A0A096N6P8_PAPAN Loading...

Mono-ADP ribosylhydrolase 1

AlphaFold DB (A0A2I3M1A0), UniProt , Accession A0A096N6P8, Species PAPAN (Papio anubis, Olive baboon), Gene MACROD1, Length 325 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	41.8	Very low	42.2	Very low	236 Å²	236	157.2 Å²	157.2	100%	1.163	83%	0.829	S	S	*	*				0	124.5	0	-58.4	166.2	84.5	0	0	107.5
2	S	34.3	Very low	42.4	Very low	86 Å²	86	154.8 Å²	154.8	60%	0.601	83%	0.825	S	S	*	*			cis	172.8	137.8	-17.7	27.5	0	0	0	0	104	Q4	S2-Q4 PolarHBondContact O-N 3.45Å
3	L	37.2	Very low	42.2	Very low	179 Å²	179	157.2 Å²	157.2	94%	0.937	83%	0.828	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	24.6	-163.7	-115.7	81.7	0	0	0	116.5
4	Q	41.9	Very low	42	Very low	172 Å²	172	157.4 Å²	157.4	80%	0.804	83%	0.829	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	-4.8	-159.9	-87.9	-178.9	-32.5	0	0	117.7	S2	S2-Q4 PolarHBondContact O-N 3.45Å
5	S	43.9	Very low	41.7	Very low	106 Å²	106	163.6 Å²	163.6	74%	0.741	84%	0.837	S	S	*	*	S	Bend	trans	-98.9	2.4	-172.5	62.4	0	0	0	0	116.9
6	R	43.9	Very low	41.6	Very low	238 Å²	238	159.9 Å²	159.9	90%	0.898	84%	0.839	S	S	*	*	S	Bend	trans	-121	20.8	-178.9	-61.9	-166.5	-172.8	-148.6	3.2	115.6
7	L	42.2	Very low	41.7	Very low	147 Å²	147	156.4 Å²	156.4	77%	0.77	84%	0.837	S	S	*	*	S	Bend	trans	-106	8.2	174.1	-86.5	166.3	0	0	0	114.7
8	S	48.6	Very low	41.7	Very low	106 Å²	106	151.6 Å²	151.6	74%	0.741	83%	0.831	S	S	*	*	S	Bend	trans	-88.5	-20.5	178.4	-169.5	0	0	0	0	114	R10	S8-R10 PolarHBondContact O-N 3.48Å
9	G	43.6	Very low	41.4	Very low	77 Å²	77	153.7 Å²	153.7	79%	0.794	84%	0.835	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	0.4	-172.8	0	0	0	0	0	117.2
10	R	46.1	Very low	41.1	Very low	226 Å²	226	154.1 Å²	154.1	85%	0.853	84%	0.835	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.1	6.4	-174.5	-91.6	-171	175.1	-162.4	-1.1	115.9	S8	S8-R10 PolarHBondContact O-N 3.48Å
11	L	40	Very low	40.8	Very low	156 Å²	156	155.3 Å²	155.3	82%	0.817	84%	0.84	S	S	*	*	S	Bend	trans	-107.1	9.9	-178.7	-118.6	84	0	0	0	115.6
12	V	44.6	Very low	40.8	Very low	128 Å²	128	149.8 Å²	149.8	78%	0.776	82%	0.819	S	S	*	*	S	Bend	trans	-111.6	-5.9	-174.6	-179.3	0	0	0	0	113.9
13	Q	40.8	Very low	41.5	Very low	187 Å²	187	150.8 Å²	150.8	87%	0.874	82%	0.824	S	S	*	*	S	Bend	trans	-113.9	10.7	178.7	-85.2	-176.5	-25.9	0	0	115.7
14	L	38.3	Very low	42	Very low	160 Å²	160	148.4 Å²	148.4	84%	0.838	82%	0.819	S	S	*	*	S	Bend	trans	-109.3	37.6	173.7	-81.8	166.4	0	0	0	113.1
15	R	38.9	Very low	42	Very low	250 Å²	250	151.6 Å²	151.6	94%	0.943	82%	0.824	S	S	*	*	S	Bend	trans	-132.6	31.9	172.8	-103.6	-172.6	179.2	-173.1	0.8	113.6
16	A	39.5	Very low	41.7	Very low	105 Å²	105	152.5 Å²	152.5	87%	0.868	83%	0.827	S	S	*	*	S	Bend	trans	-123.5	19.6	173.5	0	0	0	0	0	112.9
17	A	43.6	Very low	41.6	Very low	99 Å²	99	152.9 Å²	152.9	82%	0.818	83%	0.829	S	S	*	*	S	Bend	trans	-122.6	108.4	174	0	0	0	0	0	108.9
18	G	40.9	Very low	41.5	Very low	70 Å²	70	152 Å²	152	72%	0.722	83%	0.831	S	S	*	*			trans	125.4	72.4	173.7	0	0	0	0	0	115.5
19	Q	36	Very low	40.6	Very low	193 Å²	193	150.1 Å²	150.1	90%	0.902	83%	0.829	S	S	*	*			trans	-174.9	156.1	136	-101.4	159.9	30	0	0	111.3
20	L	35.7	Very low	40.1	Very low	161 Å²	161	155.8 Å²	155.8	84%	0.843	83%	0.834	S	S	*	*			trans	80.9	63.1	175.6	-58	167.9	0	0	0	118.1	V22	L20-V22 HydrophobicContact CD2-CG2 4.44Å
21	L	35.3	Very low	39.6	Very low	180 Å²	180	153.1 Å²	153.1	94%	0.942	84%	0.836	S	S	*	*			trans	-86.8	118.2	141.2	-84.5	162.2	0	0	0	108.8
22	V	42.5	Very low	39.3	Very low	119 Å²	119	150.5 Å²	150.5	72%	0.721	84%	0.837	S	S	*	*			trans	-139.8	119.1	166.2	-178.2	0	0	0	0	108.8	L20	L20-V22 HydrophobicContact CD2-CG2 4.44Å
23	P	46.9	Very low	38.6	Very low	108 Å²	108	147.9 Å²	147.9	70%	0.701	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-80.9	151.7	177.7	32.4	-34.3	0	0	0	112.3
24	P	48.8	Very low	38.3	Very low	128 Å²	128	143.2 Å²	143.2	83%	0.831	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-73.5	145.6	176.6	30.4	-34.3	0	0	0	112.3
25	R	42.1	Very low	38	Very low	240 Å²	240	141.9 Å²	141.9	91%	0.906	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-78.7	146.3	176	-65.7	-178.2	179.2	-177.3	-0.3	111.9
26	P	38.1	Very low	37.7	Very low	125 Å²	125	140.5 Å²	140.5	81%	0.812	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-74.9	152.8	171.3	32	-34.5	0	0	0	112.2
27	R	40.4	Very low	37.2	Very low	246 Å²	246	141 Å²	141	93%	0.928	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-96.3	152.6	166.9	-75.8	-172.5	178	-172.1	0.3	110.8
28	P	40.5	Very low	36.6	Very low	128 Å²	128	147.1 Å²	147.1	83%	0.831	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-94.1	153.4	-171.5	36.3	-35.3	0	0	0	114.7
29	G	30	Very low	36	Very low	66 Å²	66	148.4 Å²	148.4	68%	0.68	82%	0.815	S	S	*	*			trans	91.9	111.1	142.7	0	0	0	0	0	118.6
30	H	32.6	Very low	35.8	Very low	196 Å²	196	144.3 Å²	144.3	91%	0.907	81%	0.808	S	S	*	*				-166	144.7	93.7	-109.3	-81.3	0	0	0	112.5
31	L	35.5	Very low	35.6	Very low	170 Å²	170	142.8 Å²	142.8	89%	0.89	81%	0.805	S	S	*	*			trans	-93.3	140	173.9	-80.9	80.7	0	0	0	111.9
32	A	35.1	Very low	35.3	Very low	101 Å²	101	140.4 Å²	140.4	84%	0.835	80%	0.802	S	S	*	*			trans	-168.5	137.4	138.5	0	0	0	0	0	106.5
33	G	30.1	Very low	34.7	Very low	74 Å²	74	140.7 Å²	140.7	76%	0.763	81%	0.808	S	S	*	*			cis	95.4	65.9	37.2	0	0	0	0	0	108.7
34	A	32.8	Very low	34.7	Very low	89 Å²	89	140.9 Å²	140.9	74%	0.736	81%	0.809	S	S	*	*				103.6	132.1	80.6	0	0	0	0	0	113.6
35	T	32.3	Very low	34.5	Very low	131 Å²	131	140.8 Å²	140.8	80%	0.804	81%	0.808	S	S	*	*			trans	68.5	134	154.5	46	0	0	0	0	123.7
36	R	32.3	Very low	34.1	Very low	221 Å²	221	133.6 Å²	133.6	83%	0.834	80%	0.801	S	S	*	*			trans	105	99.8	130.4	-95.5	-178	174.8	175.6	-0.7	122.2
37	T	30.2	Very low	33.7	Very low	116 Å²	116	137 Å²	137	71%	0.712	80%	0.803	S	S	*	*				71.5	135.5	120.5	51.3	0	0	0	0	124.6
38	R	30.8	Very low	33.3	Very low	228 Å²	228	132.5 Å²	132.5	86%	0.86	80%	0.797	S	S	*	*			trans	86.1	102.7	138.3	-85.1	-174.5	175.5	-160.7	-1.3	121.6
39	S	29	Very low	32.8	Very low	97 Å²	97	129.2 Å²	129.2	68%	0.678	79%	0.786	S	S	*	*				40.4	124.4	115.3	65.1	0	0	0	0	122.2
40	S	31.3	Very low	32.9	Very low	107 Å²	107	132.4 Å²	132.4	75%	0.748	79%	0.792	S	S	*	*			trans	162.4	112.1	135	39.1	0	0	0	0	108.9
41	T	31	Very low	32.9	Very low	128 Å²	128	132.5 Å²	132.5	79%	0.785	79%	0.79	S	S	*	*				49.8	108.6	96.1	62.1	0	0	0	0	115.7
42	C	29.1	Very low	32.6	Very low	130 Å²	130	128.2 Å²	128.2	88%	0.878	79%	0.788	S	S	*	*				176.6	151.3	103	-93.9	0	0	0	0	113.1
43	C	30	Very low	32.4	Very low	125 Å²	125	134.8 Å²	134.8	85%	0.845	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-92.9	172.8	171	-108.8	0	0	0	0	111.1
44	P	46.8	Very low	32.5	Very low	112 Å²	112	137 Å²	137	73%	0.727	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-93.1	172.3	-159.4	38.3	-38.3	0	0	0	114.1
45	P	43.7	Very low	32.5	Very low	126 Å²	126	136.2 Å²	136.2	82%	0.818	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-98	145.6	160.7	35.5	-28.7	0	0	0	112.8
46	A	34.1	Very low	32.6	Very low	90 Å²	90	140.9 Å²	140.9	74%	0.744	79%	0.791	S	S	*	*			trans	-119.8	140.7	161.3	0	0	0	0	0	109.3
47	F	29.7	Very low	32.5	Very low	195 Å²	195	136.1 Å²	136.1	86%	0.855	79%	0.787	S	S	*	*			trans	177.3	151.5	171.7	-87.2	-40.6	0	0	0	107
48	L	32.3	Very low	32.6	Very low	152 Å²	152	135.5 Å²	135.5	80%	0.796	79%	0.787	S	S	*	*			cis	-147.1	171.3	-8.5	-94.9	161	0	0	0	106.3
49	G	29.7	Very low	32.7	Very low	60 Å²	60	129.4 Å²	129.4	62%	0.619	79%	0.785	S	S	*	*			cis	118.3	52.7	3.2	0	0	0	0	0	115.6
50	V	32.5	Very low	32.8	Very low	132 Å²	132	136.8 Å²	136.8	80%	0.8	80%	0.798	S	S	*	*			trans	-148.1	110.1	170.5	-173.1	0	0	0	0	108.4
51	F	32.1	Very low	33	Very low	198 Å²	198	138.6 Å²	138.6	87%	0.868	81%	0.805	S	S	*	*				63.2	119.1	84.2	-93.9	-81.9	0	0	0	117.4
52	G	30	Very low	33	Very low	81 Å²	81	136.4 Å²	136.4	84%	0.835	81%	0.807	S	S	*	*			trans	-171.5	132.3	169.1	0	0	0	0	0	110.9
53	R	31.4	Very low	33.1	Very low	238 Å²	238	133.9 Å²	133.9	90%	0.898	80%	0.796	S	S	*	*			trans	-132.3	154.3	-164.6	-121	-172.7	-179.8	-157.9	2.5	111.9
54	S	31.9	Very low	33.1	Very low	120 Å²	120	140.3 Å²	140.3	84%	0.839	80%	0.803	S	S	*	*			trans	71.4	156.6	160.2	-119.2	0	0	0	0	116.5
55	A	32.7	Very low	32.2	Very low	74 Å²	74	138.6 Å²	138.6	61%	0.612	81%	0.805	S	S	*	*			cis	-155.9	163.5	3.3	0	0	0	0	0	112.1
56	R	33.1	Very low	31.9	Very low	229 Å²	229	138 Å²	138	86%	0.864	81%	0.811	S	S	*	*			trans	35.6	148.5	132.7	-62.5	-178.6	-173.5	-171.6	2.1	120.4
57	T	31.5	Very low	31.9	Very low	120 Å²	120	138 Å²	138	74%	0.736	81%	0.811	S	S	*	*			cis	-169	171.2	22.2	-7.1	0	0	0	0	112.5
58	S	32.2	Very low	32.3	Very low	104 Å²	104	134 Å²	134	73%	0.727	81%	0.814	S	S	*	*			trans	55.1	117.4	153.9	56.8	0	0	0	0	119.5
59	A	33.5	Very low	32.6	Very low	99 Å²	99	133.4 Å²	133.4	82%	0.818	82%	0.816	S	S	*	*				75.1	114.3	54.9	0	0	0	0	0	115.4
60	R	31.1	Very low	32.6	Very low	253 Å²	253	133.6 Å²	133.6	96%	0.955	82%	0.818	S	S	*	*			trans	-153.5	148.4	146.4	-117.7	179.1	-172	-160.1	0.9	111.9
61	V	35.2	Very low	32.8	Very low	145 Å²	145	139.9 Å²	139.9	88%	0.879	83%	0.828	S	S	*	*			trans	-96.6	144.4	-176.2	174.7	0	0	0	0	109.8
62	G	30.3	Very low	33	Very low	81 Å²	81	136.8 Å²	136.8	84%	0.835	83%	0.825	S	S	*	*			trans	-157.8	123.8	167	0	0	0	0	0	108.7
