBondContact O-N 2.76Å; C95-A99 PolarHBondContact O-N 3.5Å
96	L	80.9	Confident	81.1	Confident	70 Å²	70	71.2 Å²	71.2	37%	0.366	35%	0.354	S	S	.	.	H	α-helix	trans	-60.9	-39.4	174.4	175.6	62.6	0	0	0	112	L89 A99 L100 I113 I127	L89-L96 HydrophobicContact CD1-CB 4.25Å; L89-L96 HydrophobicContact CD1-CD1 4.42Å; L96-A99 PolarHBondContact O-N 3.35Å; L96-L100 HydrophobicContact CD1-CD1 4.14Å; L96-L100 HydrophobicContact CD1-CG 4.11Å; L96-L100 HydrophobicContact CG-CD1 4.07Å; L96-L100 HydrophobicContact CG-CG 4.43Å; L96-L100 WeakPolarHBondContact O-CG 3.37Å; L96-L100 PolarHBondContact O-N 3.2Å; L96-I113 HydrophobicContact CD1-CD1 4.36Å; L96-I127 HydrophobicContact CD1-CD1 3.48Å; L96-I127 VanDerWaalsContact CD1-CD1 3.48Å; L96-I127 HydrophobicContact CD1-CG1 4.19Å
97	V	82.8	Confident	81	Confident	79 Å²	79	80.6 Å²	80.6	48%	0.479	39%	0.389	S	S	.	.	H	α-helix	trans	-65.8	-40.7	178.7	-180	0	0	0	0	111	G94 C95 A99 L100 R101	G94-V97 PolarHBondContact O-N 2.9Å; C95-V97 VanDerWaalsContact C-N 3.3Å; C95-V97 PolarHBondContact O-N 2.65Å; V97-A99 VanDerWaalsContact C-N 3.34Å; V97-L100 PolarHBondContact O-N 3.3Å; V97-R101 WeakPolarHBondContact O-CG 3.4Å; V97-R101 PolarHBondContact O-N 3.35Å; V97-R101 VanDerWaalsContact O-N 3.07Å
98	K	82.1	Confident	80.9	Confident	147 Å²	147	80.9 Å²	80.9	64%	0.639	39%	0.391	S	S	*	.	H	α-helix	trans	-61.1	-43.5	173.7	-71.5	173.9	-177	177.1	0	111.3	G94 C95 R101	G94-K98 WeakPolarHBondContact O-CG 3.09Å; G94-K98 PolarHBondContact O-N 3.35Å; C95-K98 PolarHBondContact O-N 2.76Å; K98-R101 PolarHBondContact O-N 3.06Å
99	A	81.8	Confident	80.6	Confident	5 Å²	5	86 Å²	86	4%	0.041	42%	0.418	C	S	.	.	H	α-helix	trans	-61.8	-48.4	176.4	0	0	0	0	0	111.5	F87 L89 C95 L96 V97 R101 L102 F103	F87-A99 HydrophobicContact CE2-CB 3.75Å; F87-A99 HydrophobicContact CZ-CB 4.14Å; L89-A99 HydrophobicContact CD1-CB 3.8Å; L89-A99 HydrophobicContact CD2-CB 4.23Å; C95-A99 PolarHBondContact O-N 3.5Å; L96-A99 PolarHBondContact O-N 3.35Å; V97-A99 VanDerWaalsContact C-N 3.34Å; A99-R101 VanDerWaalsContact C-N 3.29Å; A99-R101 PolarHBondContact O-N 3.31Å; A99-L102 VanDerWaalsContact O-CB 3.29Å; A99-L102 WeakPolarHBondContact O-CB 3.46Å; A99-L102 PolarHBondContact O-N 3.49Å; A99-F103 VanDerWaalsContact O-CD2 3.29Å; A99-F103 WeakPolarHBondContact O-CD2 3.32Å
100	L	82.7	Confident	80.4	Confident	57 Å²	57	88 Å²	88	30%	0.298	43%	0.428	S	S	.	.	H	α-helix	trans	-64.2	-28.6	-179.6	-68	175.9	0	0	0	113.9	L96 V97 L102 F103 Q104 L110 I113	L96-L100 HydrophobicContact CD1-CD1 4.14Å; L96-L100 HydrophobicContact CD1-CG 4.11Å; L96-L100 HydrophobicContact CG-CD1 4.07Å; L96-L100 HydrophobicContact CG-CG 4.43Å; L96-L100 WeakPolarHBondContact O-CG 3.37Å; L96-L100 PolarHBondContact O-N 3.2Å; V97-L100 PolarHBondContact O-N 3.3Å; L100-L102 VanDerWaalsContact C-N 3.27Å; L100-L102 PolarHBondContact O-N 3.24Å; L100-F103 WeakPolarHBondContact O-CB 3.45Å; L100-F103 PolarHBondContact O-N 2.9Å; L100-Q104 PolarHBondContact O-N 3.39Å; L100-Q104 VanDerWaalsContact O-N 3.14Å; L100-L110 HydrophobicContact CD2-CD1 3.55Å; L100-I113 HydrophobicContact CD2-CD1 3.84Å
101	R	83.4	Confident	80.2	Confident	153 Å²	153	86.8 Å²	86.8	58%	0.577	43%	0.428	S	S	*	.	H	α-helix	trans	-61.7	-35.2	171.8	-75.7	178.5	-175	-178.5	1.3	112.3	V97 K98 A99 F103 Q104 E105	V97-R101 WeakPolarHBondContact O-CG 3.4Å; V97-R101 PolarHBondContact O-N 3.35Å; V97-R101 VanDerWaalsContact O-N 3.07Å; K98-R101 PolarHBondContact O-N 3.06Å; A99-R101 VanDerWaalsContact C-N 3.29Å; A99-R101 PolarHBondContact O-N 3.31Å; R101-F103 VanDerWaalsContact C-N 3.32Å; R101-F103 PolarHBondContact O-N 2.89Å; R101-Q104 WeakPolarHBondContact O-CB 3.22Å; R101-Q104 PolarHBondContact O-N 2.95Å; R101-E105 WeakPolarHBondContact O-CG 3.41Å; R101-E105 PolarHBondContact O-N 3.47Å
102	L	81.6	Confident	80.1	Confident	32 Å²	32	86.6 Å²	86.6	17%	0.168	42%	0.423	C	S	.	.	H	α-helix	trans	-64.5	-37	175.9	-62.5	168.1	0	0	0	111.9	A99 L100 Q104 R106 L145	A99-L102 VanDerWaalsContact O-CB 3.29Å; A99-L102 WeakPolarHBondContact O-CB 3.46Å; A99-L102 PolarHBondContact O-N 3.49Å; L100-L102 VanDerWaalsContact C-N 3.27Å; L100-L102 PolarHBondContact O-N 3.24Å; L102-Q104 VanDerWaalsContact C-N 3.34Å; L102-R106 PolarHBondContact O-N 2.79Å; L102-L145 HydrophobicContact CD1-CD2 4.16Å
103	F	83.6	Confident	80.1	Confident	4 Å²	4	84.3 Å²	84.3	2%	0.018	41%	0.414	C	S	.	.	H	α-helix	trans	-64.8	-40.8	173.9	-71.7	-105.6	0	0	0	111	V85 F87 A99 L100 R101 R106 R107 V108 L110 A129 L141 L145	V85-F103 HydrophobicContact CG1-CE1 4.1Å; V85-F103 HydrophobicContact CG1-CZ 3.97Å; F87-F103 HydrophobicContact CD1-CZ 4.46Å; F87-F103 AromaticContact CE1-CE2 3.95Å; F87-F103 HydrophobicContact CE1-CE2 3.95Å; F87-F103 AromaticContact CE1-CZ 3.7Å; F87-F103 HydrophobicContact CE1-CZ 3.7Å; F87-F103 AromaticContact CZ-CE2 3.96Å; F87-F103 HydrophobicContact CZ-CE2 3.96Å; F87-F103 HydrophobicContact CZ-CZ 4.19Å; A99-F103 VanDerWaalsContact O-CD2 3.29Å; A99-F103 WeakPolarHBondContact O-CD2 3.32Å; L100-F103 WeakPolarHBondContact O-CB 3.45Å; L100-F103 PolarHBondContact O-N 2.9Å; R101-F103 VanDerWaalsContact C-N 3.32Å; R101-F103 PolarHBondContact O-N 2.89Å; F103-R106 PolarHBondContact O-N 3.46Å; F103-R107 PolarHBondContact O-N 3.09Å; F103-V108 HydrophobicContact CD1-CB 4.28Å; F103-V108 HydrophobicContact CD1-CG1 3.98Å; F103-V108 PolarHBondContact O-N 3.39Å; F103-L110 HydrophobicContact CD1-CD2 3.63Å; F103-L110 HydrophobicContact CD1-CG 4.3Å; F103-L110 HydrophobicContact CE1-CD2 3.79Å; F103-L110 HydrophobicContact CG-CD2 4.47Å; F103-A129 HydrophobicContact CE1-CB 4.03Å; F103-A129 HydrophobicContact CZ-CB 4.16Å; F103-L141 HydrophobicContact CD1-CD1 4.32Å; F103-L141 HydrophobicContact CD1-CD2 3.68Å; F103-L141 HydrophobicContact CD2-CD1 4.25Å; F103-L141 HydrophobicContact CE1-CD1 4.5Å; F103-L141 HydrophobicContact CE1-CD2 3.46Å; F103-L141 VanDerWaalsContact CE1-CD2 3.46Å; F103-L141 HydrophobicContact CE2-CD1 4.41Å; F103-L141 HydrophobicContact CG-CD1 4.21Å; F103-L141 HydrophobicContact CG-CD2 4.38Å; F103-L141 HydrophobicContact CZ-CD2 3.98Å; F103-L145 HydrophobicContact CE2-CD1 4.06Å; F103-L145 HydrophobicContact CE2-CD2 4.25Å; F103-L145 HydrophobicContact CZ-CD1 3.88Å
104	Q	81.7	Confident	80.3	Confident	155 Å²	155	79.6 Å²	79.6	72%	0.724	38%	0.382	S	S	*	.	H	α-helix	trans	-66	-44.3	177.6	-172.8	178.9	-6	0	0	112.5	L100 R101 L102 R106 R107	L100-Q104 PolarHBondContact O-N 3.39Å; L100-Q104 VanDerWaalsContact O-N 3.14Å; R101-Q104 WeakPolarHBondContact O-CB 3.22Å; R101-Q104 PolarHBondContact O-N 2.95Å; L102-Q104 VanDerWaalsContact C-N 3.34Å; Q104-R106 PolarHBondContact O-N 3.37Å; Q104-R107 PolarHBondContact O-N 3.03Å
105	E	82.6	Confident	80.3	Confident	124 Å²	124	81.9 Å²	81.9	58%	0.579	39%	0.393	S	S	*	.	H	α-helix	trans	-62.4	-28.7	178.4	-75.1	174.3	-165.2	0	0	113.1	R101	R101-E105 WeakPolarHBondContact O-CG 3.41Å; R101-E105 PolarHBondContact O-N 3.47Å
106	R	78.8	Confident	80.1	Confident	83 Å²	83	85 Å²	85	31%	0.313	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	10.8	179.3	-64.4	-67.4	177.9	-96.7	-0.8	113.8	L102 F103 Q104 V108 H144	L102-R106 PolarHBondContact O-N 2.79Å; F103-R106 PolarHBondContact O-N 3.46Å; Q104-R106 PolarHBondContact O-N 3.37Å; R106-V108 HydrophobicContact CB-CG2 4.14Å; R106-V108 PolarHBondContact O-N 2.85Å; R106-H144 PolarHBondContact NH2-NE2 3.4Å
107	R	76.9	Confident	79.7	Confident	206 Å²	206	87.4 Å²	87.4	78%	0.777	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	31.1	-179.6	-59.5	-176.3	176.1	-177.6	-0.9	113.5	F103 Q104	F103-R107 PolarHBondContact O-N 3.09Å; Q104-R107 PolarHBondContact O-N 3.03Å
108	V	80.3	Confident	79	Confident	7 Å²	7	84.4 Å²	84.4	4%	0.042	39%	0.394	C	S	.	.			trans	-88.5	115.8	176.7	179.2	0	0	0	0	108.8	F103 R106 C131 C133 L141	F103-V108 HydrophobicContact CD1-CB 4.28Å; F103-V108 HydrophobicContact CD1-CG1 3.98Å; F103-V108 PolarHBondContact O-N 3.39Å; R106-V108 HydrophobicContact CB-CG2 4.14Å; R106-V108 PolarHBondContact O-N 2.85Å; V108-C131 HydrophobicContact CG1-CB 3.62Å; V108-C133 HydrophobicContact CB-CB 4.35Å; V108-C133 HydrophobicContact CG1-CB 4.02Å; V108-C133 HydrophobicContact CG2-CB 3.96Å; V108-L141 HydrophobicContact CB-CD2 4.4Å; V108-L141 HydrophobicContact CG1-CD2 4.17Å; V108-L141 HydrophobicContact CG2-CD2 4.13Å
109	N	78.4	Confident	78.1	Confident	109 Å²	109	85.3 Å²	85.3	58%	0.583	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.3	143.3	175.8	-68.2	-50	0	0	0	110.4	C131 K132	N109-C131 CarbonylContact O-C 3.56Å; N109-C131 WeakPolarHBondContact O-CA 3.33Å; N109-K132 HydrophobicContact CB-CB 4.36Å; N109-K132 PolarHBondContact N-O 2.74Å; N109-K132 PolarHBondContact O-N 3.38Å
110	L	80.4	Confident	77.2	Confident	62 Å²	62	90.8 Å²	90.8	33%	0.325	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	123.9	177.4	-64.9	174.1	0	0	0	109.9	L100 F103 A129	L100-L110 HydrophobicContact CD2-CD1 3.55Å; F103-L110 HydrophobicContact CD1-CD2 3.63Å; F103-L110 HydrophobicContact CD1-CG 4.3Å; F103-L110 HydrophobicContact CE1-CD2 3.79Å; F103-L110 HydrophobicContact CG-CD2 4.47Å; L110-A129 HydrophobicContact CD2-CB 3.67Å
111	N	77.2	Confident	76.6	Confident	98 Å²	98	90.6 Å²	90.6	52%	0.524	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	-39.9	172.9	-67.3	-20.4	0	0	0	111.2	D130	N111-D130 HydrophobicContact CB-CB 4.38Å; N111-D130 PolarHBondContact N-O 2.89Å
112	H	75.9	Confident	75.8	Confident	93 Å²	93	88.9 Å²	88.9	43%	0.431	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	137.9	-178.1	-177.8	75.4	0	0	0	110.2	F128 A129 D130	H112-F128 AromaticContact CD2-CE1 3.86Å; H112-A129 WeakPolarHBondContact O-CA 3.27Å; H112-D130 HydrophobicContact CB-CB 3.96Å; H112-D130 PolarHBondContact O-N 3.44Å
113	I	80.9	Confident	75.6	Confident	73 Å²	73	93.6 Å²	93.6	37%	0.374	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	134.7	172.6	-169.4	171.2	0	0	0	109.7	L96 L100 I127 F128	L96-I113 HydrophobicContact CD1-CD1 4.36Å; L100-I113 HydrophobicContact CD2-CD1 3.84Å; I113-I127 HydrophobicContact CD1-CG2 3.99Å; I113-I127 HydrophobicContact CG1-CG2 3.93Å; I113-F128 VanDerWaalsContact CA-O 3.29Å; I113-F128 WeakPolarHBondContact CA-O 3.31Å
114	E	77.6	Confident	75.5	Confident	61 Å²	61	93.9 Å²	93.9	29%	0.285	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	156.3	172.5	163.8	-177.5	-163	0	0	108.6	R116 I127 F128 W161	E114-R116 HydrophobicContact CG-CG 4.41Å; E114-R116 IonicContact OE1-CZ 3.37Å; E114-R116 IonicContact OE1-NE 2.77Å; E114-R116 PolarHBondContact OE1-NE 2.9Å; E114-R116 IonicContact OE1-NH2 3.15Å; E114-R116 PolarHBondContact OE1-NH2 3.4Å; E114-R116 IonicContact OE2-NH2 2.89Å; E114-R116 PolarHBondContact OE2-NH2 2.97Å; E114-I127 WeakPolarHBondContact O-CA 3.17Å; E114-F128 PolarHBondContact N-O 2.94Å; E114-F128 PolarHBondContact O-N 3.21Å; E114-F128 VanDerWaalsContact O-N 3.1Å; E114-W161 HydrophobicContact CB-CH2 3.31Å; E114-W161 HydrophobicContact CB-CZ2 4.46Å; E114-W161 HydrophobicContact CB-CZ3 3.57Å; E114-W161 HydrophobicContact CG-CH2 3.43Å; E114-W161 VanDerWaalsContact CG-CH2 3.43Å; E114-W161 HydrophobicContact CG-CZ2 4.29Å; E114-W161 HydrophobicContact CG-CZ3 3.68Å; E114-W161 WeakPolarHBondContact O-CH2 3.34Å; E114-W161 WeakPolarHBondContact O-CZ2 3.38Å; E114-W161 VanDerWaalsContact OE2-CZ3 3.26Å; E114-W161 WeakPolarHBondContact OE2-CZ3 3.36Å
115	S	77.7	Confident	75.4	Confident	78 Å²	78	87.6 Å²	87.6	55%	0.545	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	133.1	179.7	61.4	0	0	0	0	109.8	E126	S115-E126 WeakPolarHBondContact CA-O 3.24Å
116	R	74.7	Confident	75.3	Confident	90 Å²	90	82.3 Å²	82.3	34%	0.34	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	146.8	178.3	-62.9	-173.5	178.8	176.3	8.2	110.2	E114 S118 V125 E126 S162	E114-R116 HydrophobicContact CG-CG 4.41Å; E114-R116 IonicContact OE1-CZ 3.37Å; E114-R116 IonicContact OE1-NE 2.77Å; E114-R116 PolarHBondContact OE1-NE 2.9Å; E114-R116 IonicContact OE1-NH2 3.15Å; E114-R116 PolarHBondContact OE1-NH2 3.4Å; E114-R116 IonicContact OE2-NH2 2.89Å; E114-R116 PolarHBondContact OE2-NH2 2.97Å; R116-S118 PolarHBondContact O-N 3.37Å; R116-V125 CarbonylContact O-C 3.54Å; R116-V125 WeakPolarHBondContact O-CA 3.07Å; R116-V125 VanDerWaalsContact O-CG1 3.3Å; R116-V125 WeakPolarHBondContact O-CG1 3.48Å; R116-E126 PolarHBondContact N-O 3.15Å; R116-E126 PolarHBondContact O-N 3.47Å; R116-S162 PolarHBondContact NH1-OG 3.29Å
117	M	73.1	Confident	75.4	Confident	120 Å²	120	78.5 Å²	78.5	59%	0.591	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60	130.7	171.3	-66.2	-62	-66.1	0	0	109.5	K119 V125	M117-K119 PolarHBondContact O-N 3.4Å; M117-V125 HydrophobicContact SD-CG2 4.12Å
118	S	67	Low	75.6	Confident	15 Å²	15	69.3 Å²	69.3	11%	0.105	35%	0.351	C	S	.	.			trans	-65.3	133.6	177.5	-176.3	0	0	0	0	109.7	R116 R120 I121 E124 E126	R116-S118 PolarHBondContact O-N 3.37Å; S118-R120 PolarHBondContact OG-N 2.89Å; S118-R120 VanDerWaalsContact OG-N 3.15Å; S118-I121 WeakPolarHBondContact CB-O 3.41Å; S118-I121 PolarHBondContact OG-N 3.46Å; S118-E124 WeakPolarHBondContact CB-O 3.34Å; S118-E124 PolarHBondContact N-O 3.06Å; S118-E126 WeakPolarHBondContact CB-OE1 3.49Å; S118-E126 PolarHBondContact OG-OE1 2.85Å
119	K	63.4	Low	75.6	Confident	167 Å²	167	69 Å²	69	73%	0.726	35%	0.349	S	S	*	.	S	Bend	trans	-88.9	-14.3	170.4	-64.4	-178	-178	175.5	0	112.2	M117	M117-K119 PolarHBondContact O-N 3.4Å
120	R	64.1	Low	75.7	Confident	119 Å²	119	66.2 Å²	66.2	45%	0.449	33%	0.334	S	S	.	.	S	Bend	trans	-89.3	-40.1	-175.5	-58.9	177.2	-173.3	-160.5	0.6	111.3	S118 I151 E164 A165	S118-R120 PolarHBondContact OG-N 2.89Å; S118-R120 VanDerWaalsContact OG-N 3.15Å; R120-I151 HydrophobicContact CB-CD1 4.29Å; R120-E164 PolarHBondContact NH2-O 3.21Å; R120-A165 VanDerWaalsContact NH2-N 3.15Å
121	I	69.6	Low	75.7	Confident	54 Å²	54	63.4 Å²	63.4	28%	0.277	32%	0.32	S	S	.	.	S	Bend	trans	-127.7	122.2	-177.7	-57.2	174.4	0	0	0	109.6	S118 E124 N150 I151	S118-I121 WeakPolarHBondContact CB-O 3.41Å; S118-I121 PolarHBondContact OG-N 3.46Å; I121-E124 HydrophobicContact CB-CB 4.25Å; I121-E124 HydrophobicContact CB-CG 4.18Å; I121-E124 HydrophobicContact CG2-CB 4.34Å; I121-E124 HydrophobicContact CG2-CG 3.78Å; I121-E124 PolarHBondContact O-N 2.77Å; I121-N150 HydrophobicContact CD1-CB 4.43Å; I121-I151 HydrophobicContact CD1-CD1 3.74Å; I121-I151 HydrophobicContact CD1-CG1 4.22Å; I121-I151 HydrophobicContact CG1-CD1 4.28Å
122	P	67.3	Low	75.8	Confident	117 Å²	117	65.5 Å²	65.5	76%	0.76	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	142.8	174.4	26.4	-31.9	0	0	0	110.7	E124	P122-E124 VanDerWaalsContact C-N 3.31Å; P122-E124 PolarHBondContact O-N 3.5Å
123	N	75.8	Confident	75.8	Confident	131 Å²	131	62.4 Å²	62.4	70%	0.701	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.9	14.2	-174.5	-77.1	0.1	0	0	0	116.9	N91	N91-N123 VanDerWaalsContact CB-O 3.28Å; N91-N123 WeakPolarHBondContact CB-O 3.41Å; N91-N123 PolarHBondContact N-O 2.77Å
124	E	81.9	Confident	75.6	Confident	10 Å²	10	61.6 Å²	61.6	5%	0.047	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	156.2	169	-67.3	-166.8	-176.8	0	0	112.5	S88 L89 S118 I121 P122 N150	S88-E124 WeakPolarHBondContact CB-OE2 3.23Å; S88-E124 PolarHBondContact OG-OE2 2.8Å; L89-E124 CarbonylContact O-C 3.49Å; L89-E124 VanDerWaalsContact O-CA 3.25Å; L89-E124 WeakPolarHBondContact O-CA 3.42Å; L89-E124 WeakPolarHBondContact O-CB 3.29Å; S118-E124 WeakPolarHBondContact CB-O 3.34Å; S118-E124 PolarHBondContact N-O 3.06Å; I121-E124 HydrophobicContact CB-CB 4.25Å; I121-E124 HydrophobicContact CB-CG 4.18Å; I121-E124 HydrophobicContact CG2-CB 4.34Å; I121-E124 HydrophobicContact CG2-CG 3.78Å; I121-E124 PolarHBondContact O-N 2.77Å; P122-E124 VanDerWaalsContact C-N 3.31Å; P122-E124 PolarHBondContact O-N 3.5Å; E124-N150 PolarHBondContact OE1-ND2 3.22Å
125	V	79.3	Confident	75.3	Confident	22 Å²	22	63.8 Å²	63.8	13%	0.133	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	128.7	174.6	-178.2	0	0	0	0	107.6	S88 L89 N91 R116 M117 I127	S88-V125 CarbonylContact C-O 3.51Å; S88-V125 WeakPolarHBondContact CA-O 3.16Å; L89-V125 PolarHBondContact N-O 3.06Å; L89-V125 PolarHBondContact O-N 2.81Å; N91-V125 HydrophobicContact CB-CG2 3.88Å; R116-V125 CarbonylContact O-C 3.54Å; R116-V125 WeakPolarHBondContact O-CA 3.07Å; R116-V125 VanDerWaalsContact O-CG1 3.3Å; R116-V125 WeakPolarHBondContact O-CG1 3.48Å; M117-V125 HydrophobicContact SD-CG2 4.12Å; V125-I127 HydrophobicContact CG1-CG1 4.4Å
126	E	81.3	Confident	75.1	Confident	14 Å²	14	67.2 Å²	67.2	7%	0.065	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	128.1	171.2	-73	170	-152.9	0	0	109.2	S115 R116 S118	S115-E126 WeakPolarHBondContact CA-O 3.24Å; R116-E126 PolarHBondContact N-O 3.15Å; R116-E126 PolarHBondContact O-N 3.47Å; S118-E126 WeakPolarHBondContact CB-OE1 3.49Å; S118-E126 PolarHBondContact OG-OE1 2.85Å
127	I	81	Confident	75.2	Confident	3 Å²	3	66 Å²	66	2%	0.015	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	135.9	-180	-66.3	148.7	0	0	0	107.6	V86 F87 L89 L96 I113 E114 V125	V86-I127 CarbonylContact C-O 3.52Å; V86-I127 VanDerWaalsContact CA-O 3.24Å; V86-I127 WeakPolarHBondContact CA-O 3.36Å; F87-I127 HydrophobicContact CE1-CB 4.11Å; F87-I127 HydrophobicContact CE1-CG2 3.78Å; F87-I127 HydrophobicContact CE2-CB 4.19Å; F87-I127 HydrophobicContact CE2-CD1 3.85Å; F87-I127 HydrophobicContact CE2-CG2 4.41Å; F87-I127 HydrophobicContact CZ-CB 3.94Å; F87-I127 HydrophobicContact CZ-CD1 4.14Å; F87-I127 HydrophobicContact CZ-CG2 3.69Å; F87-I127 PolarHBondContact N-O 3.26Å; F87-I127 PolarHBondContact O-N 3.12Å; L89-I127 HydrophobicContact CB-CD1 4.24Å; L89-I127 HydrophobicContact CD1-CD1 3.22Å; L89-I127 HydrophobicContact CG-CD1 3.7Å; L96-I127 HydrophobicContact CD1-CD1 3.48Å; L96-I127 VanDerWaalsContact CD1-CD1 3.48Å; L96-I127 HydrophobicContact CD1-CG1 4.19Å; I113-I127 HydrophobicContact CD1-CG2 3.99Å; I113-I127 HydrophobicContact CG1-CG2 3.93Å; E114-I127 WeakPolarHBondContact O-CA 3.17Å; V125-I127 HydrophobicContact CG1-CG1 4.4Å
128	F	81.4	Confident	75.5	Confident	12 Å²	12	60.7 Å²	60.7	5%	0.053	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	139.9	164.4	137.5	-40.2	0	0	0	111.8	A84 V85 V86 H112 I113 E114 D130 T156 A158 W161	A84-F128 HydrophobicContact CB-CD2 4.38Å; A84-F128 HydrophobicContact CB-CE2 3.71Å; A84-F128 HydrophobicContact CB-CZ 4.01Å; V85-F128 VanDerWaalsContact O-CA 3.24Å; V85-F128 WeakPolarHBondContact O-CA 3.35Å; V86-F128 HydrophobicContact CB-CB 4.39Å; V86-F128 HydrophobicContact CG2-CB 3.77Å; V86-F128 HydrophobicContact CG2-CD2 3.78Å; V86-F128 HydrophobicContact CG2-CG 4.35Å; H112-F128 AromaticContact CD2-CE1 3.86Å; I113-F128 VanDerWaalsContact CA-O 3.29Å; I113-F128 WeakPolarHBondContact CA-O 3.31Å; E114-F128 PolarHBondContact N-O 2.94Å; E114-F128 PolarHBondContact O-N 3.21Å; E114-F128 VanDerWaalsContact O-N 3.1Å; F128-D130 HydrophobicContact CE1-CB 4.23Å; F128-D130 HydrophobicContact CZ-CB 4.48Å; F128-T156 WeakPolarHBondContact CE2-O 3.07Å; F128-A158 HydrophobicContact CE1-CB 4.33Å; F128-A158 HydrophobicContact CE2-CB 4.16Å; F128-A158 HydrophobicContact CZ-CB 3.85Å; F128-W161 HydrophobicContact CB-CD2 3.51Å; F128-W161 VanDerWaalsContact CB-CE2 3.48Å; F128-W161 HydrophobicContact CB-CE3 3.47Å; F128-W161 VanDerWaalsContact CB-CE3 3.47Å; F128-W161 HydrophobicContact CB-CG 4.29Å; F128-W161 HydrophobicContact CB-CH2 3.23Å; F128-W161 HydrophobicContact CB-CZ2 3.42Å; F128-W161 VanDerWaalsContact CB-CZ2 3.42Å; F128-W161 HydrophobicContact CB-CZ3 3.3Å; F128-W161 AromaticContact CD1-CE3 3.77Å; F128-W161 HydrophobicContact CD1-CE3 3.77Å; F128-W161 AromaticContact CD1-CH2 3.84Å; F128-W161 HydrophobicContact CD1-CH2 3.84Å; F128-W161 AromaticContact CD1-CZ3 3.25Å; F128-W161 HydrophobicContact CD1-CZ3 3.25Å; F128-W161 HydrophobicContact CD2-CD2 4.23Å; F128-W161 AromaticContact CD2-CE3 3.83Å; F128-W161 HydrophobicContact CD2-CE3 3.83Å; F128-W161 HydrophobicContact CD2-CZ3 4.16Å; F128-W161 HydrophobicContact CE1-CZ3 4.2Å; F128-W161 AromaticContact CG-CD2 3.92Å; F128-W161 HydrophobicContact CG-CD2 3.92Å; F128-W161 AromaticContact CG-CE3 3.4Å; F128-W161 HydrophobicContact CG-CE3 3.4Å; F128-W161 AromaticContact CG-CH2 3.75Å; F128-W161 HydrophobicContact CG-CH2 3.75Å; F128-W161 HydrophobicContact CG-CZ2 4.36Å; F128-W161 AromaticContact CG-CZ3 3.27Å; F128-W161 HydrophobicContact CG-CZ3 3.27Å
129	A	80.1	Confident	75.9	Confident	1 Å²	1	64.5 Å²	64.5	1%	0.008	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	108.6	-170.6	0	0	0	0	0	106.5	A84 V85 F87 F103 L110 H112 C131	A84-A129 WeakPolarHBondContact CA-O 3.23Å; V85-A129 HydrophobicContact CG1-CB 3.88Å; V85-A129 PolarHBondContact N-O 3.21Å; V85-A129 PolarHBondContact O-N 3.17Å; F87-A129 HydrophobicContact CE1-CB 4.31Å; F103-A129 HydrophobicContact CE1-CB 4.03Å; F103-A129 HydrophobicContact CZ-CB 4.16Å; L110-A129 HydrophobicContact CD2-CB 3.67Å; H112-A129 WeakPolarHBondContact O-CA 3.27Å; A129-C131 PolarHBondContact O-SG 3.38Å
130	D	80.4	Confident	76.7	Confident	50 Å²	50	60.6 Å²	60.6	27%	0.267	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	117.1	166.6	-174	30.8	0	0	0	108.1	N111 H112 F128	N111-D130 HydrophobicContact CB-CB 4.38Å; N111-D130 PolarHBondContact N-O 2.89Å; H112-D130 HydrophobicContact CB-CB 3.96Å; H112-D130 PolarHBondContact O-N 3.44Å; F128-D130 HydrophobicContact CE1-CB 4.23Å; F128-D130 HydrophobicContact CZ-CB 4.48Å
131	C	80.7	Confident	77.5	Confident	3 Å²	3	55 Å²	55	2%	0.02	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	150.5	-170.6	-55	0	0	0	0	111	T83 V108 N109 A129 F138	T83-C131 WeakPolarHBondContact O-CA 3.2Å; T83-C131 WeakPolarHBondContact O-CB 3.25Å; T83-C131 PolarHBondContact O-N 2.91Å; T83-C131 PolarHBondContact OG1-O 3.45Å; V108-C131 HydrophobicContact CG1-CB 3.62Å; N109-C131 CarbonylContact O-C 3.56Å; N109-C131 WeakPolarHBondContact O-CA 3.33Å; A129-C131 PolarHBondContact O-SG 3.38Å; C131-F138 HydrophobicContact CB-CD2 4.4Å; C131-F138 HydrophobicContact CB-CE2 4.33Å
132	K	78.3	Confident	77.9	Confident	142 Å²	142	53 Å²	53	62%	0.617	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.3	95.7	169.7	-173	178.6	-178.1	179.2	0	108.5	N109	N109-K132 HydrophobicContact CB-CB 4.36Å; N109-K132 PolarHBondContact N-O 2.74Å; N109-K132 PolarHBondContact O-N 3.38Å
133	C	76.6	Confident	78.4	Confident	29 Å²	29	52.8 Å²	52.8	20%	0.196	26%	0.26	C	S	.	.	S	Bend	trans	-155.2	168.4	-179.7	56.8	0	0	0	0	111.3	V108 E137	V108-C133 HydrophobicContact CB-CB 4.35Å; V108-C133 HydrophobicContact CG1-CB 4.02Å; V108-C133 HydrophobicContact CG2-CB 3.96Å; C133-E137 HydrophobicContact CB-CB 4.21Å
134	S	76.1	Confident	78.5	Confident	55 Å²	55	49.8 Å²	49.8	39%	0.385	24%	0.242	S	C	.	.			trans	-70	157.8	170.8	68.5	0	0	0	0	111.2	K136 E137 F138	S134-K136 PolarHBondContact O-N 2.99Å; S134-E137 WeakPolarHBondContact CB-OE2 3.03Å; S134-E137 PolarHBondContact N-OE2 3.06Å; S134-E137 PolarHBondContact O-N 3.42Å; S134-E137 VanDerWaalsContact OG-CG 3.27Å; S134-E137 WeakPolarHBondContact OG-CG 3.36Å; S134-E137 PolarHBondContact OG-N 2.93Å; S134-E137 PolarHBondContact OG-OE2 3Å; S134-F138 WeakPolarHBondContact O-CB 3.45Å; S134-F138 PolarHBondContact O-N 2.89Å
135	K	71.7	Confident	78.3	Confident	108 Å²	108	49.4 Å²	49.4	47%	0.47	24%	0.24	S	C	.	.	H	α-helix	trans	-58.5	-32.1	176.8	-71.8	-177.8	-179.2	178	0	113	D79 N139	D79-K135 IonicContact OD2-NZ 3.77Å; D79-K135 PolarHBondContact OD2-NZ 3.27Å; K135-N139 WeakPolarHBondContact O-CB 3.13Å; K135-N139 VanDerWaalsContact O-CG 3.28Å; K135-N139 PolarHBondContact O-N 3.16Å; K135-N139 PolarHBondContact O-ND2 3.5Å
136	K	74.2	Confident	78.1	Confident	149 Å²	149	53.3 Å²	53.3	65%	0.648	26%	0.255	S	S	*	.	H	α-helix	trans	-68.4	-50.1	179.3	-172.1	179.1	175.7	-175.8	0	111	S134 F138 N139 E140	S134-K136 PolarHBondContact O-N 2.99Å; K136-F138 VanDerWaalsContact C-N 3.31Å; K136-F138 PolarHBondContact O-N 2.9Å; K136-N139 PolarHBondContact O-N 3.34Å; K136-E140 WeakPolarHBondContact CE-OE1 3.35Å; K136-E140 WeakPolarHBondContact O-CG 3.49Å; K136-E140 PolarHBondContact O-N 2.93Å; K136-E140 VanDerWaalsContact O-N 3.09Å
137	E	75.9	Confident	77.7	Confident	66 Å²	66	58.5 Å²	58.5	31%	0.308	28%	0.284	S	S	.	.	H	α-helix	trans	-62.8	-38.3	176.7	-67.1	160.4	153	0	0	111.7	C133 S134 E140 L141	C133-E137 HydrophobicContact CB-CB 4.21Å; S134-E137 WeakPolarHBondContact CB-OE2 3.03Å; S134-E137 PolarHBondContact N-OE2 3.06Å; S134-E137 PolarHBondContact O-N 3.42Å; S134-E137 VanDerWaalsContact OG-CG 3.27Å; S134-E137 WeakPolarHBondContact OG-CG 3.36Å; S134-E137 PolarHBondContact OG-N 2.93Å; S134-E137 PolarHBondContact OG-OE2 3Å; E137-E140 PolarHBondContact O-N 2.7Å; E137-L141 WeakPolarHBondContact O-CB 3.43Å; E137-L141 PolarHBondContact O-N 3.09Å
138	F	78.6	Confident	77.1	Confident	8 Å²	8	64.4 Å²	64.4	4%	0.035	31%	0.311	C	S	.	.	H	α-helix	trans	-63.6	-44	176.6	-169.5	-110	0	0	0	112.3	T83 V85 C131 S134 K136 L141 L142 F154	T83-F138 HydrophobicContact CG2-CB 4.17Å; T83-F138 HydrophobicContact CG2-CD1 3.98Å; T83-F138 HydrophobicContact CG2-CD2 3.93Å; T83-F138 HydrophobicContact CG2-CE1 4.32Å; T83-F138 HydrophobicContact CG2-CE2 4.29Å; T83-F138 HydrophobicContact CG2-CG 3.76Å; T83-F138 HydrophobicContact CG2-CZ 4.47Å; V85-F138 HydrophobicContact CB-CE2 4.3Å; V85-F138 HydrophobicContact CB-CZ 4.24Å; C131-F138 HydrophobicContact CB-CD2 4.4Å; C131-F138 HydrophobicContact CB-CE2 4.33Å; S134-F138 WeakPolarHBondContact O-CB 3.45Å; S134-F138 PolarHBondContact O-N 2.89Å; K136-F138 VanDerWaalsContact C-N 3.31Å; K136-F138 PolarHBondContact O-N 2.9Å; F138-L141 WeakPolarHBondContact O-CB 3.44Å; F138-L141 PolarHBondContact O-N 3.33Å; F138-L142 HydrophobicContact CD1-CD1 3.84Å; F138-L142 HydrophobicContact CD1-CG 4.31Å; F138-L142 HydrophobicContact CE1-CD1 3.59Å; F138-L142 HydrophobicContact CE1-CD2 4.48Å; F138-L142 HydrophobicContact CE1-CG 4.13Å; F138-L142 HydrophobicContact CZ-CD1 4.3Å; F138-L142 HydrophobicContact CZ-CD2 4.4Å; F138-L142 HydrophobicContact CZ-CG 4.44Å; F138-L142 WeakPolarHBondContact O-CG 3.47Å; F138-L142 PolarHBondContact O-N 2.85Å; F138-F154 HydrophobicContact CE1-CB 4.13Å; F138-F154 HydrophobicContact CZ-CB 4.23Å
139	N	76.5	Confident	76.8	Confident	94 Å²	94	64.6 Å²	64.6	50%	0.503	31%	0.313	S	S	.	.	H	α-helix	trans	-68.1	-37	178.8	-75.5	-27.6	0	0	0	112.4	K135 K136 L142 Q143	K135-N139 WeakPolarHBondContact O-CB 3.13Å; K135-N139 VanDerWaalsContact O-CG 3.28Å; K135-N139 PolarHBondContact O-N 3.16Å; K135-N139 PolarHBondContact O-ND2 3.5Å; K136-N139 PolarHBondContact O-N 3.34Å; N139-L142 PolarHBondContact O-N 2.96Å; N139-Q143 WeakPolarHBondContact O-CG 3.36Å; N139-Q143 PolarHBondContact O-N 3.19Å; N139-Q143 VanDerWaalsContact O-N 3.13Å
140	E	79.5	Confident	75.9	Confident	85 Å²	85	70.1 Å²	70.1	40%	0.397	34%	0.342	S	S	.	.	H	α-helix	trans	-64.9	-41	173.8	-71.8	173.4	-166.9	0	0	111.4	K136 E137 Q143 H144	K136-E140 WeakPolarHBondContact CE-OE1 3.35Å; K136-E140 WeakPolarHBondContact O-CG 3.49Å; K136-E140 PolarHBondContact O-N 2.93Å; K136-E140 VanDerWaalsContact O-N 3.09Å; E137-E140 PolarHBondContact O-N 2.7Å; E140-Q143 PolarHBondContact O-N 3.25Å; E140-H144 PolarHBondContact O-CD2 3.01Å; E140-H144 PolarHBondContact O-N 3.12Å
141	L	81.9	Confident	75.1	Confident	1 Å²	1	69.3 Å²	69.3	1%	0.005	34%	0.338	C	S	.	.	H	α-helix	trans	-60.9	-45.3	172.8	176.7	73	0	0	0	111.7	F103 V108 E137 F138 Q143 H144 L145	F103-L141 HydrophobicContact CD1-CD1 4.32Å; F103-L141 HydrophobicContact CD1-CD2 3.68Å; F103-L141 HydrophobicContact CD2-CD1 4.25Å; F103-L141 HydrophobicContact CE1-CD1 4.5Å; F103-L141 HydrophobicContact CE1-CD2 3.46Å; F103-L141 VanDerWaalsContact CE1-CD2 3.46Å; F103-L141 HydrophobicContact CE2-CD1 4.41Å; F103-L141 HydrophobicContact CG-CD1 4.21Å; F103-L141 HydrophobicContact CG-CD2 4.38Å; F103-L141 HydrophobicContact CZ-CD2 3.98Å; V108-L141 HydrophobicContact CB-CD2 4.4Å; V108-L141 HydrophobicContact CG1-CD2 4.17Å; V108-L141 HydrophobicContact CG2-CD2 4.13Å; E137-L141 WeakPolarHBondContact O-CB 3.43Å; E137-L141 PolarHBondContact O-N 3.09Å; F138-L141 WeakPolarHBondContact O-CB 3.44Å; F138-L141 PolarHBondContact O-N 3.33Å; L141-Q143 VanDerWaalsContact C-N 3.32Å; L141-Q143 PolarHBondContact O-N 3.22Å; L141-H144 PolarHBondContact O-N 2.89Å; L141-L145 HydrophobicContact CD1-CD1 4.08Å; L141-L145 HydrophobicContact CD1-CG 4.26Å; L141-L145 HydrophobicContact CD2-CD1 4.26Å; L141-L145 HydrophobicContact CG-CD1 3.81Å; L141-L145 HydrophobicContact CG-CG 4.35Å; L141-L145 WeakPolarHBondContact O-CB 3.41Å; L141-L145 WeakPolarHBondContact O-CG 3.28Å; L141-L145 PolarHBondContact O-N 2.92Å
142	L	78.1	Confident	74.6	Confident	13 Å²	13	71.3 Å²	71.3	7%	0.068	35%	0.348	C	S	.	.	H	α-helix	trans	-61.3	-38.5	179.4	-74.8	177.1	0	0	0	112.5	V85 F138 N139 K146 I152 F154	V85-L142 HydrophobicContact CB-CD2 4.33Å; V85-L142 HydrophobicContact CG2-CD2 3.62Å; F138-L142 HydrophobicContact CD1-CD1 3.84Å; F138-L142 HydrophobicContact CD1-CG 4.31Å; F138-L142 HydrophobicContact CE1-CD1 3.59Å; F138-L142 HydrophobicContact CE1-CD2 4.48Å; F138-L142 HydrophobicContact CE1-CG 4.13Å; F138-L142 HydrophobicContact CZ-CD1 4.3Å; F138-L142 HydrophobicContact CZ-CD2 4.4Å; F138-L142 HydrophobicContact CZ-CG 4.44Å; F138-L142 WeakPolarHBondContact O-CG 3.47Å; F138-L142 PolarHBondContact O-N 2.85Å; N139-L142 PolarHBondContact O-N 2.96Å; L142-K146 VanDerWaalsContact O-CG 3.31Å; L142-K146 WeakPolarHBondContact O-CG 3.29Å; L142-K146 PolarHBondContact O-N 3.2Å; L142-I152 HydrophobicContact CD2-CD1 3.62Å; L142-I152 HydrophobicContact CD2-CG1 4.14Å; L142-F154 HydrophobicContact CD1-CB 4.12Å; L142-F154 HydrophobicContact CD1-CD1 4.25Å; L142-F154 HydrophobicContact CD1-CG 4.16Å; L142-F154 HydrophobicContact CD2-CB 4.24Å
143	Q	77.8	Confident	74	Confident	112 Å²	112	66.8 Å²	66.8	52%	0.523	33%	0.334	S	S	.	.	H	α-helix	trans	-64.9	-44.5	176.8	-70.1	-65.9	-1.4	0	0	111.5	N139 E140 L141 L145 K146	N139-Q143 WeakPolarHBondContact O-CG 3.36Å; N139-Q143 PolarHBondContact O-N 3.19Å; N139-Q143 VanDerWaalsContact O-N 3.13Å; E140-Q143 PolarHBondContact O-N 3.25Å; L141-Q143 VanDerWaalsContact C-N 3.32Å; L141-Q143 PolarHBondContact O-N 3.22Å; Q143-L145 PolarHBondContact O-N 3.49Å; Q143-K146 WeakPolarHBondContact O-CB 3.37Å; Q143-K146 PolarHBondContact O-N 3.12Å
144	H	77.3	Confident	73.5	Confident	69 Å²	69	71 Å²	71	32%	0.319	35%	0.349	S	S	.	.	H	α-helix	trans	-69.2	-33.9	177.8	-79.7	-65.6	0	0	0	113.6	R106 E140 L141 D147 H148	R106-H144 PolarHBondContact NH2-NE2 3.4Å; E140-H144 PolarHBondContact O-CD2 3.01Å; E140-H144 PolarHBondContact O-N 3.12Å; L141-H144 PolarHBondContact O-N 2.89Å; H144-D147 PolarHBondContact O-N 3.26Å; H144-H148 PolarHBondContact O-ND1 3.37Å