63	A	31.6	Very low	33.4	Very low	78 Å²	78	137.7 Å²	137.7	65%	0.645	82%	0.824	S	S	*	*			trans	-130.6	175.6	-172.5	0	0	0	0	0	111.2
64	W	30.3	Very low	33.4	Very low	260 Å²	260	129.6 Å²	129.6	99%	0.985	82%	0.815	S	S	*	*			trans	84.2	130	174.6	-59.9	75.7	0	0	0	116.7
65	G	28.1	Very low	33.7	Very low	76 Å²	76	129.8 Å²	129.8	78%	0.784	81%	0.811	S	S	*	*			trans	156.8	55	-176.5	0	0	0	0	0	112.5	A67	G65-A67 PolarHBondContact O-N 3.03Å
66	A	36.9	Very low	34	Very low	113 Å²	113	137.1 Å²	137.1	93%	0.934	82%	0.823	S	S	*	*			trans	-79.4	116.5	176.3	0	0	0	0	0	110.1
67	A	32.7	Very low	34	Very low	90 Å²	90	132 Å²	132	74%	0.744	82%	0.817	S	S	*	*			trans	-135.7	114.2	171	0	0	0	0	0	109.3	G65	G65-A67 PolarHBondContact O-N 3.03Å
68	A	39.5	Very low	34.2	Very low	112 Å²	112	137.2 Å²	137.2	93%	0.926	82%	0.824	S	S	*	*			trans	-78	123	174.8	0	0	0	0	0	109.8
69	V	37.3	Very low	34.2	Very low	139 Å²	139	136 Å²	136	84%	0.842	82%	0.82	S	S	*	*			trans	-126.8	132.5	167.7	-177.9	0	0	0	0	108.1
70	G	30.8	Very low	34.5	Very low	64 Å²	64	137 Å²	137	66%	0.66	82%	0.818	S	S	*	*			trans	-66.1	150.7	-164.9	0	0	0	0	0	114.8	T72	G70-T72 PolarHBondContact O-N 2.86Å
71	R	36.3	Very low	35.2	Very low	263 Å²	263	132.6 Å²	132.6	99%	0.992	81%	0.813	S	S	*	*			trans	-70.4	92.5	167.7	-67.9	-179.3	179.5	-175.3	0.1	109.9	A73	R71-A73 PolarHBondContact O-N 2.89Å
72	T	35.7	Very low	35.4	Very low	134 Å²	134	130 Å²	130	82%	0.822	81%	0.807	S	S	*	*			trans	-76.7	117.7	158.6	46.4	0	0	0	0	108.4	G70 G74	G70-T72 PolarHBondContact O-N 2.86Å; T72-G74 VanDerWaalsContact C-N 3.29Å; T72-G74 PolarHBondContact O-N 2.94Å
73	A	39	Very low	35.9	Very low	99 Å²	99	135 Å²	135	82%	0.818	81%	0.811	S	S	*	*			trans	-70.1	88.1	174.9	0	0	0	0	0	109.3	R71 V75	R71-A73 PolarHBondContact O-N 2.89Å; A73-V75 PolarHBondContact O-N 2.84Å
74	G	32.1	Very low	36.7	Very low	68 Å²	68	134.7 Å²	134.7	70%	0.701	81%	0.808	S	S	*	*			trans	-63.9	99.1	172.3	0	0	0	0	0	109.8	T72 R76	T72-G74 VanDerWaalsContact C-N 3.29Å; T72-G74 PolarHBondContact O-N 2.94Å; G74-R76 VanDerWaalsContact C-N 3.34Å; G74-R76 PolarHBondContact O-N 2.98Å
75	V	38.2	Very low	37.8	Very low	125 Å²	125	126.3 Å²	126.3	76%	0.758	79%	0.794	S	S	*	*			trans	-59.1	101.7	165.9	176.9	0	0	0	0	106.7	A73 T77	A73-V75 PolarHBondContact O-N 2.84Å; V75-T77 HydrophobicContact CG1-CG2 4.47Å; V75-T77 PolarHBondContact O-N 2.88Å
76	R	38.4	Very low	39.5	Very low	227 Å²	227	132.1 Å²	132.1	86%	0.857	80%	0.798	S	S	*	*			trans	-66.8	89	167.3	-80	-175.3	172.5	-177.4	-2.4	107.3	G74 W78	G74-R76 VanDerWaalsContact C-N 3.34Å; G74-R76 PolarHBondContact O-N 2.98Å; R76-W78 PolarHBondContact O-N 2.79Å
77	T	33.1	Very low	41.2	Very low	121 Å²	121	128 Å²	128	74%	0.742	76%	0.761	S	S	*	*			trans	-54	108.9	161.2	44.6	0	0	0	0	106.8	V75 A79	V75-T77 HydrophobicContact CG1-CG2 4.47Å; V75-T77 PolarHBondContact O-N 2.88Å; T77-A79 VanDerWaalsContact C-N 3.28Å; T77-A79 PolarHBondContact O-N 2.63Å
78	W	35.8	Very low	43.3	Very low	230 Å²	230	127.1 Å²	127.1	87%	0.871	74%	0.744	S	S	*	*			trans	-63	99.5	166	-91.5	62.5	0	0	0	106.4	R76	R76-W78 PolarHBondContact O-N 2.79Å
79	A	33.3	Very low	45.2	Very low	80 Å²	80	122.2 Å²	122.2	66%	0.661	70%	0.702	S	S	*	*			trans	-55.9	124.5	161	0	0	0	0	0	106.2	T77 L81	T77-A79 VanDerWaalsContact C-N 3.28Å; T77-A79 PolarHBondContact O-N 2.63Å; A79-L81 PolarHBondContact O-N 2.74Å
80	P	39.5	Very low	46.8	Very low	119 Å²	119	118.7 Å²	118.7	77%	0.773	68%	0.684	S	S	*	*			trans	-57.3	138.3	176.7	23	-31.2	0	0	0	108.3	A82	P80-A82 PolarHBondContact O-N 2.63Å
81	L	45.6	Very low	48.5	Very low	160 Å²	160	120.4 Å²	120.4	84%	0.838	68%	0.681	S	S	*	*			trans	-44.3	128.3	176.5	-133.2	77.4	0	0	0	108.5	A79 M83	A79-L81 PolarHBondContact O-N 2.74Å; L81-M83 PolarHBondContact O-N 2.78Å; L81-M83 VanDerWaalsContact O-N 3.09Å
82	A	39.5	Very low	49.9	Very low	92 Å²	92	109.2 Å²	109.2	76%	0.76	64%	0.644	S	S	*	*			trans	-48.4	124.8	178.7	0	0	0	0	0	108.5	P80 A84	P80-A82 PolarHBondContact O-N 2.63Å; A82-A84 PolarHBondContact O-N 2.81Å
83	M	40	Very low	51.5	Low	185 Å²	185	109.6 Å²	109.6	91%	0.911	65%	0.646	S	S	*	*			trans	-50.6	110.1	177.2	-75	-75.6	-171.3	0	0	107.1	L81 A85	L81-M83 PolarHBondContact O-N 2.78Å; L81-M83 VanDerWaalsContact O-N 3.09Å; M83-A85 PolarHBondContact O-N 3.35Å
84	A	48.2	Very low	53.9	Low	71 Å²	71	107.3 Å²	107.3	59%	0.587	62%	0.62	S	S	*	*			trans	-53.1	118.3	173.3	0	0	0	0	0	106	A82 K86 F101	A82-A84 PolarHBondContact O-N 2.81Å; A84-K86 PolarHBondContact O-N 2.77Å; A84-K86 VanDerWaalsContact O-N 3.14Å; A84-F101 HydrophobicContact CB-CD2 4.43Å; A84-F101 HydrophobicContact CB-CE2 4.43Å
85	A	54.9	Low	56.8	Low	84 Å²	84	106.2 Å²	106.2	69%	0.694	59%	0.594	S	S	*	*			trans	-49.7	127.5	-176.2	0	0	0	0	0	107.6	M83 V87	M83-A85 PolarHBondContact O-N 3.35Å; A85-V87 PolarHBondContact O-N 2.65Å
86	K	62.6	Low	59.5	Low	199 Å²	199	106.2 Å²	106.2	87%	0.865	58%	0.584	S	S	*	*			trans	-58.1	101	-173.6	-80.9	-174.9	172.9	-176.5	0	108.6	A84 D88	A84-K86 PolarHBondContact O-N 2.77Å; A84-K86 VanDerWaalsContact O-N 3.14Å; K86-D88 PolarHBondContact O-N 2.95Å
87	V	73.6	Confident	62.1	Low	26 Å²	26	101 Å²	101	16%	0.158	57%	0.57	C	S	.	*			trans	-70.4	107.1	177	-177.2	0	0	0	0	106.9	A85 L89 A98 F101	A85-V87 PolarHBondContact O-N 2.65Å; V87-L89 HydrophobicContact CG1-CD2 4.44Å; V87-L89 PolarHBondContact O-N 3.15Å; V87-L89 VanDerWaalsContact O-N 3.15Å; V87-A98 HydrophobicContact CG1-CB 4.08Å; V87-F101 HydrophobicContact CB-CB 4.28Å; V87-F101 HydrophobicContact CB-CD1 3.89Å; V87-F101 HydrophobicContact CB-CD2 4.44Å; V87-F101 HydrophobicContact CB-CE1 4.35Å; V87-F101 HydrophobicContact CB-CG 3.95Å; V87-F101 HydrophobicContact CG2-CB 3.84Å; V87-F101 HydrophobicContact CG2-CD1 4.26Å; V87-F101 HydrophobicContact CG2-CD2 4.02Å; V87-F101 HydrophobicContact CG2-CG 3.77Å
88	D	76.3	Confident	65.1	Low	72 Å²	72	95.3 Å²	95.3	39%	0.385	53%	0.534	S	S	.	.			trans	-73.7	104.7	173.9	-179.8	2.8	0	0	0	109.1	K86 S90 T91 S92	K86-D88 PolarHBondContact O-N 2.95Å; D88-S90 VanDerWaalsContact CG-OG 3.27Å; D88-S90 PolarHBondContact O-N 3.25Å; D88-S90 WeakPolarHBondContact OD1-CA 3.39Å; D88-S90 WeakPolarHBondContact OD1-CB 3.38Å; D88-S90 PolarHBondContact OD1-N 3.02Å; D88-S90 PolarHBondContact OD1-OG 2.72Å; D88-S90 PolarHBondContact OD2-OG 3.06Å; D88-T91 WeakPolarHBondContact CB-OG1 3.28Å; D88-T91 PolarHBondContact O-N 3.34Å; D88-T91 WeakPolarHBondContact OD2-CB 3.3Å; D88-T91 WeakPolarHBondContact OD2-CG2 3.5Å; D88-T91 PolarHBondContact OD2-OG1 3.24Å; D88-S92 WeakPolarHBondContact O-CB 3.37Å; D88-S92 PolarHBondContact O-N 3.49Å
89	L	79.6	Confident	67.9	Low	8 Å²	8	87.2 Å²	87.2	4%	0.042	51%	0.505	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-7.3	178.1	-55.6	176.4	0	0	0	113.8	V87 A98 L102 H113 L194 R217	V87-L89 HydrophobicContact CG1-CD2 4.44Å; V87-L89 PolarHBondContact O-N 3.15Å; V87-L89 VanDerWaalsContact O-N 3.15Å; L89-A98 HydrophobicContact CD2-CB 3.71Å; L89-L102 HydrophobicContact CD1-CD1 4.08Å; L89-L102 HydrophobicContact CD1-CD2 4.02Å; L89-L102 HydrophobicContact CD1-CG 4.37Å; L89-L102 HydrophobicContact CD2-CD1 3.91Å; L89-L102 HydrophobicContact CD2-CG 4.22Å; L89-H113 HydrophobicContact CD1-CB 3.85Å; L89-L194 HydrophobicContact CD2-CD1 4.48Å; L89-R217 HydrophobicContact CB-CG 3.73Å; L89-R217 HydrophobicContact CD1-CG 4.03Å
90	S	70.3	Confident	70.8	Confident	66 Å²	66	87.4 Å²	87.4	46%	0.462	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-23.4	176.6	74.3	0	0	0	0	114.1	D88	D88-S90 VanDerWaalsContact CG-OG 3.27Å; D88-S90 PolarHBondContact O-N 3.25Å; D88-S90 WeakPolarHBondContact OD1-CA 3.39Å; D88-S90 WeakPolarHBondContact OD1-CB 3.38Å; D88-S90 PolarHBondContact OD1-N 3.02Å; D88-S90 PolarHBondContact OD1-OG 2.72Å; D88-S90 PolarHBondContact OD2-OG 3.06Å
91	T	66.8	Low	73.5	Confident	100 Å²	100	83.4 Å²	83.4	61%	0.613	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.1	-10.4	-177.2	63	0	0	0	0	115.1	D88	D88-T91 WeakPolarHBondContact CB-OG1 3.28Å; D88-T91 PolarHBondContact O-N 3.34Å; D88-T91 WeakPolarHBondContact OD2-CB 3.3Å; D88-T91 WeakPolarHBondContact OD2-CG2 3.5Å; D88-T91 PolarHBondContact OD2-OG1 3.24Å
92	S	66.6	Low	75.9	Confident	28 Å²	28	76.7 Å²	76.7	20%	0.196	44%	0.438	C	S	.	.			trans	-58.5	141.8	175.8	-179.9	0	0	0	0	111.5	D88 D94 L194	D88-S92 WeakPolarHBondContact O-CB 3.37Å; D88-S92 PolarHBondContact O-N 3.49Å; S92-D94 PolarHBondContact OG-N 2.98Å; S92-D94 PolarHBondContact OG-O 3.41Å; S92-L194 WeakPolarHBondContact O-CD2 3.22Å
93	T	67.8	Low	78.5	Confident	141 Å²	141	80.2 Å²	80.2	87%	0.865	44%	0.436	S	S	*	.	S	Bend	trans	-97.2	-9.9	179.3	53.1	0	0	0	0	113.7
94	D	89.1	Confident	81	Confident	51 Å²	51	74.6 Å²	74.6	27%	0.273	43%	0.425	S	S	.	.			trans	-118.2	112.7	175.8	-164.7	-10.8	0	0	0	112	S92 K96 E97 A98	S92-D94 PolarHBondContact OG-N 2.98Å; S92-D94 PolarHBondContact OG-O 3.41Å; D94-K96 PolarHBondContact O-N 2.7Å; D94-K96 VanDerWaalsContact OD1-CB 3.25Å; D94-K96 WeakPolarHBondContact OD1-CB 3.38Å; D94-K96 WeakPolarHBondContact OD1-CG 3.47Å; D94-K96 PolarHBondContact OD1-N 2.74Å; D94-E97 HydrophobicContact CB-CB 4.35Å; D94-E97 HydrophobicContact CB-CG 4.05Å; D94-E97 PolarHBondContact O-N 2.91Å; D94-A98 PolarHBondContact O-N 3.18Å
95	W	94.6	Very high	83.3	Confident	45 Å²	45	72.8 Å²	72.8	17%	0.17	41%	0.406	C	S	.	.	H	α-helix	trans	-64.9	-27.2	175.1	66.2	-100.9	0	0	0	112.6	K99 L194 E198 T201 Y216	W95-K99 HydrophobicContact CE3-CD 4.35Å; W95-K99 HydrophobicContact CZ3-CD 4.15Å; W95-K99 WeakPolarHBondContact O-CB 3.21Å; W95-K99 PolarHBondContact O-N 3.32Å; W95-L194 HydrophobicContact CB-CB 4.12Å; W95-L194 HydrophobicContact CB-CD2 4.11Å; W95-E198 HydrophobicContact CD2-CB 3.75Å; W95-E198 HydrophobicContact CD2-CG 4.01Å; W95-E198 HydrophobicContact CE3-CB 3.86Å; W95-E198 HydrophobicContact CE3-CG 3.72Å; W95-E198 HydrophobicContact CG-CB 4.05Å; W95-E198 HydrophobicContact CH2-CG 3.94Å; W95-E198 HydrophobicContact CZ2-CG 4.21Å; W95-E198 HydrophobicContact CZ3-CB 4.34Å; W95-E198 HydrophobicContact CZ3-CG 3.68Å; W95-E198 WeakPolarHBondContact CZ3-OE1 3.3Å; W95-T201 HydrophobicContact CZ2-CG2 3.89Å; W95-Y216 HydrophobicContact CB-CE1 4.01Å
96	K	95	Very high	85.3	Confident	126 Å²	126	71.7 Å²	71.7	55%	0.548	39%	0.392	S	S	.	.	H	α-helix	trans	-69	-44.2	178.5	-61.2	172.4	-176.9	170.2	0	111.4	D94 K99 S100	D94-K96 PolarHBondContact O-N 2.7Å; D94-K96 VanDerWaalsContact OD1-CB 3.25Å; D94-K96 WeakPolarHBondContact OD1-CB 3.38Å; D94-K96 WeakPolarHBondContact OD1-CG 3.47Å; D94-K96 PolarHBondContact OD1-N 2.74Å; K96-K99 PolarHBondContact O-N 3.42Å; K96-S100 WeakPolarHBondContact O-CB 3.47Å; K96-S100 PolarHBondContact O-N 3.33Å
97	E	93	Very high	86.8	Confident	118 Å²	118	65.6 Å²	65.6	55%	0.551	37%	0.369	S	S	*	.	H	α-helix	trans	-62.4	-47.7	176	-66.6	-170.1	167	0	0	110.6	D94 K99 S100 F101	D94-E97 HydrophobicContact CB-CB 4.35Å; D94-E97 HydrophobicContact CB-CG 4.05Å; D94-E97 PolarHBondContact O-N 2.91Å; E97-K99 PolarHBondContact O-N 3.33Å; E97-S100 PolarHBondContact O-N 3.31Å; E97-F101 WeakPolarHBondContact O-CB 3.41Å; E97-F101 PolarHBondContact O-N 3.36Å
98	A	94.5	Very high	87.8	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-59.1	-44.1	175.5	0	0	0	0	0	113	V87 L89 D94 S100 F101 L102 L194 Y216	V87-A98 HydrophobicContact CG1-CB 4.08Å; L89-A98 HydrophobicContact CD2-CB 3.71Å; D94-A98 PolarHBondContact O-N 3.18Å; A98-S100 VanDerWaalsContact C-N 3.34Å; A98-S100 PolarHBondContact O-N 2.84Å; A98-F101 PolarHBondContact O-N 2.87Å; A98-L102 WeakPolarHBondContact O-CB 3.49Å; A98-L102 WeakPolarHBondContact O-CG 3.38Å; A98-L102 PolarHBondContact O-N 3.21Å; A98-L194 HydrophobicContact CB-CD1 3.56Å; A98-Y216 HydrophobicContact CB-CD1 4.36Å; A98-Y216 HydrophobicContact CB-CE1 4.33Å
99	K	95.5	Very high	88.8	Confident	60 Å²	60	73.1 Å²	73.1	26%	0.261	40%	0.398	S	S	.	.	H	α-helix	trans	-65.6	-35.9	177.2	-170	174.3	-173.5	179.1	0	112.1	W95 K96 E97 K103 E198	W95-K99 HydrophobicContact CE3-CD 4.35Å; W95-K99 HydrophobicContact CZ3-CD 4.15Å; W95-K99 WeakPolarHBondContact O-CB 3.21Å; W95-K99 PolarHBondContact O-N 3.32Å; K96-K99 PolarHBondContact O-N 3.42Å; E97-K99 PolarHBondContact O-N 3.33Å; K99-K103 WeakPolarHBondContact O-CB 3.4Å; K99-K103 PolarHBondContact O-N 3.5Å; K99-E198 IonicContact NZ-OE1 2.75Å; K99-E198 PolarHBondContact NZ-OE1 3Å; K99-E198 IonicContact NZ-OE2 3.64Å
100	S	95	Very high	89.6	Confident	85 Å²	85	73.4 Å²	73.4	59%	0.594	40%	0.399	S	S	*	.	H	α-helix	trans	-69.1	-48.4	174.3	-168.2	0	0	0	0	111.8	K96 E97 A98 L102 K103 G104	K96-S100 WeakPolarHBondContact O-CB 3.47Å; K96-S100 PolarHBondContact O-N 3.33Å; E97-S100 PolarHBondContact O-N 3.31Å; A98-S100 VanDerWaalsContact C-N 3.34Å; A98-S100 PolarHBondContact O-N 2.84Å; S100-L102 PolarHBondContact O-N 3.29Å; S100-K103 WeakPolarHBondContact O-CB 3.41Å; S100-K103 PolarHBondContact O-N 3.15Å; S100-G104 PolarHBondContact O-N 3.48Å
101	F	94.7	Very high	90.9	Very high	34 Å²	34	72.2 Å²	72.2	15%	0.149	39%	0.386	C	S	.	.	H	α-helix	trans	-55.3	-52.8	176.6	169.6	-103.9	0	0	0	111.7	A84 V87 E97 A98 K103 G104 L105 H113	A84-F101 HydrophobicContact CB-CD2 4.43Å; A84-F101 HydrophobicContact CB-CE2 4.43Å; V87-F101 HydrophobicContact CB-CB 4.28Å; V87-F101 HydrophobicContact CB-CD1 3.89Å; V87-F101 HydrophobicContact CB-CD2 4.44Å; V87-F101 HydrophobicContact CB-CE1 4.35Å; V87-F101 HydrophobicContact CB-CG 3.95Å; V87-F101 HydrophobicContact CG2-CB 3.84Å; V87-F101 HydrophobicContact CG2-CD1 4.26Å; V87-F101 HydrophobicContact CG2-CD2 4.02Å; V87-F101 HydrophobicContact CG2-CG 3.77Å; E97-F101 WeakPolarHBondContact O-CB 3.41Å; E97-F101 PolarHBondContact O-N 3.36Å; A98-F101 PolarHBondContact O-N 2.87Å; F101-K103 PolarHBondContact O-N 3Å; F101-G104 PolarHBondContact O-N 2.82Å; F101-L105 HydrophobicContact CE1-CD1 3.88Å; F101-L105 HydrophobicContact CE2-CD2 4.33Å; F101-L105 HydrophobicContact CZ-CD1 3.99Å; F101-L105 HydrophobicContact CZ-CD2 4.28Å; F101-L105 HydrophobicContact CZ-CG 4.45Å; F101-H113 AromaticContact CE1-CE1 3.75Å; F101-H113 AromaticContact CE1-NE2 3.84Å; F101-H113 AromaticContact CZ-CE1 3.86Å; F101-H113 AromaticContact CZ-NE2 3.79Å
102	L	95.6	Very high	92.3	Very high	20 Å²	20	74.6 Å²	74.6	11%	0.105	39%	0.39	C	S	.	.	H	α-helix	trans	-61.2	-30.8	179.4	-76.6	168.4	0	0	0	113.5	L89 A98 S100 G104 L105 Y216	L89-L102 HydrophobicContact CD1-CD1 4.08Å; L89-L102 HydrophobicContact CD1-CD2 4.02Å; L89-L102 HydrophobicContact CD1-CG 4.37Å; L89-L102 HydrophobicContact CD2-CD1 3.91Å; L89-L102 HydrophobicContact CD2-CG 4.22Å; A98-L102 WeakPolarHBondContact O-CB 3.49Å; A98-L102 WeakPolarHBondContact O-CG 3.38Å; A98-L102 PolarHBondContact O-N 3.21Å; S100-L102 PolarHBondContact O-N 3.29Å; L102-G104 VanDerWaalsContact C-N 3.31Å; L102-L105 HydrophobicContact CD2-CD1 4.33Å; L102-L105 PolarHBondContact O-N 2.89Å; L102-Y216 WeakPolarHBondContact CD1-O 3.28Å
103	K	94.1	Very high	93.7	Very high	166 Å²	166	75.8 Å²	75.8	72%	0.722	39%	0.392	S	S	*	.	H	α-helix	trans	-72.7	-23	175.8	-173.1	178.3	178	-174.6	0	112.8	K99 S100 F101	K99-K103 WeakPolarHBondContact O-CB 3.4Å; K99-K103 PolarHBondContact O-N 3.5Å; S100-K103 WeakPolarHBondContact O-CB 3.41Å; S100-K103 PolarHBondContact O-N 3.15Å; F101-K103 PolarHBondContact O-N 3Å
104	G	94.1	Very high	95.1	Very high	67 Å²	67	69.7 Å²	69.7	69%	0.691	35%	0.354	S	S	*	.	H	α-helix	trans	-82.5	-12.3	175.3	0	0	0	0	0	114.7	S100 F101 L102	S100-G104 PolarHBondContact O-N 3.48Å; F101-G104 PolarHBondContact O-N 2.82Å; L102-G104 VanDerWaalsContact C-N 3.31Å
105	L	95.3	Very high	95.6	Very high	33 Å²	33	70.2 Å²	70.2	17%	0.173	35%	0.354	C	S	.	.	S	Bend	trans	-86.3	143.2	-179.4	-62.2	-174.7	0	0	0	112.2	F101 L102 Q109 R110	F101-L105 HydrophobicContact CE1-CD1 3.88Å; F101-L105 HydrophobicContact CE2-CD2 4.33Å; F101-L105 HydrophobicContact CZ-CD1 3.99Å; F101-L105 HydrophobicContact CZ-CD2 4.28Å; F101-L105 HydrophobicContact CZ-CG 4.45Å; L102-L105 HydrophobicContact CD2-CD1 4.33Å; L102-L105 PolarHBondContact O-N 2.89Å; L105-Q109 HydrophobicContact CB-CB 4.08Å; L105-Q109 HydrophobicContact CD1-CB 4.45Å; L105-Q109 HydrophobicContact CD2-CB 4.23Å; L105-Q109 HydrophobicContact CG-CB 4.49Å; L105-R110 HydrophobicContact CB-CG 3.77Å; L105-R110 HydrophobicContact CD1-CG 4.34Å
106	S	97.1	Very high	95.7	Very high	60 Å²	60	68.6 Å²	68.6	42%	0.42	35%	0.349	S	S	.	.			trans	-67.5	154.5	163.7	66.5	0	0	0	0	110.9	K108 Q109 R110	S106-K108 PolarHBondContact O-N 2.78Å; S106-K108 VanDerWaalsContact O-N 3.14Å; S106-Q109 WeakPolarHBondContact O-CB 3.04Å; S106-Q109 PolarHBondContact O-N 2.82Å; S106-Q109 WeakPolarHBondContact OG-CG 3.48Å; S106-Q109 PolarHBondContact OG-OE1 3.09Å; S106-R110 PolarHBondContact O-N 2.9Å
107	D	94.4	Very high	95.8	Very high	71 Å²	71	69.2 Å²	69.2	38%	0.38	35%	0.351	S	S	.	.	H	α-helix	trans	-55.1	-36.6	-179	-78.6	-37.6	0	0	0	112.5	Q109 R110 E111 K221	D107-Q109 PolarHBondContact O-N 2.75Å; D107-R110 WeakPolarHBondContact O-CB 3.28Å; D107-R110 PolarHBondContact O-N 2.69Å; D107-R110 IonicContact OD1-CZ 2.71Å; D107-R110 IonicContact OD1-NH1 3.73Å; D107-R110 PolarHBondContact OD1-NH1 3.23Å; D107-E111 PolarHBondContact O-N 2.91Å; D107-K221 WeakPolarHBondContact OD1-CE 3.35Å; D107-K221 IonicContact OD1-NZ 2.74Å; D107-K221 PolarHBondContact OD1-NZ 2.7Å; D107-K221 IonicContact OD2-NZ 3.91Å; D107-K221 PolarHBondContact OD2-NZ 2.76Å
108	K	95.5	Very high	96.1	Very high	163 Å²	163	68 Å²	68	71%	0.709	35%	0.349	S	S	*	.	H	α-helix	trans	-64.7	-36.2	174.8	-172	-179.6	177	-172.6	0	113.5	S106 E111	S106-K108 PolarHBondContact O-N 2.78Å; S106-K108 VanDerWaalsContact O-N 3.14Å; K108-E111 WeakPolarHBondContact O-CB 3.43Å
109	Q	96.5	Very high	96.2	Very high	94 Å²	94	69.7 Å²	69.7	44%	0.439	36%	0.356	S	S	.	.	H	α-helix	trans	-71.9	-33.4	175.5	-71.2	163.9	-63.1	0	0	111.3	L105 S106 D107 E111 E112 H113	L105-Q109 HydrophobicContact CB-CB 4.08Å; L105-Q109 HydrophobicContact CD1-CB 4.45Å; L105-Q109 HydrophobicContact CD2-CB 4.23Å; L105-Q109 HydrophobicContact CG-CB 4.49Å; S106-Q109 WeakPolarHBondContact O-CB 3.04Å; S106-Q109 PolarHBondContact O-N 2.82Å; S106-Q109 WeakPolarHBondContact OG-CG 3.48Å; S106-Q109 PolarHBondContact OG-OE1 3.09Å; D107-Q109 PolarHBondContact O-N 2.75Å; Q109-E111 PolarHBondContact O-N 2.74Å; Q109-E112 PolarHBondContact O-N 2.89Å; Q109-H113 PolarHBondContact O-CD2 3.21Å