145	L	77.9	Confident	72.6	Confident	1 Å²	1	72.6 Å²	72.6	1%	0.005	35%	0.353	C	S	.	.	H	α-helix	trans	-68.6	-34.9	175.1	-76.5	172.5	0	0	0	111.9	V85 L102 F103 L141 Q143 D147 H148 V149 I152	V85-L145 HydrophobicContact CG2-CD1 4.44Å; L102-L145 HydrophobicContact CD1-CD2 4.16Å; F103-L145 HydrophobicContact CE2-CD1 4.06Å; F103-L145 HydrophobicContact CE2-CD2 4.25Å; F103-L145 HydrophobicContact CZ-CD1 3.88Å; L141-L145 HydrophobicContact CD1-CD1 4.08Å; L141-L145 HydrophobicContact CD1-CG 4.26Å; L141-L145 HydrophobicContact CD2-CD1 4.26Å; L141-L145 HydrophobicContact CG-CD1 3.81Å; L141-L145 HydrophobicContact CG-CG 4.35Å; L141-L145 WeakPolarHBondContact O-CB 3.41Å; L141-L145 WeakPolarHBondContact O-CG 3.28Å; L141-L145 PolarHBondContact O-N 2.92Å; Q143-L145 PolarHBondContact O-N 3.49Å; L145-D147 PolarHBondContact O-N 3.1Å; L145-H148 PolarHBondContact O-N 2.93Å; L145-H148 VanDerWaalsContact O-N 3.1Å; L145-V149 VanDerWaalsContact O-CB 3.3Å; L145-V149 WeakPolarHBondContact O-CB 3.5Å; L145-V149 WeakPolarHBondContact O-CG2 3.46Å; L145-V149 PolarHBondContact O-N 3.39Å; L145-V149 VanDerWaalsContact O-N 3.09Å; L145-I152 HydrophobicContact CB-CD1 3.59Å; L145-I152 HydrophobicContact CD1-CD1 4.46Å
146	K	75.6	Confident	71.7	Confident	104 Å²	104	68.5 Å²	68.5	45%	0.452	34%	0.337	S	S	.	.	H	α-helix	trans	-57.4	-34.8	174.5	-80.9	172.7	-177.4	-178.5	0	113	L142 Q143 H148 I152	L142-K146 VanDerWaalsContact O-CG 3.31Å; L142-K146 WeakPolarHBondContact O-CG 3.29Å; L142-K146 PolarHBondContact O-N 3.2Å; Q143-K146 WeakPolarHBondContact O-CB 3.37Å; Q143-K146 PolarHBondContact O-N 3.12Å; K146-H148 PolarHBondContact O-N 3.07Å; K146-I152 HydrophobicContact CG-CD1 4.22Å; K146-I152 HydrophobicContact CG-CG2 3.76Å
147	D	72.3	Confident	70.7	Confident	123 Å²	123	64.8 Å²	64.8	66%	0.658	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-19.8	-179.5	-62.9	-24.6	0	0	0	113	H144 L145	H144-D147 PolarHBondContact O-N 3.26Å; L145-D147 PolarHBondContact O-N 3.1Å
148	H	69	Low	69.3	Low	128 Å²	128	63.8 Å²	63.8	59%	0.593	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.2	-7.1	-171.2	-65.9	84.6	0	0	0	114	H144 L145 K146	H144-H148 PolarHBondContact O-ND1 3.37Å; L145-H148 PolarHBondContact O-N 2.93Å; L145-H148 VanDerWaalsContact O-N 3.1Å; K146-H148 PolarHBondContact O-N 3.07Å
149	V	74.8	Confident	68	Low	16 Å²	16	71.1 Å²	71.1	10%	0.097	37%	0.366	C	S	.	.			trans	-134.6	139.2	-167.8	172.6	0	0	0	0	111.6	F87 S88 L89 L145 I151	F87-V149 HydrophobicContact CB-CG1 4Å; F87-V149 HydrophobicContact CB-CG2 4.44Å; F87-V149 HydrophobicContact CD2-CG2 4.06Å; S88-V149 WeakPolarHBondContact O-CG1 3.46Å; L89-V149 HydrophobicContact CD2-CG2 3.95Å; L145-V149 VanDerWaalsContact O-CB 3.3Å; L145-V149 WeakPolarHBondContact O-CB 3.5Å; L145-V149 WeakPolarHBondContact O-CG2 3.46Å; L145-V149 PolarHBondContact O-N 3.39Å; L145-V149 VanDerWaalsContact O-N 3.09Å; V149-I151 WeakPolarHBondContact CG1-O 3.39Å
150	N	61.6	Low	66.8	Low	116 Å²	116	69.3 Å²	69.3	62%	0.62	36%	0.358	S	S	*	.	S	Bend	trans	-72.4	-35.6	178.3	-70.9	-25.9	0	0	0	113.8	I121 E124	I121-N150 HydrophobicContact CD1-CB 4.43Å; E124-N150 PolarHBondContact OE1-ND2 3.22Å
151	I	63.8	Low	64.9	Low	33 Å²	33	65.6 Å²	65.6	17%	0.169	34%	0.34	C	S	.	.			trans	-127.8	123.3	-177.8	-57.7	173.1	0	0	0	109.4	F87 S88 R120 I121 V149	F87-I151 CarbonylContact C-O 3.53Å; F87-I151 WeakPolarHBondContact CA-O 3.46Å; S88-I151 PolarHBondContact N-O 2.9Å; S88-I151 PolarHBondContact OG-N 2.94Å; R120-I151 HydrophobicContact CB-CD1 4.29Å; I121-I151 HydrophobicContact CD1-CD1 3.74Å; I121-I151 HydrophobicContact CD1-CG1 4.22Å; I121-I151 HydrophobicContact CG1-CD1 4.28Å; V149-I151 WeakPolarHBondContact CG1-O 3.39Å
152	I	69.7	Low	63	Low	45 Å²	45	67.8 Å²	67.8	23%	0.231	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	132.3	171.4	-161.2	170.3	0	0	0	110.4	V85 V86 F87 L142 L145 K146	V85-I152 HydrophobicContact CG2-CD1 4.3Å; V85-I152 HydrophobicContact CG2-CG1 3.95Å; V86-I152 CarbonylContact O-C 3.56Å; V86-I152 WeakPolarHBondContact O-CA 3.38Å; F87-I152 HydrophobicContact CB-CG1 4.42Å; L142-I152 HydrophobicContact CD2-CD1 3.62Å; L142-I152 HydrophobicContact CD2-CG1 4.14Å; L145-I152 HydrophobicContact CB-CD1 3.59Å; L145-I152 HydrophobicContact CD1-CD1 4.46Å; K146-I152 HydrophobicContact CG-CD1 4.22Å; K146-I152 HydrophobicContact CG-CG2 3.76Å
153	S	65.9	Low	61.2	Low	48 Å²	48	68.7 Å²	68.7	34%	0.336	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	144.9	172.3	-158.1	0	0	0	0	109.2	V85 V86 T156	V85-S153 CarbonylContact C-O 3.53Å; V85-S153 WeakPolarHBondContact CA-O 3.39Å; V85-S153 WeakPolarHBondContact CG2-O 3.39Å; V86-S153 PolarHBondContact N-O 2.8Å; V86-S153 PolarHBondContact O-N 3.34Å; S153-T156 WeakPolarHBondContact CB-OG1 3.38Å; S153-T156 PolarHBondContact OG-OG1 3.41Å
154	F	65.6	Low	59.3	Low	117 Å²	117	68.6 Å²	68.6	51%	0.513	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	148.1	179	58.1	-87.2	0	0	0	109.3	A84 F138 L142 T156	A84-F154 CarbonylContact O-C 3.56Å; A84-F154 WeakPolarHBondContact O-CA 3Å; F138-F154 HydrophobicContact CE1-CB 4.13Å; F138-F154 HydrophobicContact CZ-CB 4.23Å; L142-F154 HydrophobicContact CD1-CB 4.12Å; L142-F154 HydrophobicContact CD1-CD1 4.25Å; L142-F154 HydrophobicContact CD1-CG 4.16Å; L142-F154 HydrophobicContact CD2-CB 4.24Å; F154-T156 PolarHBondContact O-N 3.21Å
155	N	57.1	Low	57.5	Low	88 Å²	88	68.5 Å²	68.5	47%	0.471	38%	0.376	S	S	.	.	S	Bend	trans	60.9	20.2	-179.2	-59.5	-6.5	0	0	0	115	K82 A84 P157	K82-N155 PolarHBondContact O-OD1 2.95Å; A84-N155 PolarHBondContact O-N 2.71Å; N155-P157 WeakPolarHBondContact O-CD 3.32Å
156	T	52.9	Low	55.7	Low	22 Å²	22	72.9 Å²	72.9	14%	0.135	40%	0.399	C	S	.	.			trans	-71.8	120.8	169.5	-40.5	0	0	0	0	109	F128 S153 F154 V160	F128-T156 WeakPolarHBondContact CE2-O 3.07Å; S153-T156 WeakPolarHBondContact CB-OG1 3.38Å; S153-T156 PolarHBondContact OG-OG1 3.41Å; F154-T156 PolarHBondContact O-N 3.21Å; T156-V160 HydrophobicContact CG2-CB 3.76Å; T156-V160 HydrophobicContact CG2-CG1 3.86Å
157	P	52.8	Low	54	Low	71 Å²	71	74.6 Å²	74.6	46%	0.461	41%	0.409	S	S	.	.			trans	-60.5	144.5	174.7	-19.9	30.9	0	0	0	110.6	N155 H159 V160 W161	N155-P157 WeakPolarHBondContact O-CD 3.32Å; P157-H159 PolarHBondContact O-N 3.33Å; P157-V160 HydrophobicContact CB-CG2 4.18Å; P157-V160 HydrophobicContact CG-CG2 4.1Å; P157-V160 PolarHBondContact O-N 3.1Å; P157-W161 PolarHBondContact O-N 2.89Å
158	A	45.9	Very low	52.6	Low	46 Å²	46	76.9 Å²	76.9	38%	0.38	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-26.2	-178.7	0	0	0	0	0	114	F128	F128-A158 HydrophobicContact CE1-CB 4.33Å; F128-A158 HydrophobicContact CE2-CB 4.16Å; F128-A158 HydrophobicContact CZ-CB 3.85Å
159	H	51.3	Low	51.8	Low	162 Å²	162	75.8 Å²	75.8	75%	0.75	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-19.1	176.2	98.1	-86.8	0	0	0	114.5	P157	P157-H159 PolarHBondContact O-N 3.33Å
160	V	52	Low	50.8	Low	55 Å²	55	77.3 Å²	77.3	33%	0.333	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-16.7	-178.9	-175.1	0	0	0	0	111.6	T156 P157 S162 A163	T156-V160 HydrophobicContact CG2-CB 3.76Å; T156-V160 HydrophobicContact CG2-CG1 3.86Å; P157-V160 HydrophobicContact CB-CG2 4.18Å; P157-V160 HydrophobicContact CG-CG2 4.1Å; P157-V160 PolarHBondContact O-N 3.1Å; V160-S162 PolarHBondContact O-N 3.32Å; V160-A163 HydrophobicContact CG1-CB 4.23Å; V160-A163 WeakPolarHBondContact O-CB 3.5Å; V160-A163 PolarHBondContact O-N 3.37Å
161	W	40.2	Very low	50.6	Low	7 Å²	7	72.4 Å²	72.4	3%	0.027	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-17.3	-175.7	173.2	21.7	0	0	0	114.7	V86 E114 F128 P157	V86-W161 VanDerWaalsContact CG1-CD1 3.43Å; V86-W161 HydrophobicContact CG1-CG 4.4Å; V86-W161 HydrophobicContact CG2-CB 4.43Å; V86-W161 HydrophobicContact CG2-CG 4.06Å; E114-W161 HydrophobicContact CB-CH2 3.31Å; E114-W161 HydrophobicContact CB-CZ2 4.46Å; E114-W161 HydrophobicContact CB-CZ3 3.57Å; E114-W161 HydrophobicContact CG-CH2 3.43Å; E114-W161 VanDerWaalsContact CG-CH2 3.43Å; E114-W161 HydrophobicContact CG-CZ2 4.29Å; E114-W161 HydrophobicContact CG-CZ3 3.68Å; E114-W161 WeakPolarHBondContact O-CH2 3.34Å; E114-W161 WeakPolarHBondContact O-CZ2 3.38Å; E114-W161 VanDerWaalsContact OE2-CZ3 3.26Å; E114-W161 WeakPolarHBondContact OE2-CZ3 3.36Å; F128-W161 HydrophobicContact CB-CD2 3.51Å; F128-W161 VanDerWaalsContact CB-CE2 3.48Å; F128-W161 HydrophobicContact CB-CE3 3.47Å; F128-W161 VanDerWaalsContact CB-CE3 3.47Å; F128-W161 HydrophobicContact CB-CG 4.29Å; F128-W161 HydrophobicContact CB-CH2 3.23Å; F128-W161 HydrophobicContact CB-CZ2 3.42Å; F128-W161 VanDerWaalsContact CB-CZ2 3.42Å; F128-W161 HydrophobicContact CB-CZ3 3.3Å; F128-W161 AromaticContact CD1-CE3 3.77Å; F128-W161 HydrophobicContact CD1-CE3 3.77Å; F128-W161 AromaticContact CD1-CH2 3.84Å; F128-W161 HydrophobicContact CD1-CH2 3.84Å; F128-W161 AromaticContact CD1-CZ3 3.25Å; F128-W161 HydrophobicContact CD1-CZ3 3.25Å; F128-W161 HydrophobicContact CD2-CD2 4.23Å; F128-W161 AromaticContact CD2-CE3 3.83Å; F128-W161 HydrophobicContact CD2-CE3 3.83Å; F128-W161 HydrophobicContact CD2-CZ3 4.16Å; F128-W161 HydrophobicContact CE1-CZ3 4.2Å; F128-W161 AromaticContact CG-CD2 3.92Å; F128-W161 HydrophobicContact CG-CD2 3.92Å; F128-W161 AromaticContact CG-CE3 3.4Å; F128-W161 HydrophobicContact CG-CE3 3.4Å; F128-W161 AromaticContact CG-CH2 3.75Å; F128-W161 HydrophobicContact CG-CH2 3.75Å; F128-W161 HydrophobicContact CG-CZ2 4.36Å; F128-W161 AromaticContact CG-CZ3 3.27Å; F128-W161 HydrophobicContact CG-CZ3 3.27Å; P157-W161 PolarHBondContact O-N 2.89Å
162	S	40.9	Very low	50.6	Low	48 Å²	48	76.1 Å²	76.1	34%	0.336	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.7	14.7	168.8	78.7	0	0	0	0	114.7	R116 V160	R116-S162 PolarHBondContact NH1-OG 3.29Å; V160-S162 PolarHBondContact O-N 3.32Å
163	A	40.8	Very low	50	Low	31 Å²	31	75.5 Å²	75.5	26%	0.256	41%	0.406	S	S	.	.	S	Bend	trans	-62.1	149.5	157.6	0	0	0	0	0	106.4	V160	V160-A163 HydrophobicContact CG1-CB 4.23Å; V160-A163 WeakPolarHBondContact O-CB 3.5Å; V160-A163 PolarHBondContact O-N 3.37Å
164	E	39.1	Very low	49.5	Very low	110 Å²	110	74.2 Å²	74.2	51%	0.514	40%	0.396	S	S	.	.			trans	-56.3	172	176.3	-53.2	-177.6	146.9	0	0	106.6	R120 D166 K472	R120-E164 PolarHBondContact NH2-O 3.21Å; E164-D166 VanDerWaalsContact CB-OD1 3.28Å; E164-D166 WeakPolarHBondContact CB-OD1 3.17Å; E164-D166 PolarHBondContact N-OD1 2.88Å; E164-D166 VanDerWaalsContact N-OD1 3.15Å; E164-D166 PolarHBondContact O-N 3.18Å; E164-K472 IonicContact OE1-NZ 2.9Å; E164-K472 PolarHBondContact OE1-NZ 3.45Å; E164-K472 IonicContact OE2-NZ 2.58Å; E164-K472 PolarHBondContact OE2-NZ 2.87Å; E164-K472 VanDerWaalsContact OE2-NZ 3.15Å
165	A	38.9	Very low	48.8	Very low	68 Å²	68	72.7 Å²	72.7	56%	0.562	39%	0.392	S	S	*	.	S	Bend	trans	-62.6	83.1	148.7	0	0	0	0	0	102.7	R120 E167	R120-A165 VanDerWaalsContact NH2-N 3.15Å; A165-E167 PolarHBondContact O-N 3.47Å
166	D	39.1	Very low	48.7	Very low	92 Å²	92	74.3 Å²	74.3	49%	0.492	40%	0.395	S	S	.	.			trans	-61.3	112.5	-169.8	-85.4	-9.5	0	0	0	102.5	E164 E168	E164-D166 VanDerWaalsContact CB-OD1 3.28Å; E164-D166 WeakPolarHBondContact CB-OD1 3.17Å; E164-D166 PolarHBondContact N-OD1 2.88Å; E164-D166 VanDerWaalsContact N-OD1 3.15Å; E164-D166 PolarHBondContact O-N 3.18Å; D166-E168 PolarHBondContact O-N 3.36Å
167	E	41.1	Very low	48.9	Very low	140 Å²	140	74.5 Å²	74.5	65%	0.654	39%	0.394	S	S	*	.			trans	-34.6	118.3	153.6	-68	179.8	160.3	0	0	106.4	A165 N169	A165-E167 PolarHBondContact O-N 3.47Å; E167-N169 PolarHBondContact O-N 2.94Å
168	E	42.7	Very low	49.3	Very low	172 Å²	172	73.7 Å²	73.7	80%	0.804	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-26.9	121.6	-170.9	-63.5	173.9	139.3	0	0	113.9	D166 V170	D166-E168 PolarHBondContact O-N 3.36Å; E168-V170 PolarHBondContact O-N 2.74Å
169	N	51.2	Low	49.8	Very low	104 Å²	104	73.2 Å²	73.2	56%	0.556	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	43.9	150.9	-60.9	-40.7	0	0	0	118.1	E167 P171 Q359	E167-N169 PolarHBondContact O-N 2.94Å; N169-P171 WeakPolarHBondContact O-CD 3.32Å; N169-Q359 VanDerWaalsContact C-OE1 3.28Å; N169-Q359 HydrophobicContact CB-CB 4.45Å; N169-Q359 HydrophobicContact CB-CG 4.45Å; N169-Q359 VanDerWaalsContact CG-NE2 3.35Å; N169-Q359 PolarHBondContact O-OE1 2.88Å; N169-Q359 PolarHBondContact OD1-NE2 2.82Å
170	V	54	Low	50.1	Low	48 Å²	48	66.8 Å²	66.8	29%	0.291	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-88.6	118.8	169.1	-179.2	0	0	0	0	110.6	E168 P456 F457	E168-V170 PolarHBondContact O-N 2.74Å; V170-P456 HydrophobicContact CG2-CG 3.61Å; V170-F457 HydrophobicContact CB-CE1 4.47Å; V170-F457 HydrophobicContact CG1-CE1 3.75Å; V170-F457 HydrophobicContact CG1-CZ 3.58Å; V170-F457 HydrophobicContact CG2-CE1 4.02Å
171	P	57.6	Low	50.3	Low	14 Å²	14	65.2 Å²	65.2	9%	0.091	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-64.4	138.3	175	-21.1	32.9	0	0	0	112	N169 F173 L356 Q359 L360	N169-P171 WeakPolarHBondContact O-CD 3.32Å; P171-F173 WeakPolarHBondContact O-CD1 3.45Å; P171-L356 HydrophobicContact CB-CD2 4.08Å; P171-L356 HydrophobicContact CB-CG 4.45Å; P171-L356 HydrophobicContact CG-CD2 4.38Å; P171-Q359 HydrophobicContact CG-CB 4.04Å; P171-L360 HydrophobicContact CG-CB 4.19Å; P171-L360 HydrophobicContact CG-CD1 3.8Å; P171-L360 HydrophobicContact CG-CG 3.96Å
172	W	63.4	Low	51.2	Low	111 Å²	111	70.5 Å²	70.5	42%	0.42	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-57.3	139	173.6	179.8	91.9	0	0	0	112.1	P174 I355	W172-P174 HydrophobicContact CH2-CB 4.07Å; W172-I355 HydrophobicContact CE3-CD1 4.33Å; W172-I355 HydrophobicContact CE3-CG2 3.79Å; W172-I355 HydrophobicContact CZ3-CD1 3.78Å; W172-I355 HydrophobicContact CZ3-CG2 4.3Å
173	F	57.7	Low	51.7	Low	31 Å²	31	68.5 Å²	68.5	14%	0.136	35%	0.352	C	S	.	.			trans	-141.2	152	170.2	60.7	-86.9	0	0	0	109.9	P171 M175 F457 V468 L470	P171-F173 WeakPolarHBondContact O-CD1 3.45Å; F173-M175 HydrophobicContact CE2-CG 4.19Å; F173-M175 PolarHBondContact O-N 3.45Å; F173-F457 HydrophobicContact CE1-CE2 4.02Å; F173-F457 AromaticContact CE1-CZ 3.84Å; F173-F457 HydrophobicContact CE1-CZ 3.84Å; F173-F457 AromaticContact CZ-CE2 4Å; F173-F457 HydrophobicContact CZ-CE2 4Å; F173-F457 HydrophobicContact CZ-CZ 4.18Å; F173-V468 HydrophobicContact CE2-CG1 4.37Å; F173-L470 HydrophobicContact CE2-CD2 4.2Å; F173-L470 HydrophobicContact CZ-CD2 3.59Å
174	P	54.4	Low	52.2	Low	22 Å²	22	67.8 Å²	67.8	14%	0.143	35%	0.345	C	S	.	.			trans	-69.1	130.1	-179.3	28	-34.2	0	0	0	110.9	W172 E179 L180	W172-P174 HydrophobicContact CH2-CB 4.07Å; P174-E179 HydrophobicContact CB-CB 3.91Å; P174-L180 HydrophobicContact CB-CD2 4.32Å; P174-L180 HydrophobicContact CG-CD2 3.82Å
175	M	52.7	Low	52.8	Low	84 Å²	84	67.8 Å²	67.8	41%	0.414	35%	0.345	S	S	.	.	S	Bend	trans	-95	-25.7	178	-66.7	-174.6	-69.3	0	0	112.2	F173 E179 S467 V468 L470	F173-M175 HydrophobicContact CE2-CG 4.19Å; F173-M175 PolarHBondContact O-N 3.45Å; M175-E179 PolarHBondContact N-OE2 3.49Å; M175-S467 CarbonylContact O-C 3.52Å; M175-S467 WeakPolarHBondContact O-CA 3.37Å; M175-V468 PolarHBondContact O-N 3.01Å; M175-L470 HydrophobicContact SD-CD1 4.3Å
176	K	54.2	Low	53.3	Low	123 Å²	123	72.7 Å²	72.7	54%	0.535	35%	0.349	S	S	.	.	B	Isolated β-bridge	trans	-117.1	146.9	174	-63.9	-179.1	-178.3	179.7	0	110.6	S178 E179	K176-S178 PolarHBondContact O-N 3.09Å; K176-S178 VanDerWaalsContact O-N 3.16Å; K176-E179 HydrophobicContact CB-CG 4.14Å; K176-E179 PolarHBondContact N-OE2 3.37Å; K176-E179 WeakPolarHBondContact O-CB 3.48Å; K176-E179 PolarHBondContact O-N 3.44Å
177	I	57.7	Low	53.7	Low	25 Å²	25	71 Å²	71	13%	0.128	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-54	-35.4	176.2	-171	176.6	0	0	0	113.4	E179 L180 F222 P299 Q466	I177-E179 PolarHBondContact O-N 2.93Å; I177-L180 HydrophobicContact CG1-CD1 4.14Å; I177-L180 VanDerWaalsContact O-CB 3.3Å; I177-L180 WeakPolarHBondContact O-CB 3.33Å; I177-L180 WeakPolarHBondContact O-CD1 3.41Å; I177-L180 VanDerWaalsContact O-CG 3.27Å; I177-L180 WeakPolarHBondContact O-CG 3.38Å; I177-L180 PolarHBondContact O-N 2.89Å; I177-F222 HydrophobicContact CB-CE2 4.43Å; I177-F222 HydrophobicContact CB-CZ 4.31Å; I177-F222 HydrophobicContact CD1-CD2 4.13Å; I177-F222 HydrophobicContact CD1-CE2 3.24Å; I177-F222 HydrophobicContact CD1-CZ 3.55Å; I177-F222 HydrophobicContact CG1-CD2 3.99Å; I177-F222 HydrophobicContact CG1-CE2 3.56Å; I177-F222 HydrophobicContact CG1-CZ 3.9Å; I177-F222 HydrophobicContact CG2-CD1 4.35Å; I177-F222 HydrophobicContact CG2-CE1 3.64Å; I177-F222 HydrophobicContact CG2-CE2 4.08Å; I177-F222 HydrophobicContact CG2-CZ 3.49Å; I177-F222 VanDerWaalsContact CG2-CZ 3.49Å; I177-P299 HydrophobicContact CD1-CB 3.39Å; I177-P299 HydrophobicContact CD1-CG 3.62Å; I177-P299 HydrophobicContact CG1-CB 4.03Å; I177-P299 HydrophobicContact CG1-CG 4.38Å; I177-Q466 HydrophobicContact CG2-CB 4.18Å
178	S	60.1	Low	53.7	Low	54 Å²	54	70.4 Å²	70.4	38%	0.378	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-66.5	-24.9	177.7	54.3	0	0	0	0	113.4	K176 L180 D181	K176-S178 PolarHBondContact O-N 3.09Å; K176-S178 VanDerWaalsContact O-N 3.16Å; S178-L180 PolarHBondContact O-N 2.94Å; S178-D181 PolarHBondContact O-N 2.97Å
179	E	56.1	Low	53.5	Low	37 Å²	37	65.6 Å²	65.6	17%	0.173	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-72.5	-13.2	179.8	-64.5	169.2	-172.2	0	0	112.3	P174 M175 K176 I177 D181 Q182	P174-E179 HydrophobicContact CB-CB 3.91Å; M175-E179 PolarHBondContact N-OE2 3.49Å; K176-E179 HydrophobicContact CB-CG 4.14Å; K176-E179 PolarHBondContact N-OE2 3.37Å; K176-E179 WeakPolarHBondContact O-CB 3.48Å; K176-E179 PolarHBondContact O-N 3.44Å; I177-E179 PolarHBondContact O-N 2.93Å; E179-D181 PolarHBondContact O-N 3.35Å; E179-D181 VanDerWaalsContact O-N 3.13Å; E179-Q182 WeakPolarHBondContact O-CB 3.37Å; E179-Q182 WeakPolarHBondContact O-CG 3.41Å; E179-Q182 PolarHBondContact O-N 2.97Å
180	L	57.7	Low	53.2	Low	27 Å²	27	64.6 Å²	64.6	14%	0.141	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-58.5	-23.4	170.8	-66	174.3	0	0	0	112.7	P174 I177 S178 Q182 C183 H302	P174-L180 HydrophobicContact CB-CD2 4.32Å; P174-L180 HydrophobicContact CG-CD2 3.82Å; I177-L180 HydrophobicContact CG1-CD1 4.14Å; I177-L180 VanDerWaalsContact O-CB 3.3Å; I177-L180 WeakPolarHBondContact O-CB 3.33Å; I177-L180 WeakPolarHBondContact O-CD1 3.41Å; I177-L180 VanDerWaalsContact O-CG 3.27Å; I177-L180 WeakPolarHBondContact O-CG 3.38Å; I177-L180 PolarHBondContact O-N 2.89Å; S178-L180 PolarHBondContact O-N 2.94Å; L180-Q182 PolarHBondContact O-N 3.31Å; L180-C183 PolarHBondContact O-N 3.41Å; L180-H302 HydrophobicContact CD2-CB 4.41Å
181	D	56.7	Low	53	Low	21 Å²	21	63.2 Å²	63.2	11%	0.112	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-67.1	-22.7	175.2	-71.7	-13.2	0	0	0	112.9	S178 E179 C183 S184 K221 F222 R305	S178-D181 PolarHBondContact O-N 2.97Å; E179-D181 PolarHBondContact O-N 3.35Å; E179-D181 VanDerWaalsContact O-N 3.13Å; D181-C183 PolarHBondContact O-N 3.15Å; D181-S184 WeakPolarHBondContact O-CB 3.49Å; D181-S184 PolarHBondContact O-N 3.33Å; D181-S184 PolarHBondContact O-OG 3.33Å; D181-K221 HydrophobicContact CB-CD 4.13Å; D181-K221 WeakPolarHBondContact OD2-CA 3.44Å; D181-K221 WeakPolarHBondContact OD2-CD 3.47Å; D181-F222 PolarHBondContact OD1-N 2.86Å; D181-F222 WeakPolarHBondContact OD2-CB 3.11Å; D181-F222 PolarHBondContact OD2-N 2.89Å; D181-R305 IonicContact OD1-CZ 2.76Å; D181-R305 IonicContact OD1-NH1 3.17Å; D181-R305 PolarHBondContact OD1-NH1 3.47Å; D181-R305 IonicContact OD1-NH2 3.71Å; D181-R305 PolarHBondContact OD1-NH2 3.39Å
182	Q	58.8	Low	52.6	Low	118 Å²	118	65.4 Å²	65.4	55%	0.551	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-70.9	-24.2	175.7	-57.5	177.5	18.1	0	0	111.7	E179 L180	E179-Q182 WeakPolarHBondContact O-CB 3.37Å; E179-Q182 WeakPolarHBondContact O-CG 3.41Å; E179-Q182 PolarHBondContact O-N 2.97Å; L180-Q182 PolarHBondContact O-N 3.31Å
183	C	52.3	Low	52.1	Low	7 Å²	7	67.8 Å²	67.8	5%	0.047	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-18.5	178.5	-45.3	0	0	0	0	112.7	L180 D181 H185 R186 I355	L180-C183 PolarHBondContact O-N 3.41Å; D181-C183 PolarHBondContact O-N 3.15Å; C183-H185 VanDerWaalsContact C-N 3.27Å; C183-H185 PolarHBondContact O-N 3.02Å; C183-R186 PolarHBondContact O-N 2.88Å; C183-R186 VanDerWaalsContact O-N 3.14Å; C183-I355 HydrophobicContact CB-CD1 3.79Å; C183-I355 WeakPolarHBondContact SG-CD1 3.26Å
184	S	51.5	Low	52.1	Low	16 Å²	16	67.2 Å²	67.2	11%	0.112	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-31.7	-169.4	60.5	0	0	0	0	114.7	D181 R186	D181-S184 WeakPolarHBondContact O-CB 3.49Å; D181-S184 PolarHBondContact O-N 3.33Å; D181-S184 PolarHBondContact O-OG 3.33Å; S184-R186 VanDerWaalsContact C-N 3.32Å; S184-R186 PolarHBondContact O-N 3.49Å
185	H	50.6	Low	52.4	Low	110 Å²	110	70 Å²	70	51%	0.509	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-2.1	-176.1	-64.2	63.6	0	0	0	113.4	C183 V187 M218	C183-H185 VanDerWaalsContact C-N 3.27Å; C183-H185 PolarHBondContact O-N 3.02Å; H185-V187 PolarHBondContact O-N 3.41Å; H185-M218 HydrophobicContact CB-SD 4.44Å
186	R	50	Low	53	Low	170 Å²	170	69.5 Å²	69.5	64%	0.642	36%	0.358	S	S	*	.			trans	-99	55.5	-174.4	-59.8	-174.5	-177.6	-173	0.7	112	C183 S184 L188	C183-R186 PolarHBondContact O-N 2.88Å; C183-R186 VanDerWaalsContact O-N 3.14Å; S184-R186 VanDerWaalsContact C-N 3.32Å; S184-R186 PolarHBondContact O-N 3.49Å; R186-L188 PolarHBondContact O-N 3.31Å
187	V	48	Very low	53.3	Low	56 Å²	56	70.6 Å²	70.6	34%	0.339	37%	0.37	S	S	.	.			trans	-82.6	108.8	177.6	179.8	0	0	0	0	109.6	H185 M189 M218	H185-V187 PolarHBondContact O-N 3.41Å; V187-M189 WeakPolarHBondContact CG1-O 3.3Å; V187-M218 HydrophobicContact CB-CE 4.07Å; V187-M218 HydrophobicContact CG2-CE 3.5Å; V187-M218 VanDerWaalsContact CG2-CE 3.5Å
188	L	41.5	Very low	53.4	Low	128 Å²	128	70.5 Å²	70.5	67%	0.67	37%	0.369	S	S	*	.			trans	-89.1	-20.4	-179.9	-49.9	103.5	0	0	0	115.4	R186 R354	R186-L188 PolarHBondContact O-N 3.31Å; L188-R354 HydrophobicContact CD1-CG 4.41Å; L188-R354 VanDerWaalsContact CD1-NE 3.28Å; L188-R354 VanDerWaalsContact CD1-NH2 3.28Å
189	M	38.7	Very low	53.5	Low	72 Å²	72	70.6 Å²	70.6	36%	0.355	37%	0.368	S	S	.	.	S	Bend	trans	-142.7	151.9	-178.4	-64.1	-128.7	82.8	0	0	111	M24 V187 G191	M24-M189 HydrophobicContact CE-SD 3.78Å; M24-M189 HydrophobicContact SD-CE 4.29Å; M24-M189 HydrophobicContact SD-SD 3.52Å; V187-M189 WeakPolarHBondContact CG1-O 3.3Å; M189-G191 PolarHBondContact O-N 3.2Å
190	Y	44.8	Very low	53.9	Low	83 Å²	83	68.9 Å²	68.9	33%	0.325	36%	0.36	S	S	.	.	S	Bend	trans	56.4	30.3	-179.5	-52.7	-71.8	0	0	0	114.8	M24	M24-Y190 HydrophobicContact CE-CE2 4.13Å
191	G	48.1	Very low	54.5	Low	19 Å²	19	71 Å²	71	20%	0.196	37%	0.368	C	S	.	.	S	Bend	trans	-69.6	-143	173	0	0	0	0	0	112.5	M189 E193	M189-G191 PolarHBondContact O-N 3.2Å; G191-E193 PolarHBondContact O-N 3.1Å
192	S	50.3	Low	55.3	Low	59 Å²	59	78.8 Å²	78.8	41%	0.413	40%	0.401	S	S	.	.	S	Bend	trans	-63.6	-22.6	177.3	46.4	0	0	0	0	113.7
193	E	52.4	Low	56.3	Low	162 Å²	162	74.9 Å²	74.9	76%	0.757	38%	0.384	S	S	*	.	S	Bend	trans	-104.3	140.4	-176.5	-61.3	-170.9	170.2	0	0	111.6	G191	G191-E193 PolarHBondContact O-N 3.1Å
194	L	58.7	Low	57.7	Low	18 Å²	18	79.6 Å²	79.6	9%	0.094	41%	0.409	C	S	.	.			trans	-102.7	142.2	179.2	-67.9	179.2	0	0	0	109.4	H198 G200 F201 Y206 R207	L194-H198 HydrophobicContact CB-CB 4.1Å; L194-H198 HydrophobicContact CD2-CB 4.33Å; L194-G200 WeakPolarHBondContact CD1-O 3.32Å; L194-F201 HydrophobicContact CB-CD2 3.89Å; L194-F201 VanDerWaalsContact O-CD2 3.3Å; L194-F201 WeakPolarHBondContact O-CD2 3.47Å; L194-F201 VanDerWaalsContact O-CE2 3.28Å; L194-F201 WeakPolarHBondContact O-CE2 3.27Å; L194-Y206 HydrophobicContact CD1-CD1 3.94Å; L194-Y206 HydrophobicContact CD1-CE1 3.88Å; L194-Y206 HydrophobicContact CD2-CE1 4.47Å; L194-R207 HydrophobicContact CD1-CG 3.56Å; L194-R207 HydrophobicContact CG-CG 4.33Å
195	D	60.8	Low	59.1	Low	81 Å²	81	83.5 Å²	83.5	43%	0.433	43%	0.431	S	S	.	.			trans	-63.6	149.4	166.7	-61.4	-45.3	0	0	0	110.4	D197 H198 F201	D195-D197 PolarHBondContact O-N 3.38Å; D195-D197 VanDerWaalsContact O-N 3.15Å; D195-H198 WeakPolarHBondContact O-CB 3.49Å; D195-H198 PolarHBondContact O-N 3.28Å; D195-F201 WeakPolarHBondContact O-CD2 3.37Å
196	A	63.7	Low	60.2	Low	73 Å²	73	78.5 Å²	78.5	60%	0.603	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-30.1	-178.8	0	0	0	0	0	113.2	H198 F201	A196-H198 VanDerWaalsContact C-N 3.29Å; A196-F201 HydrophobicContact CB-CZ 4.46Å
197	D	61	Low	61.3	Low	147 Å²	147	73.7 Å²	73.7	79%	0.786	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-7.9	178.1	-60.9	-37	0	0	0	113	D195	D195-D197 PolarHBondContact O-N 3.38Å; D195-D197 VanDerWaalsContact O-N 3.15Å
198	H	60.8	Low	62.8	Low	23 Å²	23	77.5 Å²	77.5	11%	0.106	40%	0.404	C	S	.	.	S	Bend	trans	-65.4	130.9	176.3	-169	-81.5	0	0	0	108.7	L194 D195 A196 G200 F201 Y206 R210	L194-H198 HydrophobicContact CB-CB 4.1Å; L194-H198 HydrophobicContact CD2-CB 4.33Å; D195-H198 WeakPolarHBondContact O-CB 3.49Å; D195-H198 PolarHBondContact O-N 3.28Å; A196-H198 VanDerWaalsContact C-N 3.29Å; H198-G200 PolarHBondContact ND1-N 2.83Å; H198-G200 PolarHBondContact O-N 3.47Å; H198-G200 VanDerWaalsContact O-N 3.09Å; H198-F201 HydrophobicContact CB-CB 4.37Å; H198-F201 WeakPolarHBondContact O-CA 3.4Å; H198-F201 WeakPolarHBondContact O-CB 3.3Å; H198-F201 PolarHBondContact O-N 3.19Å; H198-Y206 AromaticContact CE1-CE1 3.62Å; H198-Y206 AromaticContact CE1-CZ 3.8Å; H198-Y206 PolarHBondContact CE1-OH 3.36Å; H198-Y206 VanDerWaalsContact CE1-OH 3.3Å; H198-R210 PolarHBondContact NE2-NH1 3.09Å
199	P	61	Low	64.6	Low	56 Å²	56	74 Å²	74	36%	0.364	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-20.5	-170.4	34.1	-41.9	0	0	0	111.2	C320 Y321	P199-C320 HydrophobicContact CB-CB 3.15Å; P199-C320 HydrophobicContact CG-CB 3.5Å; P199-C320 VanDerWaalsContact CG-CB 3.5Å; P199-C320 VanDerWaalsContact O-CB 3.29Å; P199-C320 WeakPolarHBondContact O-CB 3.49Å; P199-C320 PolarHBondContact O-SG 2.92Å; P199-C320 VanDerWaalsContact O-SG 3.35Å; P199-Y321 HydrophobicContact CG-CD2 4.24Å; P199-Y321 HydrophobicContact CG-CE2 4Å
200	G	65.2	Low	66.2	Low	0 Å²	0	71.2 Å²	71.2	0%	0	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	4.8	169.1	0	0	0	0	0	115.5	L194 H198 K202 D203 C320	L194-G200 WeakPolarHBondContact CD1-O 3.32Å; H198-G200 PolarHBondContact ND1-N 2.83Å; H198-G200 PolarHBondContact O-N 3.47Å; H198-G200 VanDerWaalsContact O-N 3.09Å; G200-K202 PolarHBondContact O-N 3.23Å; G200-D203 PolarHBondContact O-N 3.49Å; G200-D203 VanDerWaalsContact O-N 3.12Å; G200-C320 WeakPolarHBondContact CA-SG 3.29Å; G200-C320 PolarHBondContact N-SG 3.33Å
201	F	69	Low	67.7	Low	71 Å²	71	72 Å²	72	31%	0.311	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-28.9	-177.5	-178.4	-98.1	0	0	0	112.6	L194 D195 A196 H198 R207	L194-F201 HydrophobicContact CB-CD2 3.89Å; L194-F201 VanDerWaalsContact O-CD2 3.3Å; L194-F201 WeakPolarHBondContact O-CD2 3.47Å; L194-F201 VanDerWaalsContact O-CE2 3.28Å; L194-F201 WeakPolarHBondContact O-CE2 3.27Å; D195-F201 WeakPolarHBondContact O-CD2 3.37Å; A196-F201 HydrophobicContact CB-CZ 4.46Å; H198-F201 HydrophobicContact CB-CB 4.37Å; H198-F201 WeakPolarHBondContact O-CA 3.4Å; H198-F201 WeakPolarHBondContact O-CB 3.3Å; H198-F201 PolarHBondContact O-N 3.19Å; F201-R207 PolarHBondContact O-NE 2.95Å; F201-R207 PolarHBondContact O-NH1 2.79Å; F201-R207 PolarHBondContact O-NH2 2.89Å
202	K	75	Confident	69.1	Low	186 Å²	186	75.6 Å²	75.6	81%	0.809	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-10.5	177.9	-64.8	-172	179.6	-175	0	114	G200 N204	G200-K202 PolarHBondContact O-N 3.23Å; K202-N204 PolarHBondContact O-N 2.81Å
203	D	78.9	Confident	70.1	Confident	36 Å²	36	73.2 Å²	73.2	19%	0.193	36%	0.363	C	S	.	.			trans	-86.4	112	-179.2	-175.6	-21.5	0	0	0	109.8	G200 V205 Y206 R207 K319	G200-D203 PolarHBondContact O-N 3.49Å; G200-D203 VanDerWaalsContact O-N 3.12Å; D203-V205 WeakPolarHBondContact OD1-CB 3.44Å; D203-V205 PolarHBondContact OD1-N 3.08Å; D203-Y206 PolarHBondContact OD1-N 3.2Å; D203-R207 WeakPolarHBondContact O-CB 3.44Å; D203-R207 VanDerWaalsContact O-CG 3.31Å; D203-R207 WeakPolarHBondContact O-CG 3.06Å; D203-R207 PolarHBondContact O-N 3.44Å; D203-R207 VanDerWaalsContact O-N 3.11Å; D203-R207 PolarHBondContact O-NE 3.48Å; D203-K319 WeakPolarHBondContact OD2-CD 3.3Å; D203-K319 VanDerWaalsContact OD2-CE 3.27Å; D203-K319 WeakPolarHBondContact OD2-CE 3.45Å; D203-K319 IonicContact OD2-NZ 3.62Å; D203-K319 PolarHBondContact OD2-NZ 2.94Å
204	N	81.7	Confident	70.9	Confident	105 Å²	105	66.3 Å²	66.3	56%	0.561	33%	0.332	S	S	*	.	H	α-helix	trans	-72.7	-37.4	-179.2	-70	-16.8	0	0	0	112.5	K202 Y206 R207 Q208	K202-N204 PolarHBondContact O-N 2.81Å; N204-Y206 VanDerWaalsContact C-N 3.32Å; N204-R207 PolarHBondContact O-N 3.2Å; N204-R207 PolarHBondContact OD1-NH2 3.08Å; N204-Q208 WeakPolarHBondContact O-CG 3.23Å; N204-Q208 PolarHBondContact O-N 2.76Å
205	V	80.6	Confident	71.6	Confident	98 Å²	98	70.9 Å²	70.9	59%	0.594	35%	0.353	S	S	*	.	H	α-helix	trans	-64.9	-44.2	178.6	178	0	0	0	0	109.2	D203 R207 Q208 R209	D203-V205 WeakPolarHBondContact OD1-CB 3.44Å; D203-V205 PolarHBondContact OD1-N 3.08Å; V205-R207 PolarHBondContact O-N 3.1Å; V205-Q208 PolarHBondContact O-N 2.79Å; V205-R209 VanDerWaalsContact O-CB 3.3Å; V205-R209 WeakPolarHBondContact O-CB 3.03Å; V205-R209 PolarHBondContact O-N 3.04Å
206	Y	73.5	Confident	72.2	Confident	6 Å²	6	68.4 Å²	68.4	2%	0.024	34%	0.341	C	S	.	.	H	α-helix	trans	-60.2	-44.8	175.1	-178.4	-93.6	0	0	0	112.9	L194 H198 D203 N204 R209 R210 F316	L194-Y206 HydrophobicContact CD1-CD1 3.94Å; L194-Y206 HydrophobicContact CD1-CE1 3.88Å; L194-Y206 HydrophobicContact CD2-CE1 4.47Å; H198-Y206 AromaticContact CE1-CE1 3.62Å; H198-Y206 AromaticContact CE1-CZ 3.8Å; H198-Y206 PolarHBondContact CE1-OH 3.36Å; H198-Y206 VanDerWaalsContact CE1-OH 3.3Å; D203-Y206 PolarHBondContact OD1-N 3.2Å; N204-Y206 VanDerWaalsContact C-N 3.32Å; Y206-R209 PolarHBondContact O-N 2.79Å; Y206-R210 HydrophobicContact CD1-CG 4.16Å; Y206-R210 HydrophobicContact CE1-CG 3.72Å; Y206-R210 WeakPolarHBondContact O-CG 3.49Å; Y206-R210 PolarHBondContact O-N 3.15Å; Y206-R210 PolarHBondContact OH-NH1 2.93Å; Y206-F316 AromaticContact CD2-CD1 3.99Å; Y206-F316 HydrophobicContact CD2-CD1 3.99Å; Y206-F316 HydrophobicContact CE2-CB 3.42Å; Y206-F316 VanDerWaalsContact CE2-CB 3.42Å; Y206-F316 AromaticContact CE2-CD1 3.61Å; Y206-F316 HydrophobicContact CE2-CD1 3.61Å; Y206-F316 AromaticContact CE2-CG 3.9Å; Y206-F316 HydrophobicContact CE2-CG 3.9Å; Y206-F316 WeakPolarHBondContact CE2-O 3.01Å; Y206-F316 VanDerWaalsContact CZ-O 3.25Å; Y206-F316 VanDerWaalsContact OH-C 3.25Å; Y206-F316 VanDerWaalsContact OH-CB 3.28Å; Y206-F316 WeakPolarHBondContact OH-CB 3.2Å; Y206-F316 PolarHBondContact OH-O 3.02Å
207	R	74.4	Confident	72.3	Confident	69 Å²	69	66 Å²	66	26%	0.26	32%	0.321	S	S	.	.	H	α-helix	trans	-62.5	-43.6	177.7	-79.5	-174.6	-82.8	-175	-4.5	112	L194 F201 D203 N204 V205 R210 K211	L194-R207 HydrophobicContact CD1-CG 3.56Å; L194-R207 HydrophobicContact CG-CG 4.33Å; F201-R207 PolarHBondContact O-NE 2.95Å; F201-R207 PolarHBondContact O-NH1 2.79Å; F201-R207 PolarHBondContact O-NH2 2.89Å; D203-R207 WeakPolarHBondContact O-CB 3.44Å; D203-R207 VanDerWaalsContact O-CG 3.31Å; D203-R207 WeakPolarHBondContact O-CG 3.06Å; D203-R207 PolarHBondContact O-N 3.44Å; D203-R207 VanDerWaalsContact O-N 3.11Å; D203-R207 PolarHBondContact O-NE 3.48Å; N204-R207 PolarHBondContact O-N 3.2Å; N204-R207 PolarHBondContact OD1-NH2 3.08Å; V205-R207 PolarHBondContact O-N 3.1Å; R207-R210 PolarHBondContact O-N 2.61Å; R207-K211 WeakPolarHBondContact O-CG 3.19Å; R207-K211 PolarHBondContact O-N 3.27Å