110	R	97	Very high	96.4	Very high	14 Å²	14	68.7 Å²	68.7	5%	0.053	36%	0.355	C	S	.	.	H	α-helix	trans	-60.7	-31.1	176.1	-65.3	176.4	55.8	-108.8	-12.7	112.4	L105 S106 D107 E112 H113 Y114 P219	L105-R110 HydrophobicContact CB-CG 3.77Å; L105-R110 HydrophobicContact CD1-CG 4.34Å; S106-R110 PolarHBondContact O-N 2.9Å; D107-R110 WeakPolarHBondContact O-CB 3.28Å; D107-R110 PolarHBondContact O-N 2.69Å; D107-R110 IonicContact OD1-CZ 2.71Å; D107-R110 IonicContact OD1-NH1 3.73Å; D107-R110 PolarHBondContact OD1-NH1 3.23Å; R110-E112 PolarHBondContact O-N 2.83Å; R110-E112 VanDerWaalsContact O-N 3.13Å; R110-H113 PolarHBondContact O-N 3.11Å; R110-Y114 VanDerWaalsContact C-CE1 3.48Å; R110-Y114 HydrophobicContact CB-CE1 3.65Å; R110-Y114 PolarHBondContact NH1-OH 3.49Å; R110-Y114 WeakPolarHBondContact O-CD1 3.27Å; R110-Y114 VanDerWaalsContact O-CE1 3.29Å; R110-Y114 WeakPolarHBondContact O-CE1 3.49Å; R110-Y114 PolarHBondContact O-N 2.89Å; R110-P219 PolarHBondContact NH1-O 3.14Å; R110-P219 PolarHBondContact NH2-O 3.03Å
111	E	97	Very high	96.6	Very high	40 Å²	40	68 Å²	68	19%	0.187	34%	0.339	C	S	.	.	H	α-helix	trans	-56.7	-26.2	177.1	-60.2	174.8	-153.4	0	0	114.3	D107 K108 Q109 H113 Y114 K117 F119 R121	D107-E111 PolarHBondContact O-N 2.91Å; K108-E111 WeakPolarHBondContact O-CB 3.43Å; Q109-E111 PolarHBondContact O-N 2.74Å; E111-H113 VanDerWaalsContact C-N 3.32Å; E111-Y114 HydrophobicContact CB-CD2 4.41Å; E111-Y114 HydrophobicContact CB-CE2 4.2Å; E111-Y114 HydrophobicContact CG-CD2 4.49Å; E111-Y114 HydrophobicContact CG-CE2 3.83Å; E111-K117 PolarHBondContact O-NZ 2.62Å; E111-F119 HydrophobicContact CB-CE1 4.44Å; E111-F119 HydrophobicContact CB-CZ 4.22Å; E111-F119 HydrophobicContact CG-CE1 4.34Å; E111-F119 HydrophobicContact CG-CE2 4.19Å; E111-F119 HydrophobicContact CG-CZ 3.66Å; E111-R121 IonicContact OE1-CZ 3.15Å; E111-R121 IonicContact OE1-NH1 3.43Å; E111-R121 PolarHBondContact OE1-NH1 3.48Å; E111-R121 IonicContact OE1-NH2 3.73Å; E111-R121 PolarHBondContact OE1-NH2 3.3Å; E111-R121 IonicContact OE2-CZ 3.75Å; E111-R121 IonicContact OE2-NH2 3.66Å; E111-R121 PolarHBondContact OE2-NH2 3.07Å
112	E	95.9	Very high	96.7	Very high	150 Å²	150	68.3 Å²	68.3	70%	0.701	34%	0.342	S	S	*	.	H	α-helix	trans	-68.8	-34.4	174.9	-66	-177	-162.7	0	0	111.5	Q109 R110 K117	Q109-E112 PolarHBondContact O-N 2.89Å; R110-E112 PolarHBondContact O-N 2.83Å; R110-E112 VanDerWaalsContact O-N 3.13Å; E112-K117 PolarHBondContact O-NZ 2.99Å; E112-K117 VanDerWaalsContact O-NZ 3.12Å
113	H	96.2	Very high	96.9	Very high	53 Å²	53	75.6 Å²	75.6	25%	0.245	37%	0.373	C	S	.	.	H	α-helix	trans	-92.4	-8.5	-173.4	-63.9	-79.9	0	0	0	114.9	L89 F101 Q109 R110 E111	L89-H113 HydrophobicContact CD1-CB 3.85Å; F101-H113 AromaticContact CE1-CE1 3.75Å; F101-H113 AromaticContact CE1-NE2 3.84Å; F101-H113 AromaticContact CZ-CE1 3.86Å; F101-H113 AromaticContact CZ-NE2 3.79Å; Q109-H113 PolarHBondContact O-CD2 3.21Å; R110-H113 PolarHBondContact O-N 3.11Å; E111-H113 VanDerWaalsContact C-N 3.32Å
114	Y	97.9	Very high	97	Very high	14 Å²	14	75.5 Å²	75.5	6%	0.055	37%	0.373	C	S	.	.			trans	-62.1	143.7	177.4	-62.5	-13.9	0	0	0	112	R110 E111 C116 F119 E165 R217 P219	R110-Y114 VanDerWaalsContact C-CE1 3.48Å; R110-Y114 HydrophobicContact CB-CE1 3.65Å; R110-Y114 PolarHBondContact NH1-OH 3.49Å; R110-Y114 WeakPolarHBondContact O-CD1 3.27Å; R110-Y114 VanDerWaalsContact O-CE1 3.29Å; R110-Y114 WeakPolarHBondContact O-CE1 3.49Å; R110-Y114 PolarHBondContact O-N 2.89Å; E111-Y114 HydrophobicContact CB-CD2 4.41Å; E111-Y114 HydrophobicContact CB-CE2 4.2Å; E111-Y114 HydrophobicContact CG-CD2 4.49Å; E111-Y114 HydrophobicContact CG-CE2 3.83Å; Y114-C116 WeakPolarHBondContact CB-O 2.93Å; Y114-C116 PolarHBondContact O-N 3.04Å; Y114-F119 HydrophobicContact CD2-CB 4.31Å; Y114-F119 AromaticContact CD2-CD1 3.75Å; Y114-F119 HydrophobicContact CD2-CD1 3.75Å; Y114-F119 HydrophobicContact CD2-CD2 4.22Å; Y114-F119 HydrophobicContact CD2-CE1 4.07Å; Y114-F119 HydrophobicContact CD2-CE2 4.49Å; Y114-F119 AromaticContact CD2-CG 3.84Å; Y114-F119 HydrophobicContact CD2-CG 3.84Å; Y114-F119 HydrophobicContact CD2-CZ 4.43Å; Y114-F119 HydrophobicContact CE2-CD1 4.18Å; Y114-F119 AromaticContact CE2-CD2 3.88Å; Y114-F119 HydrophobicContact CE2-CD2 3.88Å; Y114-F119 HydrophobicContact CE2-CE1 4.29Å; Y114-F119 AromaticContact CE2-CE2 3.96Å; Y114-F119 HydrophobicContact CE2-CE2 3.96Å; Y114-F119 AromaticContact CE2-CG 3.99Å; Y114-F119 HydrophobicContact CE2-CG 3.99Å; Y114-F119 HydrophobicContact CE2-CZ 4.19Å; Y114-E165 WeakPolarHBondContact CE2-OE1 3.28Å; Y114-E165 PolarHBondContact OH-OE1 2.99Å; Y114-R217 CarbonylContact C-O 3.55Å; Y114-R217 VanDerWaalsContact CA-O 3.3Å; Y114-R217 WeakPolarHBondContact CA-O 3.25Å; Y114-P219 HydrophobicContact CD1-CB 4.45Å; Y114-P219 HydrophobicContact CD2-CB 3.95Å; Y114-P219 HydrophobicContact CD2-CG 3.86Å; Y114-P219 VanDerWaalsContact CE1-CA 3.5Å; Y114-P219 HydrophobicContact CE1-CB 4.35Å; Y114-P219 HydrophobicContact CE2-CB 3.83Å; Y114-P219 HydrophobicContact CE2-CG 4.27Å; Y114-P219 HydrophobicContact CG-CB 4.29Å; Y114-P219 HydrophobicContact CG-CG 4.01Å
115	F	98	Very high	97.3	Very high	62 Å²	62	72.6 Å²	72.6	27%	0.272	34%	0.341	S	S	.	.	S	Bend	trans	-64.8	-21.3	176.2	85.1	-78.6	0	0	0	113.2	T162 K163 A190 R217 L218	F115-T162 WeakPolarHBondContact CE1-O 3.44Å; F115-T162 WeakPolarHBondContact CZ-OG1 3.47Å; F115-K163 HydrophobicContact CZ-CG 4.26Å; F115-A190 WeakPolarHBondContact CB-O 3.16Å; F115-A190 HydrophobicContact CD1-CB 3.96Å; F115-A190 HydrophobicContact CD2-CB 3.98Å; F115-A190 HydrophobicContact CE1-CB 3.8Å; F115-A190 HydrophobicContact CE2-CB 3.81Å; F115-A190 HydrophobicContact CG-CB 4.06Å; F115-A190 HydrophobicContact CZ-CB 3.72Å; F115-R217 HydrophobicContact CB-CB 4.09Å; F115-R217 WeakPolarHBondContact CD1-O 3.36Å; F115-R217 PolarHBondContact N-O 3.19Å; F115-L218 HydrophobicContact CD1-CD2 4.38Å; F115-L218 HydrophobicContact CE1-CD2 4.07Å
116	C	97.6	Very high	97.4	Very high	10 Å²	10	73.8 Å²	73.8	7%	0.068	35%	0.351	C	S	.	.			trans	-127	158.5	-177.8	67.2	0	0	0	0	111.5	Y114 D118	Y114-C116 WeakPolarHBondContact CB-O 2.93Å; Y114-C116 PolarHBondContact O-N 3.04Å; C116-D118 WeakPolarHBondContact CB-OD1 3.35Å
117	K	97.6	Very high	97.4	Very high	139 Å²	139	71.3 Å²	71.3	60%	0.604	33%	0.334	S	S	*	.	S	Bend	trans	-109.5	-13.3	174.4	-61.9	-56.9	179.3	-161.1	0	113.1	E111 E112 F119	E111-K117 PolarHBondContact O-NZ 2.62Å; E112-K117 PolarHBondContact O-NZ 2.99Å; E112-K117 VanDerWaalsContact O-NZ 3.12Å; K117-F119 VanDerWaalsContact C-N 3.3Å; K117-F119 PolarHBondContact O-N 3.05Å
118	D	97.9	Very high	97.6	Very high	94 Å²	94	68 Å²	68	50%	0.503	32%	0.316	S	S	.	.	S	Bend	trans	-94.2	38.4	175	64.3	-37.4	0	0	0	112.2	C116 K163	C116-D118 WeakPolarHBondContact CB-OD1 3.35Å; D118-K163 IonicContact OD1-NZ 2.78Å; D118-K163 IonicContact OD2-NZ 2.74Å; D118-K163 PolarHBondContact OD2-NZ 3.29Å
119	F	98.5	Very high	97.6	Very high	35 Å²	35	63.7 Å²	63.7	15%	0.154	30%	0.297	C	S	.	.			trans	-70.8	145.6	178.6	64.6	-85.2	0	0	0	112	E111 Y114 K117 R121 K163 E165 P219	E111-F119 HydrophobicContact CB-CE1 4.44Å; E111-F119 HydrophobicContact CB-CZ 4.22Å; E111-F119 HydrophobicContact CG-CE1 4.34Å; E111-F119 HydrophobicContact CG-CE2 4.19Å; E111-F119 HydrophobicContact CG-CZ 3.66Å; Y114-F119 HydrophobicContact CD2-CB 4.31Å; Y114-F119 AromaticContact CD2-CD1 3.75Å; Y114-F119 HydrophobicContact CD2-CD1 3.75Å; Y114-F119 HydrophobicContact CD2-CD2 4.22Å; Y114-F119 HydrophobicContact CD2-CE1 4.07Å; Y114-F119 HydrophobicContact CD2-CE2 4.49Å; Y114-F119 AromaticContact CD2-CG 3.84Å; Y114-F119 HydrophobicContact CD2-CG 3.84Å; Y114-F119 HydrophobicContact CD2-CZ 4.43Å; Y114-F119 HydrophobicContact CE2-CD1 4.18Å; Y114-F119 AromaticContact CE2-CD2 3.88Å; Y114-F119 HydrophobicContact CE2-CD2 3.88Å; Y114-F119 HydrophobicContact CE2-CE1 4.29Å; Y114-F119 AromaticContact CE2-CE2 3.96Å; Y114-F119 HydrophobicContact CE2-CE2 3.96Å; Y114-F119 AromaticContact CE2-CG 3.99Å; Y114-F119 HydrophobicContact CE2-CG 3.99Å; Y114-F119 HydrophobicContact CE2-CZ 4.19Å; K117-F119 VanDerWaalsContact C-N 3.3Å; K117-F119 PolarHBondContact O-N 3.05Å; F119-R121 HydrophobicContact CD2-CG 4.16Å; F119-R121 HydrophobicContact CE2-CG 3.85Å; F119-K163 CarbonylContact C-O 3.49Å; F119-K163 WeakPolarHBondContact CA-O 3.44Å; F119-E165 HydrophobicContact CD2-CB 4.03Å; F119-E165 WeakPolarHBondContact CE2-OE1 3.27Å; F119-P219 HydrophobicContact CB-CB 4.09Å; F119-P219 HydrophobicContact CB-CG 3.64Å
120	V	98.6	Very high	97.5	Very high	38 Å²	38	63.9 Å²	63.9	23%	0.23	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	107.5	-175.8	-174.7	0	0	0	0	109.3	I125 F157 K163 L164 E165	V120-I125 HydrophobicContact CG1-CD1 4.08Å; V120-I125 HydrophobicContact CG1-CG1 3.71Å; V120-F157 HydrophobicContact CG1-CE2 4.26Å; V120-F157 HydrophobicContact CG1-CZ 4.41Å; V120-F157 HydrophobicContact CG2-CZ 4.25Å; V120-K163 PolarHBondContact N-O 2.88Å; V120-L164 HydrophobicContact CB-CD2 3.89Å; V120-L164 HydrophobicContact CG1-CD2 4.26Å; V120-L164 HydrophobicContact CG2-CD2 4.43Å; V120-E165 PolarHBondContact O-N 3.19Å
121	R	98.6	Very high	97.4	Very high	71 Å²	71	65.3 Å²	65.3	27%	0.268	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	137.5	176	-52.8	-162.9	178.2	-103.9	12	111.3	E111 F119 K123 K124 E165	E111-R121 IonicContact OE1-CZ 3.15Å; E111-R121 IonicContact OE1-NH1 3.43Å; E111-R121 PolarHBondContact OE1-NH1 3.48Å; E111-R121 IonicContact OE1-NH2 3.73Å; E111-R121 PolarHBondContact OE1-NH2 3.3Å; E111-R121 IonicContact OE2-CZ 3.75Å; E111-R121 IonicContact OE2-NH2 3.66Å; E111-R121 PolarHBondContact OE2-NH2 3.07Å; F119-R121 HydrophobicContact CD2-CG 4.16Å; F119-R121 HydrophobicContact CE2-CG 3.85Å; R121-K123 HydrophobicContact CB-CG 4.12Å; R121-K123 PolarHBondContact O-N 2.93Å; R121-K124 WeakPolarHBondContact O-CB 3.46Å; R121-K124 PolarHBondContact O-N 2.97Å; R121-E165 VanDerWaalsContact CG-OE2 3.28Å; R121-E165 WeakPolarHBondContact CG-OE2 3.45Å; R121-E165 IonicContact CZ-OE2 3.34Å; R121-E165 IonicContact NE-OE2 2.7Å; R121-E165 IonicContact NH1-OE1 2.77Å; R121-E165 IonicContact NH1-OE2 2.72Å; R121-E165 PolarHBondContact NH1-OE2 3.12Å
122	L	98.4	Very high	97	Very high	41 Å²	41	64 Å²	64	22%	0.215	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-45.9	-42	175.7	178	59.6	0	0	0	113.8	K124 I125 E165 V166 R300 I302	L122-K124 PolarHBondContact O-N 2.96Å; L122-K124 VanDerWaalsContact O-N 3.11Å; L122-I125 PolarHBondContact O-N 2.93Å; L122-E165 PolarHBondContact N-O 2.98Å; L122-V166 HydrophobicContact CB-CG1 4.47Å; L122-V166 HydrophobicContact CD1-CG1 4.28Å; L122-R300 HydrophobicContact CD1-CB 3.69Å; L122-R300 HydrophobicContact CD1-CG 3.93Å; L122-I302 HydrophobicContact CD1-CD1 4.04Å
123	K	97.8	Very high	96.5	Very high	173 Å²	173	64.1 Å²	64.1	75%	0.752	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-65.2	-9	178.2	70.9	-178.3	177.9	-173.5	0	115.7	R121	R121-K123 HydrophobicContact CB-CG 4.12Å; R121-K123 PolarHBondContact O-N 2.93Å
124	K	98.1	Very high	95.2	Very high	164 Å²	164	65.5 Å²	65.5	71%	0.713	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-100.8	-7.2	174.7	-70.6	-65.7	-168.4	174	0	112.6	R121 L122	R121-K124 WeakPolarHBondContact O-CB 3.46Å; R121-K124 PolarHBondContact O-N 2.97Å; L122-K124 PolarHBondContact O-N 2.96Å; L122-K124 VanDerWaalsContact O-N 3.11Å
125	I	98.4	Very high	93.9	Very high	5 Å²	5	67 Å²	67	3%	0.026	34%	0.338	C	S	.	.	S	Bend	trans	-90.2	113.4	179	-53.9	176.5	0	0	0	108	V120 L122 F157 L164 R300 I302	V120-I125 HydrophobicContact CG1-CD1 4.08Å; V120-I125 HydrophobicContact CG1-CG1 3.71Å; L122-I125 PolarHBondContact O-N 2.93Å; I125-F157 HydrophobicContact CG2-CB 4.17Å; I125-F157 HydrophobicContact CG2-CD2 4.21Å; I125-F157 HydrophobicContact CG2-CG 4.48Å; I125-L164 HydrophobicContact CD1-CD2 3.94Å; I125-R300 PolarHBondContact O-NH1 2.83Å; I125-I302 HydrophobicContact CD1-CD1 3.66Å
126	P	97.9	Very high	92.2	Very high	58 Å²	58	69 Å²	69	38%	0.377	37%	0.367	S	S	.	.			trans	-64	141.2	-177.1	27	-34.3	0	0	0	110.8	E130 S155	P126-E130 HydrophobicContact CB-CB 4.27Å; P126-S155 WeakPolarHBondContact O-CB 3.49Å; P126-S155 PolarHBondContact O-OG 2.89Å
127	T	98.4	Very high	90.6	Very high	9 Å²	9	70.8 Å²	70.8	6%	0.055	38%	0.377	C	S	.	.			trans	-65	158.6	166.8	56.8	0	0	0	0	110.6	K129 E130 M131 E152 R300	T127-K129 PolarHBondContact O-N 2.83Å; T127-E130 WeakPolarHBondContact CB-OE2 3.39Å; T127-E130 WeakPolarHBondContact CG2-OE2 3.38Å; T127-E130 PolarHBondContact N-OE2 2.88Å; T127-E130 PolarHBondContact O-N 3.37Å; T127-E130 WeakPolarHBondContact OG1-CB 3.49Å; T127-E130 WeakPolarHBondContact OG1-CG 3.24Å; T127-E130 PolarHBondContact OG1-N 2.89Å; T127-E130 PolarHBondContact OG1-OE2 3.26Å; T127-M131 PolarHBondContact O-N 2.77Å; T127-E152 VanDerWaalsContact CG2-O 3.28Å; T127-E152 WeakPolarHBondContact CG2-O 3.49Å; T127-R300 VanDerWaalsContact CG2-NH2 3.3Å
128	W	97.3	Very high	88.8	Confident	1 Å²	1	73.6 Å²	73.6	0%	0.004	39%	0.389	C	S	.	.	H	α-helix	trans	-57.2	-39.8	168.5	175	-124.4	0	0	0	111.9	E130 M131 A132 N151 I154 L318 P319 F322 V324	W128-E130 PolarHBondContact O-N 2.87Å; W128-M131 HydrophobicContact CE3-CB 4.21Å; W128-M131 HydrophobicContact CE3-CG 4.48Å; W128-M131 HydrophobicContact CE3-SD 4.17Å; W128-M131 HydrophobicContact CZ3-CG 4.48Å; W128-M131 HydrophobicContact CZ3-SD 4.21Å; W128-M131 PolarHBondContact O-N 3.3Å; W128-A132 HydrophobicContact CD2-CB 4.47Å; W128-A132 HydrophobicContact CH2-CB 4.4Å; W128-A132 HydrophobicContact CZ2-CB 4.24Å; W128-A132 VanDerWaalsContact O-CB 3.24Å; W128-A132 WeakPolarHBondContact O-CB 3.4Å; W128-A132 PolarHBondContact O-N 2.95Å; W128-N151 PolarHBondContact N-O 3Å; W128-I154 HydrophobicContact CB-CG2 3.72Å; W128-I154 WeakPolarHBondContact CB-O 3.47Å; W128-I154 HydrophobicContact CG-CG2 4.33Å; W128-I154 PolarHBondContact N-O 3.25Å; W128-L318 HydrophobicContact CD2-CB 4.28Å; W128-L318 HydrophobicContact CD2-CD1 4.24Å; W128-L318 HydrophobicContact CD2-CD2 4.42Å; W128-L318 HydrophobicContact CE3-CB 4.36Å; W128-L318 HydrophobicContact CE3-CD1 3.84Å; W128-L318 HydrophobicContact CH2-CB 3.85Å; W128-L318 HydrophobicContact CZ2-CB 3.75Å; W128-L318 HydrophobicContact CZ3-CB 4.15Å; W128-L318 HydrophobicContact CZ3-CD1 4.02Å; W128-P319 HydrophobicContact CH2-CG 3.99Å; W128-P319 HydrophobicContact CZ2-CB 4.48Å; W128-P319 HydrophobicContact CZ2-CG 3.77Å; W128-F322 PolarHBondContact NE1-O 2.83Å; W128-V324 HydrophobicContact CZ2-CG1 4.4Å
129	K	95.7	Very high	87.5	Confident	73 Å²	73	70.7 Å²	70.7	32%	0.317	38%	0.375	S	S	.	.	H	α-helix	trans	-54.9	-35.6	171.7	178.1	-172.3	164.5	-155.1	0	113.4	T127 K133 N151 E152	T127-K129 PolarHBondContact O-N 2.83Å; K129-K133 WeakPolarHBondContact O-CG 3.32Å; K129-N151 HydrophobicContact CB-CB 3.96Å; K129-N151 WeakPolarHBondContact CB-O 3.33Å; K129-N151 PolarHBondContact N-O 2.91Å; K129-E152 HydrophobicContact CB-CG 4.36Å; K129-E152 HydrophobicContact CD-CG 3.42Å; K129-E152 VanDerWaalsContact CD-CG 3.42Å; K129-E152 VanDerWaalsContact CD-OE1 3.28Å; K129-E152 WeakPolarHBondContact CD-OE1 3.39Å; K129-E152 WeakPolarHBondContact CE-OE1 3.44Å; K129-E152 IonicContact NZ-OE1 3.76Å; K129-E152 PolarHBondContact NZ-OE1 3.48Å
130	E	95.7	Very high	85.9	Confident	97 Å²	97	78.2 Å²	78.2	45%	0.453	41%	0.411	S	S	.	.	H	α-helix	trans	-81.2	-45.3	177.2	-72.7	156.7	146.1	0	0	111.6	P126 T127 W128 A132 K133	P126-E130 HydrophobicContact CB-CB 4.27Å; T127-E130 WeakPolarHBondContact CB-OE2 3.39Å; T127-E130 WeakPolarHBondContact CG2-OE2 3.38Å; T127-E130 PolarHBondContact N-OE2 2.88Å; T127-E130 PolarHBondContact O-N 3.37Å; T127-E130 WeakPolarHBondContact OG1-CB 3.49Å; T127-E130 WeakPolarHBondContact OG1-CG 3.24Å; T127-E130 PolarHBondContact OG1-N 2.89Å; T127-E130 PolarHBondContact OG1-OE2 3.26Å; W128-E130 PolarHBondContact O-N 2.87Å; E130-A132 PolarHBondContact O-N 3.33Å; E130-K133 WeakPolarHBondContact O-CB 3.41Å; E130-K133 PolarHBondContact O-N 2.84Å; E130-K133 VanDerWaalsContact O-N 3.12Å
131	M	93.3	Very high	84.8	Confident	45 Å²	45	84.7 Å²	84.7	22%	0.222	44%	0.438	C	S	.	.	H	α-helix	trans	-60.4	-33.5	179	-168.7	-178.5	-162.1	0	0	112.7	T127 W128 K133 V135 L156	T127-M131 PolarHBondContact O-N 2.77Å; W128-M131 HydrophobicContact CE3-CB 4.21Å; W128-M131 HydrophobicContact CE3-CG 4.48Å; W128-M131 HydrophobicContact CE3-SD 4.17Å; W128-M131 HydrophobicContact CZ3-CG 4.48Å; W128-M131 HydrophobicContact CZ3-SD 4.21Å; W128-M131 PolarHBondContact O-N 3.3Å; M131-K133 VanDerWaalsContact C-N 3.32Å; M131-K133 PolarHBondContact O-N 3.02Å; M131-V135 WeakPolarHBondContact O-CG2 3.31Å; M131-L156 HydrophobicContact CE-CD2 4.25Å; M131-L156 HydrophobicContact SD-CB 4.05Å; M131-L156 HydrophobicContact SD-CD2 4.44Å
132	A	90.1	Very high	83.6	Confident	12 Å²	12	84.6 Å²	84.6	10%	0.099	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-11.1	179.2	0	0	0	0	0	114.4	W128 E130 G134 V135 V324	W128-A132 HydrophobicContact CD2-CB 4.47Å; W128-A132 HydrophobicContact CH2-CB 4.4Å; W128-A132 HydrophobicContact CZ2-CB 4.24Å; W128-A132 VanDerWaalsContact O-CB 3.24Å; W128-A132 WeakPolarHBondContact O-CB 3.4Å; W128-A132 PolarHBondContact O-N 2.95Å; E130-A132 PolarHBondContact O-N 3.33Å; A132-G134 PolarHBondContact O-N 3.27Å; A132-V135 PolarHBondContact O-N 2.81Å; A132-V135 VanDerWaalsContact O-N 3.07Å; A132-V324 HydrophobicContact CB-CB 4.13Å; A132-V324 HydrophobicContact CB-CG1 3.69Å; A132-V324 HydrophobicContact CB-CG2 4.03Å
133	K	85.4	Confident	82.9	Confident	153 Å²	153	90.7 Å²	90.7	67%	0.665	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	96.1	175.2	-66.8	175.6	-175.1	174.4	0	109.8	K129 E130 M131	K129-K133 WeakPolarHBondContact O-CG 3.32Å; E130-K133 WeakPolarHBondContact O-CB 3.41Å; E130-K133 PolarHBondContact O-N 2.84Å; E130-K133 VanDerWaalsContact O-N 3.12Å; M131-K133 VanDerWaalsContact C-N 3.32Å; M131-K133 PolarHBondContact O-N 3.02Å
134	G	68.4	Low	82.7	Confident	81 Å²	81	84.8 Å²	84.8	84%	0.835	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	114.6	-4.6	-176.6	0	0	0	0	0	114	A132	A132-G134 PolarHBondContact O-N 3.27Å
135	V	71.1	Confident	82.6	Confident	45 Å²	45	85.5 Å²	85.5	27%	0.273	44%	0.443	S	S	.	.			trans	-90.5	107.4	168.7	-163.5	0	0	0	0	108.2	M131 A132 V137	M131-V135 WeakPolarHBondContact O-CG2 3.31Å; A132-V135 PolarHBondContact O-N 2.81Å; A132-V135 VanDerWaalsContact O-N 3.07Å; V135-V137 HydrophobicContact CB-CG2 4.06Å; V135-V137 HydrophobicContact CG1-CG2 3.4Å; V135-V137 PolarHBondContact O-N 3.36Å
136	A	61.4	Low	82.4	Confident	105 Å²	105	90.3 Å²	90.3	87%	0.868	46%	0.464	S	S	*	.			trans	-75.8	65.3	179.5	0	0	0	0	0	111.7	K138	A136-K138 PolarHBondContact O-N 3.5Å
137	V	63.3	Low	82.4	Confident	47 Å²	47	90.1 Å²	90.1	29%	0.285	46%	0.46	S	S	.	.			trans	-86	102.2	178.1	-159.8	0	0	0	0	110.4	V135 V139 P319	V135-V137 HydrophobicContact CB-CG2 4.06Å; V135-V137 HydrophobicContact CG1-CG2 3.4Å; V135-V137 PolarHBondContact O-N 3.36Å; V137-V139 HydrophobicContact CG1-CG2 3.61Å; V137-V139 PolarHBondContact O-N 3.01Å; V137-P319 HydrophobicContact CB-CB 4.21Å; V137-P319 HydrophobicContact CB-CG 4.15Å; V137-P319 HydrophobicContact CG1-CB 3.72Å; V137-P319 HydrophobicContact CG1-CG 3.8Å; V137-P319 HydrophobicContact CG2-CB 4.4Å; V137-P319 HydrophobicContact CG2-CG 3.81Å