208	Q	79.8	Confident	72.6	Confident	136 Å²	136	61 Å²	61	64%	0.636	29%	0.293	S	S	*	.	H	α-helix	trans	-63.1	-44.1	174.8	-72.9	175.6	-10.4	0	0	111.5	N204 V205 R210 K211 Y212	N204-Q208 WeakPolarHBondContact O-CG 3.23Å; N204-Q208 PolarHBondContact O-N 2.76Å; V205-Q208 PolarHBondContact O-N 2.79Å; Q208-R210 VanDerWaalsContact C-N 3.33Å; Q208-R210 PolarHBondContact O-N 3.45Å; Q208-K211 WeakPolarHBondContact O-CB 3.28Å; Q208-K211 PolarHBondContact O-N 3.36Å; Q208-Y212 PolarHBondContact O-N 2.93Å
209	R	79.3	Confident	73.3	Confident	55 Å²	55	65.8 Å²	65.8	21%	0.208	32%	0.32	C	S	.	.	H	α-helix	trans	-61.6	-38.5	177.1	-169.2	61.4	166.7	168.8	2.6	112.3	V205 Y206 Y212 F213 E230 E235 F316	V205-R209 VanDerWaalsContact O-CB 3.3Å; V205-R209 WeakPolarHBondContact O-CB 3.03Å; V205-R209 PolarHBondContact O-N 3.04Å; Y206-R209 PolarHBondContact O-N 2.79Å; R209-Y212 WeakPolarHBondContact O-CB 3.19Å; R209-Y212 PolarHBondContact O-N 3.39Å; R209-F213 HydrophobicContact CG-CE2 3.76Å; R209-F213 HydrophobicContact CG-CZ 4.29Å; R209-F213 WeakPolarHBondContact O-CD2 3.24Å; R209-F213 WeakPolarHBondContact O-CE2 3.41Å; R209-F213 PolarHBondContact O-N 2.88Å; R209-E230 PolarHBondContact NH2-O 2.96Å; R209-E235 IonicContact CZ-OE1 3.61Å; R209-E235 IonicContact CZ-OE2 3.96Å; R209-E235 IonicContact NE-OE1 3.27Å; R209-E235 PolarHBondContact NE-OE1 2.83Å; R209-E235 IonicContact NE-OE2 2.8Å; R209-E235 IonicContact NH2-OE1 2.71Å; R209-E235 PolarHBondContact NH2-OE1 2.93Å; R209-E235 IonicContact NH2-OE2 3.78Å; R209-E235 PolarHBondContact NH2-OE2 3.4Å; R209-F316 HydrophobicContact CG-CE1 4.03Å; R209-F316 HydrophobicContact CG-CZ 3.99Å
210	R	72.1	Confident	73.9	Confident	13 Å²	13	64.7 Å²	64.7	5%	0.049	31%	0.309	C	S	.	.	H	α-helix	trans	-63.8	-45.6	172.2	-79.2	-92.7	-75.6	-112.2	9.4	112.5	H198 Y206 R207 Q208 Y212 F213 V214	H198-R210 PolarHBondContact NE2-NH1 3.09Å; Y206-R210 HydrophobicContact CD1-CG 4.16Å; Y206-R210 HydrophobicContact CE1-CG 3.72Å; Y206-R210 WeakPolarHBondContact O-CG 3.49Å; Y206-R210 PolarHBondContact O-N 3.15Å; Y206-R210 PolarHBondContact OH-NH1 2.93Å; R207-R210 PolarHBondContact O-N 2.61Å; Q208-R210 VanDerWaalsContact C-N 3.33Å; Q208-R210 PolarHBondContact O-N 3.45Å; R210-Y212 VanDerWaalsContact C-N 3.29Å; R210-Y212 PolarHBondContact O-N 3.42Å; R210-F213 PolarHBondContact O-N 3.15Å; R210-F213 VanDerWaalsContact O-N 3.15Å; R210-V214 WeakPolarHBondContact O-CG2 3.17Å; R210-V214 PolarHBondContact O-N 3.08Å
211	K	74.9	Confident	74.1	Confident	100 Å²	100	68.6 Å²	68.6	44%	0.435	33%	0.325	S	S	.	.	H	α-helix	trans	-57.5	-44.1	176.8	-73.9	179.9	179.1	-171.4	0	111.5	R207 Q208 F213 V214 E215	R207-K211 WeakPolarHBondContact O-CG 3.19Å; R207-K211 PolarHBondContact O-N 3.27Å; Q208-K211 WeakPolarHBondContact O-CB 3.28Å; Q208-K211 PolarHBondContact O-N 3.36Å; K211-F213 VanDerWaalsContact C-N 3.34Å; K211-F213 PolarHBondContact O-N 3.29Å; K211-V214 PolarHBondContact O-N 2.8Å; K211-V214 VanDerWaalsContact O-N 3.14Å; K211-E215 WeakPolarHBondContact O-CG 3.02Å; K211-E215 PolarHBondContact O-N 2.99Å
212	Y	77.3	Confident	74	Confident	94 Å²	94	69 Å²	69	37%	0.369	33%	0.328	S	S	.	.	H	α-helix	trans	-53.6	-47.1	173.8	169.9	-102	0	0	0	112.6	Q208 R209 R210 V214 E215 V216	Q208-Y212 PolarHBondContact O-N 2.93Å; R209-Y212 WeakPolarHBondContact O-CB 3.19Å; R209-Y212 PolarHBondContact O-N 3.39Å; R210-Y212 VanDerWaalsContact C-N 3.29Å; R210-Y212 PolarHBondContact O-N 3.42Å; Y212-V214 PolarHBondContact O-N 2.82Å; Y212-E215 PolarHBondContact O-N 3.01Å; Y212-V216 HydrophobicContact CD2-CG2 4.32Å; Y212-V216 HydrophobicContact CE1-CG2 4.15Å; Y212-V216 HydrophobicContact CE2-CG2 3.9Å; Y212-V216 VanDerWaalsContact O-CG2 3.3Å; Y212-V216 WeakPolarHBondContact O-CG2 3.15Å; Y212-V216 PolarHBondContact O-N 2.85Å
213	F	72.7	Confident	73.7	Confident	9 Å²	9	63.3 Å²	63.3	4%	0.039	32%	0.321	C	S	.	.	H	α-helix	trans	-66.2	-37.5	177.9	-64.6	-55.6	0	0	0	113.8	R209 R210 K211 V216 A217 I229 I312 F316	R209-F213 HydrophobicContact CG-CE2 3.76Å; R209-F213 HydrophobicContact CG-CZ 4.29Å; R209-F213 WeakPolarHBondContact O-CD2 3.24Å; R209-F213 WeakPolarHBondContact O-CE2 3.41Å; R209-F213 PolarHBondContact O-N 2.88Å; R210-F213 PolarHBondContact O-N 3.15Å; R210-F213 VanDerWaalsContact O-N 3.15Å; K211-F213 VanDerWaalsContact C-N 3.34Å; K211-F213 PolarHBondContact O-N 3.29Å; F213-V216 PolarHBondContact O-N 3.5Å; F213-A217 WeakPolarHBondContact O-CB 2.75Å; F213-A217 PolarHBondContact O-N 3.48Å; F213-I229 HydrophobicContact CD1-CD1 3.75Å; F213-I229 HydrophobicContact CD1-CG1 4.4Å; F213-I229 HydrophobicContact CE1-CB 4.44Å; F213-I229 HydrophobicContact CE1-CD1 3.62Å; F213-I229 HydrophobicContact CE1-CG1 4.03Å; F213-I229 HydrophobicContact CE1-CG2 3.59Å; F213-I229 HydrophobicContact CZ-CG2 4.17Å; F213-I312 HydrophobicContact CB-CD1 4.25Å; F213-I312 HydrophobicContact CB-CG2 3.99Å; F213-I312 HydrophobicContact CD1-CD1 3.9Å; F213-I312 HydrophobicContact CD1-CG2 4.16Å; F213-I312 HydrophobicContact CD2-CG2 3.23Å; F213-I312 HydrophobicContact CE1-CD1 4.49Å; F213-I312 HydrophobicContact CE2-CG2 3.65Å; F213-I312 HydrophobicContact CG-CD1 4.07Å; F213-I312 HydrophobicContact CG-CG2 3.53Å; F213-I312 HydrophobicContact CZ-CG2 4.28Å; F213-F316 HydrophobicContact CD2-CE2 4.04Å; F213-F316 AromaticContact CE2-CD2 3.99Å; F213-F316 HydrophobicContact CE2-CD2 3.99Å; F213-F316 HydrophobicContact CE2-CE1 4.43Å; F213-F316 AromaticContact CE2-CE2 3.14Å; F213-F316 HydrophobicContact CE2-CE2 3.14Å; F213-F316 AromaticContact CE2-CZ 3.39Å; F213-F316 HydrophobicContact CE2-CZ 3.39Å; F213-F316 AromaticContact CZ-CE2 3.65Å; F213-F316 HydrophobicContact CZ-CE2 3.65Å; F213-F316 AromaticContact CZ-CZ 3.8Å; F213-F316 HydrophobicContact CZ-CZ 3.8Å
214	V	68.3	Low	73.6	Confident	17 Å²	17	66.3 Å²	66.3	10%	0.103	33%	0.334	C	S	.	.	H	α-helix	trans	-63.3	-45.3	175.7	173.9	0	0	0	0	109.9	R210 K211 Y212 A217 M218	R210-V214 WeakPolarHBondContact O-CG2 3.17Å; R210-V214 PolarHBondContact O-N 3.08Å; K211-V214 PolarHBondContact O-N 2.8Å; K211-V214 VanDerWaalsContact O-N 3.14Å; Y212-V214 PolarHBondContact O-N 2.82Å; V214-A217 PolarHBondContact O-N 2.99Å; V214-M218 HydrophobicContact CG1-CE 4.24Å; V214-M218 HydrophobicContact CG1-CG 4.17Å; V214-M218 WeakPolarHBondContact O-CB 3.35Å; V214-M218 WeakPolarHBondContact O-CG 3.01Å; V214-M218 PolarHBondContact O-N 3.49Å
215	E	73.1	Confident	73.4	Confident	113 Å²	113	65.6 Å²	65.6	53%	0.528	34%	0.335	S	S	.	.	H	α-helix	trans	-61	-45.7	177	-72.6	169.4	-166.8	0	0	112	K211 Y212 A217 M218 N219	K211-E215 WeakPolarHBondContact O-CG 3.02Å; K211-E215 PolarHBondContact O-N 2.99Å; Y212-E215 PolarHBondContact O-N 3.01Å; E215-A217 VanDerWaalsContact C-N 3.29Å; E215-A217 PolarHBondContact O-N 3.27Å; E215-M218 PolarHBondContact O-N 2.91Å; E215-N219 WeakPolarHBondContact O-CB 2.98Å; E215-N219 VanDerWaalsContact O-CG 3.28Å; E215-N219 PolarHBondContact O-N 3.21Å; E215-N219 PolarHBondContact O-ND2 3.4Å
216	V	73.1	Confident	73.1	Confident	29 Å²	29	62.4 Å²	62.4	18%	0.176	32%	0.315	C	S	.	.	H	α-helix	trans	-57.8	-42.6	174.8	171.1	0	0	0	0	111.2	Y212 F213 Y220 P227	Y212-V216 HydrophobicContact CD2-CG2 4.32Å; Y212-V216 HydrophobicContact CE1-CG2 4.15Å; Y212-V216 HydrophobicContact CE2-CG2 3.9Å; Y212-V216 VanDerWaalsContact O-CG2 3.3Å; Y212-V216 WeakPolarHBondContact O-CG2 3.15Å; Y212-V216 PolarHBondContact O-N 2.85Å; F213-V216 PolarHBondContact O-N 3.5Å; V216-Y220 PolarHBondContact O-N 2.87Å; V216-P227 HydrophobicContact CG1-CB 3.87Å; V216-P227 HydrophobicContact CG1-CG 3.94Å
217	A	67.2	Low	73.3	Confident	23 Å²	23	64.9 Å²	64.9	19%	0.19	33%	0.331	C	S	.	.	H	α-helix	trans	-70.4	-37.7	179.6	0	0	0	0	0	113.1	F213 V214 E215 Y220 I309	F213-A217 WeakPolarHBondContact O-CB 2.75Å; F213-A217 PolarHBondContact O-N 3.48Å; V214-A217 PolarHBondContact O-N 2.99Å; E215-A217 VanDerWaalsContact C-N 3.29Å; E215-A217 PolarHBondContact O-N 3.27Å; A217-Y220 PolarHBondContact O-N 3.4Å; A217-I309 HydrophobicContact CB-CD1 4.01Å; A217-I309 HydrophobicContact CB-CG1 4.28Å
218	M	67.7	Low	73.7	Confident	42 Å²	42	68 Å²	68	21%	0.207	34%	0.343	C	S	.	.	H	α-helix	trans	-68.1	-35.7	178.4	-71.4	-67.6	-174.7	0	0	112.2	H185 V187 V214 E215 Y220	H185-M218 HydrophobicContact CB-SD 4.44Å; V187-M218 HydrophobicContact CB-CE 4.07Å; V187-M218 HydrophobicContact CG2-CE 3.5Å; V187-M218 VanDerWaalsContact CG2-CE 3.5Å; V214-M218 HydrophobicContact CG1-CE 4.24Å; V214-M218 HydrophobicContact CG1-CG 4.17Å; V214-M218 WeakPolarHBondContact O-CB 3.35Å; V214-M218 WeakPolarHBondContact O-CG 3.01Å; V214-M218 PolarHBondContact O-N 3.49Å; E215-M218 PolarHBondContact O-N 2.91Å; M218-Y220 VanDerWaalsContact C-N 3.33Å
219	N	75.3	Confident	73.8	Confident	124 Å²	124	62 Å²	62	66%	0.663	32%	0.315	S	S	*	.	H	α-helix	trans	-79.2	-15.9	-179.2	-70	-20.2	0	0	0	113.5	E215	E215-N219 WeakPolarHBondContact O-CB 2.98Å; E215-N219 VanDerWaalsContact O-CG 3.28Å; E215-N219 PolarHBondContact O-N 3.21Å; E215-N219 PolarHBondContact O-ND2 3.4Å
220	Y	73.4	Confident	74.1	Confident	33 Å²	33	67.8 Å²	67.8	13%	0.129	35%	0.345	C	S	.	.			trans	-72.1	131.2	-179	173.3	-115.1	0	0	0	112.1	V216 A217 M218 Q224 I226 R305	V216-Y220 PolarHBondContact O-N 2.87Å; A217-Y220 PolarHBondContact O-N 3.4Å; M218-Y220 VanDerWaalsContact C-N 3.33Å; Y220-Q224 HydrophobicContact CD2-CB 4.37Å; Y220-Q224 HydrophobicContact CE2-CB 4.17Å; Y220-Q224 WeakPolarHBondContact CE2-O 3.04Å; Y220-I226 HydrophobicContact CE1-CG1 4.5Å; Y220-I226 HydrophobicContact CE2-CG1 3.93Å; Y220-R305 VanDerWaalsContact CD1-CZ 3.41Å; Y220-R305 VanDerWaalsContact CE1-CZ 3.46Å; Y220-R305 VanDerWaalsContact CE1-NE 3.26Å
221	K	69.4	Low	74.6	Confident	81 Å²	81	69.1 Å²	69.1	35%	0.352	35%	0.35	S	S	.	.			trans	-116.6	149.6	173.4	-62.8	-63.7	-178.1	-176.8	0	111.9	D181 G223 Q224	D181-K221 HydrophobicContact CB-CD 4.13Å; D181-K221 WeakPolarHBondContact OD2-CA 3.44Å; D181-K221 WeakPolarHBondContact OD2-CD 3.47Å; K221-G223 PolarHBondContact O-N 3.31Å; K221-Q224 HydrophobicContact CB-CG 4.48Å; K221-Q224 WeakPolarHBondContact O-CB 3.26Å; K221-Q224 PolarHBondContact O-N 2.76Å
222	F	66.5	Low	75.1	Confident	81 Å²	81	67.2 Å²	67.2	36%	0.355	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	135.1	176.6	178.5	-99.6	0	0	0	110.8	I177 D181	I177-F222 HydrophobicContact CB-CE2 4.43Å; I177-F222 HydrophobicContact CB-CZ 4.31Å; I177-F222 HydrophobicContact CD1-CD2 4.13Å; I177-F222 HydrophobicContact CD1-CE2 3.24Å; I177-F222 HydrophobicContact CD1-CZ 3.55Å; I177-F222 HydrophobicContact CG1-CD2 3.99Å; I177-F222 HydrophobicContact CG1-CE2 3.56Å; I177-F222 HydrophobicContact CG1-CZ 3.9Å; I177-F222 HydrophobicContact CG2-CD1 4.35Å; I177-F222 HydrophobicContact CG2-CE1 3.64Å; I177-F222 HydrophobicContact CG2-CE2 4.08Å; I177-F222 HydrophobicContact CG2-CZ 3.49Å; I177-F222 VanDerWaalsContact CG2-CZ 3.49Å; D181-F222 PolarHBondContact OD1-N 2.86Å; D181-F222 WeakPolarHBondContact OD2-CB 3.11Å; D181-F222 PolarHBondContact OD2-N 2.89Å
223	G	68.8	Low	75.6	Confident	66 Å²	66	68 Å²	68	68%	0.68	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.9	-16.7	-177.4	0	0	0	0	0	114.5	K221	K221-G223 PolarHBondContact O-N 3.31Å
224	Q	76.3	Confident	76.1	Confident	98 Å²	98	72.5 Å²	72.5	46%	0.458	39%	0.387	S	S	.	.	S	Bend	trans	-79	154.5	172.6	-64.6	178	-18.9	0	0	110.9	Y220 K221	Y220-Q224 HydrophobicContact CD2-CB 4.37Å; Y220-Q224 HydrophobicContact CE2-CB 4.17Å; Y220-Q224 WeakPolarHBondContact CE2-O 3.04Å; K221-Q224 HydrophobicContact CB-CG 4.48Å; K221-Q224 WeakPolarHBondContact O-CB 3.26Å; K221-Q224 PolarHBondContact O-N 2.76Å
225	P	77.1	Confident	76.7	Confident	90 Å²	90	72.9 Å²	72.9	58%	0.584	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-65.9	140.8	166.5	28.3	-33.3	0	0	0	109.8
226	I	74.9	Confident	77.1	Confident	32 Å²	32	69.2 Å²	69.2	16%	0.164	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-67.9	128.6	176.8	-58.7	168.4	0	0	0	108.5	Y220 R228 L279 E280	Y220-I226 HydrophobicContact CE1-CG1 4.5Å; Y220-I226 HydrophobicContact CE2-CG1 3.93Å; I226-R228 PolarHBondContact O-N 2.9Å; I226-L279 HydrophobicContact CD1-CB 4.19Å; I226-L279 HydrophobicContact CG2-CB 3.93Å; I226-L279 HydrophobicContact CG2-CD1 4.27Å; I226-E280 HydrophobicContact CB-CB 4.03Å; I226-E280 PolarHBondContact N-OE2 3.06Å
227	P	77.9	Confident	77.6	Confident	57 Å²	57	75.5 Å²	75.5	37%	0.37	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-57.5	134.2	179.7	-27.1	36.4	0	0	0	111.9	V216	V216-P227 HydrophobicContact CG1-CB 3.87Å; V216-P227 HydrophobicContact CG1-CG 3.94Å
228	R	82.3	Confident	78.1	Confident	135 Å²	135	76 Å²	76	51%	0.509	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-76.9	142.2	173.8	-70.5	-173.1	179	-97.7	-11.2	110.1	I226 D281	I226-R228 PolarHBondContact O-N 2.9Å; R228-D281 IonicContact CZ-OD1 2.75Å; R228-D281 IonicContact CZ-OD2 2.83Å; R228-D281 VanDerWaalsContact CZ-OD2 3.27Å; R228-D281 IonicContact NH1-OD2 3.87Å; R228-D281 PolarHBondContact NH1-OD2 3.33Å; R228-D281 IonicContact NH2-OD1 2.87Å; R228-D281 PolarHBondContact NH2-OD1 3.21Å; R228-D281 IonicContact NH2-OD2 3.62Å; R228-D281 PolarHBondContact NH2-OD2 3.46Å
229	I	81.4	Confident	78.8	Confident	9 Å²	9	74.4 Å²	74.4	5%	0.046	39%	0.39	C	S	.	.			trans	-111.7	126.1	-179.6	-68.7	159.8	0	0	0	108.6	F213 Y231 Q278 I312	F213-I229 HydrophobicContact CD1-CD1 3.75Å; F213-I229 HydrophobicContact CD1-CG1 4.4Å; F213-I229 HydrophobicContact CE1-CB 4.44Å; F213-I229 HydrophobicContact CE1-CD1 3.62Å; F213-I229 HydrophobicContact CE1-CG1 4.03Å; F213-I229 HydrophobicContact CE1-CG2 3.59Å; F213-I229 HydrophobicContact CZ-CG2 4.17Å; I229-Y231 HydrophobicContact CB-CE1 4.39Å; I229-Y231 HydrophobicContact CB-CE2 4.15Å; I229-Y231 HydrophobicContact CG2-CD1 3.87Å; I229-Y231 HydrophobicContact CG2-CD2 4.27Å; I229-Y231 HydrophobicContact CG2-CE1 3.68Å; I229-Y231 HydrophobicContact CG2-CE2 4.1Å; I229-Y231 HydrophobicContact CG2-CG 4.16Å; I229-Y231 WeakPolarHBondContact O-CD2 3.39Å; I229-Y231 PolarHBondContact O-N 3.02Å; I229-Q278 PolarHBondContact O-NE2 3.39Å; I229-I312 HydrophobicContact CD1-CD1 4.2Å
230	E	86.8	Confident	79	Confident	177 Å²	177	68.7 Å²	68.7	83%	0.827	36%	0.361	S	S	*	.			trans	-80.4	108.6	165.5	-67.8	-177	-179.8	0	0	109.1	R209	R209-E230 PolarHBondContact NH2-O 2.96Å
231	Y	82.2	Confident	79.4	Confident	41 Å²	41	68.8 Å²	68.8	16%	0.161	37%	0.365	C	S	.	.			trans	-81.3	144.3	178	-64.7	-78.2	0	0	0	111.1	I229 E235 I276	I229-Y231 HydrophobicContact CB-CE1 4.39Å; I229-Y231 HydrophobicContact CB-CE2 4.15Å; I229-Y231 HydrophobicContact CG2-CD1 3.87Å; I229-Y231 HydrophobicContact CG2-CD2 4.27Å; I229-Y231 HydrophobicContact CG2-CE1 3.68Å; I229-Y231 HydrophobicContact CG2-CE2 4.1Å; I229-Y231 HydrophobicContact CG2-CG 4.16Å; I229-Y231 WeakPolarHBondContact O-CD2 3.39Å; I229-Y231 PolarHBondContact O-N 3.02Å; Y231-E235 VanDerWaalsContact CA-OE2 3.23Å; Y231-E235 WeakPolarHBondContact CA-OE2 3.34Å; Y231-E235 HydrophobicContact CD1-CB 4.48Å; Y231-E235 WeakPolarHBondContact CD1-OE2 3.38Å; Y231-I276 HydrophobicContact CD1-CD1 3.74Å; Y231-I276 HydrophobicContact CD2-CB 3.73Å; Y231-I276 HydrophobicContact CD2-CD1 4.13Å; Y231-I276 HydrophobicContact CD2-CG1 4.48Å; Y231-I276 HydrophobicContact CD2-CG2 3.98Å; Y231-I276 HydrophobicContact CE1-CD1 4.25Å; Y231-I276 HydrophobicContact CE1-CG2 4.13Å; Y231-I276 HydrophobicContact CE2-CB 3.77Å; Y231-I276 HydrophobicContact CE2-CG2 3.5Å; Y231-I276 HydrophobicContact CG-CB 4.2Å; Y231-I276 HydrophobicContact CG-CD1 3.68Å; Y231-I276 HydrophobicContact CG-CG1 4.49Å; Y231-I276 HydrophobicContact CG-CG2 4.48Å
232	T	85.4	Confident	79.9	Confident	61 Å²	61	65.3 Å²	65.3	37%	0.374	35%	0.35	S	S	.	.			trans	-74.3	157.6	175.7	69.3	0	0	0	0	110.8	E234 E235 V236	T232-E234 PolarHBondContact O-N 3.12Å; T232-E235 PolarHBondContact N-OE2 3.33Å; T232-E235 WeakPolarHBondContact O-CB 3.44Å; T232-E235 PolarHBondContact O-N 3.03Å; T232-E235 WeakPolarHBondContact OG1-CG 3.46Å; T232-E235 PolarHBondContact OG1-N 3.11Å; T232-E235 PolarHBondContact OG1-OE1 2.9Å; T232-V236 WeakPolarHBondContact O-CG2 3.14Å; T232-V236 PolarHBondContact O-N 3.14Å
233	S	88.3	Confident	80.6	Confident	109 Å²	109	62.9 Å²	62.9	76%	0.762	34%	0.339	S	S	*	.	H	α-helix	trans	-60.2	-29.5	177.3	-48.3	0	0	0	0	112.8	K237	S233-K237 VanDerWaalsContact O-CB 3.29Å; S233-K237 WeakPolarHBondContact O-CB 3.42Å; S233-K237 PolarHBondContact O-N 3.16Å
234	E	82.8	Confident	81.5	Confident	105 Å²	105	64.1 Å²	64.1	49%	0.491	32%	0.324	S	S	.	.	H	α-helix	trans	-68.7	-41.5	174.6	-170.5	-177.2	-179.4	0	0	111.6	T232 K237 T238 K319	T232-E234 PolarHBondContact O-N 3.12Å; E234-K237 PolarHBondContact O-N 3.35Å; E234-T238 WeakPolarHBondContact O-CB 3.44Å; E234-T238 PolarHBondContact O-N 3.06Å; E234-T238 PolarHBondContact O-OG1 3.22Å; E234-K319 VanDerWaalsContact OE1-CE 3.25Å; E234-K319 WeakPolarHBondContact OE1-CE 3.31Å; E234-K319 IonicContact OE2-NZ 3.55Å
235	E	79.8	Confident	81.9	Confident	25 Å²	25	62 Å²	62	12%	0.117	31%	0.313	C	S	.	.	H	α-helix	trans	-63.5	-45.8	176.2	-70.6	158.3	-169	0	0	110.7	R209 Y231 T232 T238 W239 I276 F316	R209-E235 IonicContact CZ-OE1 3.61Å; R209-E235 IonicContact CZ-OE2 3.96Å; R209-E235 IonicContact NE-OE1 3.27Å; R209-E235 PolarHBondContact NE-OE1 2.83Å; R209-E235 IonicContact NE-OE2 2.8Å; R209-E235 IonicContact NH2-OE1 2.71Å; R209-E235 PolarHBondContact NH2-OE1 2.93Å; R209-E235 IonicContact NH2-OE2 3.78Å; R209-E235 PolarHBondContact NH2-OE2 3.4Å; Y231-E235 VanDerWaalsContact CA-OE2 3.23Å; Y231-E235 WeakPolarHBondContact CA-OE2 3.34Å; Y231-E235 HydrophobicContact CD1-CB 4.48Å; Y231-E235 WeakPolarHBondContact CD1-OE2 3.38Å; T232-E235 PolarHBondContact N-OE2 3.33Å; T232-E235 WeakPolarHBondContact O-CB 3.44Å; T232-E235 PolarHBondContact O-N 3.03Å; T232-E235 WeakPolarHBondContact OG1-CG 3.46Å; T232-E235 PolarHBondContact OG1-N 3.11Å; T232-E235 PolarHBondContact OG1-OE1 2.9Å; E235-T238 WeakPolarHBondContact O-CB 3.4Å; E235-T238 PolarHBondContact O-N 3.09Å; E235-W239 PolarHBondContact O-N 3.32Å; E235-I276 HydrophobicContact CB-CD1 4.21Å; E235-F316 HydrophobicContact CG-CE1 3.55Å; E235-F316 HydrophobicContact CG-CZ 3.54Å; E235-F316 VanDerWaalsContact OE1-CE1 3.23Å; E235-F316 WeakPolarHBondContact OE1-CE1 3.45Å; E235-F316 WeakPolarHBondContact OE1-CZ 3.4Å
236	V	82.9	Confident	82.2	Confident	36 Å²	36	57.7 Å²	57.7	22%	0.218	29%	0.286	C	S	.	.	H	α-helix	trans	-63.9	-43.5	177.9	174.8	0	0	0	0	111.3	T232 T238 W239 G240 D274 I276	T232-V236 WeakPolarHBondContact O-CG2 3.14Å; T232-V236 PolarHBondContact O-N 3.14Å; V236-T238 VanDerWaalsContact C-N 3.29Å; V236-T238 PolarHBondContact O-N 3.3Å; V236-W239 WeakPolarHBondContact O-CB 3.29Å; V236-W239 PolarHBondContact O-N 3.05Å; V236-G240 PolarHBondContact O-N 2.87Å; V236-D274 WeakPolarHBondContact CG1-O 2.86Å; V236-I276 HydrophobicContact CG2-CD1 4.16Å; V236-I276 HydrophobicContact CG2-CG1 4.4Å
237	K	83.4	Confident	82.6	Confident	161 Å²	161	58.7 Å²	58.7	70%	0.7	29%	0.293	S	S	*	.	H	α-helix	trans	-60.7	-41.3	176.1	-173	178.1	-176.6	179.3	0	111.8	S233 E234 G240 V241	S233-K237 VanDerWaalsContact O-CB 3.29Å; S233-K237 WeakPolarHBondContact O-CB 3.42Å; S233-K237 PolarHBondContact O-N 3.16Å; E234-K237 PolarHBondContact O-N 3.35Å; K237-G240 PolarHBondContact O-N 3.37Å; K237-V241 WeakPolarHBondContact O-CG2 3.01Å; K237-V241 PolarHBondContact O-N 2.8Å
238	T	78.3	Confident	83.3	Confident	32 Å²	32	62 Å²	62	20%	0.196	30%	0.302	C	S	.	.	H	α-helix	trans	-60.5	-49.8	176.2	-62.2	0	0	0	0	111.4	E234 E235 V236 G240 V241 V242 Y318	E234-T238 WeakPolarHBondContact O-CB 3.44Å; E234-T238 PolarHBondContact O-N 3.06Å; E234-T238 PolarHBondContact O-OG1 3.22Å; E235-T238 WeakPolarHBondContact O-CB 3.4Å; E235-T238 PolarHBondContact O-N 3.09Å; V236-T238 VanDerWaalsContact C-N 3.29Å; V236-T238 PolarHBondContact O-N 3.3Å; T238-G240 VanDerWaalsContact C-N 3.32Å; T238-G240 PolarHBondContact O-N 3.2Å; T238-V241 PolarHBondContact O-N 2.93Å; T238-V242 WeakPolarHBondContact O-CG2 3.34Å; T238-V242 PolarHBondContact O-N 3.02Å; T238-Y318 HydrophobicContact CG2-CD1 4.05Å; T238-Y318 HydrophobicContact CG2-CD2 3.89Å; T238-Y318 HydrophobicContact CG2-CG 3.45Å; T238-Y318 VanDerWaalsContact CG2-CG 3.45Å
239	W	80.9	Confident	83.6	Confident	10 Å²	10	56.4 Å²	56.4	4%	0.038	28%	0.282	C	S	.	.	H	α-helix	trans	-55	-47	174.6	165.3	-98.1	0	0	0	112	E235 V236 V241 V242 F243 Y271 R272 N275 I276 P277 W311	E235-W239 PolarHBondContact O-N 3.32Å; V236-W239 WeakPolarHBondContact O-CB 3.29Å; V236-W239 PolarHBondContact O-N 3.05Å; W239-V241 VanDerWaalsContact C-N 3.35Å; W239-V241 PolarHBondContact O-N 3.29Å; W239-V242 WeakPolarHBondContact O-CB 3.49Å; W239-V242 PolarHBondContact O-N 3.29Å; W239-V242 VanDerWaalsContact O-N 3.12Å; W239-F243 HydrophobicContact CH2-CD2 4.24Å; W239-F243 HydrophobicContact CZ2-CB 4.5Å; W239-F243 AromaticContact CZ2-CD2 3.61Å; W239-F243 HydrophobicContact CZ2-CD2 3.61Å; W239-F243 HydrophobicContact CZ2-CE2 4.25Å; W239-F243 HydrophobicContact CZ2-CG 4.36Å; W239-F243 WeakPolarHBondContact O-CB 3.42Å; W239-F243 PolarHBondContact O-N 3.49Å; W239-Y271 HydrophobicContact CH2-CD1 4.49Å; W239-Y271 HydrophobicContact CH2-CE1 4.43Å; W239-Y271 HydrophobicContact CZ2-CD1 4.43Å; W239-R272 PolarHBondContact NE1-O 3.2Å; W239-N275 PolarHBondContact NE1-O 2.87Å; W239-N275 VanDerWaalsContact NE1-O 3.12Å; W239-I276 HydrophobicContact CB-CD1 3.94Å; W239-I276 HydrophobicContact CB-CG1 3.56Å; W239-I276 HydrophobicContact CD2-CG1 4.1Å; W239-I276 HydrophobicContact CG-CD1 4.44Å; W239-I276 HydrophobicContact CG-CG1 3.55Å; W239-P277 HydrophobicContact CZ2-CG 4.23Å; W239-W311 HydrophobicContact CE3-CH2 4.35Å; W239-W311 HydrophobicContact CE3-CZ2 4.33Å; W239-W311 AromaticContact CH2-CH2 3.9Å; W239-W311 HydrophobicContact CH2-CH2 3.9Å; W239-W311 AromaticContact CH2-CZ2 3.59Å; W239-W311 HydrophobicContact CH2-CZ2 3.59Å; W239-W311 AromaticContact CZ3-CH2 3.66Å; W239-W311 HydrophobicContact CZ3-CH2 3.66Å; W239-W311 AromaticContact CZ3-CZ2 3.32Å; W239-W311 HydrophobicContact CZ3-CZ2 3.32Å
240	G	79.8	Confident	83.8	Confident	4 Å²	4	56.1 Å²	56.1	4%	0.041	28%	0.28	C	S	.	.	H	α-helix	trans	-59.1	-42.3	-179	0	0	0	0	0	113.6	V236 K237 T238 V242 F243 R244 E273	V236-G240 PolarHBondContact O-N 2.87Å; K237-G240 PolarHBondContact O-N 3.37Å; T238-G240 VanDerWaalsContact C-N 3.32Å; T238-G240 PolarHBondContact O-N 3.2Å; G240-V242 VanDerWaalsContact C-N 3.29Å; G240-V242 PolarHBondContact O-N 2.98Å; G240-F243 PolarHBondContact O-N 2.97Å; G240-R244 VanDerWaalsContact O-CB 3.22Å; G240-R244 WeakPolarHBondContact O-CB 3.36Å; G240-R244 PolarHBondContact O-N 2.93Å; G240-E273 VanDerWaalsContact CA-CG 3.42Å; G240-E273 WeakPolarHBondContact CA-O 2.92Å; G240-E273 WeakPolarHBondContact O-CG 3.29Å
241	V	83	Confident	84	Confident	35 Å²	35	51.5 Å²	51.5	21%	0.212	27%	0.266	C	S	.	.	H	α-helix	trans	-57.8	-44.7	176.1	172.3	0	0	0	0	111.3	K237 T238 W239 E245	K237-V241 WeakPolarHBondContact O-CG2 3.01Å; K237-V241 PolarHBondContact O-N 2.8Å; T238-V241 PolarHBondContact O-N 2.93Å; W239-V241 VanDerWaalsContact C-N 3.35Å; W239-V241 PolarHBondContact O-N 3.29Å; V241-E245 WeakPolarHBondContact O-CG 3.47Å; V241-E245 PolarHBondContact O-N 3.24Å
242	V	78.4	Confident	84.4	Confident	7 Å²	7	53.3 Å²	53.3	4%	0.042	28%	0.281	C	S	.	.	H	α-helix	trans	-70.7	-49.7	-176.7	176.2	0	0	0	0	111	T238 W239 G240 R244 E245 L246 Y318	T238-V242 WeakPolarHBondContact O-CG2 3.34Å; T238-V242 PolarHBondContact O-N 3.02Å; W239-V242 WeakPolarHBondContact O-CB 3.49Å; W239-V242 PolarHBondContact O-N 3.29Å; W239-V242 VanDerWaalsContact O-N 3.12Å; G240-V242 VanDerWaalsContact C-N 3.29Å; G240-V242 PolarHBondContact O-N 2.98Å; V242-R244 VanDerWaalsContact C-N 3.25Å; V242-R244 PolarHBondContact O-N 2.69Å; V242-E245 PolarHBondContact O-N 3.21Å; V242-L246 HydrophobicContact CG1-CD1 3.6Å; V242-L246 HydrophobicContact CG1-CG 4.32Å; V242-L246 WeakPolarHBondContact O-CB 3.48Å; V242-L246 WeakPolarHBondContact O-CG 3.43Å; V242-L246 PolarHBondContact O-N 3.03Å; V242-Y318 HydrophobicContact CB-CE1 4.45Å; V242-Y318 WeakPolarHBondContact CG1-OH 3.36Å; V242-Y318 HydrophobicContact CG2-CD1 3.89Å; V242-Y318 HydrophobicContact CG2-CE1 3.09Å; V242-Y318 HydrophobicContact CG2-CE2 4.04Å; V242-Y318 WeakPolarHBondContact CG2-OH 3.42Å
243	F	81.2	Confident	84.5	Confident	30 Å²	30	52.2 Å²	52.2	13%	0.132	27%	0.271	C	S	.	.	H	α-helix	trans	-56	-45.4	180	-175.5	-93.3	0	0	0	110.3	W239 G240 T247 Y271 E273	W239-F243 HydrophobicContact CH2-CD2 4.24Å; W239-F243 HydrophobicContact CZ2-CB 4.5Å; W239-F243 AromaticContact CZ2-CD2 3.61Å; W239-F243 HydrophobicContact CZ2-CD2 3.61Å; W239-F243 HydrophobicContact CZ2-CE2 4.25Å; W239-F243 HydrophobicContact CZ2-CG 4.36Å; W239-F243 WeakPolarHBondContact O-CB 3.42Å; W239-F243 PolarHBondContact O-N 3.49Å; G240-F243 PolarHBondContact O-N 2.97Å; F243-T247 WeakPolarHBondContact O-CB 3.44Å; F243-T247 PolarHBondContact O-N 3.29Å; F243-T247 PolarHBondContact O-OG1 3.45Å; F243-Y271 HydrophobicContact CE2-CD1 4.32Å; F243-E273 HydrophobicContact CD1-CB 4.17Å
244	R	87.3	Confident	84.3	Confident	93 Å²	93	47 Å²	47	35%	0.351	24%	0.235	S	C	.	.	H	α-helix	trans	-62.9	-47.5	178.8	-175.8	178.1	62.2	-127.4	-1.4	112.8	G240 V242 K248 E273	G240-R244 VanDerWaalsContact O-CB 3.22Å; G240-R244 WeakPolarHBondContact O-CB 3.36Å; G240-R244 PolarHBondContact O-N 2.93Å; V242-R244 VanDerWaalsContact C-N 3.25Å; V242-R244 PolarHBondContact O-N 2.69Å; R244-K248 WeakPolarHBondContact O-CG 3.4Å; R244-K248 PolarHBondContact O-N 2.61Å; R244-E273 HydrophobicContact CB-CG 4.47Å; R244-E273 IonicContact CZ-OE1 3.36Å; R244-E273 IonicContact NE-OE1 2.83Å; R244-E273 IonicContact NH1-OE1 3.66Å; R244-E273 PolarHBondContact NH1-OE1 2.72Å
245	E	86	Confident	84.3	Confident	52 Å²	52	42 Å²	42	24%	0.243	21%	0.212	C	C	.	.	H	α-helix	trans	-70.3	-37.9	-177.9	-68.1	-53	123.8	0	0	112.8	V241 V242 K248 I397	V241-E245 WeakPolarHBondContact O-CG 3.47Å; V241-E245 PolarHBondContact O-N 3.24Å; V242-E245 PolarHBondContact O-N 3.21Å; E245-K248 IonicContact OE1-NZ 3.96Å; E245-K248 PolarHBondContact OE1-NZ 3.25Å; E245-K248 IonicContact OE2-NZ 2.63Å; E245-I397 HydrophobicContact CB-CD1 3.39Å; E245-I397 HydrophobicContact CB-CG1 4.26Å; E245-I397 HydrophobicContact CG-CD1 4.14Å
246	L	82.4	Confident	84.4	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-69.9	-39.3	175.1	-70.1	171.9	0	0	0	112.1	V242 K248 L249 Y250 I397	V242-L246 HydrophobicContact CG1-CD1 3.6Å; V242-L246 HydrophobicContact CG1-CG 4.32Å; V242-L246 WeakPolarHBondContact O-CB 3.48Å; V242-L246 WeakPolarHBondContact O-CG 3.43Å; V242-L246 PolarHBondContact O-N 3.03Å; L246-K248 PolarHBondContact O-N 2.75Å; L246-L249 WeakPolarHBondContact O-CA 3.31Å; L246-L249 PolarHBondContact O-N 2.84Å; L246-Y250 HydrophobicContact CB-CE1 4.03Å; L246-Y250 HydrophobicContact CB-CE2 3.9Å; L246-Y250 WeakPolarHBondContact CB-OH 3.29Å; L246-Y250 WeakPolarHBondContact O-CD2 3.49Å; L246-Y250 VanDerWaalsContact O-CG 3.28Å; L246-Y250 PolarHBondContact O-N 2.58Å; L246-I397 HydrophobicContact CD2-CG1 3.68Å; L246-I397 HydrophobicContact CG-CG1 4.02Å
247	T	85	Confident	84.2	Confident	52 Å²	52	49.2 Å²	49.2	32%	0.319	24%	0.236	S	C	.	.	H	α-helix	trans	-60.6	-32.1	178.2	-60.6	0	0	0	0	112.4	F243 L249 P251	F243-T247 WeakPolarHBondContact O-CB 3.44Å; F243-T247 PolarHBondContact O-N 3.29Å; F243-T247 PolarHBondContact O-OG1 3.45Å; T247-L249 VanDerWaalsContact C-N 3.31Å; T247-L249 PolarHBondContact O-N 2.63Å; T247-P251 WeakPolarHBondContact O-CD 3.41Å
248	K	91.5	Very high	83.8	Confident	127 Å²	127	42 Å²	42	55%	0.552	21%	0.205	S	C	*	.	H	α-helix	trans	-66	-31.2	172.2	-68.3	168.8	-174.6	171.4	0	113.1	R244 E245 L246	R244-K248 WeakPolarHBondContact O-CG 3.4Å; R244-K248 PolarHBondContact O-N 2.61Å; E245-K248 IonicContact OE1-NZ 3.96Å; E245-K248 PolarHBondContact OE1-NZ 3.25Å; E245-K248 IonicContact OE2-NZ 2.63Å; L246-K248 PolarHBondContact O-N 2.75Å
249	L	88.9	Confident	83.9	Confident	17 Å²	17	43.4 Å²	43.4	9%	0.089	21%	0.21	C	C	.	.	H	α-helix	trans	-89.4	-27.1	-176.2	-66.4	176.3	0	0	0	113.4	L246 T247 P251 T252 H253 I397 L400 R401	L246-L249 WeakPolarHBondContact O-CA 3.31Å; L246-L249 PolarHBondContact O-N 2.84Å; T247-L249 VanDerWaalsContact C-N 3.31Å; T247-L249 PolarHBondContact O-N 2.63Å; L249-P251 VanDerWaalsContact C-CD 3.48Å; L249-T252 PolarHBondContact O-N 2.83Å; L249-T252 PolarHBondContact O-OG1 3.49Å; L249-T252 VanDerWaalsContact O-OG1 3.12Å; L249-H253 WeakPolarHBondContact O-CB 3.45Å; L249-H253 PolarHBondContact O-N 3.27Å; L249-H253 PolarHBondContact O-ND1 2.9Å; L249-I397 HydrophobicContact CD1-CG2 3.89Å; L249-L400 HydrophobicContact CB-CD2 4.01Å; L249-L400 HydrophobicContact CD1-CD2 4.33Å; L249-R401 HydrophobicContact CD1-CG 4.19Å
250	Y	86.6	Confident	83.9	Confident	4 Å²	4	50 Å²	50	2%	0.016	24%	0.24	C	C	.	.	H	α-helix	trans	-55.1	-43.6	-175.7	-64.1	-38.2	0	0	0	115.2	L246 T252 H253 A254 Y258 L262 N335 L394	L246-Y250 HydrophobicContact CB-CE1 4.03Å; L246-Y250 HydrophobicContact CB-CE2 3.9Å; L246-Y250 WeakPolarHBondContact CB-OH 3.29Å; L246-Y250 WeakPolarHBondContact O-CD2 3.49Å; L246-Y250 VanDerWaalsContact O-CG 3.28Å; L246-Y250 PolarHBondContact O-N 2.58Å; Y250-T252 PolarHBondContact O-N 2.65Å; Y250-T252 VanDerWaalsContact O-N 3.1Å; Y250-H253 PolarHBondContact O-N 2.46Å; Y250-A254 HydrophobicContact CD1-CB 3.98Å; Y250-A254 HydrophobicContact CG-CB 4.39Å; Y250-A254 VanDerWaalsContact O-CB 3.29Å; Y250-A254 WeakPolarHBondContact O-CB 3.2Å; Y250-A254 PolarHBondContact O-N 3.03Å; Y250-Y258 HydrophobicContact CD1-CD1 4.25Å; Y250-Y258 AromaticContact CD1-CE1 3.68Å; Y250-Y258 HydrophobicContact CD1-CE1 3.68Å; Y250-Y258 HydrophobicContact CD2-CD1 4.5Å; Y250-Y258 AromaticContact CD2-CE1 3.55Å; Y250-Y258 HydrophobicContact CD2-CE1 3.55Å; Y250-Y258 AromaticContact CE1-CE1 3.74Å; Y250-Y258 HydrophobicContact CE1-CE1 3.74Å; Y250-Y258 AromaticContact CE1-CZ 3.98Å; Y250-Y258 AromaticContact CE2-CE1 3.63Å; Y250-Y258 HydrophobicContact CE2-CE1 3.63Å; Y250-Y258 AromaticContact CE2-CZ 3.9Å; Y250-Y258 VanDerWaalsContact CE2-OH 3.32Å; Y250-Y258 WeakPolarHBondContact CE2-OH 3.22Å; Y250-Y258 HydrophobicContact CG-CD1 4.2Å; Y250-Y258 AromaticContact CG-CE1 3.59Å; Y250-Y258 HydrophobicContact CG-CE1 3.59Å; Y250-Y258 AromaticContact CZ-CE1 3.7Å; Y250-Y258 AromaticContact CZ-CZ 3.71Å; Y250-Y258 PolarHBondContact OH-OH 3.16Å; Y250-Y258 VanDerWaalsContact OH-OH 3.06Å; Y250-L262 HydrophobicContact CD2-CD2 3.83Å; Y250-L262 HydrophobicContact CE2-CD2 4.29Å; Y250-N335 PolarHBondContact OH-ND2 3.29Å; Y250-N335 VanDerWaalsContact OH-ND2 3.09Å; Y250-L394 HydrophobicContact CD1-CD2 4.24Å; Y250-L394 HydrophobicContact CE1-CB 4.37Å; Y250-L394 HydrophobicContact CE1-CD2 4.16Å; Y250-L394 VanDerWaalsContact CE1-O 3.26Å; Y250-L394 WeakPolarHBondContact CE1-O 3.44Å; Y250-L394 PolarHBondContact OH-O 3.34Å
251	P	90.8	Very high	83.7	Confident	80 Å²	80	50.8 Å²	50.8	52%	0.519	24%	0.242	S	C	.	.	H	α-helix	trans	-58.1	-30	-177.1	-26.8	35.9	0	0	0	114	T247 L249	T247-P251 WeakPolarHBondContact O-CD 3.41Å; L249-P251 VanDerWaalsContact C-CD 3.48Å
252	T	89.3	Confident	83.4	Confident	79 Å²	79	50 Å²	50	49%	0.485	24%	0.237	S	C	.	.	H	α-helix	trans	-101	-27.5	-177.9	48.3	0	0	0	0	113.1	L249 Y250 R387	L249-T252 PolarHBondContact O-N 2.83Å; L249-T252 PolarHBondContact O-OG1 3.49Å; L249-T252 VanDerWaalsContact O-OG1 3.12Å; Y250-T252 PolarHBondContact O-N 2.65Å; Y250-T252 VanDerWaalsContact O-N 3.1Å; T252-R387 PolarHBondContact O-NE 3.33Å; T252-R387 PolarHBondContact O-NH1 3.44Å
253	H	88.1	Confident	83.6	Confident	37 Å²	37	53.4 Å²	53.4	17%	0.171	26%	0.259	C	S	.	.	H	α-helix	trans	-109.6	-27.3	-171.4	-63.7	62.9	0	0	0	113.8	L249 Y250 R387 A388 L400 L404	L249-H253 WeakPolarHBondContact O-CB 3.45Å; L249-H253 PolarHBondContact O-N 3.27Å; L249-H253 PolarHBondContact O-ND1 2.9Å; Y250-H253 PolarHBondContact O-N 2.46Å; H253-R387 CarbonylContact O-C 3.41Å; H253-R387 WeakPolarHBondContact O-CA 3.42Å; H253-A388 PolarHBondContact O-N 3.4Å; H253-L400 HydrophobicContact CB-CD1 3.83Å; H253-L400 HydrophobicContact CB-CD2 3.9Å; H253-L400 HydrophobicContact CB-CG 3.77Å; H253-L404 HydrophobicContact CB-CD1 3.58Å; H253-L404 WeakPolarHBondContact O-CD1 3.47Å
254	A	83.5	Confident	83.5	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-89	152.4	-174.3	0	0	0	0	0	113	Y250 Y258 L259 R387 L394	Y250-A254 HydrophobicContact CD1-CB 3.98Å; Y250-A254 HydrophobicContact CG-CB 4.39Å; Y250-A254 VanDerWaalsContact O-CB 3.29Å; Y250-A254 WeakPolarHBondContact O-CB 3.2Å; Y250-A254 PolarHBondContact O-N 3.03Å; A254-Y258 HydrophobicContact CB-CD1 3.75Å; A254-Y258 HydrophobicContact CB-CG 4.21Å; A254-L259 HydrophobicContact CB-CD2 4.5Å; A254-L259 HydrophobicContact CB-CG 4.49Å; A254-R387 WeakPolarHBondContact O-CD 3.44Å; A254-L394 HydrophobicContact CB-CD2 3.57Å
255	C	84.3	Confident	83	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.252	C	S	.	.			trans	-64.4	152.7	175.2	72.5	0	0	0	0	112.6	E257 Y258 L259 C380 R387 A388	C255-E257 PolarHBondContact O-N 2.9Å; C255-E257 VanDerWaalsContact O-N 3.09Å; C255-Y258 WeakPolarHBondContact O-CB 3.23Å; C255-Y258 PolarHBondContact O-N 2.91Å; C255-Y258 VanDerWaalsContact O-N 3.08Å; C255-L259 PolarHBondContact O-N 2.8Å; C255-C380 VanDerWaalsContact CB-SG 3.56Å; C255-R387 HydrophobicContact CB-CB 4.27Å; C255-A388 PolarHBondContact N-O 2.77Å
256	R	81.8	Confident	82.8	Confident	166 Å²	166	50.9 Å²	50.9	63%	0.626	26%	0.258	S	S	*	.	H	α-helix	trans	-51.9	-36.2	-178	-179.4	171.6	64.4	173.9	-1.3	113.2	L259 K260	R256-L259 PolarHBondContact O-N 2.95Å; R256-K260 PolarHBondContact O-N 3.13Å
257	E	77.3	Confident	82.9	Confident	47 Å²	47	58.7 Å²	58.7	22%	0.22	29%	0.291	C	S	.	.	H	α-helix	trans	-77.4	-33	-176.7	-59.7	93.6	136.1	0	0	112.7	C255 L259 K260 N261 K339 Q382 F438	C255-E257 PolarHBondContact O-N 2.9Å; C255-E257 VanDerWaalsContact O-N 3.09Å; E257-L259 VanDerWaalsContact C-N 3.29Å; E257-K260 PolarHBondContact O-N 2.8Å; E257-N261 VanDerWaalsContact O-CB 3.26Å; E257-N261 WeakPolarHBondContact O-CB 3.39Å; E257-N261 PolarHBondContact O-N 2.86Å; E257-N261 PolarHBondContact O-ND2 3.18Å; E257-N261 VanDerWaalsContact O-ND2 3.12Å; E257-K339 HydrophobicContact CB-CD 3.94Å; E257-K339 IonicContact OE1-NZ 2.9Å; E257-K339 PolarHBondContact OE1-NZ 3.47Å; E257-K339 IonicContact OE2-NZ 2.8Å; E257-K339 PolarHBondContact OE2-NZ 3.48Å; E257-Q382 PolarHBondContact OE2-NE2 2.93Å; E257-F438 WeakPolarHBondContact OE1-CE2 3.39Å
258	Y	76.3	Confident	82.7	Confident	10 Å²	10	61.3 Å²	61.3	4%	0.039	30%	0.3	C	S	.	.	H	α-helix	trans	-58.9	-47.2	168.3	-176.1	-93.5	0	0	0	109.9	Y250 A254 C255 K260 N261 L262 D337 L394	Y250-Y258 HydrophobicContact CD1-CD1 4.25Å; Y250-Y258 AromaticContact CD1-CE1 3.68Å; Y250-Y258 HydrophobicContact CD1-CE1 3.68Å; Y250-Y258 HydrophobicContact CD2-CD1 4.5Å; Y250-Y258 AromaticContact CD2-CE1 3.55Å; Y250-Y258 HydrophobicContact CD2-CE1 3.55Å; Y250-Y258 AromaticContact CE1-CE1 3.74Å; Y250-Y258 HydrophobicContact CE1-CE1 3.74Å; Y250-Y258 AromaticContact CE1-CZ 3.98Å; Y250-Y258 AromaticContact CE2-CE1 3.63Å; Y250-Y258 HydrophobicContact CE2-CE1 3.63Å; Y250-Y258 AromaticContact CE2-CZ 3.9Å; Y250-Y258 VanDerWaalsContact CE2-OH 3.32Å; Y250-Y258 WeakPolarHBondContact CE2-OH 3.22Å; Y250-Y258 HydrophobicContact CG-CD1 4.2Å; Y250-Y258 AromaticContact CG-CE1 3.59Å; Y250-Y258 HydrophobicContact CG-CE1 3.59Å; Y250-Y258 AromaticContact CZ-CE1 3.7Å; Y250-Y258 AromaticContact CZ-CZ 3.71Å; Y250-Y258 PolarHBondContact OH-OH 3.16Å; Y250-Y258 VanDerWaalsContact OH-OH 3.06Å; A254-Y258 HydrophobicContact CB-CD1 3.75Å; A254-Y258 HydrophobicContact CB-CG 4.21Å; C255-Y258 WeakPolarHBondContact O-CB 3.23Å; C255-Y258 PolarHBondContact O-N 2.91Å; C255-Y258 VanDerWaalsContact O-N 3.08Å; Y258-K260 VanDerWaalsContact C-N 3.32Å; Y258-K260 PolarHBondContact O-N 3.38Å; Y258-N261 PolarHBondContact O-N 3.47Å; Y258-N261 VanDerWaalsContact O-N 3.1Å; Y258-L262 HydrophobicContact CE1-CB 4.45Å; Y258-L262 HydrophobicContact CE1-CD1 4.5Å; Y258-L262 HydrophobicContact CE1-CD2 4.15Å; Y258-L262 WeakPolarHBondContact O-CB 3.37Å; Y258-L262 PolarHBondContact O-N 3.22Å; Y258-D337 HydrophobicContact CD2-CB 4.19Å; Y258-D337 VanDerWaalsContact CD2-CG 3.42Å; Y258-D337 WeakPolarHBondContact CD2-OD1 3.4Å; Y258-D337 WeakPolarHBondContact CD2-OD2 3.26Å; Y258-D337 HydrophobicContact CE2-CB 4.44Å; Y258-L394 HydrophobicContact CD2-CD1 3.63Å; Y258-L394 HydrophobicContact CE2-CD1 4Å; Y258-L394 HydrophobicContact CG-CD1 4.1Å
259	L	79.5	Confident	81.8	Confident	61 Å²	61	55.6 Å²	55.6	32%	0.319	28%	0.276	S	S	.	.	H	α-helix	trans	-63	-35.2	178.7	-65.4	175.7	0	0	0	113.3	A254 C255 R256 E257 N261 P263	A254-L259 HydrophobicContact CB-CD2 4.5Å; A254-L259 HydrophobicContact CB-CG 4.49Å; C255-L259 PolarHBondContact O-N 2.8Å; R256-L259 PolarHBondContact O-N 2.95Å; E257-L259 VanDerWaalsContact C-N 3.29Å; L259-N261 VanDerWaalsContact C-N 3.33Å; L259-P263 WeakPolarHBondContact O-CD 3.47Å
260	K	80.9	Confident	81.5	Confident	149 Å²	149	55.5 Å²	55.5	65%	0.648	28%	0.279	S	S	*	.	H	α-helix	trans	-68.3	-34.4	174.4	-175.7	176.4	178.4	177.5	0	112.3	R256 E257 Y258	R256-K260 PolarHBondContact O-N 3.13Å; E257-K260 PolarHBondContact O-N 2.8Å; Y258-K260 VanDerWaalsContact C-N 3.32Å; Y258-K260 PolarHBondContact O-N 3.38Å
261	N	75.9	Confident	81.2	Confident	19 Å²	19	55.9 Å²	55.9	10%	0.102	28%	0.28	C	S	.	.	H	α-helix	trans	-88	-32.2	-171.8	-76.5	-18.4	0	0	0	113.4	E257 Y258 L259 L264 L265 I338	E257-N261 VanDerWaalsContact O-CB 3.26Å; E257-N261 WeakPolarHBondContact O-CB 3.39Å; E257-N261 PolarHBondContact O-N 2.86Å; E257-N261 PolarHBondContact O-ND2 3.18Å; E257-N261 VanDerWaalsContact O-ND2 3.12Å; Y258-N261 PolarHBondContact O-N 3.47Å; Y258-N261 VanDerWaalsContact O-N 3.1Å; L259-N261 VanDerWaalsContact C-N 3.33Å; N261-L264 WeakPolarHBondContact O-CB 3.48Å; N261-L264 PolarHBondContact O-N 3Å; N261-L265 PolarHBondContact O-N 2.81Å; N261-I338 HydrophobicContact CB-CB 4.29Å; N261-I338 HydrophobicContact CB-CD1 3.61Å; N261-I338 WeakPolarHBondContact ND2-CG2 3.4Å
262	L	77.3	Confident	80.9	Confident	19 Å²	19	57.1 Å²	57.1	10%	0.099	28%	0.275	C	S	.	.	H	α-helix	trans	-56.8	-41.9	-178.6	-177.1	67.6	0	0	0	114	Y250 Y258 L264 L265 T266	Y250-L262 HydrophobicContact CD2-CD2 3.83Å; Y250-L262 HydrophobicContact CE2-CD2 4.29Å; Y258-L262 HydrophobicContact CE1-CB 4.45Å; Y258-L262 HydrophobicContact CE1-CD1 4.5Å; Y258-L262 HydrophobicContact CE1-CD2 4.15Å; Y258-L262 WeakPolarHBondContact O-CB 3.37Å; Y258-L262 PolarHBondContact O-N 3.22Å; L262-L264 VanDerWaalsContact C-N 3.28Å; L262-L264 PolarHBondContact O-N 3.43Å; L262-L265 PolarHBondContact O-N 3.03Å; L262-T266 PolarHBondContact O-N 3.5Å; L262-T266 PolarHBondContact O-OG1 2.99Å
263	P	82.8	Confident	80.8	Confident	78 Å²	78	57.3 Å²	57.3	51%	0.506	27%	0.27	S	S	.	.	H	α-helix	trans	-62.7	-33.8	174.3	-24.1	34.8	0	0	0	113.2	L259 T266 K267	L259-P263 WeakPolarHBondContact O-CD 3.47Å; P263-T266 WeakPolarHBondContact O-CB 2.87Å; P263-T266 PolarHBondContact O-N 2.86Å; P263-K267 WeakPolarHBondContact O-CB 3.3Å; P263-K267 PolarHBondContact O-N 3.19Å
264	L	78.8	Confident	80.9	Confident	57 Å²	57	60.2 Å²	60.2	30%	0.298	29%	0.287	S	S	.	.	H	α-helix	trans	-69.8	-41.2	177.8	-56.9	175.6	0	0	0	110.9	N261 L262 T266 K267 H268 F285 M289	N261-L264 WeakPolarHBondContact O-CB 3.48Å; N261-L264 PolarHBondContact O-N 3Å; L262-L264 VanDerWaalsContact C-N 3.28Å; L262-L264 PolarHBondContact O-N 3.43Å; L264-T266 VanDerWaalsContact C-N 3.32Å; L264-T266 PolarHBondContact O-N 3.44Å; L264-K267 PolarHBondContact O-N 3.33Å; L264-H268 WeakPolarHBondContact O-CB 3.32Å; L264-H268 PolarHBondContact O-CD2 2.97Å; L264-H268 PolarHBondContact O-N 2.97Å; L264-F285 HydrophobicContact CB-CZ 3.8Å; L264-M289 HydrophobicContact CD1-CE 3.55Å
265	L	75.9	Confident	81	Confident	5 Å²	5	62.9 Å²	62.9	3%	0.026	30%	0.301	C	S	.	.	H	α-helix	trans	-62.7	-39.1	172.6	-72.1	176.4	0	0	0	112.3	N261 L262 K267 C269 G270 Y271 F285 I338	N261-L265 PolarHBondContact O-N 2.81Å; L262-L265 PolarHBondContact O-N 3.03Å; L265-K267 VanDerWaalsContact C-N 3.35Å; L265-C269 HydrophobicContact CD2-CB 4.15Å; L265-C269 CarbonylContact O-C 3.54Å; L265-C269 VanDerWaalsContact O-CA 3.31Å; L265-C269 WeakPolarHBondContact O-CA 3.3Å; L265-C269 VanDerWaalsContact O-CB 3.27Å; L265-C269 WeakPolarHBondContact O-CB 3.48Å; L265-C269 PolarHBondContact O-N 3.36Å; L265-G270 PolarHBondContact O-N 2.95Å; L265-Y271 HydrophobicContact CB-CD1 4.32Å; L265-Y271 HydrophobicContact CB-CD2 3.75Å; L265-Y271 HydrophobicContact CB-CE2 4.12Å; L265-Y271 HydrophobicContact CB-CG 3.87Å; L265-Y271 HydrophobicContact CD1-CD1 4.43Å; L265-Y271 HydrophobicContact CD1-CE1 4.11Å; L265-Y271 HydrophobicContact CD1-CE2 4.36Å; L265-Y271 HydrophobicContact CD2-CD2 4.44Å; L265-Y271 HydrophobicContact CD2-CE2 4.02Å; L265-Y271 HydrophobicContact CG-CE2 4.41Å; L265-Y271 PolarHBondContact O-N 3.5Å; L265-F285 HydrophobicContact CD2-CD1 3.97Å; L265-F285 HydrophobicContact CD2-CE1 3.96Å; L265-I338 HydrophobicContact CD1-CD1 3.56Å; L265-I338 HydrophobicContact CD1-CG1 4.25Å; L265-I338 HydrophobicContact CD2-CD1 3.57Å; L265-I338 HydrophobicContact CD2-CG1 4.25Å; L265-I338 HydrophobicContact CG-CD1 3.39Å; L265-I338 HydrophobicContact CG-CG1 4.4Å
266	T	81.4	Confident	80.9	Confident	60 Å²	60	63.2 Å²	63.2	37%	0.368	30%	0.303	S	S	.	.	H	α-helix	trans	-61.9	-45.2	175.7	-58	0	0	0	0	110.6	L262 P263 L264 Y271	L262-T266 PolarHBondContact O-N 3.5Å; L262-T266 PolarHBondContact O-OG1 2.99Å; P263-T266 WeakPolarHBondContact O-CB 2.87Å; P263-T266 PolarHBondContact O-N 2.86Å; L264-T266 VanDerWaalsContact C-N 3.32Å; L264-T266 PolarHBondContact O-N 3.44Å; T266-Y271 WeakPolarHBondContact CG2-O 2.92Å
267	K	86.1	Confident	80.7	Confident	165 Å²	165	55.4 Å²	55.4	72%	0.717	27%	0.274	S	S	*	.	H	α-helix	trans	-73	-43	-177.5	-173.8	175.7	180	179.9	0	113.8	P263 L264 L265	P263-K267 WeakPolarHBondContact O-CB 3.3Å; P263-K267 PolarHBondContact O-N 3.19Å; L264-K267 PolarHBondContact O-N 3.33Å; L265-K267 VanDerWaalsContact C-N 3.35Å
268	H	79.3	Confident	80.7	Confident	107 Å²	107	54.6 Å²	54.6	50%	0.495	27%	0.27	S	S	.	.	H	α-helix	trans	-105.4	-26.5	-169.2	-65.5	-74.2	0	0	0	114.4	L264 F285	L264-H268 WeakPolarHBondContact O-CB 3.32Å; L264-H268 PolarHBondContact O-CD2 2.97Å; L264-H268 PolarHBondContact O-N 2.97Å; H268-F285 HydrophobicContact CB-CD2 3.56Å; H268-F285 HydrophobicContact CB-CE2 3.7Å; H268-F285 HydrophobicContact CB-CG 4.43Å; H268-F285 AromaticContact CD2-CE2 3.81Å; H268-F285 AromaticContact CG-CE2 3.88Å
269	C	73.8	Confident	80.7	Confident	7 Å²	7	55.9 Å²	55.9	5%	0.047	28%	0.278	C	S	.	.	H	α-helix	trans	-111.3	-0.2	-176.1	-58	0	0	0	0	113.2	L265 Y271 V282 F285	L265-C269 HydrophobicContact CD2-CB 4.15Å; L265-C269 CarbonylContact O-C 3.54Å; L265-C269 VanDerWaalsContact O-CA 3.31Å; L265-C269 WeakPolarHBondContact O-CA 3.3Å; L265-C269 VanDerWaalsContact O-CB 3.27Å; L265-C269 WeakPolarHBondContact O-CB 3.48Å; L265-C269 PolarHBondContact O-N 3.36Å; C269-Y271 HydrophobicContact CB-CD2 3.73Å; C269-Y271 HydrophobicContact CB-CE2 3.84Å; C269-Y271 PolarHBondContact O-N 3.15Å; C269-V282 HydrophobicContact CB-CG2 4.06Å; C269-F285 WeakPolarHBondContact SG-CB 3.2Å; C269-F285 WeakPolarHBondContact SG-CG 2.99Å
270	G	82.3	Confident	80.5	Confident	15 Å²	15	53.6 Å²	53.6	16%	0.155	27%	0.265	C	S	.	.			trans	70.5	29.4	177.3	0	0	0	0	0	114.2	L265 R272 N275	L265-G270 PolarHBondContact O-N 2.95Å; G270-R272 PolarHBondContact O-N 3.42Å; G270-N275 PolarHBondContact O-ND2 3.01Å
271	Y	79.9	Confident	80.3	Confident	12 Å²	12	48.4 Å²	48.4	5%	0.047	24%	0.244	C	C	.	.			trans	-65.6	103.7	171.2	-83	-121.1	0	0	0	109.4	W239 F243 L265 T266 C269 P277 V282	W239-Y271 HydrophobicContact CH2-CD1 4.49Å; W239-Y271 HydrophobicContact CH2-CE1 4.43Å; W239-Y271 HydrophobicContact CZ2-CD1 4.43Å; F243-Y271 HydrophobicContact CE2-CD1 4.32Å; L265-Y271 HydrophobicContact CB-CD1 4.32Å; L265-Y271 HydrophobicContact CB-CD2 3.75Å; L265-Y271 HydrophobicContact CB-CE2 4.12Å; L265-Y271 HydrophobicContact CB-CG 3.87Å; L265-Y271 HydrophobicContact CD1-CD1 4.43Å; L265-Y271 HydrophobicContact CD1-CE1 4.11Å; L265-Y271 HydrophobicContact CD1-CE2 4.36Å; L265-Y271 HydrophobicContact CD2-CD2 4.44Å; L265-Y271 HydrophobicContact CD2-CE2 4.02Å; L265-Y271 HydrophobicContact CG-CE2 4.41Å; L265-Y271 PolarHBondContact O-N 3.5Å; T266-Y271 WeakPolarHBondContact CG2-O 2.92Å; C269-Y271 HydrophobicContact CB-CD2 3.73Å; C269-Y271 HydrophobicContact CB-CE2 3.84Å; C269-Y271 PolarHBondContact O-N 3.15Å; Y271-P277 HydrophobicContact CD1-CG 4.08Å; Y271-P277 HydrophobicContact CD2-CB 3.76Å; Y271-P277 HydrophobicContact CD2-CG 3.22Å; Y271-P277 HydrophobicContact CE1-CG 4.18Å; Y271-P277 HydrophobicContact CE2-CB 3.52Å; Y271-P277 HydrophobicContact CE2-CG 3.34Å; Y271-P277 HydrophobicContact CG-CG 3.61Å; Y271-V282 HydrophobicContact CE2-CG2 3.84Å
272	R	85.5	Confident	80.2	Confident	107 Å²	107	48.2 Å²	48.2	40%	0.404	24%	0.244	S	C	.	.	B	Isolated β-bridge	trans	-146.1	163.8	177.9	-57.5	-168.7	-50.1	-88.5	0.7	110.3	W239 G270 D274 N275	W239-R272 PolarHBondContact NE1-O 3.2Å; G270-R272 PolarHBondContact O-N 3.42Å; R272-D274 VanDerWaalsContact C-N 3.26Å; R272-D274 WeakPolarHBondContact CB-OD1 3.29Å; R272-D274 IonicContact CZ-OD1 2.77Å; R272-D274 IonicContact CZ-OD2 2.9Å; R272-D274 IonicContact NE-OD1 3.01Å; R272-D274 PolarHBondContact NE-OD1 2.96Å; R272-D274 IonicContact NE-OD2 3.46Å; R272-D274 PolarHBondContact NE-OD2 3.17Å; R272-D274 IonicContact NH2-OD1 2.82Å; R272-D274 IonicContact NH2-OD2 3.88Å; R272-D274 PolarHBondContact NH2-OD2 2.79Å; R272-D274 PolarHBondContact O-N 3.35Å; R272-N275 PolarHBondContact O-N 2.85Å
273	E	86.4	Confident	79.8	Confident	82 Å²	82	47.7 Å²	47.7	38%	0.383	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-32.9	178.3	-166.5	177.6	157.3	0	0	112.7	G240 F243 R244	G240-E273 VanDerWaalsContact CA-CG 3.42Å; G240-E273 WeakPolarHBondContact CA-O 2.92Å; G240-E273 WeakPolarHBondContact O-CG 3.29Å; F243-E273 HydrophobicContact CD1-CB 4.17Å; R244-E273 HydrophobicContact CB-CG 4.47Å; R244-E273 IonicContact CZ-OE1 3.36Å; R244-E273 IonicContact NE-OE1 2.83Å; R244-E273 IonicContact NH1-OE1 3.66Å; R244-E273 PolarHBondContact NH1-OE1 2.72Å
274	D	90.2	Very high	79.3	Confident	99 Å²	99	49.7 Å²	49.7	53%	0.529	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-3.8	-177.2	67.4	-48.8	0	0	0	114	V236 R272	V236-D274 WeakPolarHBondContact CG1-O 2.86Å; R272-D274 VanDerWaalsContact C-N 3.26Å; R272-D274 WeakPolarHBondContact CB-OD1 3.29Å; R272-D274 IonicContact CZ-OD1 2.77Å; R272-D274 IonicContact CZ-OD2 2.9Å; R272-D274 IonicContact NE-OD1 3.01Å; R272-D274 PolarHBondContact NE-OD1 2.96Å; R272-D274 IonicContact NE-OD2 3.46Å; R272-D274 PolarHBondContact NE-OD2 3.17Å; R272-D274 IonicContact NH2-OD1 2.82Å; R272-D274 IonicContact NH2-OD2 3.88Å; R272-D274 PolarHBondContact NH2-OD2 2.79Å; R272-D274 PolarHBondContact O-N 3.35Å
275	N	85.4	Confident	79.1	Confident	55 Å²	55	48.5 Å²	48.5	29%	0.294	23%	0.232	S	C	.	.	B	Isolated β-bridge	trans	-145.6	125.9	-170.6	179.5	66.4	0	0	0	112.5	W239 G270 R272 P277	W239-N275 PolarHBondContact NE1-O 2.87Å; W239-N275 VanDerWaalsContact NE1-O 3.12Å; G270-N275 PolarHBondContact O-ND2 3.01Å; R272-N275 PolarHBondContact O-N 2.85Å; N275-P277 WeakPolarHBondContact O-CD 2.87Å
276	I	81.6	Confident	78.6	Confident	7 Å²	7	49.4 Å²	49.4	4%	0.036	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-81.1	121.1	172	-60.8	169.4	0	0	0	108.6	Y231 E235 V236 W239 W311	Y231-I276 HydrophobicContact CD1-CD1 3.74Å; Y231-I276 HydrophobicContact CD2-CB 3.73Å; Y231-I276 HydrophobicContact CD2-CD1 4.13Å; Y231-I276 HydrophobicContact CD2-CG1 4.48Å; Y231-I276 HydrophobicContact CD2-CG2 3.98Å; Y231-I276 HydrophobicContact CE1-CD1 4.25Å; Y231-I276 HydrophobicContact CE1-CG2 4.13Å; Y231-I276 HydrophobicContact CE2-CB 3.77Å; Y231-I276 HydrophobicContact CE2-CG2 3.5Å; Y231-I276 HydrophobicContact CG-CB 4.2Å; Y231-I276 HydrophobicContact CG-CD1 3.68Å; Y231-I276 HydrophobicContact CG-CG1 4.49Å; Y231-I276 HydrophobicContact CG-CG2 4.48Å; E235-I276 HydrophobicContact CB-CD1 4.21Å; V236-I276 HydrophobicContact CG2-CD1 4.16Å; V236-I276 HydrophobicContact CG2-CG1 4.4Å; W239-I276 HydrophobicContact CB-CD1 3.94Å; W239-I276 HydrophobicContact CB-CG1 3.56Å; W239-I276 HydrophobicContact CD2-CG1 4.1Å; W239-I276 HydrophobicContact CG-CD1 4.44Å; W239-I276 HydrophobicContact CG-CG1 3.55Å; I276-W311 HydrophobicContact CG2-CH2 4.15Å; I276-W311 HydrophobicContact CG2-CZ3 3.9Å
277	P	77.8	Confident	77.8	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.013	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-56.9	140.3	176.7	-26.1	33.6	0	0	0	113.3	W239 Y271 N275 V282	W239-P277 HydrophobicContact CZ2-CG 4.23Å; Y271-P277 HydrophobicContact CD1-CG 4.08Å; Y271-P277 HydrophobicContact CD2-CB 3.76Å; Y271-P277 HydrophobicContact CD2-CG 3.22Å; Y271-P277 HydrophobicContact CE1-CG 4.18Å; Y271-P277 HydrophobicContact CE2-CB 3.52Å; Y271-P277 HydrophobicContact CE2-CG 3.34Å; Y271-P277 HydrophobicContact CG-CG 3.61Å; N275-P277 WeakPolarHBondContact O-CD 2.87Å; P277-V282 HydrophobicContact CB-CG2 4.05Å
278	Q	78.3	Confident	76.7	Confident	30 Å²	30	45.1 Å²	45.1	14%	0.14	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-85.7	134.3	174.4	-63.3	-68.9	-34.9	0	0	110.3	I229 E280 D281 V282	I229-Q278 PolarHBondContact O-NE2 3.39Å; Q278-E280 PolarHBondContact O-N 3.02Å; Q278-D281 PolarHBondContact O-N 3.24Å; Q278-V282 PolarHBondContact O-N 2.75Å; Q278-V282 VanDerWaalsContact O-N 3.15Å
279	L	75.1	Confident	75.7	Confident	38 Å²	38	41.2 Å²	41.2	20%	0.199	20%	0.203	C	C	.	.	H	α-helix	trans	-59.6	-34.9	-176.5	-64.8	168.2	0	0	0	113.2	I226 D281 V282 S283 T308	I226-L279 HydrophobicContact CD1-CB 4.19Å; I226-L279 HydrophobicContact CG2-CB 3.93Å; I226-L279 HydrophobicContact CG2-CD1 4.27Å; L279-D281 VanDerWaalsContact C-N 3.34Å; L279-D281 PolarHBondContact O-N 3.45Å; L279-V282 PolarHBondContact O-N 3.45Å; L279-S283 WeakPolarHBondContact O-CB 3.19Å; L279-S283 PolarHBondContact O-N 3Å; L279-T308 HydrophobicContact CD1-CG2 3.26Å; L279-T308 HydrophobicContact CD2-CG2 4.41Å; L279-T308 HydrophobicContact CG-CG2 4.44Å
280	E	76.1	Confident	74.6	Confident	13 Å²	13	42.1 Å²	42.1	6%	0.061	21%	0.207	C	C	.	.	H	α-helix	trans	-63	-41.2	177.1	179.1	55.5	-156.9	0	0	111.7	I226 Q278 S283 R284 R287	I226-E280 HydrophobicContact CB-CB 4.03Å; I226-E280 PolarHBondContact N-OE2 3.06Å; Q278-E280 PolarHBondContact O-N 3.02Å; E280-S283 PolarHBondContact O-N 3.3Å; E280-R284 VanDerWaalsContact CG-CZ 3.5Å; E280-R284 WeakPolarHBondContact O-CB 3.31Å; E280-R284 WeakPolarHBondContact O-CG 3.44Å; E280-R284 PolarHBondContact O-N 3.15Å; E280-R284 WeakPolarHBondContact OE1-CG 2.85Å; E280-R284 IonicContact OE1-CZ 3.43Å; E280-R284 IonicContact OE1-NE 3.57Å; E280-R284 PolarHBondContact OE1-NE 3.46Å; E280-R284 IonicContact OE1-NH2 3.59Å; E280-R287 IonicContact OE1-NH2 2.67Å; E280-R287 PolarHBondContact OE1-NH2 2.93Å; E280-R287 IonicContact OE2-NH2 3.97Å
281	D	76.6	Confident	73	Confident	39 Å²	39	51.7 Å²	51.7	21%	0.209	24%	0.239	C	C	.	.	H	α-helix	trans	-70	-41.7	-179.9	-65.1	-35.7	0	0	0	110.8	R228 Q278 L279 R284 F285	R228-D281 IonicContact CZ-OD1 2.75Å; R228-D281 IonicContact CZ-OD2 2.83Å; R228-D281 VanDerWaalsContact CZ-OD2 3.27Å; R228-D281 IonicContact NH1-OD2 3.87Å; R228-D281 PolarHBondContact NH1-OD2 3.33Å; R228-D281 IonicContact NH2-OD1 2.87Å; R228-D281 PolarHBondContact NH2-OD1 3.21Å; R228-D281 IonicContact NH2-OD2 3.62Å; R228-D281 PolarHBondContact NH2-OD2 3.46Å; Q278-D281 PolarHBondContact O-N 3.24Å; L279-D281 VanDerWaalsContact C-N 3.34Å; L279-D281 PolarHBondContact O-N 3.45Å; D281-R284 PolarHBondContact O-N 3.28Å; D281-R284 IonicContact OD1-CZ 2.96Å; D281-R284 IonicContact OD1-NH1 3.25Å; D281-R284 PolarHBondContact OD1-NH1 2.87Å; D281-R284 IonicContact OD1-NH2 3.63Å; D281-F285 WeakPolarHBondContact O-CB 3.47Å; D281-F285 PolarHBondContact O-N 3.45Å
282	V	73.6	Confident	71.2	Confident	16 Å²	16	54.8 Å²	54.8	10%	0.097	26%	0.262	C	S	.	.	H	α-helix	trans	-61.5	-46.1	172.9	-179.2	0	0	0	0	111.1	C269 Y271 P277 Q278 L279 R284 F285 L286	C269-V282 HydrophobicContact CB-CG2 4.06Å; Y271-V282 HydrophobicContact CE2-CG2 3.84Å; P277-V282 HydrophobicContact CB-CG2 4.05Å; Q278-V282 PolarHBondContact O-N 2.75Å; Q278-V282 VanDerWaalsContact O-N 3.15Å; L279-V282 PolarHBondContact O-N 3.45Å; V282-R284 PolarHBondContact O-N 3.42Å; V282-F285 PolarHBondContact O-N 3.05Å; V282-L286 HydrophobicContact CG1-CD1 3.97Å; V282-L286 HydrophobicContact CG1-CG 4.34Å; V282-L286 WeakPolarHBondContact O-CB 3.37Å; V282-L286 VanDerWaalsContact O-CG 3.29Å; V282-L286 WeakPolarHBondContact O-CG 3.39Å; V282-L286 PolarHBondContact O-N 3.25Å
283	S	68.8	Low	68.8	Low	7 Å²	7	52.8 Å²	52.8	5%	0.049	28%	0.275	C	S	.	.	H	α-helix	trans	-60.9	-42.2	177.9	172.2	0	0	0	0	112.2	L279 E280 R287 I300	L279-S283 WeakPolarHBondContact O-CB 3.19Å; L279-S283 PolarHBondContact O-N 3Å; E280-S283 PolarHBondContact O-N 3.3Å; S283-R287 WeakPolarHBondContact O-CB 3.25Å; S283-R287 VanDerWaalsContact O-CG 3.28Å; S283-R287 WeakPolarHBondContact O-CG 3.42Å; S283-R287 PolarHBondContact O-N 2.89Å; S283-R287 PolarHBondContact O-NE 2.87Å; S283-R287 PolarHBondContact OG-NE 3.28Å; S283-R287 PolarHBondContact OG-NH2 3.13Å; S283-I300 WeakPolarHBondContact OG-CD1 3.5Å
284	R	72.9	Confident	66.2	Low	120 Å²	120	56.3 Å²	56.3	45%	0.453	29%	0.285	S	S	.	.	H	α-helix	trans	-66.2	-43.7	174.9	-75.2	-170.5	-129.9	127.7	-10.7	112.2	E280 D281 V282 R287 G288	E280-R284 VanDerWaalsContact CG-CZ 3.5Å; E280-R284 WeakPolarHBondContact O-CB 3.31Å; E280-R284 WeakPolarHBondContact O-CG 3.44Å; E280-R284 PolarHBondContact O-N 3.15Å; E280-R284 WeakPolarHBondContact OE1-CG 2.85Å; E280-R284 IonicContact OE1-CZ 3.43Å; E280-R284 IonicContact OE1-NE 3.57Å; E280-R284 PolarHBondContact OE1-NE 3.46Å; E280-R284 IonicContact OE1-NH2 3.59Å; D281-R284 PolarHBondContact O-N 3.28Å; D281-R284 IonicContact OD1-CZ 2.96Å; D281-R284 IonicContact OD1-NH1 3.25Å; D281-R284 PolarHBondContact OD1-NH1 2.87Å; D281-R284 IonicContact OD1-NH2 3.63Å; V282-R284 PolarHBondContact O-N 3.42Å; R284-R287 PolarHBondContact O-N 3.47Å; R284-G288 PolarHBondContact O-N 3.29Å
285	F	74.1	Confident	63.4	Low	33 Å²	33	52 Å²	52	15%	0.145	26%	0.263	C	S	.	.	H	α-helix	trans	-60.9	-46.9	177.7	175.8	-101.8	0	0	0	111.7	L264 L265 H268 C269 D281 V282 R287 G288 M289 I338	L264-F285 HydrophobicContact CB-CZ 3.8Å; L265-F285 HydrophobicContact CD2-CD1 3.97Å; L265-F285 HydrophobicContact CD2-CE1 3.96Å; H268-F285 HydrophobicContact CB-CD2 3.56Å; H268-F285 HydrophobicContact CB-CE2 3.7Å; H268-F285 HydrophobicContact CB-CG 4.43Å; H268-F285 AromaticContact CD2-CE2 3.81Å; H268-F285 AromaticContact CG-CE2 3.88Å; C269-F285 WeakPolarHBondContact SG-CB 3.2Å; C269-F285 WeakPolarHBondContact SG-CG 2.99Å; D281-F285 WeakPolarHBondContact O-CB 3.47Å; D281-F285 PolarHBondContact O-N 3.45Å; V282-F285 PolarHBondContact O-N 3.05Å; F285-R287 PolarHBondContact O-N 3.3Å; F285-G288 PolarHBondContact O-N 3.28Å; F285-G288 VanDerWaalsContact O-N 3.16Å; F285-M289 HydrophobicContact CD1-CG 4.47Å; F285-M289 HydrophobicContact CD1-SD 4.21Å; F285-M289 HydrophobicContact CE1-CE 4.29Å; F285-M289 HydrophobicContact CE1-CG 3.99Å; F285-M289 HydrophobicContact CE1-SD 3.32Å; F285-M289 WeakPolarHBondContact CE1-SD 2.99Å; F285-M289 HydrophobicContact CE2-CG 4.2Å; F285-M289 HydrophobicContact CE2-SD 4.29Å; F285-M289 HydrophobicContact CZ-CE 3.79Å; F285-M289 HydrophobicContact CZ-CG 3.83Å; F285-M289 HydrophobicContact CZ-SD 3.36Å; F285-M289 WeakPolarHBondContact CZ-SD 3.07Å; F285-M289 PolarHBondContact O-N 2.58Å; F285-I338 HydrophobicContact CE1-CD1 4Å
286	L	65.8	Low	60.5	Low	23 Å²	23	54.4 Å²	54.4	12%	0.12	28%	0.275	C	S	.	.	H	α-helix	trans	-59.8	-47.8	175.4	-70.2	174	0	0	0	111.3	V282 G288 M289 L290 I338	V282-L286 HydrophobicContact CG1-CD1 3.97Å; V282-L286 HydrophobicContact CG1-CG 4.34Å; V282-L286 WeakPolarHBondContact O-CB 3.37Å; V282-L286 VanDerWaalsContact O-CG 3.29Å; V282-L286 WeakPolarHBondContact O-CG 3.39Å; V282-L286 PolarHBondContact O-N 3.25Å; L286-G288 VanDerWaalsContact C-N 3.27Å; L286-G288 PolarHBondContact O-N 3.35Å; L286-M289 PolarHBondContact O-N 3.36Å; L286-L290 WeakPolarHBondContact O-CB 3.25Å; L286-L290 WeakPolarHBondContact O-CD1 3.45Å; L286-L290 WeakPolarHBondContact O-CG 3.34Å; L286-L290 PolarHBondContact O-N 3.46Å; L286-I338 HydrophobicContact CD2-CB 4.35Å; L286-I338 HydrophobicContact CD2-CG1 3.76Å; L286-I338 HydrophobicContact CD2-CG2 4.36Å
287	R	64.3	Low	57.8	Low	97 Å²	97	56.5 Å²	56.5	37%	0.366	29%	0.289	S	S	.	.	H	α-helix	trans	-57.9	-38.7	174.6	-76.7	-178.7	-73.6	-170.2	1.8	112.5	E280 S283 R284 F285 L290 R291	E280-R287 IonicContact OE1-NH2 2.67Å; E280-R287 PolarHBondContact OE1-NH2 2.93Å; E280-R287 IonicContact OE2-NH2 3.97Å; S283-R287 WeakPolarHBondContact O-CB 3.25Å; S283-R287 VanDerWaalsContact O-CG 3.28Å; S283-R287 WeakPolarHBondContact O-CG 3.42Å; S283-R287 PolarHBondContact O-N 2.89Å; S283-R287 PolarHBondContact O-NE 2.87Å; S283-R287 PolarHBondContact OG-NE 3.28Å; S283-R287 PolarHBondContact OG-NH2 3.13Å; R284-R287 PolarHBondContact O-N 3.47Å; F285-R287 PolarHBondContact O-N 3.3Å; R287-L290 PolarHBondContact O-N 3.34Å; R287-R291 WeakPolarHBondContact O-CB 3.37Å; R287-R291 WeakPolarHBondContact O-CG 3.4Å; R287-R291 PolarHBondContact O-N 2.86Å
288	G	62	Low	55.5	Low	38 Å²	38	56.8 Å²	56.8	39%	0.392	29%	0.29	S	S	.	.	H	α-helix	trans	-65.1	-46.6	175.3	0	0	0	0	0	112.8	R284 F285 L286 L290 R291 S292	R284-G288 PolarHBondContact O-N 3.29Å; F285-G288 PolarHBondContact O-N 3.28Å; F285-G288 VanDerWaalsContact O-N 3.16Å; L286-G288 VanDerWaalsContact C-N 3.27Å; L286-G288 PolarHBondContact O-N 3.35Å; G288-L290 VanDerWaalsContact C-N 3.28Å; G288-L290 PolarHBondContact O-N 2.95Å; G288-R291 PolarHBondContact O-N 3.31Å; G288-S292 WeakPolarHBondContact O-CB 3.3Å; G288-S292 PolarHBondContact O-N 3.48Å
289	M	58.3	Low	53.1	Low	25 Å²	25	56.4 Å²	56.4	12%	0.123	29%	0.291	C	S	.	.	H	α-helix	trans	-62.8	-35.5	175.9	-73	-164.4	117.9	0	0	112.7	L264 F285 L286 Y294 L295 I338	L264-M289 HydrophobicContact CD1-CE 3.55Å; F285-M289 HydrophobicContact CD1-CG 4.47Å; F285-M289 HydrophobicContact CD1-SD 4.21Å; F285-M289 HydrophobicContact CE1-CE 4.29Å; F285-M289 HydrophobicContact CE1-CG 3.99Å; F285-M289 HydrophobicContact CE1-SD 3.32Å; F285-M289 WeakPolarHBondContact CE1-SD 2.99Å; F285-M289 HydrophobicContact CE2-CG 4.2Å; F285-M289 HydrophobicContact CE2-SD 4.29Å; F285-M289 HydrophobicContact CZ-CE 3.79Å; F285-M289 HydrophobicContact CZ-CG 3.83Å; F285-M289 HydrophobicContact CZ-SD 3.36Å; F285-M289 WeakPolarHBondContact CZ-SD 3.07Å; F285-M289 PolarHBondContact O-N 2.58Å; L286-M289 PolarHBondContact O-N 3.36Å; M289-Y294 PolarHBondContact O-N 3.44Å; M289-L295 HydrophobicContact CB-CD1 4.18Å; M289-L295 PolarHBondContact O-N 3.46Å; M289-L295 HydrophobicContact SD-CD1 4.24Å; M289-I338 HydrophobicContact SD-CG2 4.25Å
290	L	52.3	Low	50.9	Low	27 Å²	27	58.4 Å²	58.4	14%	0.141	30%	0.3	C	S	.	.	H	α-helix	trans	-66.8	-43.2	175.3	-70.3	161.1	0	0	0	111.7	L286 R287 G288 G293 L295 L296 N298 T341	L286-L290 WeakPolarHBondContact O-CB 3.25Å; L286-L290 WeakPolarHBondContact O-CD1 3.45Å; L286-L290 WeakPolarHBondContact O-CG 3.34Å; L286-L290 PolarHBondContact O-N 3.46Å; R287-L290 PolarHBondContact O-N 3.34Å; G288-L290 VanDerWaalsContact C-N 3.28Å; G288-L290 PolarHBondContact O-N 2.95Å; L290-G293 PolarHBondContact O-N 3.16Å; L290-L295 WeakPolarHBondContact CA-O 3.43Å; L290-L295 HydrophobicContact CD2-CB 3.69Å; L290-L295 HydrophobicContact CG-CB 4.36Å; L290-L296 WeakPolarHBondContact CD2-O 3.46Å; L290-N298 WeakPolarHBondContact CD1-O 3.41Å; L290-T341 HydrophobicContact CD1-CG2 3.98Å; L290-T341 HydrophobicContact CD2-CG2 3.99Å; L290-T341 HydrophobicContact CG-CG2 4.46Å
291	R	48.8	Very low	48.6	Very low	215 Å²	215	59 Å²	59	81%	0.811	31%	0.305	S	S	*	.	H	α-helix	trans	-70.9	-30.7	177.7	-74.3	176.1	178.3	177.3	-1.6	113.3	R287 G288 G293	R287-R291 WeakPolarHBondContact O-CB 3.37Å; R287-R291 WeakPolarHBondContact O-CG 3.4Å; R287-R291 PolarHBondContact O-N 2.86Å; G288-R291 PolarHBondContact O-N 3.31Å; R291-G293 PolarHBondContact O-N 3.32Å
292	S	42	Very low	46.5	Very low	78 Å²	78	58.8 Å²	58.8	55%	0.545	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	3.6	178.8	-172.1	0	0	0	0	113.5	G288 Y294	G288-S292 WeakPolarHBondContact O-CB 3.3Å; G288-S292 PolarHBondContact O-N 3.48Å; S292-Y294 VanDerWaalsContact C-N 3.27Å; S292-Y294 PolarHBondContact O-N 3.13Å
293	G	35.4	Very low	44.5	Very low	64 Å²	64	59.4 Å²	59.4	66%	0.66	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.5	5.9	177.7	0	0	0	0	0	115.5	L290 R291	L290-G293 PolarHBondContact O-N 3.16Å; R291-G293 PolarHBondContact O-N 3.32Å
294	Y	30.2	Very low	42.5	Very low	156 Å²	156	59.5 Å²	59.5	61%	0.612	31%	0.307	S	S	*	.	S	Bend	trans	-76.8	-25.1	176.5	-80.7	-82.8	0	0	0	112.6	M289 S292 K342	M289-Y294 PolarHBondContact O-N 3.44Å; S292-Y294 VanDerWaalsContact C-N 3.27Å; S292-Y294 PolarHBondContact O-N 3.13Å; Y294-K342 WeakPolarHBondContact O-CE 3.43Å; Y294-K342 PolarHBondContact O-NZ 3.36Å
295	L	31.1	Very low	40.5	Very low	10 Å²	10	56.3 Å²	56.3	5%	0.052	30%	0.295	C	S	.	.	S	Bend	trans	-129.8	137.7	167	-84.3	96.4	0	0	0	108.6	M289 L290 I338 T341 K342	M289-L295 HydrophobicContact CB-CD1 4.18Å; M289-L295 PolarHBondContact O-N 3.46Å; M289-L295 HydrophobicContact SD-CD1 4.24Å; L290-L295 WeakPolarHBondContact CA-O 3.43Å; L290-L295 HydrophobicContact CD2-CB 3.69Å; L290-L295 HydrophobicContact CG-CB 4.36Å; L295-I338 HydrophobicContact CD1-CG2 3.79Å; L295-I338 HydrophobicContact CD2-CG2 4.21Å; L295-I338 WeakPolarHBondContact CD2-O 3.27Å; L295-T341 WeakPolarHBondContact CD2-OG1 3.31Å; L295-K342 HydrophobicContact CD2-CB 4.37Å; L295-K342 HydrophobicContact CD2-CD 4.42Å; L295-K342 HydrophobicContact CD2-CG 3.89Å; L295-K342 HydrophobicContact CG-CD 4.28Å; L295-K342 HydrophobicContact CG-CG 4.06Å
296	L	25.5	Very low	38.2	Very low	104 Å²	104	56.6 Å²	56.6	55%	0.545	30%	0.301	S	S	.	.			trans	-77.9	154.1	173.3	-3	90.4	0	0	0	110.8	L290 N298 Q345	L290-L296 WeakPolarHBondContact CD2-O 3.46Å; L296-N298 PolarHBondContact O-N 3.16Å; L296-Q345 VanDerWaalsContact CB-CD 3.48Å; L296-Q345 VanDerWaalsContact CB-NE2 3.28Å; L296-Q345 PolarHBondContact O-OE1 3.49Å
297	P	25.1	Very low	36.4	Very low	51 Å²	51	56 Å²	56	33%	0.331	30%	0.297	S	S	.	.			trans	-65.3	131.3	-154.8	22.1	-33.4	0	0	0	114.1	Q345 P463	P297-Q345 PolarHBondContact O-NE2 3.31Å; P297-Q345 VanDerWaalsContact O-NE2 3.15Å; P297-P463 HydrophobicContact CB-CB 4.03Å; P297-P463 HydrophobicContact CG-CB 3.53Å; P297-P463 HydrophobicContact CG-CG 4.38Å