138	K	60.4	Low	82.3	Confident	198 Å²	198	96.3 Å²	96.3	86%	0.861	49%	0.486	S	S	*	.			trans	-82.3	104.5	155.6	-69.3	-174.3	177.8	-178.2	0	107.8	A136	A136-K138 PolarHBondContact O-N 3.5Å
139	V	71.1	Confident	82.3	Confident	33 Å²	33	99.2 Å²	99.2	20%	0.2	50%	0.5	C	S	.	.			trans	-90.4	116.2	163.1	-175.8	0	0	0	0	106.2	V137 E141 P142 P319 H320	V137-V139 HydrophobicContact CG1-CG2 3.61Å; V137-V139 PolarHBondContact O-N 3.01Å; V139-E141 VanDerWaalsContact C-N 3.34Å; V139-E141 PolarHBondContact O-N 3.19Å; V139-P142 HydrophobicContact CG1-CB 4.31Å; V139-P319 HydrophobicContact CG2-CB 3.6Å; V139-H320 WeakPolarHBondContact CG1-ND1 3.5Å
140	E	63.5	Low	82.4	Confident	194 Å²	194	95.8 Å²	95.8	91%	0.907	49%	0.485	S	S	*	.	S	Bend	trans	-66.6	-37.4	-175.4	-61.7	-170.7	148.9	0	0	111.8
141	E	76.4	Confident	82.5	Confident	174 Å²	174	91.4 Å²	91.4	81%	0.813	47%	0.465	S	S	*	.	S	Bend	trans	-133.5	98.1	172.4	-65.1	-171.6	167	0	0	111	V139	V139-E141 VanDerWaalsContact C-N 3.34Å; V139-E141 PolarHBondContact O-N 3.19Å
142	P	74.3	Confident	82.7	Confident	69 Å²	69	92.4 Å²	92.4	45%	0.448	47%	0.469	S	S	.	.			trans	-74.3	129.7	176.6	29	-33	0	0	0	111.1	V139 Y144 P323	V139-P142 HydrophobicContact CG1-CB 4.31Å; P142-Y144 VanDerWaalsContact C-N 3.26Å; P142-Y144 PolarHBondContact O-N 3Å; P142-P323 HydrophobicContact CB-CB 4.33Å; P142-P323 HydrophobicContact CB-CG 3.85Å
143	R	83.5	Confident	83.1	Confident	169 Å²	169	92.9 Å²	92.9	64%	0.638	47%	0.469	S	S	*	.	S	Bend	trans	-70.7	-21	-175.2	-159	-179.5	-163	172.3	7	113.3	E281 H320 Y321	R143-E281 IonicContact NH1-OE2 2.78Å; R143-H320 PolarHBondContact N-O 3.19Å; R143-Y321 PolarHBondContact NH1-OH 3.41Å
144	Y	93.9	Very high	83.8	Confident	48 Å²	48	85.6 Å²	85.6	19%	0.188	44%	0.437	C	S	.	.	S	Bend	trans	-129.2	164.4	178.2	-68	-99.1	0	0	0	110.5	P142 R288 Y321 P323	P142-Y144 VanDerWaalsContact C-N 3.26Å; P142-Y144 PolarHBondContact O-N 3Å; Y144-R288 HydrophobicContact CD1-CG 3.52Å; Y144-R288 HydrophobicContact CD2-CG 4.39Å; Y144-R288 HydrophobicContact CE1-CG 3.59Å; Y144-R288 HydrophobicContact CE2-CG 4.46Å; Y144-R288 HydrophobicContact CG-CG 3.96Å; Y144-Y321 AromaticContact CD2-CD1 3.88Å; Y144-Y321 HydrophobicContact CD2-CD1 3.88Å; Y144-Y321 HydrophobicContact CD2-CE1 4.48Å; Y144-Y321 HydrophobicContact CD2-CG 4.45Å; Y144-Y321 AromaticContact CE2-CD1 3.32Å; Y144-Y321 HydrophobicContact CE2-CD1 3.32Å; Y144-Y321 AromaticContact CE2-CE1 3.6Å; Y144-Y321 HydrophobicContact CE2-CE1 3.6Å; Y144-Y321 HydrophobicContact CE2-CG 4.29Å; Y144-P323 WeakPolarHBondContact O-CG 3.49Å
145	K	94.4	Very high	85.2	Confident	179 Å²	179	81.7 Å²	81.7	78%	0.778	40%	0.397	S	S	*	.			trans	-77.2	146.8	171.5	-64.7	179.7	-177.6	176.6	0	110.9	D147 R288	K145-D147 PolarHBondContact O-N 3.41Å; K145-R288 VanDerWaalsContact O-CZ 3.3Å; K145-R288 PolarHBondContact O-NH1 2.78Å; K145-R288 PolarHBondContact O-NH2 3.34Å
146	K	95.1	Very high	86.5	Confident	107 Å²	107	79.8 Å²	79.8	47%	0.465	39%	0.385	S	S	.	.			trans	-60.7	130.4	169.4	167.1	164.9	163.3	175.5	0	111	P323 V324 A325	K146-P323 HydrophobicContact CB-CB 4.21Å; K146-P323 WeakPolarHBondContact CG-O 3.41Å; K146-V324 VanDerWaalsContact CE-O 3.3Å; K146-V324 WeakPolarHBondContact CE-O 3.23Å; K146-V324 PolarHBondContact NZ-O 3.5Å; K146-A325 VanDerWaalsContact CD-O 3.27Å; K146-A325 WeakPolarHBondContact CD-O 3.31Å; K146-A325 VanDerWaalsContact CD-OXT 3.22Å; K146-A325 WeakPolarHBondContact CD-OXT 3.25Å; K146-A325 WeakPolarHBondContact CE-OXT 3.19Å; K146-A325 VanDerWaalsContact NZ-C 3.3Å; K146-A325 PolarHBondContact NZ-OXT 2.89Å
147	D	97.3	Very high	88.3	Confident	54 Å²	54	76.8 Å²	76.8	29%	0.289	35%	0.353	S	S	.	.			trans	-134.8	119.3	170.7	-173.4	-48.5	0	0	0	109.9	K145 Q149 L150 N151	K145-D147 PolarHBondContact O-N 3.41Å; D147-Q149 WeakPolarHBondContact OD1-CA 3.3Å; D147-Q149 WeakPolarHBondContact OD1-CB 3.46Å; D147-Q149 PolarHBondContact OD1-N 3.05Å; D147-L150 HydrophobicContact CB-CB 4.07Å; D147-L150 HydrophobicContact CB-CD1 4.11Å; D147-L150 HydrophobicContact CB-CG 3.8Å; D147-L150 PolarHBondContact OD1-N 3.27Å; D147-N151 PolarHBondContact O-N 3.41Å; D147-N151 VanDerWaalsContact O-N 3.15Å; D147-N151 PolarHBondContact O-ND2 2.96Å; D147-N151 PolarHBondContact O-OD1 2.87Å
148	K	95.8	Very high	90	Very high	138 Å²	138	79.1 Å²	79.1	60%	0.6	36%	0.356	S	S	*	.	H	α-helix	trans	-66.6	-37.4	-178.3	-178.8	-174.4	170.5	-168.2	0	112.5	E152	K148-E152 WeakPolarHBondContact O-CG 3.47Å; K148-E152 PolarHBondContact O-N 2.98Å
149	Q	97.4	Very high	91.7	Very high	63 Å²	63	70.8 Å²	70.8	29%	0.294	33%	0.327	S	S	.	.	H	α-helix	trans	-72.7	-36.8	-178.5	-160.3	-166.1	1.4	0	0	110.6	D147 E152 K153 D296	D147-Q149 WeakPolarHBondContact OD1-CA 3.3Å; D147-Q149 WeakPolarHBondContact OD1-CB 3.46Å; D147-Q149 PolarHBondContact OD1-N 3.05Å; Q149-E152 PolarHBondContact O-N 3.29Å; Q149-K153 HydrophobicContact CG-CD 4.49Å; Q149-K153 WeakPolarHBondContact O-CG 3.35Å; Q149-K153 PolarHBondContact O-N 3.45Å; Q149-D296 PolarHBondContact NE2-OD1 3.01Å
150	L	98.3	Very high	93	Very high	0 Å²	0	71.9 Å²	71.9	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-67.8	-39.8	174.4	-58	-165.2	0	0	0	111.9	D147 E152 K153 I154 L291 E292 K295 F322	D147-L150 HydrophobicContact CB-CB 4.07Å; D147-L150 HydrophobicContact CB-CD1 4.11Å; D147-L150 HydrophobicContact CB-CG 3.8Å; D147-L150 PolarHBondContact OD1-N 3.27Å; L150-E152 PolarHBondContact O-N 3.38Å; L150-K153 WeakPolarHBondContact O-CA 3.45Å; L150-K153 PolarHBondContact O-N 2.71Å; L150-I154 PolarHBondContact O-N 2.99Å; L150-L291 HydrophobicContact CD1-CB 4.48Å; L150-L291 HydrophobicContact CD2-CB 4.04Å; L150-E292 HydrophobicContact CD1-CG 3.67Å; L150-K295 HydrophobicContact CD2-CB 3.66Å; L150-K295 HydrophobicContact CD2-CD 3.86Å; L150-K295 HydrophobicContact CD2-CG 4.38Å; L150-F322 HydrophobicContact CB-CD1 4.2Å; L150-F322 HydrophobicContact CB-CE1 4.15Å
151	N	97.8	Very high	94.7	Very high	6 Å²	6	63 Å²	63	3%	0.032	29%	0.29	C	S	.	.	H	α-helix	trans	-65.1	-18.1	176.4	-64.8	-10.6	0	0	0	113.4	W128 K129 D147 F322 P323	W128-N151 PolarHBondContact N-O 3Å; K129-N151 HydrophobicContact CB-CB 3.96Å; K129-N151 WeakPolarHBondContact CB-O 3.33Å; K129-N151 PolarHBondContact N-O 2.91Å; D147-N151 PolarHBondContact O-N 3.41Å; D147-N151 VanDerWaalsContact O-N 3.15Å; D147-N151 PolarHBondContact O-ND2 2.96Å; D147-N151 PolarHBondContact O-OD1 2.87Å; N151-F322 WeakPolarHBondContact OD1-CB 3.41Å; N151-P323 PolarHBondContact ND2-O 3.32Å
152	E	98.2	Very high	95.8	Very high	66 Å²	66	54.9 Å²	54.9	31%	0.308	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-13.5	171.8	-71.6	166.7	-174.5	0	0	113.1	T127 K129 K148 Q149 L150 R300	T127-E152 VanDerWaalsContact CG2-O 3.28Å; T127-E152 WeakPolarHBondContact CG2-O 3.49Å; K129-E152 HydrophobicContact CB-CG 4.36Å; K129-E152 HydrophobicContact CD-CG 3.42Å; K129-E152 VanDerWaalsContact CD-CG 3.42Å; K129-E152 VanDerWaalsContact CD-OE1 3.28Å; K129-E152 WeakPolarHBondContact CD-OE1 3.39Å; K129-E152 WeakPolarHBondContact CE-OE1 3.44Å; K129-E152 IonicContact NZ-OE1 3.76Å; K129-E152 PolarHBondContact NZ-OE1 3.48Å; K148-E152 WeakPolarHBondContact O-CG 3.47Å; K148-E152 PolarHBondContact O-N 2.98Å; Q149-E152 PolarHBondContact O-N 3.29Å; L150-E152 PolarHBondContact O-N 3.38Å; E152-R300 PolarHBondContact O-NE 3.22Å; E152-R300 VanDerWaalsContact O-NE 3.15Å
153	K	98.6	Very high	97	Very high	21 Å²	21	54.2 Å²	54.2	9%	0.091	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	-4	-174.8	-72.2	172.8	-178.8	-67.5	0	114.4	Q149 L150 L291 K295 V298 R300 L301	Q149-K153 HydrophobicContact CG-CD 4.49Å; Q149-K153 WeakPolarHBondContact O-CG 3.35Å; Q149-K153 PolarHBondContact O-N 3.45Å; L150-K153 WeakPolarHBondContact O-CA 3.45Å; L150-K153 PolarHBondContact O-N 2.71Å; K153-L291 HydrophobicContact CB-CD2 4.16Å; K153-K295 HydrophobicContact CD-CB 3.72Å; K153-K295 VanDerWaalsContact CD-O 3.28Å; K153-K295 WeakPolarHBondContact CD-O 3.42Å; K153-K295 WeakPolarHBondContact CE-O 3.28Å; K153-K295 PolarHBondContact NZ-O 3.47Å; K153-V298 PolarHBondContact NZ-O 3.21Å; K153-R300 CarbonylContact O-C 3.55Å; K153-R300 WeakPolarHBondContact O-CA 3.44Å; K153-L301 PolarHBondContact O-N 2.97Å
154	I	98.7	Very high	97.7	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	145.1	172.2	-161.9	166.8	0	0	0	111.6	W128 L150 L287 L291 L301 I303 L318 F322	W128-I154 HydrophobicContact CB-CG2 3.72Å; W128-I154 WeakPolarHBondContact CB-O 3.47Å; W128-I154 HydrophobicContact CG-CG2 4.33Å; W128-I154 PolarHBondContact N-O 3.25Å; L150-I154 PolarHBondContact O-N 2.99Å; I154-L287 HydrophobicContact CD1-CB 4.43Å; I154-L287 HydrophobicContact CD1-CD1 4.2Å; I154-L291 HydrophobicContact CB-CD1 4.38Å; I154-L301 CarbonylContact C-O 3.5Å; I154-L301 VanDerWaalsContact CA-O 3.32Å; I154-L301 WeakPolarHBondContact CA-O 3.43Å; I154-I303 HydrophobicContact CD1-CD1 4.19Å; I154-L318 HydrophobicContact CD1-CD2 4.3Å; I154-F322 HydrophobicContact CB-CE1 4.45Å; I154-F322 HydrophobicContact CD1-CD2 4.14Å; I154-F322 HydrophobicContact CD1-CE1 4.22Å; I154-F322 HydrophobicContact CD1-CE2 3.52Å; I154-F322 HydrophobicContact CD1-CZ 3.55Å; I154-F322 HydrophobicContact CG2-CD1 3.88Å; I154-F322 HydrophobicContact CG2-CE1 4.03Å; I154-F322 HydrophobicContact CG2-CG 4.14Å; I154-F322 HydrophobicContact CG2-CZ 4.42Å
155	S	98.8	Very high	97.9	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	141.9	174.3	-77	0	0	0	0	110.2	P126 R300 L301 I302 I303	P126-S155 WeakPolarHBondContact O-CB 3.49Å; P126-S155 PolarHBondContact O-OG 2.89Å; S155-R300 WeakPolarHBondContact OG-CD 3.38Å; S155-R300 PolarHBondContact OG-NH1 3.19Å; S155-L301 PolarHBondContact N-O 2.8Å; S155-I302 WeakPolarHBondContact O-CA 3.34Å; S155-I303 PolarHBondContact O-N 3.19Å
156	L	98.6	Very high	98.1	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.021	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	131.4	159.5	178.7	60.5	0	0	0	107.7	M131 I303 V305 E311 Y314 R315 L318	M131-L156 HydrophobicContact CE-CD2 4.25Å; M131-L156 HydrophobicContact SD-CB 4.05Å; M131-L156 HydrophobicContact SD-CD2 4.44Å; L156-I303 HydrophobicContact CD1-CB 4.18Å; L156-I303 HydrophobicContact CD1-CG2 4.16Å; L156-V305 HydrophobicContact CD1-CG1 3.74Å; L156-V305 HydrophobicContact CD1-CG2 4.09Å; L156-E311 HydrophobicContact CD2-CG 4.34Å; L156-Y314 HydrophobicContact CD1-CG 4.34Å; L156-R315 HydrophobicContact CD2-CB 3.97Å; L156-L318 HydrophobicContact CB-CD1 3.87Å; L156-L318 HydrophobicContact CD2-CD1 4.07Å; L156-L318 HydrophobicContact CG-CD1 4.5Å
157	F	98.6	Very high	98.3	Very high	42 Å²	42	32.8 Å²	32.8	18%	0.184	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	127.7	178.3	176.7	-95.4	0	0	0	109.6	V120 I125 L164 I302 I303 C304 V305	V120-F157 HydrophobicContact CG1-CE2 4.26Å; V120-F157 HydrophobicContact CG1-CZ 4.41Å; V120-F157 HydrophobicContact CG2-CZ 4.25Å; I125-F157 HydrophobicContact CG2-CB 4.17Å; I125-F157 HydrophobicContact CG2-CD2 4.21Å; I125-F157 HydrophobicContact CG2-CG 4.48Å; F157-L164 HydrophobicContact CD1-CD1 4.43Å; F157-L164 HydrophobicContact CD1-CD2 4Å; F157-L164 HydrophobicContact CE1-CD2 3.66Å; F157-L164 HydrophobicContact CZ-CD2 4.06Å; F157-I302 HydrophobicContact CB-CG2 3.78Å; F157-I303 PolarHBondContact N-O 2.79Å; F157-C304 CarbonylContact O-C 3.57Å; F157-C304 VanDerWaalsContact O-CA 3.29Å; F157-C304 WeakPolarHBondContact O-CA 3.47Å; F157-V305 PolarHBondContact O-N 3.49Å
158	R	98.5	Very high	98.4	Very high	97 Å²	97	30.2 Å²	30.2	37%	0.366	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	123.1	171.1	-179.4	172.3	166.7	-165.5	-3.4	110.6	V305 E308 E311	R158-V305 VanDerWaalsContact CA-O 3.31Å; R158-V305 WeakPolarHBondContact CA-O 3.4Å; R158-V305 HydrophobicContact CB-CG2 3.7Å; R158-V305 HydrophobicContact CG-CG2 4.11Å; R158-E308 IonicContact CZ-OE2 3.17Å; R158-E308 IonicContact NH1-OE2 3.9Å; R158-E308 PolarHBondContact NH1-OE2 3.16Å; R158-E308 IonicContact NH2-OE2 3.95Å; R158-E308 PolarHBondContact NH2-OE2 3.39Å; R158-E311 WeakPolarHBondContact CD-OE2 3.35Å; R158-E311 IonicContact CZ-OE2 3.34Å; R158-E311 IonicContact NE-OE2 3.71Å; R158-E311 IonicContact NH1-OE2 3.1Å; R158-E311 PolarHBondContact NH1-OE2 3.08Å
159	G	98	Very high	98.6	Very high	23 Å²	23	23.7 Å²	23.7	24%	0.237	11%	0.114	C	C	.	.	S	Bend	trans	161.3	-162.4	175.1	0	0	0	0	0	114.2	V305	G159-V305 PolarHBondContact N-O 2.91Å
160	D	98.4	Very high	98.6	Very high	56 Å²	56	20.7 Å²	20.7	30%	0.299	10%	0.1	S	C	.	.			trans	-83.7	111.6	178.1	-176.4	-7.9	0	0	0	110.7	T162 K163	D160-T162 PolarHBondContact O-N 3.23Å; D160-T162 WeakPolarHBondContact OD1-CB 3.37Å; D160-T162 WeakPolarHBondContact OD1-CG2 3.48Å; D160-T162 PolarHBondContact OD1-N 3.19Å; D160-T162 PolarHBondContact OD1-OG1 3.31Å; D160-T162 PolarHBondContact OD2-OG1 2.89Å; D160-T162 VanDerWaalsContact OD2-OG1 3.12Å; D160-K163 HydrophobicContact CB-CD 4.27Å; D160-K163 HydrophobicContact CB-CG 4.21Å; D160-K163 PolarHBondContact O-N 3.24Å; D160-K163 VanDerWaalsContact O-N 3.15Å
161	I	98.8	Very high	98.6	Very high	8 Å²	8	20.7 Å²	20.7	4%	0.041	10%	0.1	C	C	.	.	G	3₁₀ helix	trans	-58.8	-28	-179.8	-160.8	172.4	0	0	0	112.7	K163 L164 I169 V183 I187 A263 P265 C304	I161-K163 PolarHBondContact O-N 3.45Å; I161-L164 HydrophobicContact CG1-CD1 4.19Å; I161-L164 PolarHBondContact O-N 3.29Å; I161-I169 HydrophobicContact CD1-CB 4.23Å; I161-I169 HydrophobicContact CG1-CB 4.1Å; I161-I169 HydrophobicContact CG1-CG2 3.99Å; I161-V183 HydrophobicContact CG2-CG2 3.56Å; I161-I187 HydrophobicContact CG2-CD1 4.36Å; I161-I187 HydrophobicContact CG2-CG1 4.47Å; I161-A263 HydrophobicContact CD1-CB 4.18Å; I161-A263 HydrophobicContact CG1-CB 4.11Å; I161-P265 HydrophobicContact CD1-CB 4.14Å; I161-P265 HydrophobicContact CD1-CG 4.28Å; I161-C304 HydrophobicContact CB-CB 4.27Å; I161-C304 VanDerWaalsContact CB-SG 3.59Å; I161-C304 HydrophobicContact CD1-CB 3.99Å; I161-C304 HydrophobicContact CG1-CB 3.93Å
162	T	98.9	Very high	98.6	Very high	3 Å²	3	21.4 Å²	21.4	2%	0.018	11%	0.107	C	C	.	.	G	3₁₀ helix	trans	-66.8	-20.4	-178.3	66.9	0	0	0	0	112.5	F115 D160 C186 I187 A190 L218 P219	F115-T162 WeakPolarHBondContact CE1-O 3.44Å; F115-T162 WeakPolarHBondContact CZ-OG1 3.47Å; D160-T162 PolarHBondContact O-N 3.23Å; D160-T162 WeakPolarHBondContact OD1-CB 3.37Å; D160-T162 WeakPolarHBondContact OD1-CG2 3.48Å; D160-T162 PolarHBondContact OD1-N 3.19Å; D160-T162 PolarHBondContact OD1-OG1 3.31Å; D160-T162 PolarHBondContact OD2-OG1 2.89Å; D160-T162 VanDerWaalsContact OD2-OG1 3.12Å; T162-C186 HydrophobicContact CG2-CB 4.1Å; T162-I187 HydrophobicContact CG2-CG1 3.92Å; T162-A190 HydrophobicContact CG2-CB 4.01Å; T162-L218 HydrophobicContact CG2-CD2 4.32Å; T162-L218 WeakPolarHBondContact O-CD2 3.38Å; T162-P219 VanDerWaalsContact O-CD 3.3Å; T162-P219 WeakPolarHBondContact O-CD 3.25Å
163	K	98.8	Very high	98.5	Very high	54 Å²	54	18.3 Å²	18.3	24%	0.235	9%	0.093	C	C	.	.	G	3₁₀ helix	trans	-88.8	-3.1	-178.5	-59	-172.2	-177.5	-173.5	0	114	F115 D118 F119 V120 D160 I161 E165	F115-K163 HydrophobicContact CZ-CG 4.26Å; D118-K163 IonicContact OD1-NZ 2.78Å; D118-K163 IonicContact OD2-NZ 2.74Å; D118-K163 PolarHBondContact OD2-NZ 3.29Å; F119-K163 CarbonylContact C-O 3.49Å; F119-K163 WeakPolarHBondContact CA-O 3.44Å; V120-K163 PolarHBondContact N-O 2.88Å; D160-K163 HydrophobicContact CB-CD 4.27Å; D160-K163 HydrophobicContact CB-CG 4.21Å; D160-K163 PolarHBondContact O-N 3.24Å; D160-K163 VanDerWaalsContact O-N 3.15Å; I161-K163 PolarHBondContact O-N 3.45Å; K163-E165 PolarHBondContact O-N 2.84Å
164	L	98.9	Very high	98.4	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	118.8	-175	-58.3	-173.2	0	0	0	111.8	V120 I125 F157 I161 V166 I169 A220 A263 C304	V120-L164 HydrophobicContact CB-CD2 3.89Å; V120-L164 HydrophobicContact CG1-CD2 4.26Å; V120-L164 HydrophobicContact CG2-CD2 4.43Å; I125-L164 HydrophobicContact CD1-CD2 3.94Å; F157-L164 HydrophobicContact CD1-CD1 4.43Å; F157-L164 HydrophobicContact CD1-CD2 4Å; F157-L164 HydrophobicContact CE1-CD2 3.66Å; F157-L164 HydrophobicContact CZ-CD2 4.06Å; I161-L164 HydrophobicContact CG1-CD1 4.19Å; I161-L164 PolarHBondContact O-N 3.29Å; L164-V166 HydrophobicContact CB-CG1 4.43Å; L164-V166 HydrophobicContact CB-CG2 4.18Å; L164-V166 PolarHBondContact O-N 2.81Å; L164-V166 VanDerWaalsContact O-N 3.16Å; L164-I169 HydrophobicContact CB-CG2 4.47Å; L164-A220 PolarHBondContact O-N 3.49Å; L164-A263 HydrophobicContact CD1-CB 3.53Å; L164-C304 HydrophobicContact CD1-CB 4.27Å
165	E	98.8	Very high	98.3	Very high	25 Å²	25	22.8 Å²	22.8	12%	0.117	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	90.7	170	176	175.4	-101.4	0	0	108.9	Y114 F119 V120 R121 L122 K163 P219	Y114-E165 WeakPolarHBondContact CE2-OE1 3.28Å; Y114-E165 PolarHBondContact OH-OE1 2.99Å; F119-E165 HydrophobicContact CD2-CB 4.03Å; F119-E165 WeakPolarHBondContact CE2-OE1 3.27Å; V120-E165 PolarHBondContact O-N 3.19Å; R121-E165 VanDerWaalsContact CG-OE2 3.28Å; R121-E165 WeakPolarHBondContact CG-OE2 3.45Å; R121-E165 IonicContact CZ-OE2 3.34Å; R121-E165 IonicContact NE-OE2 2.7Å; R121-E165 IonicContact NH1-OE1 2.77Å; R121-E165 IonicContact NH1-OE2 2.72Å; R121-E165 PolarHBondContact NH1-OE2 3.12Å; L122-E165 PolarHBondContact N-O 2.98Å; K163-E165 PolarHBondContact O-N 2.84Å; E165-P219 HydrophobicContact CB-CB 3.94Å
166	V	98.9	Very high	98.1	Very high	5 Å²	5	24.8 Å²	24.8	3%	0.03	14%	0.138	C	C	.	.	S	Bend	trans	-138.8	173.5	179	-67.7	0	0	0	0	110	L122 L164 A168 I169 A220 K221 I302	L122-V166 HydrophobicContact CB-CG1 4.47Å; L122-V166 HydrophobicContact CD1-CG1 4.28Å; L164-V166 HydrophobicContact CB-CG1 4.43Å; L164-V166 HydrophobicContact CB-CG2 4.18Å; L164-V166 PolarHBondContact O-N 2.81Å; L164-V166 VanDerWaalsContact O-N 3.16Å; V166-A168 VanDerWaalsContact CG2-O 3.27Å; V166-A168 WeakPolarHBondContact CG2-O 3.28Å; V166-I169 HydrophobicContact CG2-CG2 3.78Å; V166-A220 HydrophobicContact CG2-CB 4.45Å; V166-A220 VanDerWaalsContact O-CA 3.28Å; V166-A220 WeakPolarHBondContact O-CA 3.46Å; V166-K221 PolarHBondContact O-N 3.11Å; V166-I302 HydrophobicContact CG1-CD1 3.79Å