298	N	29.2	Very low	34.7	Very low	9 Å²	9	52.6 Å²	52.6	5%	0.048	29%	0.288	C	S	.	.			trans	-144.2	131.4	151.4	-159.2	7.9	0	0	0	112.3	L290 L296 T341 L344 S349	L290-N298 WeakPolarHBondContact CD1-O 3.41Å; L296-N298 PolarHBondContact O-N 3.16Å; N298-T341 HydrophobicContact CB-CG2 4.15Å; N298-L344 WeakPolarHBondContact ND2-CB 3.42Å; N298-L344 WeakPolarHBondContact ND2-CD1 3.25Å; N298-S349 PolarHBondContact ND2-OG 3.43Å; N298-S349 PolarHBondContact OD1-OG 3.42Å
299	P	28.2	Very low	32.9	Very low	22 Å²	22	52.3 Å²	52.3	14%	0.143	28%	0.277	C	S	.	.			trans	-45.2	144.3	148.6	-35.4	39.9	0	0	0	113.9	I177 T301 Y461	I177-P299 HydrophobicContact CD1-CB 3.39Å; I177-P299 HydrophobicContact CD1-CG 3.62Å; I177-P299 HydrophobicContact CG1-CB 4.03Å; I177-P299 HydrophobicContact CG1-CG 4.38Å; P299-T301 PolarHBondContact O-N 3.29Å; P299-Y461 WeakPolarHBondContact CD-OH 3.44Å; P299-Y461 HydrophobicContact CG-CE2 4.49Å; P299-Y461 WeakPolarHBondContact CG-OH 3.39Å
300	I	29.2	Very low	31.5	Very low	79 Å²	79	54.7 Å²	54.7	41%	0.405	29%	0.289	S	S	.	.			trans	-53.8	104.7	163.9	-63.1	157.7	0	0	0	107.8	S283	S283-I300 WeakPolarHBondContact OG-CD1 3.5Å
301	T	28.1	Very low	30.4	Very low	26 Å²	26	53.8 Å²	53.8	16%	0.16	28%	0.284	C	S	.	.			trans	-65.4	160	172.1	48.4	0	0	0	0	109.5	P299 E303 G304 L344	P299-T301 PolarHBondContact O-N 3.29Å; T301-E303 PolarHBondContact O-N 2.78Å; T301-G304 PolarHBondContact O-N 2.83Å; T301-L344 HydrophobicContact CG2-CD1 3.91Å
302	H	31.3	Very low	29.3	Very low	35 Å²	35	44 Å²	44	16%	0.162	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.9	-22.9	179.2	-179.8	-90.1	0	0	0	115	L180 G304 R305 S306	L180-H302 HydrophobicContact CD2-CB 4.41Å; H302-G304 VanDerWaalsContact C-N 3.31Å; H302-G304 PolarHBondContact O-N 3.35Å; H302-R305 PolarHBondContact O-N 3.35Å; H302-S306 PolarHBondContact O-N 2.69Å
303	E	32.2	Very low	28.4	Very low	28 Å²	28	40.8 Å²	40.8	13%	0.131	23%	0.227	C	C	.	.	H	α-helix	trans	-65.3	-25.4	171	-101.7	147.9	-159.4	0	0	113.3	T301 R305 S306 L307 T353 Y371	T301-E303 PolarHBondContact O-N 2.78Å; E303-R305 VanDerWaalsContact C-N 3.31Å; E303-R305 PolarHBondContact O-N 2.77Å; E303-S306 PolarHBondContact O-N 3.1Å; E303-L307 HydrophobicContact CB-CD1 3.82Å; E303-L307 HydrophobicContact CB-CG 4.22Å; E303-L307 HydrophobicContact CG-CD1 4.38Å; E303-L307 HydrophobicContact CG-CG 4.47Å; E303-L307 VanDerWaalsContact O-CA 3.29Å; E303-L307 WeakPolarHBondContact O-CA 3.16Å; E303-L307 WeakPolarHBondContact O-CB 3.44Å; E303-L307 WeakPolarHBondContact O-CD1 3.28Å; E303-L307 WeakPolarHBondContact O-CG 3.46Å; E303-L307 PolarHBondContact O-N 2.99Å; E303-T353 WeakPolarHBondContact OE1-CB 3.32Å; E303-T353 PolarHBondContact OE1-OG1 2.86Å; E303-Y371 VanDerWaalsContact OE2-CE2 3.29Å; E303-Y371 WeakPolarHBondContact OE2-CE2 3.2Å; E303-Y371 VanDerWaalsContact OE2-CZ 3.26Å; E303-Y371 PolarHBondContact OE2-OH 3.45Å
304	G	27.6	Very low	28	Very low	9 Å²	9	38.1 Å²	38.1	9%	0.093	20%	0.198	C	C	.	.	H	α-helix	trans	-62	-32.6	175.4	0	0	0	0	0	114.4	T301 H302 T308	T301-G304 PolarHBondContact O-N 2.83Å; H302-G304 VanDerWaalsContact C-N 3.31Å; H302-G304 PolarHBondContact O-N 3.35Å; G304-T308 WeakPolarHBondContact O-CB 3.3Å; G304-T308 PolarHBondContact O-N 3.43Å; G304-T308 PolarHBondContact O-OG1 3.49Å
305	R	29.2	Very low	27.8	Very low	53 Å²	53	31.9 Å²	31.9	20%	0.2	18%	0.177	C	C	.	.	H	α-helix	trans	-85.5	-38.6	178.2	-69.3	179.2	179.1	157.3	-11.2	112.2	D181 Y220 H302 E303 T308 I309	D181-R305 IonicContact OD1-CZ 2.76Å; D181-R305 IonicContact OD1-NH1 3.17Å; D181-R305 PolarHBondContact OD1-NH1 3.47Å; D181-R305 IonicContact OD1-NH2 3.71Å; D181-R305 PolarHBondContact OD1-NH2 3.39Å; Y220-R305 VanDerWaalsContact CD1-CZ 3.41Å; Y220-R305 VanDerWaalsContact CE1-CZ 3.46Å; Y220-R305 VanDerWaalsContact CE1-NE 3.26Å; H302-R305 PolarHBondContact O-N 3.35Å; E303-R305 VanDerWaalsContact C-N 3.31Å; E303-R305 PolarHBondContact O-N 2.77Å; R305-T308 WeakPolarHBondContact O-CB 3.3Å; R305-T308 PolarHBondContact O-N 2.86Å; R305-I309 WeakPolarHBondContact O-CG1 3.03Å; R305-I309 PolarHBondContact O-N 2.88Å
306	S	26.6	Very low	27.6	Very low	40 Å²	40	32.4 Å²	32.4	28%	0.28	18%	0.179	S	C	.	.	H	α-helix	trans	-68.5	-42.2	171.8	-61.7	0	0	0	0	110.7	H302 E303 T308 I309 I310	H302-S306 PolarHBondContact O-N 2.69Å; E303-S306 PolarHBondContact O-N 3.1Å; S306-T308 VanDerWaalsContact C-N 3.3Å; S306-T308 PolarHBondContact O-N 3.48Å; S306-I309 CarbonylContact O-C 3.57Å; S306-I309 PolarHBondContact O-N 2.9Å; S306-I310 VanDerWaalsContact O-CB 3.3Å; S306-I310 WeakPolarHBondContact O-CB 3.3Å; S306-I310 VanDerWaalsContact O-CD1 3.3Å; S306-I310 WeakPolarHBondContact O-CD1 3.47Å; S306-I310 WeakPolarHBondContact O-CG1 3.01Å; S306-I310 PolarHBondContact O-N 3.05Å
307	L	28.5	Very low	27.7	Very low	9 Å²	9	30.9 Å²	30.9	5%	0.047	17%	0.166	C	C	.	.	H	α-helix	trans	-67.2	-27.1	170.7	-65.6	165.7	0	0	0	111.5	E303 I310 W311 P334 L336	E303-L307 HydrophobicContact CB-CD1 3.82Å; E303-L307 HydrophobicContact CB-CG 4.22Å; E303-L307 HydrophobicContact CG-CD1 4.38Å; E303-L307 HydrophobicContact CG-CG 4.47Å; E303-L307 VanDerWaalsContact O-CA 3.29Å; E303-L307 WeakPolarHBondContact O-CA 3.16Å; E303-L307 WeakPolarHBondContact O-CB 3.44Å; E303-L307 WeakPolarHBondContact O-CD1 3.28Å; E303-L307 WeakPolarHBondContact O-CG 3.46Å; E303-L307 PolarHBondContact O-N 2.99Å; L307-I310 HydrophobicContact CD2-CD1 4.45Å; L307-I310 CarbonylContact O-C 3.56Å; L307-W311 VanDerWaalsContact O-CA 3.32Å; L307-W311 WeakPolarHBondContact O-CA 3.33Å; L307-W311 WeakPolarHBondContact O-CB 3.35Å; L307-W311 PolarHBondContact O-N 3.39Å; L307-P334 HydrophobicContact CD2-CB 4.04Å; L307-P334 HydrophobicContact CD2-CG 4.35Å; L307-L336 HydrophobicContact CB-CD1 3.84Å; L307-L336 HydrophobicContact CD1-CD1 4.38Å
308	T	28.1	Very low	27.9	Very low	26 Å²	26	29.5 Å²	29.5	16%	0.16	15%	0.154	C	C	.	.	H	α-helix	trans	-69.3	-44.5	168.5	-69.6	0	0	0	0	111.3	L279 G304 R305 S306 I310 W311 I312	L279-T308 HydrophobicContact CD1-CG2 3.26Å; L279-T308 HydrophobicContact CD2-CG2 4.41Å; L279-T308 HydrophobicContact CG-CG2 4.44Å; G304-T308 WeakPolarHBondContact O-CB 3.3Å; G304-T308 PolarHBondContact O-N 3.43Å; G304-T308 PolarHBondContact O-OG1 3.49Å; R305-T308 WeakPolarHBondContact O-CB 3.3Å; R305-T308 PolarHBondContact O-N 2.86Å; S306-T308 VanDerWaalsContact C-N 3.3Å; S306-T308 PolarHBondContact O-N 3.48Å; T308-I310 VanDerWaalsContact C-N 3.3Å; T308-W311 PolarHBondContact O-N 2.71Å; T308-I312 HydrophobicContact CG2-CD1 3.69Å; T308-I312 HydrophobicContact CG2-CG1 4.32Å; T308-I312 WeakPolarHBondContact O-CB 3.45Å; T308-I312 WeakPolarHBondContact O-CG1 3.27Å; T308-I312 PolarHBondContact O-N 3.23Å
309	I	25.2	Very low	27.7	Very low	32 Å²	32	32.4 Å²	32.4	16%	0.164	17%	0.166	C	C	.	.	H	α-helix	trans	-68.5	-31.5	175.4	-67	165.8	0	0	0	111	A217 R305 S306 G313	A217-I309 HydrophobicContact CB-CD1 4.01Å; A217-I309 HydrophobicContact CB-CG1 4.28Å; R305-I309 WeakPolarHBondContact O-CG1 3.03Å; R305-I309 PolarHBondContact O-N 2.88Å; S306-I309 CarbonylContact O-C 3.57Å; S306-I309 PolarHBondContact O-N 2.9Å; I309-G313 VanDerWaalsContact O-CA 3.23Å; I309-G313 WeakPolarHBondContact O-CA 3.33Å; I309-G313 PolarHBondContact O-N 3.28Å
310	I	28.8	Very low	27.6	Very low	75 Å²	75	32.4 Å²	32.4	39%	0.385	17%	0.166	S	C	.	.	H	α-helix	trans	-76.9	-33.5	171	-61	157.7	0	0	0	109.4	S306 L307 T308 G313 S314 P334	S306-I310 VanDerWaalsContact O-CB 3.3Å; S306-I310 WeakPolarHBondContact O-CB 3.3Å; S306-I310 VanDerWaalsContact O-CD1 3.3Å; S306-I310 WeakPolarHBondContact O-CD1 3.47Å; S306-I310 WeakPolarHBondContact O-CG1 3.01Å; S306-I310 PolarHBondContact O-N 3.05Å; L307-I310 HydrophobicContact CD2-CD1 4.45Å; L307-I310 CarbonylContact O-C 3.56Å; T308-I310 VanDerWaalsContact C-N 3.3Å; I310-G313 CarbonylContact O-C 3.58Å; I310-G313 PolarHBondContact O-N 2.95Å; I310-S314 VanDerWaalsContact O-CA 3.3Å; I310-S314 WeakPolarHBondContact O-CA 3.44Å; I310-S314 WeakPolarHBondContact O-CB 3.29Å; I310-S314 PolarHBondContact O-N 2.91Å; I310-S314 PolarHBondContact O-OG 3.45Å; I310-P334 HydrophobicContact CB-CG 4.18Å; I310-P334 HydrophobicContact CG2-CG 3.44Å; I310-P334 VanDerWaalsContact CG2-CG 3.44Å
311	W	27.7	Very low	27.4	Very low	9 Å²	9	34.7 Å²	34.7	3%	0.034	17%	0.171	C	C	.	.	H	α-helix	trans	-72.7	-44.9	178.3	-158.8	70.2	0	0	0	111	W239 I276 L307 T308 C315 P334	W239-W311 HydrophobicContact CE3-CH2 4.35Å; W239-W311 HydrophobicContact CE3-CZ2 4.33Å; W239-W311 AromaticContact CH2-CH2 3.9Å; W239-W311 HydrophobicContact CH2-CH2 3.9Å; W239-W311 AromaticContact CH2-CZ2 3.59Å; W239-W311 HydrophobicContact CH2-CZ2 3.59Å; W239-W311 AromaticContact CZ3-CH2 3.66Å; W239-W311 HydrophobicContact CZ3-CH2 3.66Å; W239-W311 AromaticContact CZ3-CZ2 3.32Å; W239-W311 HydrophobicContact CZ3-CZ2 3.32Å; I276-W311 HydrophobicContact CG2-CH2 4.15Å; I276-W311 HydrophobicContact CG2-CZ3 3.9Å; L307-W311 VanDerWaalsContact O-CA 3.32Å; L307-W311 WeakPolarHBondContact O-CA 3.33Å; L307-W311 WeakPolarHBondContact O-CB 3.35Å; L307-W311 PolarHBondContact O-N 3.39Å; T308-W311 PolarHBondContact O-N 2.71Å; W311-C315 WeakPolarHBondContact O-CB 3.32Å; W311-C315 PolarHBondContact O-N 3.37Å; W311-C315 PolarHBondContact O-SG 2.92Å; W311-P334 PolarHBondContact NE1-O 3.19Å
312	I	26	Very low	27.2	Very low	10 Å²	10	41.1 Å²	41.1	5%	0.051	19%	0.193	C	C	.	.	H	α-helix	trans	-59.5	-60.1	166.1	-67.5	172.3	0	0	0	107.5	F213 I229 T308 S314 C315 F316	F213-I312 HydrophobicContact CB-CD1 4.25Å; F213-I312 HydrophobicContact CB-CG2 3.99Å; F213-I312 HydrophobicContact CD1-CD1 3.9Å; F213-I312 HydrophobicContact CD1-CG2 4.16Å; F213-I312 HydrophobicContact CD2-CG2 3.23Å; F213-I312 HydrophobicContact CE1-CD1 4.49Å; F213-I312 HydrophobicContact CE2-CG2 3.65Å; F213-I312 HydrophobicContact CG-CD1 4.07Å; F213-I312 HydrophobicContact CG-CG2 3.53Å; F213-I312 HydrophobicContact CZ-CG2 4.28Å; I229-I312 HydrophobicContact CD1-CD1 4.2Å; T308-I312 HydrophobicContact CG2-CD1 3.69Å; T308-I312 HydrophobicContact CG2-CG1 4.32Å; T308-I312 WeakPolarHBondContact O-CB 3.45Å; T308-I312 WeakPolarHBondContact O-CG1 3.27Å; T308-I312 PolarHBondContact O-N 3.23Å; I312-S314 PolarHBondContact O-N 3.29Å; I312-C315 CarbonylContact O-C 3.43Å; I312-C315 PolarHBondContact O-N 3.35Å; I312-C315 VanDerWaalsContact O-N 3.1Å; I312-F316 HydrophobicContact CB-CD2 4.48Å; I312-F316 HydrophobicContact CG2-CD2 3.58Å; I312-F316 HydrophobicContact CG2-CE2 3.73Å; I312-F316 VanDerWaalsContact O-CB 3.23Å; I312-F316 WeakPolarHBondContact O-CB 3.33Å; I312-F316 WeakPolarHBondContact O-CD2 3.22Å; I312-F316 PolarHBondContact O-N 3.02Å
313	G	23.9	Very low	27	Very low	10 Å²	10	45.4 Å²	45.4	10%	0.103	22%	0.222	C	C	.	.	H	α-helix	trans	-54.3	-30.1	-179.8	0	0	0	0	0	115.3	I309 I310 F316 R317	I309-G313 VanDerWaalsContact O-CA 3.23Å; I309-G313 WeakPolarHBondContact O-CA 3.33Å; I309-G313 PolarHBondContact O-N 3.28Å; I310-G313 CarbonylContact O-C 3.58Å; I310-G313 PolarHBondContact O-N 2.95Å; G313-F316 CarbonylContact O-C 3.09Å; G313-R317 PolarHBondContact O-N 2.98Å
314	S	27	Very low	26.6	Very low	7 Å²	7	53 Å²	53	5%	0.049	26%	0.255	C	S	.	.	H	α-helix	trans	-85	-42	177.2	-77.4	0	0	0	0	112.6	I310 I312 F316 R317 Y318 N332	I310-S314 VanDerWaalsContact O-CA 3.3Å; I310-S314 WeakPolarHBondContact O-CA 3.44Å; I310-S314 WeakPolarHBondContact O-CB 3.29Å; I310-S314 PolarHBondContact O-N 2.91Å; I310-S314 PolarHBondContact O-OG 3.45Å; I312-S314 PolarHBondContact O-N 3.29Å; S314-F316 PolarHBondContact O-N 3.44Å; S314-R317 WeakPolarHBondContact O-CB 3.09Å; S314-R317 PolarHBondContact O-N 3.09Å; S314-Y318 WeakPolarHBondContact O-CD2 3.37Å; S314-Y318 WeakPolarHBondContact O-CE2 3.06Å; S314-N332 WeakPolarHBondContact CB-O 3.43Å; S314-N332 PolarHBondContact OG-O 3.14Å
315	C	26.5	Very low	26.4	Very low	25 Å²	25	61.6 Å²	61.6	17%	0.169	28%	0.284	C	S	.	.	H	α-helix	trans	-59.5	-23.2	166	-70	0	0	0	0	111.5	W311 I312 Y318	W311-C315 WeakPolarHBondContact O-CB 3.32Å; W311-C315 PolarHBondContact O-N 3.37Å; W311-C315 PolarHBondContact O-SG 2.92Å; I312-C315 CarbonylContact O-C 3.43Å; I312-C315 PolarHBondContact O-N 3.35Å; I312-C315 VanDerWaalsContact O-N 3.1Å; C315-Y318 VanDerWaalsContact O-CD2 3.24Å; C315-Y318 WeakPolarHBondContact O-CD2 3.21Å
316	F	26.6	Very low	26.1	Very low	21 Å²	21	69 Å²	69	9%	0.092	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-4.4	176.3	-82.5	-71.3	0	0	0	113.5	Y206 R209 F213 E235 I312 G313 S314 Y318	Y206-F316 AromaticContact CD2-CD1 3.99Å; Y206-F316 HydrophobicContact CD2-CD1 3.99Å; Y206-F316 HydrophobicContact CE2-CB 3.42Å; Y206-F316 VanDerWaalsContact CE2-CB 3.42Å; Y206-F316 AromaticContact CE2-CD1 3.61Å; Y206-F316 HydrophobicContact CE2-CD1 3.61Å; Y206-F316 AromaticContact CE2-CG 3.9Å; Y206-F316 HydrophobicContact CE2-CG 3.9Å; Y206-F316 WeakPolarHBondContact CE2-O 3.01Å; Y206-F316 VanDerWaalsContact CZ-O 3.25Å; Y206-F316 VanDerWaalsContact OH-C 3.25Å; Y206-F316 VanDerWaalsContact OH-CB 3.28Å; Y206-F316 WeakPolarHBondContact OH-CB 3.2Å; Y206-F316 PolarHBondContact OH-O 3.02Å; R209-F316 HydrophobicContact CG-CE1 4.03Å; R209-F316 HydrophobicContact CG-CZ 3.99Å; F213-F316 HydrophobicContact CD2-CE2 4.04Å; F213-F316 AromaticContact CE2-CD2 3.99Å; F213-F316 HydrophobicContact CE2-CD2 3.99Å; F213-F316 HydrophobicContact CE2-CE1 4.43Å; F213-F316 AromaticContact CE2-CE2 3.14Å; F213-F316 HydrophobicContact CE2-CE2 3.14Å; F213-F316 AromaticContact CE2-CZ 3.39Å; F213-F316 HydrophobicContact CE2-CZ 3.39Å; F213-F316 AromaticContact CZ-CE2 3.65Å; F213-F316 HydrophobicContact CZ-CE2 3.65Å; F213-F316 AromaticContact CZ-CZ 3.8Å; F213-F316 HydrophobicContact CZ-CZ 3.8Å; E235-F316 HydrophobicContact CG-CE1 3.55Å; E235-F316 HydrophobicContact CG-CZ 3.54Å; E235-F316 VanDerWaalsContact OE1-CE1 3.23Å; E235-F316 WeakPolarHBondContact OE1-CE1 3.45Å; E235-F316 WeakPolarHBondContact OE1-CZ 3.4Å; I312-F316 HydrophobicContact CB-CD2 4.48Å; I312-F316 HydrophobicContact CG2-CD2 3.58Å; I312-F316 HydrophobicContact CG2-CE2 3.73Å; I312-F316 VanDerWaalsContact O-CB 3.23Å; I312-F316 WeakPolarHBondContact O-CB 3.33Å; I312-F316 WeakPolarHBondContact O-CD2 3.22Å; I312-F316 PolarHBondContact O-N 3.02Å; G313-F316 CarbonylContact O-C 3.09Å; S314-F316 PolarHBondContact O-N 3.44Å; F316-Y318 PolarHBondContact O-N 3.13Å
317	R	27.3	Very low	25.9	Very low	72 Å²	72	74 Å²	74	27%	0.272	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-15.6	168.7	-114.1	174.2	170.6	-175.6	-5.4	112	G313 S314 N332	G313-R317 PolarHBondContact O-N 2.98Å; S314-R317 WeakPolarHBondContact O-CB 3.09Å; S314-R317 PolarHBondContact O-N 3.09Å; R317-N332 PolarHBondContact NH1-ND2 3.25Å
318	Y	29.4	Very low	25.6	Very low	22 Å²	22	79 Å²	79	9%	0.086	37%	0.368	C	S	.	.	H	α-helix	trans	-79.7	-28.4	-169.7	-73.3	-89.1	0	0	0	116	T238 V242 S314 C315 F316 C320 Y322 I331	T238-Y318 HydrophobicContact CG2-CD1 4.05Å; T238-Y318 HydrophobicContact CG2-CD2 3.89Å; T238-Y318 HydrophobicContact CG2-CG 3.45Å; T238-Y318 VanDerWaalsContact CG2-CG 3.45Å; V242-Y318 HydrophobicContact CB-CE1 4.45Å; V242-Y318 WeakPolarHBondContact CG1-OH 3.36Å; V242-Y318 HydrophobicContact CG2-CD1 3.89Å; V242-Y318 HydrophobicContact CG2-CE1 3.09Å; V242-Y318 HydrophobicContact CG2-CE2 4.04Å; V242-Y318 WeakPolarHBondContact CG2-OH 3.42Å; S314-Y318 WeakPolarHBondContact O-CD2 3.37Å; S314-Y318 WeakPolarHBondContact O-CE2 3.06Å; C315-Y318 VanDerWaalsContact O-CD2 3.24Å; C315-Y318 WeakPolarHBondContact O-CD2 3.21Å; F316-Y318 PolarHBondContact O-N 3.13Å; Y318-C320 PolarHBondContact O-N 2.71Å; Y318-C320 VanDerWaalsContact O-N 3.1Å; Y318-Y322 PolarHBondContact O-N 3.21Å; Y318-I331 HydrophobicContact CE1-CD1 4.26Å; Y318-I331 HydrophobicContact CE1-CG1 4.4Å; Y318-I331 HydrophobicContact CE1-CG2 3.71Å; Y318-I331 HydrophobicContact CE2-CG2 4.38Å; Y318-I331 WeakPolarHBondContact OH-CG2 2.94Å
319	K	25.3	Very low	25.4	Very low	70 Å²	70	82.6 Å²	82.6	30%	0.304	39%	0.386	S	S	.	.	H	α-helix	trans	-61.4	-26.1	-179.6	-166.1	168.5	-176	-170	0	111.8	D203 E234	D203-K319 WeakPolarHBondContact OD2-CD 3.3Å; D203-K319 VanDerWaalsContact OD2-CE 3.27Å; D203-K319 WeakPolarHBondContact OD2-CE 3.45Å; D203-K319 IonicContact OD2-NZ 3.62Å; D203-K319 PolarHBondContact OD2-NZ 2.94Å; E234-K319 VanDerWaalsContact OE1-CE 3.25Å; E234-K319 WeakPolarHBondContact OE1-CE 3.31Å; E234-K319 IonicContact OE2-NZ 3.55Å
320	C	25	Very low	25.3	Very low	22 Å²	22	83.6 Å²	83.6	15%	0.149	40%	0.399	C	S	.	.	H	α-helix	trans	-111.2	-9.5	-164.9	-46.7	0	0	0	0	114.6	P199 G200 Y318	P199-C320 HydrophobicContact CB-CB 3.15Å; P199-C320 HydrophobicContact CG-CB 3.5Å; P199-C320 VanDerWaalsContact CG-CB 3.5Å; P199-C320 VanDerWaalsContact O-CB 3.29Å; P199-C320 WeakPolarHBondContact O-CB 3.49Å; P199-C320 PolarHBondContact O-SG 2.92Å; P199-C320 VanDerWaalsContact O-SG 3.35Å; G200-C320 WeakPolarHBondContact CA-SG 3.29Å; G200-C320 PolarHBondContact N-SG 3.33Å; Y318-C320 PolarHBondContact O-N 2.71Å; Y318-C320 VanDerWaalsContact O-N 3.1Å
321	Y	25.3	Very low	25.1	Very low	127 Å²	127	80.7 Å²	80.7	50%	0.498	38%	0.384	S	S	.	.	H	α-helix	trans	-87.1	-27.3	163.9	-82.2	-86.7	0	0	0	112.7	P199 V323 K324	P199-Y321 HydrophobicContact CG-CD2 4.24Å; P199-Y321 HydrophobicContact CG-CE2 4Å; Y321-V323 VanDerWaalsContact C-N 3.26Å; Y321-V323 PolarHBondContact O-N 2.93Å; Y321-K324 PolarHBondContact O-N 3.36Å
322	Y	24.8	Very low	24.9	Very low	161 Å²	161	81.8 Å²	81.8	63%	0.631	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-25.1	-179.7	-112.7	-86.5	0	0	0	114.2	Y318	Y318-Y322 PolarHBondContact O-N 3.21Å
323	V	25.8	Very low	24.8	Very low	125 Å²	125	81.5 Å²	81.5	76%	0.758	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-9.7	-176.7	-179.2	0	0	0	0	112.8	Y321	Y321-V323 VanDerWaalsContact C-N 3.26Å; Y321-V323 PolarHBondContact O-N 2.93Å
324	K	23.5	Very low	24.8	Very low	189 Å²	189	81.2 Å²	81.2	82%	0.822	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.7	-17	-172.1	-117.2	176	-178.6	176.1	0	121	Y321	Y321-K324 PolarHBondContact O-N 3.36Å
325	R	23.4	Very low	24.7	Very low	189 Å²	189	81.4 Å²	81.4	71%	0.713	39%	0.386	S	S	*	.			trans	-146.5	120.6	173.5	-71.2	-169.9	-161.1	152.9	7.2	113.4	N327	R325-N327 PolarHBondContact O-N 3.43Å
326	K	23	Very low	24.7	Very low	209 Å²	209	82.6 Å²	82.6	91%	0.909	39%	0.39	S	S	*	.	S	Bend	trans	-69.9	-1.3	176.5	-139.9	173.6	-178.1	179.5	0	113.8
327	N	22.6	Very low	24.6	Very low	145 Å²	145	81.9 Å²	81.9	78%	0.775	39%	0.388	S	S	*	.	S	Bend	trans	-140.4	2.2	-163	-90.2	-0.7	0	0	0	118.9	R325	R325-N327 PolarHBondContact O-N 3.43Å
328	D	23.7	Very low	24.6	Very low	112 Å²	112	78.6 Å²	78.6	60%	0.599	38%	0.376	S	S	*	.			trans	-135	102.1	176.3	-82.9	-40.8	0	0	0	111.1
329	L	23.3	Very low	24.7	Very low	102 Å²	102	78.9 Å²	78.9	53%	0.534	38%	0.377	S	S	.	.			trans	-107.6	78.8	-175.5	-76.2	149.9	0	0	0	110	I331 G398	L329-I331 HydrophobicContact CB-CD1 4.13Å; L329-I331 HydrophobicContact CB-CG1 4.25Å; L329-I331 HydrophobicContact CD2-CD1 3.77Å; L329-I331 HydrophobicContact CD2-CG1 4.25Å; L329-G398 WeakPolarHBondContact O-CA 3.28Å; L329-G398 PolarHBondContact O-N 3.23Å
330	A	22.1	Very low	25	Very low	54 Å²	54	76.9 Å²	76.9	45%	0.446	37%	0.369	S	S	.	.			trans	-91.3	110.3	163.2	0	0	0	0	0	108	F428	A330-F428 HydrophobicContact CB-CE1 4.15Å
331	I	25.3	Very low	25.2	Very low	13 Å²	13	76.7 Å²	76.7	7%	0.067	37%	0.367	C	S	.	.			trans	-123.4	88	-165.2	-63.6	178	0	0	0	108.7	Y318 L329 S333 S395 S396 I397	Y318-I331 HydrophobicContact CE1-CD1 4.26Å; Y318-I331 HydrophobicContact CE1-CG1 4.4Å; Y318-I331 HydrophobicContact CE1-CG2 3.71Å; Y318-I331 HydrophobicContact CE2-CG2 4.38Å; Y318-I331 WeakPolarHBondContact OH-CG2 2.94Å; L329-I331 HydrophobicContact CB-CD1 4.13Å; L329-I331 HydrophobicContact CB-CG1 4.25Å; L329-I331 HydrophobicContact CD2-CD1 3.77Å; L329-I331 HydrophobicContact CD2-CG1 4.25Å; I331-S333 PolarHBondContact O-N 3.48Å; I331-S395 WeakPolarHBondContact CG2-O 3.37Å; I331-S395 CarbonylContact O-C 3.57Å; I331-S396 PolarHBondContact N-OG 2.94Å; I331-S396 WeakPolarHBondContact O-CA 3.25Å; I331-S396 WeakPolarHBondContact O-CB 3.39Å; I331-S396 PolarHBondContact O-N 3.22Å; I331-S396 PolarHBondContact O-OG 3.34Å; I331-I397 HydrophobicContact CD1-CB 4.16Å; I331-I397 HydrophobicContact CD1-CD1 3.56Å; I331-I397 HydrophobicContact CD1-CG1 3.92Å
332	N	22.9	Very low	25.3	Very low	33 Å²	33	75.3 Å²	75.3	18%	0.176	36%	0.364	C	S	.	.			trans	-83.5	91.2	172.9	-56.2	-4.7	0	0	0	107.3	S314 R317	S314-N332 WeakPolarHBondContact CB-O 3.43Å; S314-N332 PolarHBondContact OG-O 3.14Å; R317-N332 PolarHBondContact NH1-ND2 3.25Å
333	S	23.9	Very low	25.4	Very low	3 Å²	3	68.6 Å²	68.6	2%	0.021	34%	0.337	C	S	.	.			trans	-82.2	157.7	151.4	175.2	0	0	0	0	107.2	I331 S395	I331-S333 PolarHBondContact O-N 3.48Å; S333-S395 VanDerWaalsContact C-OG 3.27Å; S333-S395 PolarHBondContact N-O 3.2Å; S333-S395 WeakPolarHBondContact O-CB 3.36Å; S333-S395 PolarHBondContact O-OG 3.16Å
334	P	24.7	Very low	25.6	Very low	5 Å²	5	64 Å²	64	3%	0.032	31%	0.309	C	S	.	.			trans	-115.7	87.6	162.3	8.7	3.3	0	0	0	109	L307 I310 W311 L336	L307-P334 HydrophobicContact CD2-CB 4.04Å; L307-P334 HydrophobicContact CD2-CG 4.35Å; I310-P334 HydrophobicContact CB-CG 4.18Å; I310-P334 HydrophobicContact CG2-CG 3.44Å; I310-P334 VanDerWaalsContact CG2-CG 3.44Å; W311-P334 PolarHBondContact NE1-O 3.19Å; P334-L336 PolarHBondContact O-N 3.14Å
335	N	24.1	Very low	25.7	Very low	11 Å²	11	57.7 Å²	57.7	6%	0.059	28%	0.282	C	S	.	.			trans	-61.8	112.2	173.3	-75.4	-34.8	0	0	0	107.9	Y250 D337 L394	Y250-N335 PolarHBondContact OH-ND2 3.29Å; Y250-N335 VanDerWaalsContact OH-ND2 3.09Å; N335-D337 PolarHBondContact O-N 3.18Å; N335-L394 PolarHBondContact ND2-O 2.98Å; N335-L394 VanDerWaalsContact ND2-O 3.08Å
336	L	25.9	Very low	25.9	Very low	49 Å²	49	50 Å²	50	26%	0.257	26%	0.261	S	S	.	.			trans	-63.6	89.5	171.4	-98.4	98	0	0	0	108	L307 P334	L307-L336 HydrophobicContact CB-CD1 3.84Å; L307-L336 HydrophobicContact CD1-CD1 4.38Å; P334-L336 PolarHBondContact O-N 3.14Å
337	D	26.2	Very low	26.1	Very low	7 Å²	7	44.6 Å²	44.6	4%	0.037	24%	0.237	C	C	.	.			trans	-67.4	139.9	171.5	-167.6	6	0	0	0	109.5	Y258 N335 K339 H340	Y258-D337 HydrophobicContact CD2-CB 4.19Å; Y258-D337 VanDerWaalsContact CD2-CG 3.42Å; Y258-D337 WeakPolarHBondContact CD2-OD1 3.4Å; Y258-D337 WeakPolarHBondContact CD2-OD2 3.26Å; Y258-D337 HydrophobicContact CE2-CB 4.44Å; N335-D337 PolarHBondContact O-N 3.18Å; D337-K339 PolarHBondContact O-N 2.76Å; D337-H340 PolarHBondContact N-CE1 3.37Å; D337-H340 PolarHBondContact N-ND1 2.98Å; D337-H340 VanDerWaalsContact N-ND1 3.15Å; D337-H340 WeakPolarHBondContact O-CB 3.38Å; D337-H340 PolarHBondContact O-N 3.32Å; D337-H340 PolarHBondContact O-ND1 2.8Å
338	I	27.2	Very low	26.4	Very low	3 Å²	3	38.8 Å²	38.8	2%	0.015	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-12.5	-178.7	-75.1	160.3	0	0	0	112	N261 L265 F285 L286 M289 L295 T341	N261-I338 HydrophobicContact CB-CB 4.29Å; N261-I338 HydrophobicContact CB-CD1 3.61Å; N261-I338 WeakPolarHBondContact ND2-CG2 3.4Å; L265-I338 HydrophobicContact CD1-CD1 3.56Å; L265-I338 HydrophobicContact CD1-CG1 4.25Å; L265-I338 HydrophobicContact CD2-CD1 3.57Å; L265-I338 HydrophobicContact CD2-CG1 4.25Å; L265-I338 HydrophobicContact CG-CD1 3.39Å; L265-I338 HydrophobicContact CG-CG1 4.4Å; F285-I338 HydrophobicContact CE1-CD1 4Å; L286-I338 HydrophobicContact CD2-CB 4.35Å; L286-I338 HydrophobicContact CD2-CG1 3.76Å; L286-I338 HydrophobicContact CD2-CG2 4.36Å; M289-I338 HydrophobicContact SD-CG2 4.25Å; L295-I338 HydrophobicContact CD1-CG2 3.79Å; L295-I338 HydrophobicContact CD2-CG2 4.21Å; L295-I338 WeakPolarHBondContact CD2-O 3.27Å; I338-T341 PolarHBondContact O-OG1 3.08Å
339	K	30.4	Very low	26.6	Very low	27 Å²	27	34.6 Å²	34.6	12%	0.117	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-13.5	173.2	-80.2	179.4	153	-176.9	0	116.5	E257 D337 T341 K342 Y343 F438	E257-K339 HydrophobicContact CB-CD 3.94Å; E257-K339 IonicContact OE1-NZ 2.9Å; E257-K339 PolarHBondContact OE1-NZ 3.47Å; E257-K339 IonicContact OE2-NZ 2.8Å; E257-K339 PolarHBondContact OE2-NZ 3.48Å; D337-K339 PolarHBondContact O-N 2.76Å; K339-T341 PolarHBondContact O-N 2.69Å; K339-K342 PolarHBondContact O-N 3.24Å; K339-Y343 PolarHBondContact O-N 2.89Å; K339-F438 HydrophobicContact CD-CE1 4.31Å; K339-F438 HydrophobicContact CD-CZ 4.27Å
340	H	32.3	Very low	26.9	Very low	29 Å²	29	31 Å²	31	13%	0.134	17%	0.167	C	C	.	.	H	α-helix	trans	-49.4	-34.3	170.1	-75.2	106.7	0	0	0	111	D337 L344 I375	D337-H340 PolarHBondContact N-CE1 3.37Å; D337-H340 PolarHBondContact N-ND1 2.98Å; D337-H340 VanDerWaalsContact N-ND1 3.15Å; D337-H340 WeakPolarHBondContact O-CB 3.38Å; D337-H340 PolarHBondContact O-N 3.32Å; D337-H340 PolarHBondContact O-ND1 2.8Å; H340-L344 WeakPolarHBondContact O-CD1 3.26Å; H340-I375 WeakPolarHBondContact CD2-CG2 3.42Å; H340-I375 WeakPolarHBondContact NE2-CG2 3.3Å
341	T	28.9	Very low	27.3	Very low	17 Å²	17	30.7 Å²	30.7	10%	0.104	15%	0.154	C	C	.	.	H	α-helix	trans	-74.5	-29.2	178.8	6.9	0	0	0	0	115.5	L290 L295 N298 I338 K339	L290-T341 HydrophobicContact CD1-CG2 3.98Å; L290-T341 HydrophobicContact CD2-CG2 3.99Å; L290-T341 HydrophobicContact CG-CG2 4.46Å; L295-T341 WeakPolarHBondContact CD2-OG1 3.31Å; N298-T341 HydrophobicContact CB-CG2 4.15Å; I338-T341 PolarHBondContact O-OG1 3.08Å; K339-T341 PolarHBondContact O-N 2.69Å
342	K	27.1	Very low	27.3	Very low	98 Å²	98	31 Å²	31	43%	0.426	16%	0.161	S	C	.	.	H	α-helix	trans	-83.4	-30.4	-179.3	-102.8	-177.9	-179.7	-177.9	0	113.2	Y294 L295 K339 Q345	Y294-K342 WeakPolarHBondContact O-CE 3.43Å; Y294-K342 PolarHBondContact O-NZ 3.36Å; L295-K342 HydrophobicContact CD2-CB 4.37Å; L295-K342 HydrophobicContact CD2-CD 4.42Å; L295-K342 HydrophobicContact CD2-CG 3.89Å; L295-K342 HydrophobicContact CG-CD 4.28Å; L295-K342 HydrophobicContact CG-CG 4.06Å; K339-K342 PolarHBondContact O-N 3.24Å; K342-Q345 WeakPolarHBondContact O-CB 3.36Å; K342-Q345 PolarHBondContact O-N 3.42Å
343	Y	28.2	Very low	27.7	Very low	21 Å²	21	30.9 Å²	30.9	8%	0.082	16%	0.161	C	C	.	.	H	α-helix	trans	-76.4	-26.9	-174.6	-155.9	-98.3	0	0	0	113.4	K339 Q345 I375 A441	K339-Y343 PolarHBondContact O-N 2.89Å; Y343-Q345 PolarHBondContact O-N 3.47Å; Y343-I375 HydrophobicContact CD1-CD1 3.44Å; Y343-I375 VanDerWaalsContact CD1-CD1 3.44Å; Y343-I375 HydrophobicContact CD1-CG1 3.99Å; Y343-I375 HydrophobicContact CD2-CD1 4.15Å; Y343-I375 HydrophobicContact CE1-CD1 4.04Å; Y343-I375 HydrophobicContact CE1-CG1 4.34Å; Y343-I375 HydrophobicContact CG-CD1 3.48Å; Y343-I375 VanDerWaalsContact CG-CD1 3.48Å; Y343-A441 HydrophobicContact CE2-CB 3.83Å; Y343-A441 WeakPolarHBondContact OH-CB 3.4Å; Y343-A441 PolarHBondContact OH-O 3.38Å
344	L	29.3	Very low	28.2	Very low	29 Å²	29	35.8 Å²	35.8	15%	0.152	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	4.9	174.3	-64.9	163.3	0	0	0	112.5	N298 T301 H340 G346 S349	N298-L344 WeakPolarHBondContact ND2-CB 3.42Å; N298-L344 WeakPolarHBondContact ND2-CD1 3.25Å; T301-L344 HydrophobicContact CG2-CD1 3.91Å; H340-L344 WeakPolarHBondContact O-CD1 3.26Å; L344-G346 VanDerWaalsContact C-N 3.35Å; L344-G346 PolarHBondContact O-N 2.85Å; L344-S349 WeakPolarHBondContact O-CB 3.49Å; L344-S349 PolarHBondContact O-N 3.19Å
345	Q	25.2	Very low	28.5	Very low	56 Å²	56	37.8 Å²	37.8	26%	0.262	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-24.2	-52.3	163.6	-43.9	-173.3	-57.6	0	0	120.3	L296 P297 K342 Y343	L296-Q345 VanDerWaalsContact CB-CD 3.48Å; L296-Q345 VanDerWaalsContact CB-NE2 3.28Å; L296-Q345 PolarHBondContact O-OE1 3.49Å; P297-Q345 PolarHBondContact O-NE2 3.31Å; P297-Q345 VanDerWaalsContact O-NE2 3.15Å; K342-Q345 WeakPolarHBondContact O-CB 3.36Å; K342-Q345 PolarHBondContact O-N 3.42Å; Y343-Q345 PolarHBondContact O-N 3.47Å
346	G	27.7	Very low	28.6	Very low	26 Å²	26	37.9 Å²	37.9	27%	0.268	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-166	-174.4	0	0	0	0	0	110.7	L344 Y348	L344-G346 VanDerWaalsContact C-N 3.35Å; L344-G346 PolarHBondContact O-N 2.85Å; G346-Y348 PolarHBondContact O-N 3.21Å
347	K	27	Very low	29	Very low	97 Å²	97	40.7 Å²	40.7	42%	0.422	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	19.3	168	-63.9	169.2	171.5	-179.3	0	114.9	T350 Y351	K347-T350 PolarHBondContact O-OG1 2.64Å; K347-T350 VanDerWaalsContact O-OG1 3.12Å; K347-Y351 WeakPolarHBondContact O-CE2 3.32Å
348	Y	29.9	Very low	29.1	Very low	22 Å²	22	48.2 Å²	48.2	9%	0.086	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-23.7	-173.8	-80.4	-77.8	0	0	0	114.6	G346 T350 Y351 L367 M445 A450	G346-Y348 PolarHBondContact O-N 3.21Å; Y348-T350 PolarHBondContact O-N 2.85Å; Y348-Y351 PolarHBondContact O-N 3.15Å; Y348-L367 HydrophobicContact CD1-CD2 4.4Å; Y348-L367 HydrophobicContact CE1-CD2 3.57Å; Y348-M445 HydrophobicContact CD1-CE 4.2Å; Y348-M445 HydrophobicContact CD2-CB 4.33Å; Y348-M445 HydrophobicContact CE1-CB 4.16Å; Y348-M445 HydrophobicContact CE1-CE 3.47Å; Y348-M445 VanDerWaalsContact CE1-CE 3.47Å; Y348-M445 HydrophobicContact CE2-CB 3.55Å; Y348-M445 VanDerWaalsContact CZ-C 3.48Å; Y348-M445 VanDerWaalsContact CZ-CB 3.48Å; Y348-M445 WeakPolarHBondContact OH-CA 3.43Å; Y348-M445 PolarHBondContact OH-O 3.32Å; Y348-A450 HydrophobicContact CE2-CB 4.37Å
349	S	27.2	Very low	29.2	Very low	25 Å²	25	53.1 Å²	53.1	18%	0.175	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-13.2	176.5	-169.6	0	0	0	0	114.6	N298 L344 Y351	N298-S349 PolarHBondContact ND2-OG 3.43Å; N298-S349 PolarHBondContact OD1-OG 3.42Å; L344-S349 WeakPolarHBondContact O-CB 3.49Å; L344-S349 PolarHBondContact O-N 3.19Å; S349-Y351 VanDerWaalsContact C-N 3.28Å; S349-Y351 PolarHBondContact O-N 3.21Å
350	T	29.3	Very low	29.4	Very low	26 Å²	26	54 Å²	54	16%	0.16	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-6	-179.2	17	0	0	0	0	114.4	K347 Y348 G352 V459 V468	K347-T350 PolarHBondContact O-OG1 2.64Å; K347-T350 VanDerWaalsContact O-OG1 3.12Å; Y348-T350 PolarHBondContact O-N 2.85Å; T350-G352 PolarHBondContact O-N 3.32Å; T350-V459 HydrophobicContact CG2-CG2 4.49Å; T350-V468 HydrophobicContact CG2-CB 4.25Å; T350-V468 HydrophobicContact CG2-CG1 3.72Å; T350-V468 HydrophobicContact CG2-CG2 3.49Å; T350-V468 VanDerWaalsContact CG2-CG2 3.49Å
351	Y	30.5	Very low	30	Very low	48 Å²	48	53.8 Å²	53.8	19%	0.188	26%	0.263	C	S	.	.			trans	-93.6	84.9	-175.3	-66.5	-80.7	0	0	0	111.1	K347 Y348 S349 T353 L356 L367	K347-Y351 WeakPolarHBondContact O-CE2 3.32Å; Y348-Y351 PolarHBondContact O-N 3.15Å; S349-Y351 VanDerWaalsContact C-N 3.28Å; S349-Y351 PolarHBondContact O-N 3.21Å; Y351-T353 PolarHBondContact O-N 2.99Å; Y351-T353 VanDerWaalsContact O-N 3.08Å; Y351-T353 PolarHBondContact O-OG1 2.8Å; Y351-L356 HydrophobicContact CD1-CD1 4.06Å; Y351-L367 HydrophobicContact CD1-CD1 3.74Å; Y351-L367 HydrophobicContact CD2-CD1 4.29Å; Y351-L367 HydrophobicContact CE1-CD1 3.46Å; Y351-L367 VanDerWaalsContact CE1-CD1 3.46Å; Y351-L367 HydrophobicContact CE2-CD1 4.06Å; Y351-L367 HydrophobicContact CG-CD1 4.15Å
352	G	25.5	Very low	31.4	Very low	20 Å²	20	59 Å²	59	21%	0.206	29%	0.291	C	S	.	.			trans	-61.9	106.1	156.7	0	0	0	0	0	108.7	T350 R354	T350-G352 PolarHBondContact O-N 3.32Å; G352-R354 PolarHBondContact O-N 3.12Å
353	T	31.3	Very low	33.3	Very low	30 Å²	30	56 Å²	56	18%	0.184	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	18.5	-165.9	-38.5	0	0	0	0	116.4	E303 Y351 R368	E303-T353 WeakPolarHBondContact OE1-CB 3.32Å; E303-T353 PolarHBondContact OE1-OG1 2.86Å; Y351-T353 PolarHBondContact O-N 2.99Å; Y351-T353 VanDerWaalsContact O-N 3.08Å; Y351-T353 PolarHBondContact O-OG1 2.8Å; T353-R368 HydrophobicContact CG2-CG 4.32Å
354	R	33.3	Very low	34.9	Very low	105 Å²	105	55.4 Å²	55.4	40%	0.396	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-151.2	4.1	-176.3	-113	147.6	112.2	151	2.4	120.4	L188 G352	L188-R354 HydrophobicContact CD1-CG 4.41Å; L188-R354 VanDerWaalsContact CD1-NE 3.28Å; L188-R354 VanDerWaalsContact CD1-NH2 3.28Å; G352-R354 PolarHBondContact O-N 3.12Å
355	I	31.3	Very low	36.5	Very low	47 Å²	47	55.2 Å²	55.2	24%	0.241	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-12.3	177.9	-62.1	174.8	0	0	0	113.9	W172 C183 H357	W172-I355 HydrophobicContact CE3-CD1 4.33Å; W172-I355 HydrophobicContact CE3-CG2 3.79Å; W172-I355 HydrophobicContact CZ3-CD1 3.78Å; W172-I355 HydrophobicContact CZ3-CG2 4.3Å; C183-I355 HydrophobicContact CB-CD1 3.79Å; C183-I355 WeakPolarHBondContact SG-CD1 3.26Å; I355-H357 PolarHBondContact O-N 2.63Å; I355-H357 VanDerWaalsContact O-N 3.17Å
356	L	27.1	Very low	38.9	Very low	14 Å²	14	55.6 Å²	55.6	7%	0.073	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-81.1	9.4	-179.6	-72.2	127.6	0	0	0	115.3	P171 Y351 R358 L360 V364	P171-L356 HydrophobicContact CB-CD2 4.08Å; P171-L356 HydrophobicContact CB-CG 4.45Å; P171-L356 HydrophobicContact CG-CD2 4.38Å; Y351-L356 HydrophobicContact CD1-CD1 4.06Å; L356-R358 VanDerWaalsContact C-N 3.29Å; L356-R358 PolarHBondContact O-N 3.5Å; L356-L360 HydrophobicContact CD2-CD1 3.53Å; L356-V364 HydrophobicContact CB-CB 4.45Å; L356-V364 HydrophobicContact CB-CG1 4.27Å; L356-V364 HydrophobicContact CB-CG2 3.42Å; L356-V364 VanDerWaalsContact CB-CG2 3.42Å; L356-V364 HydrophobicContact CG-CG2 4.4Å
357	H	33.3	Very low	40.8	Very low	108 Å²	108	55 Å²	55	50%	0.5	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-73.5	-11.2	-166.3	-126.9	-120.3	0	0	0	115.4	I355 R368	I355-H357 PolarHBondContact O-N 2.63Å; I355-H357 VanDerWaalsContact O-N 3.17Å; H357-R368 PolarHBondContact CD2-NH2 3.45Å; H357-R368 VanDerWaalsContact CD2-NH2 3.32Å; H357-R368 PolarHBondContact NE2-NH2 2.99Å
358	R	29.3	Very low	42.6	Very low	165 Å²	165	53.7 Å²	53.7	62%	0.623	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-94.9	-21	-167.6	-156.9	150.1	-177.2	160.7	0	115.1	L356	L356-R358 VanDerWaalsContact C-N 3.29Å; L356-R358 PolarHBondContact O-N 3.5Å
359	Q	30	Very low	44.7	Very low	106 Å²	106	54.7 Å²	54.7	50%	0.495	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.9	-12.8	179.3	-60.9	176.6	-39	0	0	115.3	N169 P171	N169-Q359 VanDerWaalsContact C-OE1 3.28Å; N169-Q359 HydrophobicContact CB-CB 4.45Å; N169-Q359 HydrophobicContact CB-CG 4.45Å; N169-Q359 VanDerWaalsContact CG-NE2 3.35Å; N169-Q359 PolarHBondContact O-OE1 2.88Å; N169-Q359 PolarHBondContact OD1-NE2 2.82Å; P171-Q359 HydrophobicContact CG-CB 4.04Å
360	L	33.8	Very low	47	Very low	46 Å²	46	53.5 Å²	53.5	24%	0.241	26%	0.261	C	S	.	.	S	Bend	trans	-106.7	20.5	170.9	-81.3	164.5	0	0	0	112.6	P171 L356 D362 D363 V364 I453	P171-L360 HydrophobicContact CG-CB 4.19Å; P171-L360 HydrophobicContact CG-CD1 3.8Å; P171-L360 HydrophobicContact CG-CG 3.96Å; L356-L360 HydrophobicContact CD2-CD1 3.53Å; L360-D362 VanDerWaalsContact C-N 3.35Å; L360-D362 PolarHBondContact O-N 3.41Å; L360-D362 VanDerWaalsContact O-N 3.09Å; L360-D363 PolarHBondContact O-N 2.72Å; L360-D363 VanDerWaalsContact O-N 3.14Å; L360-V364 HydrophobicContact CB-CG2 3.91Å; L360-V364 WeakPolarHBondContact O-CG2 3.47Å; L360-V364 PolarHBondContact O-N 3.43Å; L360-I453 HydrophobicContact CD2-CG2 4.48Å
361	G	44.6	Very low	48.9	Very low	24 Å²	24	54.2 Å²	54.2	25%	0.247	26%	0.261	C	S	.	.	H	α-helix	trans	-48.1	-44.9	-159.4	0	0	0	0	0	116	A365	G361-A365 WeakPolarHBondContact O-CB 3.32Å; G361-A365 PolarHBondContact O-N 2.86Å; G361-A365 VanDerWaalsContact O-N 3.16Å
362	D	59	Low	50.9	Low	126 Å²	126	53.4 Å²	53.4	67%	0.674	26%	0.259	S	S	*	.	H	α-helix	trans	-73.4	-41	-175.8	-69.4	-10.1	0	0	0	112.8	L360 A365 K366	L360-D362 VanDerWaalsContact C-N 3.35Å; L360-D362 PolarHBondContact O-N 3.41Å; L360-D362 VanDerWaalsContact O-N 3.09Å; D362-A365 PolarHBondContact O-N 3.14Å; D362-K366 WeakPolarHBondContact O-CB 3.42Å; D362-K366 VanDerWaalsContact O-CG 3.24Å; D362-K366 WeakPolarHBondContact O-CG 3.48Å; D362-K366 PolarHBondContact O-N 2.82Å
363	D	67.1	Low	53.4	Low	34 Å²	34	52.5 Å²	52.5	18%	0.182	25%	0.249	C	C	.	.	H	α-helix	trans	-74.2	-32	-176.8	-69.2	-20	0	0	0	111.6	L360 K366 L367 I453	L360-D363 PolarHBondContact O-N 2.72Å; L360-D363 VanDerWaalsContact O-N 3.14Å; D363-K366 PolarHBondContact O-N 3.12Å; D363-K366 IonicContact OD1-NZ 3.44Å; D363-K366 PolarHBondContact OD1-NZ 2.82Å; D363-L367 WeakPolarHBondContact O-CB 3.26Å; D363-L367 VanDerWaalsContact O-CG 3.26Å; D363-L367 WeakPolarHBondContact O-CG 3.46Å; D363-L367 PolarHBondContact O-N 3.2Å; D363-I453 HydrophobicContact CB-CG1 4.35Å
364	V	61.9	Low	55.4	Low	10 Å²	10	51.1 Å²	51.1	6%	0.061	24%	0.241	C	C	.	.	H	α-helix	trans	-68.5	-39.2	172.6	178.4	0	0	0	0	111.1	L356 L360 L367 R368	L356-V364 HydrophobicContact CB-CB 4.45Å; L356-V364 HydrophobicContact CB-CG1 4.27Å; L356-V364 HydrophobicContact CB-CG2 3.42Å; L356-V364 VanDerWaalsContact CB-CG2 3.42Å; L356-V364 HydrophobicContact CG-CG2 4.4Å; L360-V364 HydrophobicContact CB-CG2 3.91Å; L360-V364 WeakPolarHBondContact O-CG2 3.47Å; L360-V364 PolarHBondContact O-N 3.43Å; V364-L367 PolarHBondContact O-N 3.32Å; V364-R368 WeakPolarHBondContact O-CB 3.38Å; V364-R368 PolarHBondContact O-N 3.06Å
365	A	63.3	Low	57.3	Low	24 Å²	24	46.8 Å²	46.8	20%	0.198	23%	0.225	C	C	.	.	H	α-helix	trans	-64.8	-44.7	175	0	0	0	0	0	111.3	G361 D362 L367 R368 H369	G361-A365 WeakPolarHBondContact O-CB 3.32Å; G361-A365 PolarHBondContact O-N 2.86Å; G361-A365 VanDerWaalsContact O-N 3.16Å; D362-A365 PolarHBondContact O-N 3.14Å; A365-L367 PolarHBondContact O-N 2.87Å; A365-R368 WeakPolarHBondContact O-CB 3.49Å; A365-R368 PolarHBondContact O-N 3.45Å; A365-R368 VanDerWaalsContact O-N 3.16Å; A365-H369 PolarHBondContact O-N 3.42Å
366	K	74.4	Confident	59.2	Low	64 Å²	64	46 Å²	46	28%	0.278	22%	0.22	S	C	.	.	H	α-helix	trans	-58.4	-45.1	173.7	-73.8	173.3	-157.1	157.6	0	112.3	D362 D363 R368 H369 C370 C419 F449	D362-K366 WeakPolarHBondContact O-CB 3.42Å; D362-K366 VanDerWaalsContact O-CG 3.24Å; D362-K366 WeakPolarHBondContact O-CG 3.48Å; D362-K366 PolarHBondContact O-N 2.82Å; D363-K366 PolarHBondContact O-N 3.12Å; D363-K366 IonicContact OD1-NZ 3.44Å; D363-K366 PolarHBondContact OD1-NZ 2.82Å; K366-R368 VanDerWaalsContact C-N 3.31Å; K366-R368 PolarHBondContact O-N 3.41Å; K366-H369 PolarHBondContact O-N 3.29Å; K366-C370 PolarHBondContact O-N 3.19Å; K366-C370 PolarHBondContact O-SG 2.84Å; K366-C419 HydrophobicContact CB-CB 3.61Å; K366-C419 HydrophobicContact CG-CB 3.83Å; K366-F449 HydrophobicContact CB-CE2 4Å; K366-F449 HydrophobicContact CB-CZ 3.57Å; K366-F449 HydrophobicContact CD-CE2 4.42Å; K366-F449 HydrophobicContact CD-CZ 4.29Å
367	L	67.8	Low	61.6	Low	15 Å²	15	45.8 Å²	45.8	8%	0.079	22%	0.219	C	C	.	.	H	α-helix	trans	-59.1	-42.9	174.3	-78.9	173.6	0	0	0	112.1	Y348 Y351 D363 V364 A365 H369 C370 Y371 M445 F449 I453	Y348-L367 HydrophobicContact CD1-CD2 4.4Å; Y348-L367 HydrophobicContact CE1-CD2 3.57Å; Y351-L367 HydrophobicContact CD1-CD1 3.74Å; Y351-L367 HydrophobicContact CD2-CD1 4.29Å; Y351-L367 HydrophobicContact CE1-CD1 3.46Å; Y351-L367 VanDerWaalsContact CE1-CD1 3.46Å; Y351-L367 HydrophobicContact CE2-CD1 4.06Å; Y351-L367 HydrophobicContact CG-CD1 4.15Å; D363-L367 WeakPolarHBondContact O-CB 3.26Å; D363-L367 VanDerWaalsContact O-CG 3.26Å; D363-L367 WeakPolarHBondContact O-CG 3.46Å; D363-L367 PolarHBondContact O-N 3.2Å; V364-L367 PolarHBondContact O-N 3.32Å; A365-L367 PolarHBondContact O-N 2.87Å; L367-H369 VanDerWaalsContact C-N 3.32Å; L367-H369 PolarHBondContact O-N 3.39Å; L367-C370 PolarHBondContact O-N 3.02Å; L367-Y371 WeakPolarHBondContact O-CB 3.38Å; L367-Y371 PolarHBondContact O-N 3.08Å; L367-M445 HydrophobicContact CD2-CE 4.17Å; L367-F449 HydrophobicContact CD1-CE1 4.41Å; L367-F449 HydrophobicContact CD2-CD1 3.46Å; L367-F449 VanDerWaalsContact CD2-CD1 3.46Å; L367-F449 HydrophobicContact CD2-CE1 3.24Å; L367-F449 HydrophobicContact CD2-CZ 4.22Å; L367-F449 HydrophobicContact CG-CD1 4.2Å; L367-F449 HydrophobicContact CG-CE1 3.46Å; L367-F449 VanDerWaalsContact CG-CE1 3.46Å; L367-F449 HydrophobicContact CG-CZ 4.2Å; L367-I453 HydrophobicContact CD1-CD1 3.9Å; L367-I453 HydrophobicContact CD2-CD1 4.49Å; L367-I453 HydrophobicContact CG-CD1 4.4Å
368	R	65	Low	63.9	Low	68 Å²	68	40.6 Å²	40.6	26%	0.257	20%	0.195	S	C	.	.	H	α-helix	trans	-61	-41.8	177.3	-172.5	-169.4	-61.2	142	2.1	111.4	T353 H357 V364 A365 K366 Y371 F372	T353-R368 HydrophobicContact CG2-CG 4.32Å; H357-R368 PolarHBondContact CD2-NH2 3.45Å; H357-R368 VanDerWaalsContact CD2-NH2 3.32Å; H357-R368 PolarHBondContact NE2-NH2 2.99Å; V364-R368 WeakPolarHBondContact O-CB 3.38Å; V364-R368 PolarHBondContact O-N 3.06Å; A365-R368 WeakPolarHBondContact O-CB 3.49Å; A365-R368 PolarHBondContact O-N 3.45Å; A365-R368 VanDerWaalsContact O-N 3.16Å; K366-R368 VanDerWaalsContact C-N 3.31Å; K366-R368 PolarHBondContact O-N 3.41Å; R368-Y371 PolarHBondContact O-N 2.87Å; R368-F372 WeakPolarHBondContact O-CB 3.34Å; R368-F372 PolarHBondContact O-N 3.17Å
369	H	73.2	Confident	66.7	Low	43 Å²	43	32.8 Å²	32.8	20%	0.199	17%	0.165	C	C	.	.	H	α-helix	trans	-65	-43.9	175.5	-62.1	157.8	0	0	0	111.6	A365 K366 L367 Y371 F372 F373 C419 C423	A365-H369 PolarHBondContact O-N 3.42Å; K366-H369 PolarHBondContact O-N 3.29Å; L367-H369 VanDerWaalsContact C-N 3.32Å; L367-H369 PolarHBondContact O-N 3.39Å; H369-Y371 VanDerWaalsContact C-N 3.33Å; H369-Y371 PolarHBondContact O-N 2.73Å; H369-F372 WeakPolarHBondContact O-CB 3.27Å; H369-F372 PolarHBondContact O-N 3Å; H369-F373 VanDerWaalsContact O-CD2 3.27Å; H369-F373 WeakPolarHBondContact O-CD2 3.49Å; H369-F373 PolarHBondContact O-N 3.16Å; H369-C419 PolarHBondContact ND1-O 2.64Å; H369-C423 PolarHBondContact CD2-SG 2.67Å
370	C	75.5	Confident	69.4	Low	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-61	-41.3	174.5	-68.3	0	0	0	0	112.3	K366 L367 T374 M445	K366-C370 PolarHBondContact O-N 3.19Å; K366-C370 PolarHBondContact O-SG 2.84Å; L367-C370 PolarHBondContact O-N 3.02Å; C370-T374 WeakPolarHBondContact O-CB 3.26Å; C370-T374 WeakPolarHBondContact O-CG2 3.47Å; C370-T374 PolarHBondContact O-N 3.28Å; C370-T374 VanDerWaalsContact O-N 3.15Å; C370-T374 PolarHBondContact O-OG1 3Å; C370-M445 HydrophobicContact CB-CE 3.5Å; C370-M445 VanDerWaalsContact CB-CE 3.5Å; C370-M445 HydrophobicContact CB-SD 3.83Å
371	Y	70.4	Confident	72.1	Confident	41 Å²	41	29.6 Å²	29.6	16%	0.161	15%	0.148	C	C	.	.	H	α-helix	trans	-60.4	-47.4	173.6	174.6	-87	0	0	0	111.1	E303 L367 R368 H369 F373 T374 I375 E376	E303-Y371 VanDerWaalsContact OE2-CE2 3.29Å; E303-Y371 WeakPolarHBondContact OE2-CE2 3.2Å; E303-Y371 VanDerWaalsContact OE2-CZ 3.26Å; E303-Y371 PolarHBondContact OE2-OH 3.45Å; L367-Y371 WeakPolarHBondContact O-CB 3.38Å; L367-Y371 PolarHBondContact O-N 3.08Å; R368-Y371 PolarHBondContact O-N 2.87Å; H369-Y371 VanDerWaalsContact C-N 3.33Å; H369-Y371 PolarHBondContact O-N 2.73Å; Y371-F373 PolarHBondContact O-N 2.94Å; Y371-T374 PolarHBondContact O-N 3.32Å; Y371-T374 PolarHBondContact O-OG1 2.95Å; Y371-I375 HydrophobicContact CD2-CB 3.89Å; Y371-I375 HydrophobicContact CD2-CG1 3.82Å; Y371-I375 HydrophobicContact CD2-CG2 4.37Å; Y371-I375 HydrophobicContact CE1-CB 4.33Å; Y371-I375 HydrophobicContact CE1-CG2 4.41Å; Y371-I375 HydrophobicContact CE2-CB 3.6Å; Y371-I375 HydrophobicContact CE2-CG1 3.81Å; Y371-I375 HydrophobicContact CE2-CG2 3.58Å; Y371-I375 HydrophobicContact CG-CB 4.36Å; Y371-I375 PolarHBondContact O-N 3.27Å; Y371-I375 WeakPolarHBondContact OH-CG2 3.42Å; Y371-E376 HydrophobicContact CD1-CG 4.2Å; Y371-E376 HydrophobicContact CE1-CG 3.67Å; Y371-E376 WeakPolarHBondContact CE1-OE1 3.22Å; Y371-E376 PolarHBondContact O-N 3.46Å; Y371-E376 PolarHBondContact OH-OE1 3.47Å
372	F	71.6	Confident	74	Confident	31 Å²	31	29.9 Å²	29.9	14%	0.136	14%	0.143	C	C	.	.	I	π-helix	trans	-58.6	-48	-179.9	-174.3	-91.9	0	0	0	112	R368 H369 T374 E376 F377 C423	R368-F372 WeakPolarHBondContact O-CB 3.34Å; R368-F372 PolarHBondContact O-N 3.17Å; H369-F372 WeakPolarHBondContact O-CB 3.27Å; H369-F372 PolarHBondContact O-N 3Å; F372-T374 VanDerWaalsContact C-N 3.27Å; F372-T374 PolarHBondContact O-N 3.46Å; F372-E376 HydrophobicContact CD2-CB 4.3Å; F372-E376 HydrophobicContact CD2-CG 4.37Å; F372-E376 VanDerWaalsContact O-CB 3.32Å; F372-E376 WeakPolarHBondContact O-CB 3.27Å; F372-E376 PolarHBondContact O-N 2.91Å; F372-F377 AromaticContact CD1-CD2 3.99Å; F372-F377 HydrophobicContact CD1-CD2 3.99Å; F372-F377 HydrophobicContact CD2-CD2 4.23Å; F372-F377 HydrophobicContact CD2-CE2 4.25Å; F372-F377 AromaticContact CE1-CD2 3.52Å; F372-F377 HydrophobicContact CE1-CD2 3.52Å; F372-F377 AromaticContact CE1-CE2 3.9Å; F372-F377 HydrophobicContact CE1-CE2 3.9Å; F372-F377 HydrophobicContact CE1-CG 4.41Å; F372-F377 AromaticContact CE2-CD2 3.8Å; F372-F377 HydrophobicContact CE2-CD2 3.8Å; F372-F377 AromaticContact CE2-CE2 3.48Å; F372-F377 HydrophobicContact CE2-CE2 3.48Å; F372-F377 VanDerWaalsContact CE2-CE2 3.48Å; F372-F377 HydrophobicContact CG-CD2 4.33Å; F372-F377 AromaticContact CZ-CD2 3.42Å; F372-F377 HydrophobicContact CZ-CD2 3.42Å; F372-F377 VanDerWaalsContact CZ-CD2 3.42Å; F372-F377 AromaticContact CZ-CE2 3.27Å; F372-F377 HydrophobicContact CZ-CE2 3.27Å; F372-F377 HydrophobicContact CZ-CZ 4.33Å; F372-F377 PolarHBondContact O-N 3.24Å; F372-C423 HydrophobicContact CD1-CB 3.84Å; F372-C423 WeakPolarHBondContact CD1-SG 3.41Å; F372-C423 HydrophobicContact CE1-CB 3.73Å; F372-C423 HydrophobicContact CE2-CB 4.41Å; F372-C423 HydrophobicContact CG-CB 4.24Å; F372-C423 HydrophobicContact CZ-CB 4.02Å
373	F	78.4	Confident	75.2	Confident	1 Å²	1	31.1 Å²	31.1	0%	0.004	15%	0.15	C	C	.	.	I	π-helix	trans	-80.4	-2	-178.8	-74.1	-64.8	0	0	0	115.1	H369 Y371 G378 T418 Q421 C423 F433	H369-F373 VanDerWaalsContact O-CD2 3.27Å; H369-F373 WeakPolarHBondContact O-CD2 3.49Å; H369-F373 PolarHBondContact O-N 3.16Å; Y371-F373 PolarHBondContact O-N 2.94Å; F373-G378 WeakPolarHBondContact O-CA 3.39Å; F373-T418 HydrophobicContact CB-CG2 3.4Å; F373-T418 HydrophobicContact CD2-CG2 3.71Å; F373-T418 HydrophobicContact CG-CG2 3.85Å; F373-Q421 HydrophobicContact CD2-CB 4.24Å; F373-Q421 HydrophobicContact CD2-CG 4.41Å; F373-Q421 HydrophobicContact CE1-CG 4.12Å; F373-Q421 HydrophobicContact CE2-CB 3.6Å; F373-Q421 HydrophobicContact CE2-CG 3.55Å; F373-Q421 HydrophobicContact CZ-CB 4.01Å; F373-Q421 HydrophobicContact CZ-CG 3.38Å; F373-C423 VanDerWaalsContact CE2-SG 3.58Å; F373-F433 HydrophobicContact CB-CD2 3.61Å; F373-F433 HydrophobicContact CB-CE2 4.15Å; F373-F433 HydrophobicContact CB-CG 4.43Å; F373-F433 AromaticContact CD1-CD2 3.62Å; F373-F433 HydrophobicContact CD1-CD2 3.62Å; F373-F433 AromaticContact CD1-CE2 3.77Å; F373-F433 HydrophobicContact CD1-CE2 3.77Å; F373-F433 HydrophobicContact CD2-CD2 4.45Å; F373-F433 HydrophobicContact CD2-CE2 4.15Å; F373-F433 HydrophobicContact CE1-CD2 4.45Å; F373-F433 HydrophobicContact CE1-CE2 4.22Å; F373-F433 AromaticContact CG-CD2 3.63Å; F373-F433 HydrophobicContact CG-CD2 3.63Å; F373-F433 AromaticContact CG-CE2 3.74Å; F373-F433 HydrophobicContact CG-CE2 3.74Å
374	T	74.1	Confident	76	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.006	17%	0.173	C	C	.	.	I	π-helix	trans	-112.2	-68.8	173.1	52.8	0	0	0	0	110.4	C370 Y371 F372 G378 Y389 F413	C370-T374 WeakPolarHBondContact O-CB 3.26Å; C370-T374 WeakPolarHBondContact O-CG2 3.47Å; C370-T374 PolarHBondContact O-N 3.28Å; C370-T374 VanDerWaalsContact O-N 3.15Å; C370-T374 PolarHBondContact O-OG1 3Å; Y371-T374 PolarHBondContact O-N 3.32Å; Y371-T374 PolarHBondContact O-OG1 2.95Å; F372-T374 VanDerWaalsContact C-N 3.27Å; F372-T374 PolarHBondContact O-N 3.46Å; T374-G378 WeakPolarHBondContact O-CA 3.44Å; T374-G378 PolarHBondContact O-N 3.47Å; T374-Y389 WeakPolarHBondContact CA-OH 3.24Å; T374-Y389 WeakPolarHBondContact CB-OH 3.26Å; T374-Y389 WeakPolarHBondContact O-CE2 3.21Å; T374-Y389 VanDerWaalsContact O-CZ 3.32Å; T374-Y389 PolarHBondContact O-OH 3.44Å; T374-F413 HydrophobicContact CG2-CD1 4.45Å; T374-F413 HydrophobicContact CG2-CD2 3.69Å; T374-F413 HydrophobicContact CG2-CE1 4.12Å; T374-F413 HydrophobicContact CG2-CE2 3.29Å; T374-F413 HydrophobicContact CG2-CG 4.26Å; T374-F413 HydrophobicContact CG2-CZ 3.53Å
375	I	72.4	Confident	77.3	Confident	14 Å²	14	37 Å²	37	7%	0.072	19%	0.193	C	C	.	.	I	π-helix	trans	-74.4	-35.1	-172.1	-58.2	-63.7	0	0	0	112.8	H340 Y343 Y371 G390 A391	H340-I375 WeakPolarHBondContact CD2-CG2 3.42Å; H340-I375 WeakPolarHBondContact NE2-CG2 3.3Å; Y343-I375 HydrophobicContact CD1-CD1 3.44Å; Y343-I375 VanDerWaalsContact CD1-CD1 3.44Å; Y343-I375 HydrophobicContact CD1-CG1 3.99Å; Y343-I375 HydrophobicContact CD2-CD1 4.15Å; Y343-I375 HydrophobicContact CE1-CD1 4.04Å; Y343-I375 HydrophobicContact CE1-CG1 4.34Å; Y343-I375 HydrophobicContact CG-CD1 3.48Å; Y343-I375 VanDerWaalsContact CG-CD1 3.48Å; Y371-I375 HydrophobicContact CD2-CB 3.89Å; Y371-I375 HydrophobicContact CD2-CG1 3.82Å; Y371-I375 HydrophobicContact CD2-CG2 4.37Å; Y371-I375 HydrophobicContact CE1-CB 4.33Å; Y371-I375 HydrophobicContact CE1-CG2 4.41Å; Y371-I375 HydrophobicContact CE2-CB 3.6Å; Y371-I375 HydrophobicContact CE2-CG1 3.81Å; Y371-I375 HydrophobicContact CE2-CG2 3.58Å; Y371-I375 HydrophobicContact CG-CB 4.36Å; Y371-I375 PolarHBondContact O-N 3.27Å; Y371-I375 WeakPolarHBondContact OH-CG2 3.42Å; I375-G390 CarbonylContact O-C 3.53Å; I375-G390 VanDerWaalsContact O-CA 3.3Å; I375-G390 WeakPolarHBondContact O-CA 3.42Å; I375-A391 PolarHBondContact O-N 3.03Å
376	E	70.3	Confident	78.6	Confident	30 Å²	30	38.9 Å²	38.9	14%	0.14	20%	0.199	C	C	.	.	I	π-helix	trans	-86.2	-46.6	177.9	-61.3	-69.2	163.2	0	0	111.9	Y371 F372 G390 A391 G392	Y371-E376 HydrophobicContact CD1-CG 4.2Å; Y371-E376 HydrophobicContact CE1-CG 3.67Å; Y371-E376 WeakPolarHBondContact CE1-OE1 3.22Å; Y371-E376 PolarHBondContact O-N 3.46Å; Y371-E376 PolarHBondContact OH-OE1 3.47Å; F372-E376 HydrophobicContact CD2-CB 4.3Å; F372-E376 HydrophobicContact CD2-CG 4.37Å; F372-E376 VanDerWaalsContact O-CB 3.32Å; F372-E376 WeakPolarHBondContact O-CB 3.27Å; F372-E376 PolarHBondContact O-N 2.91Å; E376-G390 CarbonylContact O-C 3.36Å; E376-G390 WeakPolarHBondContact O-CA 3.41Å; E376-A391 PolarHBondContact O-N 3Å; E376-A391 VanDerWaalsContact O-N 3.13Å; E376-G392 WeakPolarHBondContact O-CA 3.27Å; E376-G392 PolarHBondContact O-N 3.21Å
377	F	77.4	Confident	79.3	Confident	10 Å²	10	38.2 Å²	38.2	4%	0.044	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.3	24.6	-171.5	-65.5	-81	0	0	0	114.8	F372 L393 E399 Q429	F372-F377 AromaticContact CD1-CD2 3.99Å; F372-F377 HydrophobicContact CD1-CD2 3.99Å; F372-F377 HydrophobicContact CD2-CD2 4.23Å; F372-F377 HydrophobicContact CD2-CE2 4.25Å; F372-F377 AromaticContact CE1-CD2 3.52Å; F372-F377 HydrophobicContact CE1-CD2 3.52Å; F372-F377 AromaticContact CE1-CE2 3.9Å; F372-F377 HydrophobicContact CE1-CE2 3.9Å; F372-F377 HydrophobicContact CE1-CG 4.41Å; F372-F377 AromaticContact CE2-CD2 3.8Å; F372-F377 HydrophobicContact CE2-CD2 3.8Å; F372-F377 AromaticContact CE2-CE2 3.48Å; F372-F377 HydrophobicContact CE2-CE2 3.48Å; F372-F377 VanDerWaalsContact CE2-CE2 3.48Å; F372-F377 HydrophobicContact CG-CD2 4.33Å; F372-F377 AromaticContact CZ-CD2 3.42Å; F372-F377 HydrophobicContact CZ-CD2 3.42Å; F372-F377 VanDerWaalsContact CZ-CD2 3.42Å; F372-F377 AromaticContact CZ-CE2 3.27Å; F372-F377 HydrophobicContact CZ-CE2 3.27Å; F372-F377 HydrophobicContact CZ-CZ 4.33Å; F372-F377 PolarHBondContact O-N 3.24Å; F377-L393 HydrophobicContact CD1-CD2 3.89Å; F377-L393 HydrophobicContact CD1-CG 3.98Å; F377-E399 HydrophobicContact CE1-CG 4.43Å; F377-E399 WeakPolarHBondContact CE1-OE1 3.37Å; F377-E399 WeakPolarHBondContact CE1-OE2 3.33Å; F377-Q429 HydrophobicContact CB-CG 4.38Å; F377-Q429 HydrophobicContact CD1-CG 4.18Å; F377-Q429 HydrophobicContact CG-CG 4.13Å
378	G	81.5	Confident	80.1	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.191	C	C	.	.			trans	-80.9	147.7	-177.6	0	0	0	0	0	115.1	F373 T374 Y389 G390	F373-G378 WeakPolarHBondContact O-CA 3.39Å; T374-G378 WeakPolarHBondContact O-CA 3.44Å; T374-G378 PolarHBondContact O-N 3.47Å; G378-Y389 VanDerWaalsContact C-CE1 3.48Å; G378-Y389 WeakPolarHBondContact O-CD1 3.35Å; G378-Y389 PolarHBondContact O-N 3.05Å; G378-G390 PolarHBondContact O-N 3.02Å
379	L	88.1	Confident	80.8	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	150	173.8	-60	177.8	0	0	0	110.6	R387 A388 Y389 L393 L404 V410 Y432 F433 V434 S435	L379-R387 CarbonylContact C-O 3.55Å; L379-R387 WeakPolarHBondContact CA-O 3.18Å; L379-A388 HydrophobicContact CD2-CB 3.96Å; L379-Y389 VanDerWaalsContact C-CE1 3.42Å; L379-Y389 VanDerWaalsContact O-CE1 3.26Å; L379-Y389 WeakPolarHBondContact O-CE1 3.34Å; L379-L393 HydrophobicContact CD2-CD1 3.53Å; L379-L393 HydrophobicContact CG-CD1 4.31Å; L379-L404 HydrophobicContact CD2-CD2 4.03Å; L379-V410 HydrophobicContact CD1-CG1 4.16Å; L379-V410 HydrophobicContact CD1-CG2 4.06Å; L379-Y432 HydrophobicContact CD1-CG 4.32Å; L379-F433 PolarHBondContact N-O 3.29Å; L379-V434 HydrophobicContact CB-CB 4.17Å; L379-V434 HydrophobicContact CB-CG2 4.24Å; L379-V434 CarbonylContact O-C 3.6Å; L379-V434 VanDerWaalsContact O-CA 3.26Å; L379-V434 WeakPolarHBondContact O-CA 3.38Å; L379-S435 PolarHBondContact O-N 3.08Å; L379-S435 PolarHBondContact O-OG 3.15Å
380	C	87.9	Confident	80.7	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.007	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	152.9	171.3	63.4	0	0	0	0	110.8	C255 R387 Y389 S435 F438	C255-C380 VanDerWaalsContact CB-SG 3.56Å; C380-R387 PolarHBondContact N-O 2.88Å; C380-R387 PolarHBondContact O-N 3.02Å; C380-Y389 HydrophobicContact CB-CD1 3.82Å; C380-Y389 HydrophobicContact CB-CE1 4.2Å; C380-S435 VanDerWaalsContact CA-O 3.27Å; C380-S435 WeakPolarHBondContact CA-O 3.24Å; C380-F438 HydrophobicContact CB-CZ 4.2Å
381	K	89.3	Confident	80.5	Confident	84 Å²	84	33 Å²	33	37%	0.365	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	126.2	173.1	-163.3	168.6	165.3	-163.3	0	109.8	Q385 V434 S435 E436	K381-Q385 WeakPolarHBondContact CA-O 3.2Å; K381-V434 HydrophobicContact CB-CG2 4.22Å; K381-S435 PolarHBondContact N-O 3.16Å; K381-E436 IonicContact NZ-OE1 2.77Å; K381-E436 PolarHBondContact NZ-OE1 3.27Å
382	Q	84.9	Confident	80.4	Confident	30 Å²	30	31.1 Å²	31.1	14%	0.14	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	125	179.6	-67.9	-174.1	-33.8	0	0	108.6	E257 G384 Q385 R387	E257-Q382 PolarHBondContact OE2-NE2 2.93Å; Q382-G384 PolarHBondContact O-N 3.19Å; Q382-G384 VanDerWaalsContact O-N 3.15Å; Q382-Q385 PolarHBondContact N-O 2.51Å; Q382-Q385 PolarHBondContact O-N 3.38Å; Q382-R387 HydrophobicContact CB-CG 4.43Å
383	D	85.1	Confident	80.6	Confident	152 Å²	152	29.6 Å²	29.6	81%	0.813	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.5	37.7	179.9	-51.7	-43.9	0	0	0	112.9	Q385	D383-Q385 PolarHBondContact O-N 2.81Å
384	G	82.8	Confident	80.4	Confident	65 Å²	65	29.6 Å²	29.6	67%	0.67	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	77	-2.3	-177.8	0	0	0	0	0	115.3	Q382	Q382-G384 PolarHBondContact O-N 3.19Å; Q382-G384 VanDerWaalsContact O-N 3.15Å
385	Q	89.1	Confident	80.3	Confident	103 Å²	103	29.5 Å²	29.5	48%	0.481	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	148.2	179.4	-59.5	-171.1	-1.7	0	0	112.1	K381 Q382 D383 R387	K381-Q385 WeakPolarHBondContact CA-O 3.2Å; Q382-Q385 PolarHBondContact N-O 2.51Å; Q382-Q385 PolarHBondContact O-N 3.38Å; D383-Q385 PolarHBondContact O-N 2.81Å; Q385-R387 VanDerWaalsContact OE1-CZ 3.22Å
386	L	91.3	Very high	80.4	Confident	64 Å²	64	28.9 Å²	28.9	34%	0.335	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	136	171.9	-66.7	175.7	0	0	0	110.3	L404 V410 V434	L386-L404 HydrophobicContact CB-CD2 3.63Å; L386-V410 HydrophobicContact CD1-CG1 4.41Å; L386-V410 HydrophobicContact CD1-CG2 4.26Å; L386-V434 HydrophobicContact CD2-CB 4.27Å; L386-V434 HydrophobicContact CD2-CG2 3.64Å
387	R	89.1	Confident	80.7	Confident	50 Å²	50	28.3 Å²	28.3	19%	0.189	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	146.9	177.1	-67.2	-61.3	-168.6	-105.5	-2.4	110.3	T252 H253 A254 C255 L379 C380 Q382 Q385	T252-R387 PolarHBondContact O-NE 3.33Å; T252-R387 PolarHBondContact O-NH1 3.44Å; H253-R387 CarbonylContact O-C 3.41Å; H253-R387 WeakPolarHBondContact O-CA 3.42Å; A254-R387 WeakPolarHBondContact O-CD 3.44Å; C255-R387 HydrophobicContact CB-CB 4.27Å; L379-R387 CarbonylContact C-O 3.55Å; L379-R387 WeakPolarHBondContact CA-O 3.18Å; C380-R387 PolarHBondContact N-O 2.88Å; C380-R387 PolarHBondContact O-N 3.02Å; Q382-R387 HydrophobicContact CB-CG 4.43Å; Q385-R387 VanDerWaalsContact OE1-CZ 3.22Å
388	A	84.6	Confident	80.8	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	138	175.6	0	0	0	0	0	111.3	H253 C255 L379 L393 L394 L400	H253-A388 PolarHBondContact O-N 3.4Å; C255-A388 PolarHBondContact N-O 2.77Å; L379-A388 HydrophobicContact CD2-CB 3.96Å; A388-L393 HydrophobicContact CB-CB 3.97Å; A388-L393 HydrophobicContact CB-CD1 3.98Å; A388-L394 HydrophobicContact CB-CD2 4.2Å; A388-L400 HydrophobicContact CB-CD1 3.5Å
389	Y	79.7	Confident	80.8	Confident	14 Å²	14	28.9 Å²	28.9	6%	0.055	16%	0.161	C	C	.	.			trans	-125.6	-14.2	166	73.5	-96.9	0	0	0	112.6	T374 G378 L379 C380 A391 F438	T374-Y389 WeakPolarHBondContact CA-OH 3.24Å; T374-Y389 WeakPolarHBondContact CB-OH 3.26Å; T374-Y389 WeakPolarHBondContact O-CE2 3.21Å; T374-Y389 VanDerWaalsContact O-CZ 3.32Å; T374-Y389 PolarHBondContact O-OH 3.44Å; G378-Y389 VanDerWaalsContact C-CE1 3.48Å; G378-Y389 WeakPolarHBondContact O-CD1 3.35Å; G378-Y389 PolarHBondContact O-N 3.05Å; L379-Y389 VanDerWaalsContact C-CE1 3.42Å; L379-Y389 VanDerWaalsContact O-CE1 3.26Å; L379-Y389 WeakPolarHBondContact O-CE1 3.34Å; C380-Y389 HydrophobicContact CB-CD1 3.82Å; C380-Y389 HydrophobicContact CB-CE1 4.2Å; Y389-A391 PolarHBondContact O-N 2.89Å; Y389-F438 AromaticContact CD1-CE1 3.74Å; Y389-F438 HydrophobicContact CD1-CE1 3.74Å; Y389-F438 AromaticContact CD1-CZ 3.99Å; Y389-F438 HydrophobicContact CD1-CZ 3.99Å; Y389-F438 AromaticContact CD2-CE1 3.72Å; Y389-F438 HydrophobicContact CD2-CE1 3.72Å; Y389-F438 HydrophobicContact CE1-CE1 4.09Å; Y389-F438 HydrophobicContact CE2-CE1 4.08Å; Y389-F438 AromaticContact CG-CE1 3.53Å; Y389-F438 HydrophobicContact CG-CE1 3.53Å; Y389-F438 AromaticContact CG-CZ 3.91Å; Y389-F438 HydrophobicContact CG-CZ 3.91Å
390	G	72.1	Confident	80.4	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.161	C	C	.	.			trans	-59.5	134.3	177.3	0	0	0	0	0	112.6	I375 E376 G378 G392 L393 L394	I375-G390 CarbonylContact O-C 3.53Å; I375-G390 VanDerWaalsContact O-CA 3.3Å; I375-G390 WeakPolarHBondContact O-CA 3.42Å; E376-G390 CarbonylContact O-C 3.36Å; E376-G390 WeakPolarHBondContact O-CA 3.41Å; G378-G390 PolarHBondContact O-N 3.02Å; G390-G392 VanDerWaalsContact C-N 3.31Å; G390-G392 PolarHBondContact O-N 2.64Å; G390-L393 PolarHBondContact O-N 3.28Å; G390-L393 VanDerWaalsContact O-N 3.13Å; G390-L394 WeakPolarHBondContact O-CG 3.4Å; G390-L394 PolarHBondContact O-N 3.35Å
391	A	70.6	Confident	80.4	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.008	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-36.8	-177.3	0	0	0	0	0	113.3	I375 E376 Y389 S395	I375-A391 PolarHBondContact O-N 3.03Å; E376-A391 PolarHBondContact O-N 3Å; E376-A391 VanDerWaalsContact O-N 3.13Å; Y389-A391 PolarHBondContact O-N 2.89Å; A391-S395 WeakPolarHBondContact O-CB 3.49Å; A391-S395 PolarHBondContact O-OG 3.23Å
392	G	68.3	Low	80.2	Confident	2 Å²	2	33.4 Å²	33.4	2%	0.021	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-27.1	175.7	0	0	0	0	0	113.4	E376 G390 S395 S396	E376-G392 WeakPolarHBondContact O-CA 3.27Å; E376-G392 PolarHBondContact O-N 3.21Å; G390-G392 VanDerWaalsContact C-N 3.31Å; G390-G392 PolarHBondContact O-N 2.64Å; G392-S395 VanDerWaalsContact C-OG 3.25Å; G392-S395 WeakPolarHBondContact CA-OG 3.15Å; G392-S395 PolarHBondContact O-OG 2.76Å; G392-S396 WeakPolarHBondContact O-CB 3.32Å
393	L	75.4	Confident	80.3	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-48.6	171.9	-66.3	176.9	0	0	0	111.2	F377 L379 A388 G390 S395 S396 E399 L400 A403 Y432	F377-L393 HydrophobicContact CD1-CD2 3.89Å; F377-L393 HydrophobicContact CD1-CG 3.98Å; L379-L393 HydrophobicContact CD2-CD1 3.53Å; L379-L393 HydrophobicContact CG-CD1 4.31Å; A388-L393 HydrophobicContact CB-CB 3.97Å; A388-L393 HydrophobicContact CB-CD1 3.98Å; G390-L393 PolarHBondContact O-N 3.28Å; G390-L393 VanDerWaalsContact O-N 3.13Å; L393-S395 PolarHBondContact O-N 3.31Å; L393-S396 PolarHBondContact O-N 3.32Å; L393-E399 HydrophobicContact CD2-CB 4.32Å; L393-E399 HydrophobicContact CD2-CG 3.86Å; L393-L400 HydrophobicContact CB-CD1 4.24Å; L393-L400 WeakPolarHBondContact O-CB 3.49Å; L393-A403 HydrophobicContact CD1-CB 4.27Å; L393-A403 HydrophobicContact CD2-CB 3.67Å; L393-Y432 HydrophobicContact CD1-CD1 4.47Å; L393-Y432 HydrophobicContact CD2-CD1 4.4Å; L393-Y432 HydrophobicContact CD2-CE1 3.87Å
394	L	74.6	Confident	80.4	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	3.8	-175.4	-69.2	175.6	0	0	0	114.8	Y250 A254 Y258 N335 A388 G390	Y250-L394 HydrophobicContact CD1-CD2 4.24Å; Y250-L394 HydrophobicContact CE1-CB 4.37Å; Y250-L394 HydrophobicContact CE1-CD2 4.16Å; Y250-L394 VanDerWaalsContact CE1-O 3.26Å; Y250-L394 WeakPolarHBondContact CE1-O 3.44Å; Y250-L394 PolarHBondContact OH-O 3.34Å; A254-L394 HydrophobicContact CB-CD2 3.57Å; Y258-L394 HydrophobicContact CD2-CD1 3.63Å; Y258-L394 HydrophobicContact CE2-CD1 4Å; Y258-L394 HydrophobicContact CG-CD1 4.1Å; N335-L394 PolarHBondContact ND2-O 2.98Å; N335-L394 VanDerWaalsContact ND2-O 3.08Å; A388-L394 HydrophobicContact CB-CD2 4.2Å; G390-L394 WeakPolarHBondContact O-CG 3.4Å; G390-L394 PolarHBondContact O-N 3.35Å
395	S	71.8	Confident	80.7	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.2	-9.4	-171.7	67.6	0	0	0	0	112.3	I331 S333 A391 G392 L393	I331-S395 WeakPolarHBondContact CG2-O 3.37Å; I331-S395 CarbonylContact O-C 3.57Å; S333-S395 VanDerWaalsContact C-OG 3.27Å; S333-S395 PolarHBondContact N-O 3.2Å; S333-S395 WeakPolarHBondContact O-CB 3.36Å; S333-S395 PolarHBondContact O-OG 3.16Å; A391-S395 WeakPolarHBondContact O-CB 3.49Å; A391-S395 PolarHBondContact O-OG 3.23Å; G392-S395 VanDerWaalsContact C-OG 3.25Å; G392-S395 WeakPolarHBondContact CA-OG 3.15Å; G392-S395 PolarHBondContact O-OG 2.76Å; L393-S395 PolarHBondContact O-N 3.31Å
396	S	74.2	Confident	80.5	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.146	C	C	.	.			trans	-116.7	108.7	-179.1	-172.1	0	0	0	0	111.4	I331 G392 L393 G398 E399 L400	I331-S396 PolarHBondContact N-OG 2.94Å; I331-S396 WeakPolarHBondContact O-CA 3.25Å; I331-S396 WeakPolarHBondContact O-CB 3.39Å; I331-S396 PolarHBondContact O-N 3.22Å; I331-S396 PolarHBondContact O-OG 3.34Å; G392-S396 WeakPolarHBondContact O-CB 3.32Å; L393-S396 PolarHBondContact O-N 3.32Å; S396-G398 VanDerWaalsContact C-N 3.33Å; S396-G398 PolarHBondContact O-N 3.29Å; S396-E399 PolarHBondContact O-N 3.2Å; S396-E399 VanDerWaalsContact OG-CB 3.29Å; S396-E399 WeakPolarHBondContact OG-CB 3.45Å; S396-E399 PolarHBondContact OG-N 3.43Å; S396-L400 WeakPolarHBondContact O-CB 3.19Å; S396-L400 PolarHBondContact O-N 2.72Å
397	I	77.1	Confident	80.1	Confident	18 Å²	18	34.8 Å²	34.8	9%	0.092	17%	0.168	C	C	.	.	H	α-helix	trans	-59.5	-46	180	-58.1	170.8	0	0	0	110.7	E245 L246 L249 I331 R401	E245-I397 HydrophobicContact CB-CD1 3.39Å; E245-I397 HydrophobicContact CB-CG1 4.26Å; E245-I397 HydrophobicContact CG-CD1 4.14Å; L246-I397 HydrophobicContact CD2-CG1 3.68Å; L246-I397 HydrophobicContact CG-CG1 4.02Å; L249-I397 HydrophobicContact CD1-CG2 3.89Å; I331-I397 HydrophobicContact CD1-CB 4.16Å; I331-I397 HydrophobicContact CD1-CD1 3.56Å; I331-I397 HydrophobicContact CD1-CG1 3.92Å; I397-R401 WeakPolarHBondContact O-CG 3.03Å; I397-R401 PolarHBondContact O-N 3.07Å
398	G	79.9	Confident	80.1	Confident	18 Å²	18	33.1 Å²	33.1	19%	0.186	17%	0.165	C	C	.	.	H	α-helix	trans	-67.9	-47	-179	0	0	0	0	0	112.5	L329 S396 R401 H402	L329-G398 WeakPolarHBondContact O-CA 3.28Å; L329-G398 PolarHBondContact O-N 3.23Å; S396-G398 VanDerWaalsContact C-N 3.33Å; S396-G398 PolarHBondContact O-N 3.29Å; G398-R401 PolarHBondContact O-N 3.37Å; G398-H402 WeakPolarHBondContact O-CB 3.48Å; G398-H402 PolarHBondContact O-N 3.19Å
399	E	80.6	Confident	80.3	Confident	4 Å²	4	35.9 Å²	35.9	2%	0.019	18%	0.184	C	C	.	.	H	α-helix	trans	-74.5	-34.6	-175.6	-155.3	163.8	-175.5	0	0	112.1	F377 L393 S396 R401 H402 A403 F428 Q429	F377-E399 HydrophobicContact CE1-CG 4.43Å; F377-E399 WeakPolarHBondContact CE1-OE1 3.37Å; F377-E399 WeakPolarHBondContact CE1-OE2 3.33Å; L393-E399 HydrophobicContact CD2-CB 4.32Å; L393-E399 HydrophobicContact CD2-CG 3.86Å; S396-E399 PolarHBondContact O-N 3.2Å; S396-E399 VanDerWaalsContact OG-CB 3.29Å; S396-E399 WeakPolarHBondContact OG-CB 3.45Å; S396-E399 PolarHBondContact OG-N 3.43Å; E399-R401 VanDerWaalsContact C-N 3.33Å; E399-R401 PolarHBondContact O-N 3.22Å; E399-H402 PolarHBondContact O-N 3.44Å; E399-A403 VanDerWaalsContact O-CB 3.25Å; E399-A403 WeakPolarHBondContact O-CB 3.41Å; E399-A403 PolarHBondContact O-N 3.36Å; E399-F428 HydrophobicContact CB-CD1 3.9Å; E399-F428 HydrophobicContact CB-CE1 3.97Å; E399-F428 HydrophobicContact CG-CD1 3.72Å; E399-F428 HydrophobicContact CG-CE1 4.32Å; E399-F428 HydrophobicContact CG-CG 4.39Å; E399-Q429 PolarHBondContact OE1-NE2 2.77Å
400	L	80.6	Confident	80.9	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-59.5	-43.9	172.9	-172.3	58.4	0	0	0	112.2	L249 H253 A388 L393 S396	L249-L400 HydrophobicContact CB-CD2 4.01Å; L249-L400 HydrophobicContact CD1-CD2 4.33Å; H253-L400 HydrophobicContact CB-CD1 3.83Å; H253-L400 HydrophobicContact CB-CD2 3.9Å; H253-L400 HydrophobicContact CB-CG 3.77Å; A388-L400 HydrophobicContact CB-CD1 3.5Å; L393-L400 HydrophobicContact CB-CD1 4.24Å; L393-L400 WeakPolarHBondContact O-CB 3.49Å; S396-L400 WeakPolarHBondContact O-CB 3.19Å; S396-L400 PolarHBondContact O-N 2.72Å
401	R	86.6	Confident	81.8	Confident	134 Å²	134	42.5 Å²	42.5	51%	0.506	22%	0.217	S	C	.	.	H	α-helix	trans	-68.2	-39.1	176.6	-73.6	178.9	177.4	-173.2	2	111.5	L249 I397 G398 E399 S405	L249-R401 HydrophobicContact CD1-CG 4.19Å; I397-R401 WeakPolarHBondContact O-CG 3.03Å; I397-R401 PolarHBondContact O-N 3.07Å; G398-R401 PolarHBondContact O-N 3.37Å; E399-R401 VanDerWaalsContact C-N 3.33Å; E399-R401 PolarHBondContact O-N 3.22Å; R401-S405 WeakPolarHBondContact O-CB 3.16Å; R401-S405 PolarHBondContact O-N 3.43Å
402	H	87.1	Confident	82.9	Confident	47 Å²	47	46.9 Å²	46.9	22%	0.218	24%	0.238	C	C	.	.	H	α-helix	trans	-68.4	-48.6	179.8	-179.2	65.2	0	0	0	111.8	G398 E399 L404 S405 A408 F428 Y432	G398-H402 WeakPolarHBondContact O-CB 3.48Å; G398-H402 PolarHBondContact O-N 3.19Å; E399-H402 PolarHBondContact O-N 3.44Å; H402-L404 PolarHBondContact O-N 3.2Å; H402-S405 WeakPolarHBondContact O-CB 3.26Å; H402-S405 PolarHBondContact O-N 3.09Å; H402-S405 PolarHBondContact O-OG 3.17Å; H402-A408 VanDerWaalsContact O-CB 3.31Å; H402-A408 WeakPolarHBondContact O-CB 3.49Å; H402-F428 HydrophobicContact CB-CD2 4.13Å; H402-F428 HydrophobicContact CB-CE2 4.3Å; H402-F428 AromaticContact CD2-CD2 3.89Å; H402-F428 AromaticContact CG-CD2 3.84Å; H402-Y432 PolarHBondContact CD2-OH 3.46Å
403	A	86.4	Confident	83.8	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.6	-26.7	-176.4	0	0	0	0	0	113.9	L393 E399 Y432	L393-A403 HydrophobicContact CD1-CB 4.27Å; L393-A403 HydrophobicContact CD2-CB 3.67Å; E399-A403 VanDerWaalsContact O-CB 3.25Å; E399-A403 WeakPolarHBondContact O-CB 3.41Å; E399-A403 PolarHBondContact O-N 3.36Å; A403-Y432 HydrophobicContact CB-CD1 3.91Å; A403-Y432 HydrophobicContact CB-CD2 4.26Å; A403-Y432 HydrophobicContact CB-CE1 3.68Å; A403-Y432 HydrophobicContact CB-CE2 4.06Å; A403-Y432 HydrophobicContact CB-CG 4.2Å
404	L	87.4	Confident	84.5	Confident	43 Å²	43	49.2 Å²	49.2	23%	0.225	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	7.6	175.8	-63.8	-176.1	0	0	0	113.6	H253 L379 L386 H402	H253-L404 HydrophobicContact CB-CD1 3.58Å; H253-L404 WeakPolarHBondContact O-CD1 3.47Å; L379-L404 HydrophobicContact CD2-CD2 4.03Å; L386-L404 HydrophobicContact CB-CD2 3.63Å; H402-L404 PolarHBondContact O-N 3.2Å
405	S	88.1	Confident	84.9	Confident	41 Å²	41	49.2 Å²	49.2	29%	0.287	25%	0.251	S	S	.	.	S	Bend	trans	-89.7	158.7	173.7	74.3	0	0	0	0	111.7	R401 H402 K407 A408	R401-S405 WeakPolarHBondContact O-CB 3.16Å; R401-S405 PolarHBondContact O-N 3.43Å; H402-S405 WeakPolarHBondContact O-CB 3.26Å; H402-S405 PolarHBondContact O-N 3.09Å; H402-S405 PolarHBondContact O-OG 3.17Å; S405-K407 PolarHBondContact O-N 3.2Å; S405-K407 PolarHBondContact OG-N 3.14Å; S405-A408 PolarHBondContact O-N 3.16Å; S405-A408 VanDerWaalsContact O-N 3.1Å
406	D	84.3	Confident	85.5	Confident	175 Å²	175	55.8 Å²	55.8	94%	0.936	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-10.6	176.3	-55.8	-40.4	0	0	0	113.9
407	K	84.6	Confident	86.1	Confident	183 Å²	183	59.4 Å²	59.4	80%	0.796	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-19.3	178.2	-61.2	-176.2	-178.7	-178.8	0	112.9	S405	S405-K407 PolarHBondContact O-N 3.2Å; S405-K407 PolarHBondContact OG-N 3.14Å
408	A	87.4	Confident	86.5	Confident	15 Å²	15	58.6 Å²	58.6	12%	0.124	30%	0.297	C	S	.	.	S	Bend	trans	-82.5	136.7	-178	0	0	0	0	0	111.2	H402 S405 V410 Y432	H402-A408 VanDerWaalsContact O-CB 3.31Å; H402-A408 WeakPolarHBondContact O-CB 3.49Å; S405-A408 PolarHBondContact O-N 3.16Å; S405-A408 VanDerWaalsContact O-N 3.1Å; A408-V410 PolarHBondContact O-N 3.34Å; A408-Y432 HydrophobicContact CB-CD2 3.89Å; A408-Y432 HydrophobicContact CB-CE2 3.89Å
409	C	89.3	Confident	86.5	Confident	58 Å²	58	58.1 Å²	58.1	39%	0.392	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	114	171.8	-170.5	0	0	0	0	109.3	D430 V431 Y432	C409-D430 VanDerWaalsContact CB-O 3.27Å; C409-D430 WeakPolarHBondContact CB-O 3.29Å; C409-V431 HydrophobicContact CB-CG2 4.27Å; C409-V431 CarbonylContact O-C 3.5Å; C409-V431 WeakPolarHBondContact O-CA 3.42Å; C409-Y432 PolarHBondContact O-N 3.19Å
410	V	91.7	Very high	86.7	Confident	49 Å²	49	63.8 Å²	63.8	30%	0.297	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	126.8	178.1	-175.3	0	0	0	0	109.6	L379 L386 A408 Y432 V434	L379-V410 HydrophobicContact CD1-CG1 4.16Å; L379-V410 HydrophobicContact CD1-CG2 4.06Å; L386-V410 HydrophobicContact CD1-CG1 4.41Å; L386-V410 HydrophobicContact CD1-CG2 4.26Å; A408-V410 PolarHBondContact O-N 3.34Å; V410-Y432 WeakPolarHBondContact CA-O 3.11Å; V410-V434 HydrophobicContact CG1-CB 3.85Å; V410-V434 HydrophobicContact CG1-CG1 3.78Å
411	K	92.6	Very high	86.8	Confident	105 Å²	105	66.2 Å²	66.2	46%	0.457	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	155.8	177.7	-65.7	-174.4	-174.1	173.6	0	111.1	V431 Y432 F433 V434	K411-V431 HydrophobicContact CB-CG1 4.26Å; K411-V431 HydrophobicContact CD-CG1 3.85Å; K411-V431 HydrophobicContact CG-CG1 3.93Å; K411-Y432 PolarHBondContact N-O 3.34Å; K411-F433 HydrophobicContact CB-CD1 4.22Å; K411-F433 HydrophobicContact CB-CE1 4.22Å; K411-F433 CarbonylContact O-C 3.56Å; K411-F433 VanDerWaalsContact O-CA 3.27Å; K411-F433 WeakPolarHBondContact O-CA 3.37Å; K411-V434 PolarHBondContact O-N 2.86Å
412	M	92.1	Very high	86.6	Confident	92 Å²	92	65.7 Å²	65.7	45%	0.453	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	137.1	172.2	-72.3	-56.4	-53.7	0	0	110.8	D414 V434 E436	M412-D414 PolarHBondContact O-N 3.15Å; M412-V434 HydrophobicContact SD-CG1 3.63Å; M412-E436 HydrophobicContact CE-CG 4.19Å
413	F	89.1	Confident	85.9	Confident	2 Å²	2	63.8 Å²	63.8	1%	0.009	33%	0.328	C	S	.	.			trans	-66.7	120.8	175.7	177.1	-111.9	0	0	0	111	T374 P415 T418 F433 V434 A441 K444 M445	T374-F413 HydrophobicContact CG2-CD1 4.45Å; T374-F413 HydrophobicContact CG2-CD2 3.69Å; T374-F413 HydrophobicContact CG2-CE1 4.12Å; T374-F413 HydrophobicContact CG2-CE2 3.29Å; T374-F413 HydrophobicContact CG2-CG 4.26Å; T374-F413 HydrophobicContact CG2-CZ 3.53Å; F413-P415 HydrophobicContact CE1-CG 3.94Å; F413-P415 HydrophobicContact CZ-CG 3.85Å; F413-T418 HydrophobicContact CD2-CG2 4.27Å; F413-T418 HydrophobicContact CE2-CG2 4.04Å; F413-F433 HydrophobicContact CB-CB 4.17Å; F413-F433 HydrophobicContact CD2-CB 4.2Å; F413-V434 WeakPolarHBondContact CB-O 3.41Å; F413-V434 PolarHBondContact N-O 2.78Å; F413-A441 HydrophobicContact CD1-CB 4.18Å; F413-A441 HydrophobicContact CE1-CB 4.25Å; F413-K444 HydrophobicContact CD1-CD 4.2Å; F413-K444 HydrophobicContact CE1-CB 4.32Å; F413-K444 PolarHBondContact O-NZ 2.77Å; F413-M445 HydrophobicContact CE1-CG 4.13Å; F413-M445 HydrophobicContact CE1-SD 4.44Å; F413-M445 HydrophobicContact CZ-CG 3.99Å; F413-M445 HydrophobicContact CZ-SD 3.8Å
414	D	88.6	Confident	85.2	Confident	49 Å²	49	65.4 Å²	65.4	26%	0.262	34%	0.336	S	S	.	.			trans	-139.6	115.1	170	168.9	16	0	0	0	108.2	M412 K416 T417 T418	M412-D414 PolarHBondContact O-N 3.15Å; D414-K416 PolarHBondContact O-N 3.49Å; D414-K416 PolarHBondContact OD1-N 3.08Å; D414-K416 VanDerWaalsContact OD1-N 3.08Å; D414-T417 PolarHBondContact O-N 2.94Å; D414-T417 PolarHBondContact O-OG1 3.36Å; D414-T417 VanDerWaalsContact O-OG1 3.05Å; D414-T418 WeakPolarHBondContact O-CB 3.42Å; D414-T418 PolarHBondContact O-N 3.41Å; D414-T418 PolarHBondContact O-OG1 2.97Å
415	P	82.9	Confident	84	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.006	34%	0.336	C	S	.	.	H	α-helix	trans	-51.2	-33.5	-178.3	-26.6	32.9	0	0	0	114.1	F413 T417 C419 K444 M445 F449	F413-P415 HydrophobicContact CE1-CG 3.94Å; F413-P415 HydrophobicContact CZ-CG 3.85Å; P415-T417 VanDerWaalsContact C-N 3.35Å; P415-T417 PolarHBondContact O-N 3.18Å; P415-C419 WeakPolarHBondContact O-CB 3.2Å; P415-C419 PolarHBondContact O-N 3.17Å; P415-C419 VanDerWaalsContact O-N 3.08Å; P415-C419 PolarHBondContact O-SG 3.29Å; P415-K444 HydrophobicContact CG-CB 3.84Å; P415-M445 HydrophobicContact CB-SD 4.04Å; P415-M445 HydrophobicContact CG-CG 4.49Å; P415-M445 HydrophobicContact CG-SD 3.84Å; P415-F449 HydrophobicContact CB-CB 3.9Å; P415-F449 HydrophobicContact CB-CD2 3.8Å; P415-F449 HydrophobicContact CB-CG 4.18Å; P415-F449 HydrophobicContact CG-CB 4.45Å
416	K	85.1	Confident	82.9	Confident	138 Å²	138	68.3 Å²	68.3	60%	0.6	35%	0.352	S	S	*	.	H	α-helix	trans	-68	-34.8	-178.4	-64.6	176	-175	168.5	0	112.6	D414 C419 N420	D414-K416 PolarHBondContact O-N 3.49Å; D414-K416 PolarHBondContact OD1-N 3.08Å; D414-K416 VanDerWaalsContact OD1-N 3.08Å; K416-C419 PolarHBondContact O-SG 3.08Å; K416-N420 PolarHBondContact O-ND2 3.1Å; K416-N420 VanDerWaalsContact O-ND2 3.1Å
417	T	86.3	Confident	82.3	Confident	76 Å²	76	63.3 Å²	63.3	47%	0.466	33%	0.328	S	S	.	.	H	α-helix	trans	-89.4	-44.6	178.5	59.1	0	0	0	0	111	D414 P415 C419 N420	D414-T417 PolarHBondContact O-N 2.94Å; D414-T417 PolarHBondContact O-OG1 3.36Å; D414-T417 VanDerWaalsContact O-OG1 3.05Å; P415-T417 VanDerWaalsContact C-N 3.35Å; P415-T417 PolarHBondContact O-N 3.18Å; T417-C419 VanDerWaalsContact C-N 3.28Å; T417-C419 PolarHBondContact O-N 3.16Å; T417-N420 PolarHBondContact O-N 3.48Å
418	T	85.1	Confident	82.1	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-60.9	-34.6	-178.8	-56.5	0	0	0	0	112.5	F373 F413 D414 N420 Q421 F433	F373-T418 HydrophobicContact CB-CG2 3.4Å; F373-T418 HydrophobicContact CD2-CG2 3.71Å; F373-T418 HydrophobicContact CG-CG2 3.85Å; F413-T418 HydrophobicContact CD2-CG2 4.27Å; F413-T418 HydrophobicContact CE2-CG2 4.04Å; D414-T418 WeakPolarHBondContact O-CB 3.42Å; D414-T418 PolarHBondContact O-N 3.41Å; D414-T418 PolarHBondContact O-OG1 2.97Å; T418-N420 PolarHBondContact O-N 3.5Å; T418-N420 VanDerWaalsContact O-N 3.16Å; T418-Q421 WeakPolarHBondContact O-CB 3.42Å; T418-Q421 PolarHBondContact O-N 2.64Å; T418-Q421 VanDerWaalsContact O-N 3.15Å; T418-F433 HydrophobicContact CG2-CD2 3.93Å; T418-F433 HydrophobicContact CG2-CE1 4.45Å; T418-F433 HydrophobicContact CG2-CE2 3.84Å; T418-F433 HydrophobicContact CG2-CG 4.24Å; T418-F433 HydrophobicContact CG2-CZ 4.1Å; T418-F433 VanDerWaalsContact OG1-CD1 3.25Å; T418-F433 WeakPolarHBondContact OG1-CD1 3.24Å; T418-F433 WeakPolarHBondContact OG1-CE1 3.48Å
419	C	81.4	Confident	81.7	Confident	8 Å²	8	57.6 Å²	57.6	5%	0.054	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-16.9	-179.4	69.6	0	0	0	0	114.9	K366 H369 P415 K416 T417 F449	K366-C419 HydrophobicContact CB-CB 3.61Å; K366-C419 HydrophobicContact CG-CB 3.83Å; H369-C419 PolarHBondContact ND1-O 2.64Å; P415-C419 WeakPolarHBondContact O-CB 3.2Å; P415-C419 PolarHBondContact O-N 3.17Å; P415-C419 VanDerWaalsContact O-N 3.08Å; P415-C419 PolarHBondContact O-SG 3.29Å; K416-C419 PolarHBondContact O-SG 3.08Å; T417-C419 VanDerWaalsContact C-N 3.28Å; T417-C419 PolarHBondContact O-N 3.16Å; C419-F449 HydrophobicContact CB-CE2 4.18Å
420	N	83.4	Confident	81.5	Confident	123 Å²	123	60.2 Å²	60.2	66%	0.658	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-4	178.6	-61.1	-49.1	0	0	0	112.7	K416 T417 T418	K416-N420 PolarHBondContact O-ND2 3.1Å; K416-N420 VanDerWaalsContact O-ND2 3.1Å; T417-N420 PolarHBondContact O-N 3.48Å; T418-N420 PolarHBondContact O-N 3.5Å; T418-N420 VanDerWaalsContact O-N 3.16Å
421	Q	84.1	Confident	81.4	Confident	51 Å²	51	58.5 Å²	58.5	24%	0.238	30%	0.301	C	S	.	.	S	Bend	trans	-74.4	133.1	-179.1	-176.6	64.2	39.9	0	0	110.6	F373 T418 F433	F373-Q421 HydrophobicContact CD2-CB 4.24Å; F373-Q421 HydrophobicContact CD2-CG 4.41Å; F373-Q421 HydrophobicContact CE1-CG 4.12Å; F373-Q421 HydrophobicContact CE2-CB 3.6Å; F373-Q421 HydrophobicContact CE2-CG 3.55Å; F373-Q421 HydrophobicContact CZ-CB 4.01Å; F373-Q421 HydrophobicContact CZ-CG 3.38Å; T418-Q421 WeakPolarHBondContact O-CB 3.42Å; T418-Q421 PolarHBondContact O-N 2.64Å; T418-Q421 VanDerWaalsContact O-N 3.15Å; Q421-F433 HydrophobicContact CB-CE2 4.28Å; Q421-F433 HydrophobicContact CB-CZ 4.3Å; Q421-F433 HydrophobicContact CG-CE2 4.11Å; Q421-F433 HydrophobicContact CG-CZ 4.37Å
422	E	80.6	Confident	81.3	Confident	123 Å²	123	53.5 Å²	53.5	58%	0.575	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-70.8	130.8	175.8	-173	171.1	-169.8	0	0	110.7
423	C	73.6	Confident	81.2	Confident	7 Å²	7	49.5 Å²	49.5	5%	0.047	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-88.6	124.8	178.6	-59.4	0	0	0	0	110	F25 H369 F372 F373	F25-C423 HydrophobicContact CD2-CB 4.33Å; F25-C423 WeakPolarHBondContact CD2-O 3.16Å; F25-C423 HydrophobicContact CE2-CB 3.81Å; F25-C423 WeakPolarHBondContact CE2-O 3.21Å; F25-C423 HydrophobicContact CZ-CB 4.32Å; H369-C423 PolarHBondContact CD2-SG 2.67Å; F372-C423 HydrophobicContact CD1-CB 3.84Å; F372-C423 WeakPolarHBondContact CD1-SG 3.41Å; F372-C423 HydrophobicContact CE1-CB 3.73Å; F372-C423 HydrophobicContact CE2-CB 4.41Å; F372-C423 HydrophobicContact CG-CB 4.24Å; F372-C423 HydrophobicContact CZ-CB 4.02Å; F373-C423 VanDerWaalsContact CE2-SG 3.58Å
424	L	72.4	Confident	81.4	Confident	34 Å²	34	49.8 Å²	49.8	18%	0.178	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-96.2	123.4	176.1	-58.5	177.3	0	0	0	109.2	Q429 D430	L424-Q429 VanDerWaalsContact N-OE1 3.14Å; L424-Q429 PolarHBondContact O-NE2 3.07Å; L424-Q429 PolarHBondContact O-OE1 3.26Å; L424-D430 HydrophobicContact CD1-CB 4.48Å
425	I	61.4	Low	81.3	Confident	43 Å²	43	47.5 Å²	47.5	22%	0.221	25%	0.249	C	C	.	.	S	Bend	trans	-95.5	-29.8	178.6	-38.9	-177	0	0	0	112	M24 F25	M24-I425 HydrophobicContact CB-CD1 3.41Å; M24-I425 VanDerWaalsContact CB-CD1 3.41Å; M24-I425 HydrophobicContact CE-CD1 3.66Å; M24-I425 HydrophobicContact CG-CD1 3.76Å; F25-I425 HydrophobicContact CD2-CD1 3.99Å; F25-I425 HydrophobicContact CD2-CG1 3.9Å; F25-I425 HydrophobicContact CE1-CD1 3.87Å; F25-I425 HydrophobicContact CE1-CG1 4.47Å; F25-I425 HydrophobicContact CE2-CB 4.43Å; F25-I425 HydrophobicContact CE2-CD1 3.19Å; F25-I425 HydrophobicContact CE2-CG1 2.95Å; F25-I425 HydrophobicContact CZ-CD1 3.09Å; F25-I425 HydrophobicContact CZ-CG1 3.32Å
426	T	64.1	Low	81.4	Confident	102 Å²	102	51.7 Å²	51.7	63%	0.626	27%	0.268	S	S	*	.	S	Bend	trans	-99	-18.3	-166.5	51	0	0	0	0	112.9
427	T	72.8	Confident	81	Confident	71 Å²	71	47.4 Å²	47.4	44%	0.436	26%	0.255	S	S	.	.	S	Bend	trans	-127.4	167.7	-179.8	57.7	0	0	0	0	109.9
428	F	79.5	Confident	80.3	Confident	73 Å²	73	45 Å²	45	32%	0.32	24%	0.239	S	C	.	.			trans	-58.2	150.4	169.1	-58.5	-30.7	0	0	0	110.6	A330 E399 H402	A330-F428 HydrophobicContact CB-CE1 4.15Å; E399-F428 HydrophobicContact CB-CD1 3.9Å; E399-F428 HydrophobicContact CB-CE1 3.97Å; E399-F428 HydrophobicContact CG-CD1 3.72Å; E399-F428 HydrophobicContact CG-CE1 4.32Å; E399-F428 HydrophobicContact CG-CG 4.39Å; H402-F428 HydrophobicContact CB-CD2 4.13Å; H402-F428 HydrophobicContact CB-CE2 4.3Å; H402-F428 AromaticContact CD2-CD2 3.89Å; H402-F428 AromaticContact CG-CD2 3.84Å
429	Q	79.9	Confident	79.7	Confident	4 Å²	4	50.2 Å²	50.2	2%	0.019	26%	0.263	C	S	.	.			trans	-67.6	137.7	177	-48.3	-48.9	-53.9	0	0	110.6	F377 E399 L424 V431 Y432	F377-Q429 HydrophobicContact CB-CG 4.38Å; F377-Q429 HydrophobicContact CD1-CG 4.18Å; F377-Q429 HydrophobicContact CG-CG 4.13Å; E399-Q429 PolarHBondContact OE1-NE2 2.77Å; L424-Q429 VanDerWaalsContact N-OE1 3.14Å; L424-Q429 PolarHBondContact O-NE2 3.07Å; L424-Q429 PolarHBondContact O-OE1 3.26Å; Q429-V431 VanDerWaalsContact C-N 3.28Å; Q429-Y432 HydrophobicContact CB-CD1 4.3Å; Q429-Y432 HydrophobicContact CB-CE1 3.72Å; Q429-Y432 HydrophobicContact CB-CE2 4.15Å; Q429-Y432 HydrophobicContact CG-CD1 4.46Å; Q429-Y432 HydrophobicContact CG-CE1 3.81Å; Q429-Y432 PolarHBondContact N-OH 3.22Å; Q429-Y432 VanDerWaalsContact N-OH 3.16Å; Q429-Y432 VanDerWaalsContact O-CE2 3.26Å; Q429-Y432 WeakPolarHBondContact O-CE2 3.48Å; Q429-Y432 PolarHBondContact O-OH 3.01Å
430	D	84.8	Confident	79.5	Confident	114 Å²	114	52 Å²	52	61%	0.61	27%	0.271	S	S	*	.	S	Bend	trans	-69.1	-31.5	173.1	-68.2	-26.5	0	0	0	111.6	C409 L424	C409-D430 VanDerWaalsContact CB-O 3.27Å; C409-D430 WeakPolarHBondContact CB-O 3.29Å; L424-D430 HydrophobicContact CD1-CB 4.48Å
431	V	89.8	Confident	79.1	Confident	13 Å²	13	46.1 Å²	46.1	8%	0.079	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	132.4	-176.7	-176.5	0	0	0	0	110.2	C409 K411 Q429 F433	C409-V431 HydrophobicContact CB-CG2 4.27Å; C409-V431 CarbonylContact O-C 3.5Å; C409-V431 WeakPolarHBondContact O-CA 3.42Å; K411-V431 HydrophobicContact CB-CG1 4.26Å; K411-V431 HydrophobicContact CD-CG1 3.85Å; K411-V431 HydrophobicContact CG-CG1 3.93Å; Q429-V431 VanDerWaalsContact C-N 3.28Å; V431-F433 HydrophobicContact CG1-CE2 4.16Å; V431-F433 HydrophobicContact CG1-CZ 4.18Å
432	Y	90.2	Very high	78.3	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	148.8	171	-58.5	-89	0	0	0	110	L379 L393 H402 A403 A408 C409 V410 K411 Q429	L379-Y432 HydrophobicContact CD1-CG 4.32Å; L393-Y432 HydrophobicContact CD1-CD1 4.47Å; L393-Y432 HydrophobicContact CD2-CD1 4.4Å; L393-Y432 HydrophobicContact CD2-CE1 3.87Å; H402-Y432 PolarHBondContact CD2-OH 3.46Å; A403-Y432 HydrophobicContact CB-CD1 3.91Å; A403-Y432 HydrophobicContact CB-CD2 4.26Å; A403-Y432 HydrophobicContact CB-CE1 3.68Å; A403-Y432 HydrophobicContact CB-CE2 4.06Å; A403-Y432 HydrophobicContact CB-CG 4.2Å; A408-Y432 HydrophobicContact CB-CD2 3.89Å; A408-Y432 HydrophobicContact CB-CE2 3.89Å; C409-Y432 PolarHBondContact O-N 3.19Å; V410-Y432 WeakPolarHBondContact CA-O 3.11Å; K411-Y432 PolarHBondContact N-O 3.34Å; Q429-Y432 HydrophobicContact CB-CD1 4.3Å; Q429-Y432 HydrophobicContact CB-CE1 3.72Å; Q429-Y432 HydrophobicContact CB-CE2 4.15Å; Q429-Y432 HydrophobicContact CG-CD1 4.46Å; Q429-Y432 HydrophobicContact CG-CE1 3.81Å; Q429-Y432 PolarHBondContact N-OH 3.22Å; Q429-Y432 VanDerWaalsContact N-OH 3.16Å; Q429-Y432 VanDerWaalsContact O-CE2 3.26Å; Q429-Y432 WeakPolarHBondContact O-CE2 3.48Å; Q429-Y432 PolarHBondContact O-OH 3.01Å
433	F	91	Very high	77.8	Confident	7 Å²	7	45 Å²	45	3%	0.031	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	130.3	179.1	-67.4	-89.7	0	0	0	111.1	F373 L379 K411 F413 T418 Q421 V431	F373-F433 HydrophobicContact CB-CD2 3.61Å; F373-F433 HydrophobicContact CB-CE2 4.15Å; F373-F433 HydrophobicContact CB-CG 4.43Å; F373-F433 AromaticContact CD1-CD2 3.62Å; F373-F433 HydrophobicContact CD1-CD2 3.62Å; F373-F433 AromaticContact CD1-CE2 3.77Å; F373-F433 HydrophobicContact CD1-CE2 3.77Å; F373-F433 HydrophobicContact CD2-CD2 4.45Å; F373-F433 HydrophobicContact CD2-CE2 4.15Å; F373-F433 HydrophobicContact CE1-CD2 4.45Å; F373-F433 HydrophobicContact CE1-CE2 4.22Å; F373-F433 AromaticContact CG-CD2 3.63Å; F373-F433 HydrophobicContact CG-CD2 3.63Å; F373-F433 AromaticContact CG-CE2 3.74Å; F373-F433 HydrophobicContact CG-CE2 3.74Å; L379-F433 PolarHBondContact N-O 3.29Å; K411-F433 HydrophobicContact CB-CD1 4.22Å; K411-F433 HydrophobicContact CB-CE1 4.22Å; K411-F433 CarbonylContact O-C 3.56Å; K411-F433 VanDerWaalsContact O-CA 3.27Å; K411-F433 WeakPolarHBondContact O-CA 3.37Å; F413-F433 HydrophobicContact CB-CB 4.17Å; F413-F433 HydrophobicContact CD2-CB 4.2Å; T418-F433 HydrophobicContact CG2-CD2 3.93Å; T418-F433 HydrophobicContact CG2-CE1 4.45Å; T418-F433 HydrophobicContact CG2-CE2 3.84Å; T418-F433 HydrophobicContact CG2-CG 4.24Å; T418-F433 HydrophobicContact CG2-CZ 4.1Å; T418-F433 VanDerWaalsContact OG1-CD1 3.25Å; T418-F433 WeakPolarHBondContact OG1-CD1 3.24Å; T418-F433 WeakPolarHBondContact OG1-CE1 3.48Å; Q421-F433 HydrophobicContact CB-CE2 4.28Å; Q421-F433 HydrophobicContact CB-CZ 4.3Å; Q421-F433 HydrophobicContact CG-CE2 4.11Å; Q421-F433 HydrophobicContact CG-CZ 4.37Å; V431-F433 HydrophobicContact CG1-CE2 4.16Å; V431-F433 HydrophobicContact CG1-CZ 4.18Å
434	V	91.8	Very high	77.9	Confident	9 Å²	9	46.6 Å²	46.6	6%	0.055	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	139.2	177.9	68.1	0	0	0	0	111.6	L379 K381 L386 V410 K411 M412 F413	L379-V434 HydrophobicContact CB-CB 4.17Å; L379-V434 HydrophobicContact CB-CG2 4.24Å; L379-V434 CarbonylContact O-C 3.6Å; L379-V434 VanDerWaalsContact O-CA 3.26Å; L379-V434 WeakPolarHBondContact O-CA 3.38Å; K381-V434 HydrophobicContact CB-CG2 4.22Å; L386-V434 HydrophobicContact CD2-CB 4.27Å; L386-V434 HydrophobicContact CD2-CG2 3.64Å; V410-V434 HydrophobicContact CG1-CB 3.85Å; V410-V434 HydrophobicContact CG1-CG1 3.78Å; K411-V434 PolarHBondContact O-N 2.86Å; M412-V434 HydrophobicContact SD-CG1 3.63Å; F413-V434 WeakPolarHBondContact CB-O 3.41Å; F413-V434 PolarHBondContact N-O 2.78Å
435	S	87.2	Confident	77.8	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.007	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	144.5	170.9	49.6	0	0	0	0	110.3	L379 C380 K381 S437	L379-S435 PolarHBondContact O-N 3.08Å; L379-S435 PolarHBondContact O-OG 3.15Å; C380-S435 VanDerWaalsContact CA-O 3.27Å; C380-S435 WeakPolarHBondContact CA-O 3.24Å; K381-S435 PolarHBondContact N-O 3.16Å; S435-S437 VanDerWaalsContact C-N 3.34Å
436	E	85.8	Confident	77.8	Confident	88 Å²	88	44.7 Å²	44.7	41%	0.411	23%	0.232	S	C	.	.	S	Bend	trans	-73.5	-33.8	175.2	-65.5	-72.4	167.9	0	0	110	K381 M412 E440	K381-E436 IonicContact NZ-OE1 2.77Å; K381-E436 PolarHBondContact NZ-OE1 3.27Å; M412-E436 HydrophobicContact CE-CG 4.19Å; E436-E440 VanDerWaalsContact CB-OE2 3.25Å; E436-E440 WeakPolarHBondContact CB-OE2 3.3Å; E436-E440 PolarHBondContact N-OE2 2.86Å
437	S	77	Confident	77.7	Confident	48 Å²	48	46.8 Å²	46.8	34%	0.336	23%	0.229	S	C	.	.			trans	-150.6	160.6	173	68.9	0	0	0	0	113.1	S435 E439 E440 A441	S435-S437 VanDerWaalsContact C-N 3.34Å; S437-E439 PolarHBondContact O-N 3.4Å; S437-E440 PolarHBondContact O-N 3.35Å; S437-E440 WeakPolarHBondContact OG-CB 3.46Å; S437-E440 PolarHBondContact OG-N 3.43Å; S437-E440 VanDerWaalsContact OG-N 3.09Å; S437-A441 PolarHBondContact O-N 3.04Å; S437-A441 VanDerWaalsContact O-N 3.14Å
438	F	71.2	Confident	77.3	Confident	26 Å²	26	47.6 Å²	47.6	11%	0.114	23%	0.227	C	C	.	.	H	α-helix	trans	-61.8	-32.2	172.6	-60.9	-77	0	0	0	111.9	E257 K339 C380 Y389 A441 K442	E257-F438 WeakPolarHBondContact OE1-CE2 3.39Å; K339-F438 HydrophobicContact CD-CE1 4.31Å; K339-F438 HydrophobicContact CD-CZ 4.27Å; C380-F438 HydrophobicContact CB-CZ 4.2Å; Y389-F438 AromaticContact CD1-CE1 3.74Å; Y389-F438 HydrophobicContact CD1-CE1 3.74Å; Y389-F438 AromaticContact CD1-CZ 3.99Å; Y389-F438 HydrophobicContact CD1-CZ 3.99Å; Y389-F438 AromaticContact CD2-CE1 3.72Å; Y389-F438 HydrophobicContact CD2-CE1 3.72Å; Y389-F438 HydrophobicContact CE1-CE1 4.09Å; Y389-F438 HydrophobicContact CE2-CE1 4.08Å; Y389-F438 AromaticContact CG-CE1 3.53Å; Y389-F438 HydrophobicContact CG-CE1 3.53Å; Y389-F438 AromaticContact CG-CZ 3.91Å; Y389-F438 HydrophobicContact CG-CZ 3.91Å; F438-A441 PolarHBondContact O-N 3.1Å; F438-K442 VanDerWaalsContact O-CB 3.3Å; F438-K442 WeakPolarHBondContact O-CB 3.5Å; F438-K442 PolarHBondContact O-N 2.81Å
439	E	72.9	Confident	76.8	Confident	110 Å²	110	44.5 Å²	44.5	51%	0.514	21%	0.214	S	C	.	.	H	α-helix	trans	-70.1	-42.4	-179.7	-86.9	23.8	-121.5	0	0	111.1	S437 K442 E443	S437-E439 PolarHBondContact O-N 3.4Å; E439-K442 PolarHBondContact O-N 3.31Å; E439-K442 IonicContact OE1-NZ 2.64Å; E439-K442 PolarHBondContact OE1-NZ 2.94Å; E439-E443 WeakPolarHBondContact O-CB 3.42Å; E439-E443 PolarHBondContact O-N 2.87Å
440	E	77.2	Confident	76.2	Confident	45 Å²	45	44.8 Å²	44.8	21%	0.21	22%	0.217	C	C	.	.	H	α-helix	trans	-61.1	-46.8	173.1	-175.2	-155.5	168.9	0	0	110.9	E436 S437 K442 E443 K444	E436-E440 VanDerWaalsContact CB-OE2 3.25Å; E436-E440 WeakPolarHBondContact CB-OE2 3.3Å; E436-E440 PolarHBondContact N-OE2 2.86Å; S437-E440 PolarHBondContact O-N 3.35Å; S437-E440 WeakPolarHBondContact OG-CB 3.46Å; S437-E440 PolarHBondContact OG-N 3.43Å; S437-E440 VanDerWaalsContact OG-N 3.09Å; E440-K442 VanDerWaalsContact C-N 3.34Å; E440-K442 PolarHBondContact O-N 3.29Å; E440-E443 PolarHBondContact O-N 3Å; E440-E443 VanDerWaalsContact O-N 3.14Å; E440-K444 HydrophobicContact CG-CD 4.31Å; E440-K444 WeakPolarHBondContact O-CG 3.28Å; E440-K444 PolarHBondContact O-N 2.91Å; E440-K444 VanDerWaalsContact OE1-CE 3.24Å; E440-K444 WeakPolarHBondContact OE1-CE 3.39Å; E440-K444 IonicContact OE1-NZ 3.87Å; E440-K444 PolarHBondContact OE1-NZ 2.75Å
441	A	73.7	Confident	75.4	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-64.6	-40.2	-179.6	0	0	0	0	0	111.5	Y343 F413 S437 F438 M445	Y343-A441 HydrophobicContact CE2-CB 3.83Å; Y343-A441 WeakPolarHBondContact OH-CB 3.4Å; Y343-A441 PolarHBondContact OH-O 3.38Å; F413-A441 HydrophobicContact CD1-CB 4.18Å; F413-A441 HydrophobicContact CE1-CB 4.25Å; S437-A441 PolarHBondContact O-N 3.04Å; S437-A441 VanDerWaalsContact O-N 3.14Å; F438-A441 PolarHBondContact O-N 3.1Å; A441-M445 WeakPolarHBondContact O-CB 3.34Å; A441-M445 VanDerWaalsContact O-CG 3.24Å; A441-M445 WeakPolarHBondContact O-CG 3.49Å; A441-M445 PolarHBondContact O-N 2.81Å
442	K	68.1	Low	74.5	Confident	63 Å²	63	50 Å²	50	27%	0.274	24%	0.242	S	C	.	.	H	α-helix	trans	-61.1	-41.5	170.8	-179.3	-174.9	73.2	-166.5	0	111.9	F438 E439 E440 S446	F438-K442 VanDerWaalsContact O-CB 3.3Å; F438-K442 WeakPolarHBondContact O-CB 3.5Å; F438-K442 PolarHBondContact O-N 2.81Å; E439-K442 PolarHBondContact O-N 3.31Å; E439-K442 IonicContact OE1-NZ 2.64Å; E439-K442 PolarHBondContact OE1-NZ 2.94Å; E440-K442 VanDerWaalsContact C-N 3.34Å; E440-K442 PolarHBondContact O-N 3.29Å; K442-S446 VanDerWaalsContact O-CB 3.22Å; K442-S446 WeakPolarHBondContact O-CB 3.41Å; K442-S446 PolarHBondContact O-N 2.94Å; K442-S446 PolarHBondContact O-OG 2.87Å
443	E	70.4	Confident	73.5	Confident	88 Å²	88	50.6 Å²	50.6	41%	0.411	25%	0.245	S	C	.	.	H	α-helix	trans	-66.6	-50.4	179.4	-173.2	173.1	176	0	0	111.6	E439 E440 M445 S446 R447	E439-E443 WeakPolarHBondContact O-CB 3.42Å; E439-E443 PolarHBondContact O-N 2.87Å; E440-E443 PolarHBondContact O-N 3Å; E440-E443 VanDerWaalsContact O-N 3.14Å; E443-M445 VanDerWaalsContact C-N 3.27Å; E443-M445 PolarHBondContact O-N 3.47Å; E443-S446 PolarHBondContact O-N 2.79Å; E443-S446 VanDerWaalsContact O-N 3.12Å; E443-S446 PolarHBondContact O-OG 2.78Å; E443-R447 HydrophobicContact CG-CB 4.36Å; E443-R447 HydrophobicContact CG-CG 4.04Å; E443-R447 WeakPolarHBondContact O-CB 3.36Å; E443-R447 PolarHBondContact O-N 3.35Å; E443-R447 WeakPolarHBondContact OE1-CD 3.24Å; E443-R447 IonicContact OE1-CZ 3.78Å; E443-R447 IonicContact OE1-NE 2.85Å; E443-R447 IonicContact OE1-NH1 3.61Å; E443-R447 PolarHBondContact OE1-NH1 2.64Å; E443-R447 IonicContact OE2-NH1 2.72Å
444	K	75.4	Confident	72.4	Confident	40 Å²	40	59.2 Å²	59.2	17%	0.174	28%	0.282	C	S	.	.	I	π-helix	trans	-55.2	-45.1	176.7	-77.1	177.2	166.9	173.4	0	111.6	F413 P415 E440 E448 F449	F413-K444 HydrophobicContact CD1-CD 4.2Å; F413-K444 HydrophobicContact CE1-CB 4.32Å; F413-K444 PolarHBondContact O-NZ 2.77Å; P415-K444 HydrophobicContact CG-CB 3.84Å; E440-K444 HydrophobicContact CG-CD 4.31Å; E440-K444 WeakPolarHBondContact O-CG 3.28Å; E440-K444 PolarHBondContact O-N 2.91Å; E440-K444 VanDerWaalsContact OE1-CE 3.24Å; E440-K444 WeakPolarHBondContact OE1-CE 3.39Å; E440-K444 IonicContact OE1-NZ 3.87Å; E440-K444 PolarHBondContact OE1-NZ 2.75Å; K444-E448 VanDerWaalsContact O-CB 3.28Å; K444-E448 WeakPolarHBondContact O-CB 3.4Å; K444-E448 PolarHBondContact O-N 3.42Å; K444-F449 PolarHBondContact O-N 2.64Å
445	M	69.9	Low	71.1	Confident	5 Å²	5	61.8 Å²	61.8	3%	0.025	29%	0.291	C	S	.	.	I	π-helix	trans	-62.9	-56.5	173.5	-70.6	-62.2	-80.7	0	0	110.5	Y348 L367 C370 F413 P415 A441 E443 F449 A450	Y348-M445 HydrophobicContact CD1-CE 4.2Å; Y348-M445 HydrophobicContact CD2-CB 4.33Å; Y348-M445 HydrophobicContact CE1-CB 4.16Å; Y348-M445 HydrophobicContact CE1-CE 3.47Å; Y348-M445 VanDerWaalsContact CE1-CE 3.47Å; Y348-M445 HydrophobicContact CE2-CB 3.55Å; Y348-M445 VanDerWaalsContact CZ-C 3.48Å; Y348-M445 VanDerWaalsContact CZ-CB 3.48Å; Y348-M445 WeakPolarHBondContact OH-CA 3.43Å; Y348-M445 PolarHBondContact OH-O 3.32Å; L367-M445 HydrophobicContact CD2-CE 4.17Å; C370-M445 HydrophobicContact CB-CE 3.5Å; C370-M445 VanDerWaalsContact CB-CE 3.5Å; C370-M445 HydrophobicContact CB-SD 3.83Å; F413-M445 HydrophobicContact CE1-CG 4.13Å; F413-M445 HydrophobicContact CE1-SD 4.44Å; F413-M445 HydrophobicContact CZ-CG 3.99Å; F413-M445 HydrophobicContact CZ-SD 3.8Å; P415-M445 HydrophobicContact CB-SD 4.04Å; P415-M445 HydrophobicContact CG-CG 4.49Å; P415-M445 HydrophobicContact CG-SD 3.84Å; A441-M445 WeakPolarHBondContact O-CB 3.34Å; A441-M445 VanDerWaalsContact O-CG 3.24Å; A441-M445 WeakPolarHBondContact O-CG 3.49Å; A441-M445 PolarHBondContact O-N 2.81Å; E443-M445 VanDerWaalsContact C-N 3.27Å; E443-M445 PolarHBondContact O-N 3.47Å; M445-F449 PolarHBondContact O-N 3.15Å; M445-F449 HydrophobicContact SD-CB 4.47Å; M445-A450 PolarHBondContact O-N 3.47Å
446	S	62.4	Low	70.1	Confident	32 Å²	32	65.4 Å²	65.4	22%	0.224	32%	0.315	C	S	.	.	I	π-helix	trans	-74.5	-32.4	-169.7	62.8	0	0	0	0	116.3	K442 E443	K442-S446 VanDerWaalsContact O-CB 3.22Å; K442-S446 WeakPolarHBondContact O-CB 3.41Å; K442-S446 PolarHBondContact O-N 2.94Å; K442-S446 PolarHBondContact O-OG 2.87Å; E443-S446 PolarHBondContact O-N 2.79Å; E443-S446 VanDerWaalsContact O-N 3.12Å; E443-S446 PolarHBondContact O-OG 2.78Å
447	R	61	Low	69.3	Low	146 Å²	146	62.8 Å²	62.8	55%	0.551	30%	0.302	S	S	*	.	I	π-helix	trans	-96.2	-31.9	-177.1	-68.4	-168	175.3	161.6	-5.7	112.7	E443 K451	E443-R447 HydrophobicContact CG-CB 4.36Å; E443-R447 HydrophobicContact CG-CG 4.04Å; E443-R447 WeakPolarHBondContact O-CB 3.36Å; E443-R447 PolarHBondContact O-N 3.35Å; E443-R447 WeakPolarHBondContact OE1-CD 3.24Å; E443-R447 IonicContact OE1-CZ 3.78Å; E443-R447 IonicContact OE1-NE 2.85Å; E443-R447 IonicContact OE1-NH1 3.61Å; E443-R447 PolarHBondContact OE1-NH1 2.64Å; E443-R447 IonicContact OE2-NH1 2.72Å; R447-K451 WeakPolarHBondContact O-CD 3.41Å; R447-K451 WeakPolarHBondContact O-CE 3.34Å; R447-K451 WeakPolarHBondContact O-CG 3.28Å
448	E	64.6	Low	68.8	Low	88 Å²	88	62.7 Å²	62.7	41%	0.411	30%	0.301	S	S	.	.	I	π-helix	trans	-103.5	-54.5	-173.5	-51.1	-177.5	-172.4	0	0	111.2	K444 S452	K444-E448 VanDerWaalsContact O-CB 3.28Å; K444-E448 WeakPolarHBondContact O-CB 3.4Å; K444-E448 PolarHBondContact O-N 3.42Å; E448-S452 PolarHBondContact O-N 3.43Å
449	F	68.7	Low	68.6	Low	8 Å²	8	62.1 Å²	62.1	4%	0.035	30%	0.3	C	S	.	.	I	π-helix	trans	-73.4	-46.7	-176.1	-168.8	-83.4	0	0	0	112	K366 L367 P415 C419 K444 M445 K451 S452 I453	K366-F449 HydrophobicContact CB-CE2 4Å; K366-F449 HydrophobicContact CB-CZ 3.57Å; K366-F449 HydrophobicContact CD-CE2 4.42Å; K366-F449 HydrophobicContact CD-CZ 4.29Å; L367-F449 HydrophobicContact CD1-CE1 4.41Å; L367-F449 HydrophobicContact CD2-CD1 3.46Å; L367-F449 VanDerWaalsContact CD2-CD1 3.46Å; L367-F449 HydrophobicContact CD2-CE1 3.24Å; L367-F449 HydrophobicContact CD2-CZ 4.22Å; L367-F449 HydrophobicContact CG-CD1 4.2Å; L367-F449 HydrophobicContact CG-CE1 3.46Å; L367-F449 VanDerWaalsContact CG-CE1 3.46Å; L367-F449 HydrophobicContact CG-CZ 4.2Å; P415-F449 HydrophobicContact CB-CB 3.9Å; P415-F449 HydrophobicContact CB-CD2 3.8Å; P415-F449 HydrophobicContact CB-CG 4.18Å; P415-F449 HydrophobicContact CG-CB 4.45Å; C419-F449 HydrophobicContact CB-CE2 4.18Å; K444-F449 PolarHBondContact O-N 2.64Å; M445-F449 PolarHBondContact O-N 3.15Å; M445-F449 HydrophobicContact SD-CB 4.47Å; F449-K451 PolarHBondContact O-N 3.45Å; F449-K451 VanDerWaalsContact O-N 3.17Å; F449-S452 PolarHBondContact O-N 3.29Å; F449-S452 PolarHBondContact O-OG 3.22Å; F449-I453 HydrophobicContact CD1-CD1 4.2Å; F449-I453 HydrophobicContact CD1-CG1 4.43Å; F449-I453 HydrophobicContact CE1-CD1 3.91Å; F449-I453 HydrophobicContact CE1-CG1 4.06Å
450	A	67	Low	68.2	Low	10 Å²	10	60 Å²	60	8%	0.083	29%	0.287	C	S	.	.	H	α-helix	trans	-64.7	-24.6	-178.6	0	0	0	0	0	113.3	Y348 M445	Y348-A450 HydrophobicContact CE2-CB 4.37Å; M445-A450 PolarHBondContact O-N 3.47Å
451	K	68.6	Low	67.6	Low	165 Å²	165	60.7 Å²	60.7	72%	0.717	29%	0.288	S	S	*	.	H	α-helix	trans	-75.3	-27	173	-71.8	-171.1	-165.4	169.5	0	113.1	R447 F449 I453	R447-K451 WeakPolarHBondContact O-CD 3.41Å; R447-K451 WeakPolarHBondContact O-CE 3.34Å; R447-K451 WeakPolarHBondContact O-CG 3.28Å; F449-K451 PolarHBondContact O-N 3.45Å; F449-K451 VanDerWaalsContact O-N 3.17Å; K451-I453 VanDerWaalsContact C-N 3.26Å; K451-I453 PolarHBondContact O-N 3.15Å
452	S	69.7	Low	67	Low	70 Å²	70	61.5 Å²	61.5	49%	0.49	29%	0.293	S	S	.	.	H	α-helix	trans	-72.9	-20.5	176.5	67.1	0	0	0	0	113.4	E448 F449 K454	E448-S452 PolarHBondContact O-N 3.43Å; F449-S452 PolarHBondContact O-N 3.29Å; F449-S452 PolarHBondContact O-OG 3.22Å; S452-K454 PolarHBondContact O-N 2.9Å
453	I	70	Confident	66.7	Low	13 Å²	13	60.6 Å²	60.6	7%	0.067	29%	0.293	C	S	.	.	S	Bend	trans	-74.5	116.7	177.6	-54.7	173.4	0	0	0	108.5	L360 D363 L367 F449 K451 R455	L360-I453 HydrophobicContact CD2-CG2 4.48Å; D363-I453 HydrophobicContact CB-CG1 4.35Å; L367-I453 HydrophobicContact CD1-CD1 3.9Å; L367-I453 HydrophobicContact CD2-CD1 4.49Å; L367-I453 HydrophobicContact CG-CD1 4.4Å; F449-I453 HydrophobicContact CD1-CD1 4.2Å; F449-I453 HydrophobicContact CD1-CG1 4.43Å; F449-I453 HydrophobicContact CE1-CD1 3.91Å; F449-I453 HydrophobicContact CE1-CG1 4.06Å; K451-I453 VanDerWaalsContact C-N 3.26Å; K451-I453 PolarHBondContact O-N 3.15Å; I453-R455 PolarHBondContact O-N 2.85Å
454	K	67.6	Low	66.5	Low	189 Å²	189	65.5 Å²	65.5	82%	0.822	31%	0.309	S	S	*	.			trans	-75.7	119.9	174.2	-66.1	-175	179.6	-177.9	0	109.2	S452	S452-K454 PolarHBondContact O-N 2.9Å
455	R	65.7	Low	65.9	Low	63 Å²	63	67.8 Å²	67.8	24%	0.238	33%	0.327	C	S	.	.			trans	-145.4	144	175.6	56.8	179.8	-166.4	-168.8	8.6	110.4	I453 F457	I453-R455 PolarHBondContact O-N 2.85Å; R455-F457 WeakPolarHBondContact CD-O 3.24Å; R455-F457 WeakPolarHBondContact CG-O 3.39Å; R455-F457 PolarHBondContact NE-O 2.81Å; R455-F457 VanDerWaalsContact NE-O 3.08Å; R455-F457 PolarHBondContact O-N 3.32Å
456	P	65.6	Low	65.3	Low	77 Å²	77	71.4 Å²	71.4	50%	0.5	34%	0.343	S	S	.	.	S	Bend	trans	-72.4	-17.9	-176	24.4	-28.6	0	0	0	113.4	V170	V170-P456 HydrophobicContact CG2-CG 3.61Å
457	F	68.1	Low	65	Low	33 Å²	33	70.7 Å²	70.7	15%	0.145	34%	0.338	C	S	.	.	S	Bend	trans	-136.2	162.4	-178.5	49	-101.4	0	0	0	112.4	V170 F173 R455 V459 L470 K472	V170-F457 HydrophobicContact CB-CE1 4.47Å; V170-F457 HydrophobicContact CG1-CE1 3.75Å; V170-F457 HydrophobicContact CG1-CZ 3.58Å; V170-F457 HydrophobicContact CG2-CE1 4.02Å; F173-F457 HydrophobicContact CE1-CE2 4.02Å; F173-F457 AromaticContact CE1-CZ 3.84Å; F173-F457 HydrophobicContact CE1-CZ 3.84Å; F173-F457 AromaticContact CZ-CE2 4Å; F173-F457 HydrophobicContact CZ-CE2 4Å; F173-F457 HydrophobicContact CZ-CZ 4.18Å; R455-F457 WeakPolarHBondContact CD-O 3.24Å; R455-F457 WeakPolarHBondContact CG-O 3.39Å; R455-F457 PolarHBondContact NE-O 2.81Å; R455-F457 VanDerWaalsContact NE-O 3.08Å; R455-F457 PolarHBondContact O-N 3.32Å; F457-V459 HydrophobicContact CD2-CG1 4.17Å; F457-V459 HydrophobicContact CE2-CG1 4.15Å; F457-L470 HydrophobicContact CD2-CD2 3.57Å; F457-L470 HydrophobicContact CE2-CD2 3.59Å; F457-L470 HydrophobicContact CG-CD2 4.29Å; F457-L470 HydrophobicContact CZ-CD2 4.31Å; F457-K472 HydrophobicContact CB-CB 4.24Å
458	S	67.1	Low	65	Low	46 Å²	46	64.6 Å²	64.6	32%	0.322	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	154.9	166.5	-83	0	0	0	0	111.6	L471	S458-L471 PolarHBondContact N-O 3.27Å; S458-L471 WeakPolarHBondContact O-CB 3.17Å; S458-L471 PolarHBondContact O-N 2.85Å
459	V	66.4	Low	64.8	Low	13 Å²	13	63 Å²	63	8%	0.079	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	139.6	177.4	-62	0	0	0	0	110	T350 F457 V468 L470	T350-V459 HydrophobicContact CG2-CG2 4.49Å; F457-V459 HydrophobicContact CD2-CG1 4.17Å; F457-V459 HydrophobicContact CE2-CG1 4.15Å; V459-V468 HydrophobicContact CB-CG1 3.93Å; V459-V468 HydrophobicContact CG1-CG1 4.16Å; V459-L470 HydrophobicContact CG1-CD2 3.87Å
460	Y	65.5	Low	64.7	Low	65 Å²	65	64.8 Å²	64.8	26%	0.255	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	139.1	170.7	176.9	-102.3	0	0	0	108.6	N462 V468 D469 V480	Y460-N462 HydrophobicContact CE1-CB 4.16Å; Y460-V468 CarbonylContact O-C 3.52Å; Y460-V468 WeakPolarHBondContact O-CA 3.16Å; Y460-D469 PolarHBondContact N-O 3.01Å; Y460-D469 PolarHBondContact O-N 3.2Å; Y460-V480 HydrophobicContact CD1-CG1 4.45Å; Y460-V480 HydrophobicContact CD1-CG2 3.81Å; Y460-V480 HydrophobicContact CD2-CG1 4.03Å; Y460-V480 HydrophobicContact CE1-CG1 4.39Å; Y460-V480 HydrophobicContact CE1-CG2 4.17Å; Y460-V480 HydrophobicContact CE2-CG1 3.96Å; Y460-V480 HydrophobicContact CG-CG1 4.27Å; Y460-V480 HydrophobicContact CG-CG2 4.07Å
461	Y	63.5	Low	64.8	Low	60 Å²	60	66.2 Å²	66.2	24%	0.235	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	120.6	175.7	176.9	-105.1	0	0	0	109	P299 P463 Q466 S467 V468	P299-Y461 WeakPolarHBondContact CD-OH 3.44Å; P299-Y461 HydrophobicContact CG-CE2 4.49Å; P299-Y461 WeakPolarHBondContact CG-OH 3.39Å; Y461-P463 HydrophobicContact CE1-CB 4.18Å; Y461-P463 WeakPolarHBondContact O-CD 3.48Å; Y461-Q466 WeakPolarHBondContact OH-CA 3.39Å; Y461-S467 WeakPolarHBondContact CD2-O 3.45Å; Y461-V468 HydrophobicContact CD2-CG2 4.23Å
462	N	61.9	Low	65	Low	18 Å²	18	63.7 Å²	63.7	10%	0.096	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	112.8	176.3	-174	-30	0	0	0	109.5	Y460 Y464 T465 Q466 S467	Y460-N462 HydrophobicContact CE1-CB 4.16Å; N462-Y464 VanDerWaalsContact C-N 3.3Å; N462-Y464 PolarHBondContact O-N 3.42Å; N462-Y464 WeakPolarHBondContact OD1-CB 3.44Å; N462-Y464 PolarHBondContact OD1-N 2.92Å; N462-T465 VanDerWaalsContact CB-OG1 3.29Å; N462-T465 WeakPolarHBondContact CB-OG1 3.25Å; N462-T465 PolarHBondContact OD1-N 3.01Å; N462-Q466 VanDerWaalsContact O-CA 3.31Å; N462-Q466 WeakPolarHBondContact O-CA 3.22Å; N462-Q466 PolarHBondContact O-N 3.4Å; N462-S467 PolarHBondContact N-O 3.26Å; N462-S467 PolarHBondContact O-N 3.32Å
463	P	61.4	Low	65.3	Low	43 Å²	43	63.7 Å²	63.7	28%	0.279	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-22.9	-176.9	29.9	-35.3	0	0	0	113.4	P297 Y461	P297-P463 HydrophobicContact CB-CB 4.03Å; P297-P463 HydrophobicContact CG-CB 3.53Å; P297-P463 HydrophobicContact CG-CG 4.38Å; Y461-P463 HydrophobicContact CE1-CB 4.18Å; Y461-P463 WeakPolarHBondContact O-CD 3.48Å
464	Y	65.8	Low	65.7	Low	192 Å²	192	68.7 Å²	68.7	75%	0.753	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-45.6	-178.6	-61.2	-76.1	0	0	0	111.5	N462	N462-Y464 VanDerWaalsContact C-N 3.3Å; N462-Y464 PolarHBondContact O-N 3.42Å; N462-Y464 WeakPolarHBondContact OD1-CB 3.44Å; N462-Y464 PolarHBondContact OD1-N 2.92Å
465	T	63.2	Low	66.1	Low	87 Å²	87	68.9 Å²	68.9	53%	0.534	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-10.7	178.3	57.5	0	0	0	0	112.7	N462 S467	N462-T465 VanDerWaalsContact CB-OG1 3.29Å; N462-T465 WeakPolarHBondContact CB-OG1 3.25Å; N462-T465 PolarHBondContact OD1-N 3.01Å; T465-S467 WeakPolarHBondContact CB-OG 3.48Å; T465-S467 PolarHBondContact O-N 2.91Å; T465-S467 PolarHBondContact OG1-OG 2.89Å
466	Q	57.1	Low	66.4	Low	81 Å²	81	66.9 Å²	66.9	38%	0.379	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	37	-173.7	-54.4	-175.3	-33	0	0	112.4	I177 Y461 N462	I177-Q466 HydrophobicContact CG2-CB 4.18Å; Y461-Q466 WeakPolarHBondContact OH-CA 3.39Å; N462-Q466 VanDerWaalsContact O-CA 3.31Å; N462-Q466 WeakPolarHBondContact O-CA 3.22Å; N462-Q466 PolarHBondContact O-N 3.4Å
467	S	57.4	Low	67.1	Low	17 Å²	17	67.3 Å²	67.3	12%	0.119	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	161.2	-178.3	64	0	0	0	0	112.3	M175 Y461 N462 T465 D469	M175-S467 CarbonylContact O-C 3.52Å; M175-S467 WeakPolarHBondContact O-CA 3.37Å; Y461-S467 WeakPolarHBondContact CD2-O 3.45Å; N462-S467 PolarHBondContact N-O 3.26Å; N462-S467 PolarHBondContact O-N 3.32Å; T465-S467 WeakPolarHBondContact CB-OG 3.48Å; T465-S467 PolarHBondContact O-N 2.91Å; T465-S467 PolarHBondContact OG1-OG 2.89Å; S467-D469 PolarHBondContact OG-OD1 2.78Å
468	V	59.5	Low	67.9	Low	18 Å²	18	70.7 Å²	70.7	11%	0.109	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	120.7	172.6	-178.8	0	0	0	0	108.2	F173 M175 T350 V459 Y460 Y461	F173-V468 HydrophobicContact CE2-CG1 4.37Å; M175-V468 PolarHBondContact O-N 3.01Å; T350-V468 HydrophobicContact CG2-CB 4.25Å; T350-V468 HydrophobicContact CG2-CG1 3.72Å; T350-V468 HydrophobicContact CG2-CG2 3.49Å; T350-V468 VanDerWaalsContact CG2-CG2 3.49Å; V459-V468 HydrophobicContact CB-CG1 3.93Å; V459-V468 HydrophobicContact CG1-CG1 4.16Å; Y460-V468 CarbonylContact O-C 3.52Å; Y460-V468 WeakPolarHBondContact O-CA 3.16Å; Y461-V468 HydrophobicContact CD2-CG2 4.23Å
469	D	61.2	Low	68.4	Low	56 Å²	56	73.2 Å²	73.2	30%	0.299	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	134.1	177.2	-59.2	-30.1	0	0	0	109.7	Y460 S467	Y460-D469 PolarHBondContact N-O 3.01Å; Y460-D469 PolarHBondContact O-N 3.2Å; S467-D469 PolarHBondContact OG-OD1 2.78Å
470	L	65.6	Low	69	Low	45 Å²	45	73.3 Å²	73.3	24%	0.236	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	118	179.1	-63.4	173.6	0	0	0	110	F173 M175 F457 V459 K472 S476	F173-L470 HydrophobicContact CE2-CD2 4.2Å; F173-L470 HydrophobicContact CZ-CD2 3.59Å; M175-L470 HydrophobicContact SD-CD1 4.3Å; F457-L470 HydrophobicContact CD2-CD2 3.57Å; F457-L470 HydrophobicContact CE2-CD2 3.59Å; F457-L470 HydrophobicContact CG-CD2 4.29Å; F457-L470 HydrophobicContact CZ-CD2 4.31Å; V459-L470 HydrophobicContact CG1-CD2 3.87Å; L470-K472 PolarHBondContact O-N 3.2Å; L470-S476 WeakPolarHBondContact O-CB 3.4Å; L470-S476 PolarHBondContact O-OG 3.03Å
471	L	70.6	Confident	70	Confident	40 Å²	40	74.2 Å²	74.2	21%	0.209	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	81.2	174.9	-53.9	-176.7	0	0	0	108.5	S458 S476 I477 V480	S458-L471 PolarHBondContact N-O 3.27Å; S458-L471 WeakPolarHBondContact O-CB 3.17Å; S458-L471 PolarHBondContact O-N 2.85Å; L471-S476 WeakPolarHBondContact CA-OG 3.29Å; L471-I477 HydrophobicContact CB-CG1 4.26Å; L471-V480 HydrophobicContact CD2-CG2 3.83Å
472	K	72.4	Confident	71.1	Confident	112 Å²	112	76.8 Å²	76.8	49%	0.487	38%	0.384	S	S	.	.			trans	-112.4	-29.9	179.8	68	-179.9	-174.1	175.7	0	113.6	E164 F457 L470 S476	E164-K472 IonicContact OE1-NZ 2.9Å; E164-K472 PolarHBondContact OE1-NZ 3.45Å; E164-K472 IonicContact OE2-NZ 2.58Å; E164-K472 PolarHBondContact OE2-NZ 2.87Å; E164-K472 VanDerWaalsContact OE2-NZ 3.15Å; F457-K472 HydrophobicContact CB-CB 4.24Å; L470-K472 PolarHBondContact O-N 3.2Å; K472-S476 PolarHBondContact N-OG 3Å
473	D	75.1	Confident	72	Confident	70 Å²	70	79.7 Å²	79.7	37%	0.374	40%	0.399	S	S	.	.	S	Bend	trans	-126.4	161	-175.3	62.5	-91.9	0	0	0	112.3	R475 S476 I477	D473-R475 PolarHBondContact O-N 3.23Å; D473-R475 WeakPolarHBondContact OD2-CA 3.41Å; D473-R475 VanDerWaalsContact OD2-CB 3.32Å; D473-R475 WeakPolarHBondContact OD2-CB 3.29Å; D473-R475 PolarHBondContact OD2-N 2.84Å; D473-S476 PolarHBondContact N-OG 3.28Å; D473-S476 PolarHBondContact O-N 3.29Å; D473-S476 PolarHBondContact O-OG 2.79Å; D473-S476 PolarHBondContact OD2-N 2.74Å; D473-I477 PolarHBondContact O-N 2.83Å
474	T	79.1	Confident	73.1	Confident	117 Å²	117	81.6 Å²	81.6	72%	0.718	41%	0.407	S	S	*	.	H	α-helix	trans	-57	-34.2	-177.5	-47.9	0	0	0	0	113	I477 E478	T474-I477 PolarHBondContact O-N 2.93Å; T474-E478 WeakPolarHBondContact O-CB 3.41Å; T474-E478 PolarHBondContact O-N 3.02Å
475	R	76.1	Confident	74.2	Confident	194 Å²	194	81.1 Å²	81.1	73%	0.732	40%	0.404	S	S	*	.	H	α-helix	trans	-71.1	-42.8	-179	-59.3	177.1	179.4	168.7	-0.2	111.2	D473 I477 E478 N479	D473-R475 PolarHBondContact O-N 3.23Å; D473-R475 WeakPolarHBondContact OD2-CA 3.41Å; D473-R475 VanDerWaalsContact OD2-CB 3.32Å; D473-R475 WeakPolarHBondContact OD2-CB 3.29Å; D473-R475 PolarHBondContact OD2-N 2.84Å; R475-I477 PolarHBondContact O-N 2.81Å; R475-E478 PolarHBondContact O-N 3.46Å; R475-N479 PolarHBondContact O-N 3.26Å
476	S	72.4	Confident	75.3	Confident	21 Å²	21	80.3 Å²	80.3	15%	0.147	40%	0.401	C	S	.	.	H	α-helix	trans	-58.4	-38.3	175.6	70.1	0	0	0	0	112.2	L470 L471 K472 D473	L470-S476 WeakPolarHBondContact O-CB 3.4Å; L470-S476 PolarHBondContact O-OG 3.03Å; L471-S476 WeakPolarHBondContact CA-OG 3.29Å; K472-S476 PolarHBondContact N-OG 3Å; D473-S476 PolarHBondContact N-OG 3.28Å; D473-S476 PolarHBondContact O-N 3.29Å; D473-S476 PolarHBondContact O-OG 2.79Å; D473-S476 PolarHBondContact OD2-N 2.74Å
477	I	80	Confident	76.6	Confident	85 Å²	85	80.1 Å²	80.1	44%	0.436	40%	0.403	S	S	.	.	H	α-helix	trans	-71.6	-43.4	176.8	-62.9	169.5	0	0	0	110.6	L471 D473 T474 R475 N479 V480 V481	L471-I477 HydrophobicContact CB-CG1 4.26Å; D473-I477 PolarHBondContact O-N 2.83Å; T474-I477 PolarHBondContact O-N 2.93Å; R475-I477 PolarHBondContact O-N 2.81Å; I477-N479 VanDerWaalsContact C-N 3.33Å; I477-N479 PolarHBondContact O-N 2.87Å; I477-V480 PolarHBondContact O-N 3.41Å; I477-V481 HydrophobicContact CG2-CG2 4.3Å; I477-V481 WeakPolarHBondContact O-CG2 3.48Å; I477-V481 PolarHBondContact O-N 3.22Å
478	E	83.7	Confident	78.2	Confident	105 Å²	105	84.6 Å²	84.6	49%	0.491	43%	0.425	S	S	.	.	H	α-helix	trans	-58.5	-43.2	178.9	-173.1	175.9	-175.8	0	0	112	T474 R475 V480 V481 Q482	T474-E478 WeakPolarHBondContact O-CB 3.41Å; T474-E478 PolarHBondContact O-N 3.02Å; R475-E478 PolarHBondContact O-N 3.46Å; E478-V480 PolarHBondContact O-N 3.49Å; E478-V481 PolarHBondContact O-N 2.78Å; E478-V481 VanDerWaalsContact O-N 3.17Å; E478-Q482 WeakPolarHBondContact O-CG 3.36Å; E478-Q482 PolarHBondContact O-N 2.96Å
479	N	79.3	Confident	79.7	Confident	98 Å²	98	87 Å²	87	52%	0.524	44%	0.44	S	S	.	.	H	α-helix	trans	-57.9	-48.6	177.3	-69.4	-18.3	0	0	0	111.8	R475 I477 V481 Q482 D483	R475-N479 PolarHBondContact O-N 3.26Å; I477-N479 VanDerWaalsContact C-N 3.33Å; I477-N479 PolarHBondContact O-N 2.87Å; N479-V481 VanDerWaalsContact C-N 3.3Å; N479-V481 PolarHBondContact O-N 3.14Å; N479-Q482 PolarHBondContact O-N 3.18Å; N479-D483 PolarHBondContact O-N 3.45Å
480	V	79	Confident	81.1	Confident	16 Å²	16	88.6 Å²	88.6	10%	0.097	45%	0.452	C	S	.	.	H	α-helix	trans	-64.5	-36.3	177.9	176.7	0	0	0	0	111.6	Y460 L471 I477 E478 D483 L484	Y460-V480 HydrophobicContact CD1-CG1 4.45Å; Y460-V480 HydrophobicContact CD1-CG2 3.81Å; Y460-V480 HydrophobicContact CD2-CG1 4.03Å; Y460-V480 HydrophobicContact CE1-CG1 4.39Å; Y460-V480 HydrophobicContact CE1-CG2 4.17Å; Y460-V480 HydrophobicContact CE2-CG1 3.96Å; Y460-V480 HydrophobicContact CG-CG1 4.27Å; Y460-V480 HydrophobicContact CG-CG2 4.07Å; L471-V480 HydrophobicContact CD2-CG2 3.83Å; I477-V480 PolarHBondContact O-N 3.41Å; E478-V480 PolarHBondContact O-N 3.49Å; V480-D483 PolarHBondContact O-N 2.82Å; V480-L484 HydrophobicContact CG1-CD1 4.17Å; V480-L484 HydrophobicContact CG1-CG 4.47Å; V480-L484 VanDerWaalsContact O-CG 3.31Å; V480-L484 WeakPolarHBondContact O-CG 2.94Å; V480-L484 PolarHBondContact O-N 3.03Å
481	V	86.7	Confident	82.2	Confident	84 Å²	84	90.4 Å²	90.4	51%	0.509	46%	0.464	S	S	.	.	H	α-helix	trans	-66	-39.2	175.9	170.7	0	0	0	0	111.3	I477 E478 N479 R485	I477-V481 HydrophobicContact CG2-CG2 4.3Å; I477-V481 WeakPolarHBondContact O-CG2 3.48Å; I477-V481 PolarHBondContact O-N 3.22Å; E478-V481 PolarHBondContact O-N 2.78Å; E478-V481 VanDerWaalsContact O-N 3.17Å; N479-V481 VanDerWaalsContact C-N 3.3Å; N479-V481 PolarHBondContact O-N 3.14Å; V481-R485 WeakPolarHBondContact O-CB 3.03Å; V481-R485 PolarHBondContact O-N 3.42Å
482	Q	85.2	Confident	83.1	Confident	114 Å²	114	92.2 Å²	92.2	53%	0.533	48%	0.48	S	S	.	.	H	α-helix	trans	-65.1	-42.8	175.6	-71.4	-162.3	6.2	0	0	111.9	E478 N479 R485 S486	E478-Q482 WeakPolarHBondContact O-CG 3.36Å; E478-Q482 PolarHBondContact O-N 2.96Å; N479-Q482 PolarHBondContact O-N 3.18Å; Q482-R485 WeakPolarHBondContact O-CB 3.36Å; Q482-R485 PolarHBondContact O-N 3.07Å; Q482-S486 PolarHBondContact O-N 2.8Å
483	D	81.8	Confident	84	Confident	78 Å²	78	91.4 Å²	91.4	42%	0.417	48%	0.48	S	S	.	.	H	α-helix	trans	-59.5	-49.2	175.8	-70.2	-17.3	0	0	0	111.1	N479 V480 R485 S486 D487	N479-D483 PolarHBondContact O-N 3.45Å; V480-D483 PolarHBondContact O-N 2.82Å; D483-R485 VanDerWaalsContact C-N 3.28Å; D483-R485 PolarHBondContact O-N 3.29Å; D483-S486 WeakPolarHBondContact O-CB 3.4Å; D483-S486 PolarHBondContact O-N 3.25Å; D483-S486 VanDerWaalsContact O-N 3.13Å; D483-D487 PolarHBondContact O-N 3.29Å
484	L	84.2	Confident	84.7	Confident	83 Å²	83	90.3 Å²	90.3	44%	0.435	48%	0.481	S	S	.	.	H	α-helix	trans	-61.5	-36.3	176.9	-71.6	173.5	0	0	0	112.6	V480 D487 L488	V480-L484 HydrophobicContact CG1-CD1 4.17Å; V480-L484 HydrophobicContact CG1-CG 4.47Å; V480-L484 VanDerWaalsContact O-CG 3.31Å; V480-L484 WeakPolarHBondContact O-CG 2.94Å; V480-L484 PolarHBondContact O-N 3.03Å; L484-D487 PolarHBondContact O-N 3.17Å; L484-L488 WeakPolarHBondContact O-CB 3.48Å; L484-L488 WeakPolarHBondContact O-CG 3.41Å; L484-L488 PolarHBondContact O-N 2.68Å
485	R	88.9	Confident	85.1	Confident	183 Å²	183	89.7 Å²	89.7	69%	0.691	47%	0.473	S	S	*	.	H	α-helix	trans	-66.5	-39.5	176	-178.1	178.7	171.1	171	-2.1	111.3	V481 Q482 D483 L488 T489	V481-R485 WeakPolarHBondContact O-CB 3.03Å; V481-R485 PolarHBondContact O-N 3.42Å; Q482-R485 WeakPolarHBondContact O-CB 3.36Å; Q482-R485 PolarHBondContact O-N 3.07Å; D483-R485 VanDerWaalsContact C-N 3.28Å; D483-R485 PolarHBondContact O-N 3.29Å; R485-L488 PolarHBondContact O-N 2.94Å; R485-T489 WeakPolarHBondContact O-CB 3.45Å; R485-T489 PolarHBondContact O-N 3.4Å; R485-T489 PolarHBondContact O-OG1 2.83Å
486	S	86.2	Confident	85.7	Confident	70 Å²	70	82.1 Å²	82.1	49%	0.49	46%	0.455	S	S	.	.	H	α-helix	trans	-62.6	-45.2	174.9	-176.1	0	0	0	0	111.4	Q482 D483 T489 T490	Q482-S486 PolarHBondContact O-N 2.8Å; D483-S486 WeakPolarHBondContact O-CB 3.4Å; D483-S486 PolarHBondContact O-N 3.25Å; D483-S486 VanDerWaalsContact O-N 3.13Å; S486-T489 PolarHBondContact O-N 3.1Å; S486-T490 PolarHBondContact O-N 3.24Å; S486-T490 PolarHBondContact O-OG1 2.9Å
487	D	84.8	Confident	86.4	Confident	76 Å²	76	87.4 Å²	87.4	41%	0.406	48%	0.476	S	S	.	.	H	α-helix	trans	-61.4	-46.1	176.4	-73.4	-14	0	0	0	111.5	D483 L484 T489 T490 V491	D483-D487 PolarHBondContact O-N 3.29Å; L484-D487 PolarHBondContact O-N 3.17Å; D487-T489 VanDerWaalsContact C-N 3.35Å; D487-T489 PolarHBondContact O-N 3.17Å; D487-T490 WeakPolarHBondContact O-CB 3.48Å; D487-T490 PolarHBondContact O-N 2.97Å; D487-V491 WeakPolarHBondContact O-CG2 3.48Å; D487-V491 PolarHBondContact O-N 3.29Å
488	L	89.9	Confident	86.6	Confident	112 Å²	112	87.5 Å²	87.5	59%	0.586	48%	0.475	S	S	*	.	H	α-helix	trans	-62.5	-40.3	176.8	-76.7	170.4	0	0	0	112.4	L484 R485 T490 V491 C492	L484-L488 WeakPolarHBondContact O-CB 3.48Å; L484-L488 WeakPolarHBondContact O-CG 3.41Å; L484-L488 PolarHBondContact O-N 2.68Å; R485-L488 PolarHBondContact O-N 2.94Å; L488-T490 VanDerWaalsContact C-N 3.3Å; L488-T490 PolarHBondContact O-N 2.97Å; L488-V491 PolarHBondContact O-N 3.43Å; L488-C492 PolarHBondContact O-N 3.45Å; L488-C492 PolarHBondContact O-SG 3.22Å; L488-C492 VanDerWaalsContact O-SG 3.33Å
489	T	91.2	Very high	86.5	Confident	69 Å²	69	87.2 Å²	87.2	42%	0.423	48%	0.477	S	S	.	.	H	α-helix	trans	-61.5	-42.6	176.8	-54.8	0	0	0	0	110.4	R485 S486 D487 V491 C492 D493	R485-T489 WeakPolarHBondContact O-CB 3.45Å; R485-T489 PolarHBondContact O-N 3.4Å; R485-T489 PolarHBondContact O-OG1 2.83Å; S486-T489 PolarHBondContact O-N 3.1Å; D487-T489 VanDerWaalsContact C-N 3.35Å; D487-T489 PolarHBondContact O-N 3.17Å; T489-V491 VanDerWaalsContact C-N 3.32Å; T489-V491 PolarHBondContact O-N 3.26Å; T489-C492 WeakPolarHBondContact O-CB 3.43Å; T489-C492 PolarHBondContact O-N 3.31Å; T489-D493 PolarHBondContact O-N 2.98Å
490	T	90.6	Very high	86.6	Confident	89 Å²	89	87.9 Å²	87.9	55%	0.546	49%	0.485	S	S	.	.	H	α-helix	trans	-60.8	-41.3	176	-56.4	0	0	0	0	111.9	S486 D487 L488 D493 A494	S486-T490 PolarHBondContact O-N 3.24Å; S486-T490 PolarHBondContact O-OG1 2.9Å; D487-T490 WeakPolarHBondContact O-CB 3.48Å; D487-T490 PolarHBondContact O-N 2.97Å; L488-T490 VanDerWaalsContact C-N 3.3Å; L488-T490 PolarHBondContact O-N 2.97Å; T490-D493 PolarHBondContact O-N 3.31Å; T490-A494 WeakPolarHBondContact O-CB 3.35Å; T490-A494 PolarHBondContact O-N 2.58Å
491	V	90	Very high	86.3	Confident	82 Å²	82	96.2 Å²	96.2	50%	0.497	52%	0.516	S	S	.	.	H	α-helix	trans	-66.3	-43.4	175.7	174.6	0	0	0	0	111.2	D487 L488 T489 D493 A494 L495	D487-V491 WeakPolarHBondContact O-CG2 3.48Å; D487-V491 PolarHBondContact O-N 3.29Å; L488-V491 PolarHBondContact O-N 3.43Å; T489-V491 VanDerWaalsContact C-N 3.32Å; T489-V491 PolarHBondContact O-N 3.26Å; V491-D493 PolarHBondContact O-N 3.07Å; V491-A494 PolarHBondContact O-N 3.35Å; V491-L495 HydrophobicContact CG1-CD1 4.09Å; V491-L495 HydrophobicContact CG1-CG 4.47Å; V491-L495 WeakPolarHBondContact O-CG 3.44Å; V491-L495 PolarHBondContact O-N 3.43Å
492	C	88.8	Confident	85.4	Confident	79 Å²	79	98 Å²	98	53%	0.534	52%	0.522	S	S	.	.	H	α-helix	trans	-60.2	-44	175.9	-72.6	0	0	0	0	111.9	L488 T489 A494 L495 G496	L488-C492 PolarHBondContact O-N 3.45Å; L488-C492 PolarHBondContact O-SG 3.22Å; L488-C492 VanDerWaalsContact O-SG 3.33Å; T489-C492 WeakPolarHBondContact O-CB 3.43Å; T489-C492 PolarHBondContact O-N 3.31Å; C492-A494 VanDerWaalsContact C-N 3.35Å; C492-A494 PolarHBondContact O-N 3.38Å; C492-L495 PolarHBondContact O-N 3.27Å; C492-G496 PolarHBondContact O-N 2.91Å
493	D	90.4	Very high	84.3	Confident	94 Å²	94	95.6 Å²	95.6	50%	0.503	53%	0.528	S	S	.	.	H	α-helix	trans	-64.1	-40.2	176.5	-73.8	-12.3	0	0	0	111.9	T489 T490 V491 G496 K497	T489-D493 PolarHBondContact O-N 2.98Å; T490-D493 PolarHBondContact O-N 3.31Å; V491-D493 PolarHBondContact O-N 3.07Å; D493-G496 PolarHBondContact O-N 2.95Å; D493-K497 WeakPolarHBondContact O-CB 3.45Å; D493-K497 VanDerWaalsContact O-CG 3.3Å; D493-K497 WeakPolarHBondContact O-CG 3.3Å; D493-K497 PolarHBondContact O-N 2.83Å
494	A	90.3	Very high	83	Confident	48 Å²	48	99.6 Å²	99.6	40%	0.397	55%	0.548	S	S	.	.	H	α-helix	trans	-63	-44.1	175.3	0	0	0	0	0	111.5	T490 V491 C492 K497 M498	T490-A494 WeakPolarHBondContact O-CB 3.35Å; T490-A494 PolarHBondContact O-N 2.58Å; V491-A494 PolarHBondContact O-N 3.35Å; C492-A494 VanDerWaalsContact C-N 3.35Å; C492-A494 PolarHBondContact O-N 3.38Å; A494-K497 PolarHBondContact O-N 3.42Å; A494-M498 VanDerWaalsContact O-CG 3.32Å; A494-M498 WeakPolarHBondContact O-CG 3.31Å; A494-M498 PolarHBondContact O-N 3.1Å
495	L	88.2	Confident	83	Confident	103 Å²	103	100.5 Å²	100.5	54%	0.539	55%	0.553	S	S	.	*	H	α-helix	trans	-63.5	-42.4	175.3	-72.3	171.2	0	0	0	111.9	V491 C492 K497 M498 N499	V491-L495 HydrophobicContact CG1-CD1 4.09Å; V491-L495 HydrophobicContact CG1-CG 4.47Å; V491-L495 WeakPolarHBondContact O-CG 3.44Å; V491-L495 PolarHBondContact O-N 3.43Å; C492-L495 PolarHBondContact O-N 3.27Å; L495-K497 VanDerWaalsContact C-N 3.35Å; L495-K497 PolarHBondContact O-N 3.28Å; L495-M498 PolarHBondContact O-N 3.49Å; L495-N499 PolarHBondContact O-N 3.4Å
496	G	87.3	Confident	82.6	Confident	35 Å²	35	96.1 Å²	96.1	36%	0.361	55%	0.546	S	S	.	.	H	α-helix	trans	-61.4	-41.9	175.8	0	0	0	0	0	112.4	C492 D493 N499 T500	C492-G496 PolarHBondContact O-N 2.91Å; D493-G496 PolarHBondContact O-N 2.95Å; G496-N499 PolarHBondContact O-N 3.39Å; G496-T500 PolarHBondContact O-N 3.09Å; G496-T500 PolarHBondContact O-OG1 2.96Å
497	K	87.4	Confident	82.4	Confident	132 Å²	132	97.6 Å²	97.6	57%	0.574	55%	0.549	S	S	*	.	H	α-helix	trans	-64	-44	172.8	-72.3	171.2	-174.4	173.2	0	111.5	D493 A494 L495 N499 T500 Y501	D493-K497 WeakPolarHBondContact O-CB 3.45Å; D493-K497 VanDerWaalsContact O-CG 3.3Å; D493-K497 WeakPolarHBondContact O-CG 3.3Å; D493-K497 PolarHBondContact O-N 2.83Å; A494-K497 PolarHBondContact O-N 3.42Å; L495-K497 VanDerWaalsContact C-N 3.35Å; L495-K497 PolarHBondContact O-N 3.28Å; K497-N499 VanDerWaalsContact C-N 3.34Å; K497-N499 PolarHBondContact O-N 3.05Å; K497-T500 PolarHBondContact O-N 3.33Å; K497-Y501 HydrophobicContact CB-CD2 4.2Å; K497-Y501 HydrophobicContact CB-CE2 4.42Å; K497-Y501 WeakPolarHBondContact O-CB 3.27Å; K497-Y501 WeakPolarHBondContact O-CD2 3.44Å; K497-Y501 PolarHBondContact O-N 3.09Å
498	M	84.3	Confident	82.3	Confident	88 Å²	88	98.8 Å²	98.8	43%	0.433	56%	0.558	S	S	.	*	H	α-helix	trans	-60.4	-43.1	176.6	-73.7	179.2	65.9	0	0	112	A494 L495 T500 Y501 L502 I504	A494-M498 VanDerWaalsContact O-CG 3.32Å; A494-M498 WeakPolarHBondContact O-CG 3.31Å; A494-M498 PolarHBondContact O-N 3.1Å; L495-M498 PolarHBondContact O-N 3.49Å; M498-T500 VanDerWaalsContact C-N 3.33Å; M498-T500 PolarHBondContact O-N 3.21Å; M498-Y501 PolarHBondContact O-N 3.32Å; M498-L502 HydrophobicContact CB-CD1 4.38Å; M498-L502 HydrophobicContact CE-CD1 4.21Å; M498-L502 HydrophobicContact CG-CD1 4.22Å; M498-L502 WeakPolarHBondContact O-CA 3.45Å; M498-L502 VanDerWaalsContact O-CB 3.24Å; M498-L502 WeakPolarHBondContact O-CB 3.47Å; M498-L502 PolarHBondContact O-N 3.26Å; M498-I504 HydrophobicContact CE-CD1 4.5Å
499	N	82.7	Confident	81.8	Confident	98 Å²	98	98 Å²	98	52%	0.524	56%	0.556	S	S	.	*	H	α-helix	trans	-60.9	-43.4	174.8	-172.6	-3.1	0	0	0	111.1	L495 G496 K497 G503 I504	L495-N499 PolarHBondContact O-N 3.4Å; G496-N499 PolarHBondContact O-N 3.39Å; K497-N499 VanDerWaalsContact C-N 3.34Å; K497-N499 PolarHBondContact O-N 3.05Å; N499-G503 WeakPolarHBondContact O-CA 3.47Å; N499-G503 PolarHBondContact O-N 3.13Å; N499-G503 VanDerWaalsContact O-N 3.09Å; N499-I504 VanDerWaalsContact CG-O 3.22Å; N499-I504 PolarHBondContact OD1-O 3.39Å; N499-I504 VanDerWaalsContact OD1-O 3.09Å
500	T	80.1	Confident	81.2	Confident	112 Å²	112	99.9 Å²	99.9	69%	0.687	57%	0.565	S	S	*	*	H	α-helix	trans	-68.2	-38	-179.5	-48.1	0	0	0	0	113.6	G496 K497 M498	G496-T500 PolarHBondContact O-N 3.09Å; G496-T500 PolarHBondContact O-OG1 2.96Å; K497-T500 PolarHBondContact O-N 3.33Å; M498-T500 VanDerWaalsContact C-N 3.33Å; M498-T500 PolarHBondContact O-N 3.21Å
501	Y	73.1	Confident	80.5	Confident	192 Å²	192	100.7 Å²	100.7	75%	0.753	57%	0.566	S	S	*	*	H	α-helix	trans	-101.7	-23.9	-173	-69.5	-70.9	0	0	0	114.7	K497 M498	K497-Y501 HydrophobicContact CB-CD2 4.2Å; K497-Y501 HydrophobicContact CB-CE2 4.42Å; K497-Y501 WeakPolarHBondContact O-CB 3.27Å; K497-Y501 WeakPolarHBondContact O-CD2 3.44Å; K497-Y501 PolarHBondContact O-N 3.09Å; M498-Y501 PolarHBondContact O-N 3.32Å
502	L	69.3	Low	79.8	Confident	121 Å²	121	102.2 Å²	102.2	63%	0.634	57%	0.571	S	S	*	*	H	α-helix	trans	-114.4	-7.3	-178.2	-62.4	166.1	0	0	0	113	M498 I504	M498-L502 HydrophobicContact CB-CD1 4.38Å; M498-L502 HydrophobicContact CE-CD1 4.21Å; M498-L502 HydrophobicContact CG-CD1 4.22Å; M498-L502 WeakPolarHBondContact O-CA 3.45Å; M498-L502 VanDerWaalsContact O-CB 3.24Å; M498-L502 WeakPolarHBondContact O-CB 3.47Å; M498-L502 PolarHBondContact O-N 3.26Å; L502-I504 VanDerWaalsContact C-N 3.32Å; L502-I504 HydrophobicContact CB-CD1 4.32Å; L502-I504 HydrophobicContact CB-CG1 4.18Å; L502-I504 PolarHBondContact O-N 3.43Å
503	G	60.6	Low	79.1	Confident	64 Å²	64	104.1 Å²	104.1	66%	0.66	58%	0.575	S	S	*	*			trans	62.7	34.8	174.3	0	0	0	0	0	114.2	N499	N499-G503 WeakPolarHBondContact O-CA 3.47Å; N499-G503 PolarHBondContact O-N 3.13Å; N499-G503 VanDerWaalsContact O-N 3.09Å
504	I	55.3	Low	78	Confident	162 Å²	162	105 Å²	105	83%	0.831	58%	0.581	S	S	*	*			trans	-95.3	0	173.8	-46.9	175.9	0	0	0	109.6	M498 N499 L502	M498-I504 HydrophobicContact CE-CD1 4.5Å; N499-I504 VanDerWaalsContact CG-O 3.22Å; N499-I504 PolarHBondContact OD1-O 3.39Å; N499-I504 VanDerWaalsContact OD1-O 3.09Å; L502-I504 VanDerWaalsContact C-N 3.32Å; L502-I504 HydrophobicContact CB-CD1 4.32Å; L502-I504 HydrophobicContact CB-CG1 4.18Å; L502-I504 PolarHBondContact O-N 3.43Å

Retrieved 504 of 504 residues in 214.9 ms (Link to these results)

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