167	D	98.9	Very high	97.9	Very high	24 Å²	24	24.6 Å²	24.6	13%	0.128	14%	0.137	C	C	.	.	S	Bend	trans	-72.4	-41.5	178.1	-56.6	-54.3	0	0	0	111.8	K221 Y222 L259 R260 S261	D167-K221 CarbonylContact O-C 3.54Å; D167-K221 WeakPolarHBondContact O-CB 3.45Å; D167-K221 PolarHBondContact O-N 2.78Å; D167-K221 WeakPolarHBondContact OD1-CD 3.44Å; D167-K221 IonicContact OD1-NZ 2.76Å; D167-K221 PolarHBondContact OD1-NZ 3Å; D167-Y222 PolarHBondContact O-N 2.86Å; D167-L259 HydrophobicContact CB-CB 3.83Å; D167-L259 HydrophobicContact CB-CD1 4.49Å; D167-L259 HydrophobicContact CB-CD2 4.18Å; D167-L259 HydrophobicContact CB-CG 4.36Å; D167-R260 PolarHBondContact OD2-N 3.32Å; D167-S261 WeakPolarHBondContact CB-O 3.47Å; D167-S261 VanDerWaalsContact CG-OG 3.28Å; D167-S261 PolarHBondContact N-O 3.17Å; D167-S261 PolarHBondContact N-OG 3.21Å; D167-S261 PolarHBondContact OD2-N 3.04Å; D167-S261 PolarHBondContact OD2-OG 3.14Å
168	A	98.9	Very high	97.7	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	141.8	174.9	0	0	0	0	0	113.4	V166 Y222 I224 L254 L259 S261 A262 A263	V166-A168 VanDerWaalsContact CG2-O 3.27Å; V166-A168 WeakPolarHBondContact CG2-O 3.28Å; A168-Y222 WeakPolarHBondContact CA-O 3.4Å; A168-I224 HydrophobicContact CB-CD1 3.74Å; A168-I224 HydrophobicContact CB-CG1 4.1Å; A168-L254 HydrophobicContact CB-CD1 3.84Å; A168-L259 HydrophobicContact CB-CD1 4.06Å; A168-S261 PolarHBondContact N-O 3.03Å; A168-A262 CarbonylContact O-C 3.14Å; A168-A262 VanDerWaalsContact O-CA 3.28Å; A168-A262 WeakPolarHBondContact O-CA 3.14Å; A168-A263 PolarHBondContact O-N 3.36Å
169	I	98.9	Very high	97.3	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	143.9	157.3	63.3	171.7	0	0	0	109.2	I161 L164 V166 I187 L218 A220 Y222 V223 I224 A263	I161-I169 HydrophobicContact CD1-CB 4.23Å; I161-I169 HydrophobicContact CG1-CB 4.1Å; I161-I169 HydrophobicContact CG1-CG2 3.99Å; L164-I169 HydrophobicContact CB-CG2 4.47Å; V166-I169 HydrophobicContact CG2-CG2 3.78Å; I169-I187 HydrophobicContact CD1-CD1 4.04Å; I169-I187 HydrophobicContact CD1-CG1 3.94Å; I169-L218 HydrophobicContact CD1-CD1 3.79Å; I169-L218 HydrophobicContact CD1-CD2 4.34Å; I169-L218 HydrophobicContact CG1-CD1 4.4Å; I169-A220 HydrophobicContact CB-CB 4.34Å; I169-A220 HydrophobicContact CD1-CB 4.42Å; I169-A220 HydrophobicContact CG1-CB 3.97Å; I169-A220 HydrophobicContact CG2-CB 3.75Å; I169-Y222 PolarHBondContact N-O 2.98Å; I169-Y222 VanDerWaalsContact N-O 3.13Å; I169-V223 HydrophobicContact CD1-CG2 4.46Å; I169-V223 HydrophobicContact CG1-CG2 4.06Å; I169-V223 WeakPolarHBondContact O-CA 3.23Å; I169-I224 PolarHBondContact O-N 2.83Å; I169-A263 HydrophobicContact CG2-CB 4.27Å
170	V	98.9	Very high	97	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	134.2	176.7	-178.4	0	0	0	0	109.3	I224 T226 A263 F264 P265 I267	V170-I224 CarbonylContact C-O 3.56Å; V170-I224 VanDerWaalsContact CA-O 3.24Å; V170-I224 WeakPolarHBondContact CA-O 3.32Å; V170-I224 WeakPolarHBondContact CG1-O 3.39Å; V170-I224 HydrophobicContact CG2-CB 4.3Å; V170-T226 HydrophobicContact CG1-CG2 3.65Å; V170-A263 PolarHBondContact N-O 3.17Å; V170-F264 HydrophobicContact CB-CD1 4.02Å; V170-F264 HydrophobicContact CB-CE1 4.42Å; V170-F264 HydrophobicContact CG1-CD1 4.17Å; V170-F264 HydrophobicContact CG1-CE1 4.48Å; V170-F264 HydrophobicContact CG2-CD1 3.65Å; V170-F264 HydrophobicContact CG2-CE1 3.63Å; V170-F264 HydrophobicContact CG2-CG 4.14Å; V170-F264 HydrophobicContact CG2-CZ 4.06Å; V170-P265 WeakPolarHBondContact O-CD 3.43Å; V170-P265 WeakPolarHBondContact O-CG 3.2Å; V170-I267 HydrophobicContact CG1-CD1 4.07Å
171	N	98.8	Very high	96.7	Very high	0 Å²	0	24 Å²	24	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	126.3	174	-176.1	13.4	0	0	0	109.7	A173 D184 I187 V223 I224 H225 T226	N171-A173 PolarHBondContact O-N 2.97Å; N171-D184 PolarHBondContact ND2-OD1 3.04Å; N171-D184 WeakPolarHBondContact OD1-CA 3.4Å; N171-D184 WeakPolarHBondContact OD1-CB 3.2Å; N171-I187 HydrophobicContact CB-CD1 3.73Å; N171-V223 HydrophobicContact CB-CG1 3.73Å; N171-I224 PolarHBondContact N-O 3.16Å; N171-H225 HydrophobicContact CB-CB 4.49Å; N171-H225 PolarHBondContact ND2-ND1 3.15Å; N171-T226 PolarHBondContact O-N 2.81Å
172	A	97.5	Very high	96.5	Very high	21 Å²	21	26.4 Å²	26.4	17%	0.174	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	76	168.6	0	0	0	0	0	108.8	V183 P265 I267	A172-V183 HydrophobicContact CB-CG1 3.9Å; A172-P265 HydrophobicContact CB-CG 4.19Å; A172-I267 HydrophobicContact CB-CB 4.48Å; A172-I267 HydrophobicContact CB-CG1 4.07Å
173	A	96.3	Very high	96.5	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.008	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	169.7	-170.6	0	0	0	0	0	112.5	N171 L177 H225 T226	N171-A173 PolarHBondContact O-N 2.97Å; A173-L177 HydrophobicContact CB-CD2 4.01Å; A173-H225 HydrophobicContact CB-CB 4.11Å; A173-T226 PolarHBondContact N-O 3.4Å
174	N	95.4	Very high	96.4	Very high	42 Å²	42	26.1 Å²	26.1	23%	0.225	20%	0.195	C	C	.	.			trans	-98.2	167.3	164.9	70.3	88.7	0	0	0	111.1	S176 L177 G179 D184 F272	N174-S176 PolarHBondContact O-N 2.96Å; N174-S176 WeakPolarHBondContact OD1-CB 3.38Å; N174-S176 PolarHBondContact OD1-N 3.49Å; N174-S176 VanDerWaalsContact OD1-N 3.14Å; N174-S176 PolarHBondContact OD1-OG 3.03Å; N174-L177 PolarHBondContact O-N 3.02Å; N174-G179 PolarHBondContact ND2-O 3.19Å; N174-D184 PolarHBondContact ND2-OD2 2.66Å; N174-D184 VanDerWaalsContact ND2-OD2 3.08Å; N174-F272 HydrophobicContact CB-CZ 4.5Å
175	S	95.8	Very high	96.4	Very high	73 Å²	73	26.4 Å²	26.4	51%	0.51	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-17.6	-173.2	56.8	0	0	0	0	115.6	S204 C205	S175-S204 CarbonylContact O-C 3.57Å; S175-S204 WeakPolarHBondContact O-CA 3.39Å; S175-S204 VanDerWaalsContact O-CB 3.25Å; S175-S204 WeakPolarHBondContact O-CB 3.3Å; S175-C205 WeakPolarHBondContact CA-O 3.31Å; S175-C205 WeakPolarHBondContact CB-O 3.35Å; S175-C205 PolarHBondContact O-N 2.93Å
176	S	94.6	Very high	96.4	Very high	42 Å²	42	27.3 Å²	27.3	29%	0.294	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-20.3	175.7	75.8	0	0	0	0	114.4	N174 L178	N174-S176 PolarHBondContact O-N 2.96Å; N174-S176 WeakPolarHBondContact OD1-CB 3.38Å; N174-S176 PolarHBondContact OD1-N 3.49Å; N174-S176 VanDerWaalsContact OD1-N 3.14Å; N174-S176 PolarHBondContact OD1-OG 3.03Å; S176-L178 WeakPolarHBondContact O-CG 3.21Å; S176-L178 PolarHBondContact O-N 3.24Å; S176-L178 VanDerWaalsContact O-N 3.11Å; S176-L178 PolarHBondContact OG-N 2.84Å
177	L	94.8	Very high	96.4	Very high	0 Å²	0	27 Å²	27	0%	0	20%	0.204	C	C	.	.			trans	58.8	9	-169.6	-51.3	177.3	0	0	0	115.5	A173 N174 G179 H188 C199 L202 C205 K211 H225	A173-L177 HydrophobicContact CB-CD2 4.01Å; N174-L177 PolarHBondContact O-N 3.02Å; L177-G179 VanDerWaalsContact C-N 3.27Å; L177-G179 PolarHBondContact O-N 3.29Å; L177-H188 PolarHBondContact O-CE1 3.35Å; L177-C199 HydrophobicContact CB-CB 4.06Å; L177-C199 WeakPolarHBondContact O-CB 3.36Å; L177-C199 PolarHBondContact O-SG 2.99Å; L177-C199 VanDerWaalsContact O-SG 3.33Å; L177-L202 HydrophobicContact CD1-CB 3.82Å; L177-L202 HydrophobicContact CD1-CD1 4.18Å; L177-C205 HydrophobicContact CD1-CB 4.13Å; L177-C205 HydrophobicContact CD2-CB 3.77Å; L177-C205 HydrophobicContact CG-CB 4.1Å; L177-K211 HydrophobicContact CD1-CD 4.13Å; L177-H225 HydrophobicContact CD2-CB 3.69Å
178	L	93.9	Very high	96.3	Very high	85 Å²	85	26.7 Å²	26.7	45%	0.445	20%	0.202	S	C	.	.	S	Bend	trans	-90.3	23.4	-176.3	-55.8	-173.5	0	0	0	113.8	S176 R200	S176-L178 WeakPolarHBondContact O-CG 3.21Å; S176-L178 PolarHBondContact O-N 3.24Å; S176-L178 VanDerWaalsContact O-N 3.11Å; S176-L178 PolarHBondContact OG-N 2.84Å; L178-R200 HydrophobicContact CD2-CG 3.62Å
179	G	90.9	Very high	96.3	Very high	15 Å²	15	34.7 Å²	34.7	16%	0.155	23%	0.232	C	C	.	.			trans	77.6	-176.7	-175.6	0	0	0	0	0	114	N174 L177 D184	N174-G179 PolarHBondContact ND2-O 3.19Å; L177-G179 VanDerWaalsContact C-N 3.27Å; L177-G179 PolarHBondContact O-N 3.29Å; G179-D184 WeakPolarHBondContact CA-OD1 3.31Å; G179-D184 WeakPolarHBondContact CA-OD2 3.47Å
180	G	91.9	Very high	96.3	Very high	46 Å²	46	35 Å²	35	47%	0.474	24%	0.235	S	C	.	.			trans	178.3	-147.3	-178.3	0	0	0	0	0	113.1	D184 G185	G180-D184 PolarHBondContact N-OD2 3.12Å; G180-G185 WeakPolarHBondContact O-CA 3.45Å; G180-G185 PolarHBondContact O-N 2.9Å
181	G	91.9	Very high	96.2	Very high	60 Å²	60	35 Å²	35	62%	0.619	24%	0.235	S	C	*	.	S	Bend	trans	-82.5	-173.9	170.9	0	0	0	0	0	113.2	D184 G185	G181-D184 PolarHBondContact O-N 3.03Å; G181-G185 PolarHBondContact O-N 3.13Å; G181-G185 VanDerWaalsContact O-N 3.17Å
182	G	95.7	Very high	96.1	Very high	59 Å²	59	35.3 Å²	35.3	61%	0.608	24%	0.238	S	C	*	.	H	α-helix	trans	57	-141.7	172.1	0	0	0	0	0	114.3	D184 G185 C186	G182-D184 VanDerWaalsContact C-N 3.33Å; G182-D184 PolarHBondContact O-N 3.48Å; G182-G185 PolarHBondContact O-N 3.24Å; G182-C186 PolarHBondContact O-N 3.42Å; G182-C186 PolarHBondContact O-SG 3.3Å; G182-C186 VanDerWaalsContact O-SG 3.38Å
183	V	97.6	Very high	96	Very high	44 Å²	44	37.6 Å²	37.6	27%	0.267	25%	0.251	S	S	.	.	H	α-helix	trans	-64.6	-35.3	-178.4	69.6	0	0	0	0	112.7	I161 A172 C186 I187 P265	I161-V183 HydrophobicContact CG2-CG2 3.56Å; A172-V183 HydrophobicContact CB-CG1 3.9Å; V183-C186 WeakPolarHBondContact O-CB 3.16Å; V183-C186 PolarHBondContact O-N 3.14Å; V183-C186 VanDerWaalsContact O-N 3.13Å; V183-I187 HydrophobicContact CG2-CD1 3.99Å; V183-I187 HydrophobicContact CG2-CG1 4.39Å; V183-I187 WeakPolarHBondContact O-CG1 3.35Å; V183-I187 PolarHBondContact O-N 2.81Å; V183-P265 HydrophobicContact CG1-CB 4.44Å; V183-P265 HydrophobicContact CG1-CG 4.5Å; V183-P265 HydrophobicContact CG2-CB 4.36Å
184	D	97.9	Very high	96	Very high	7 Å²	7	37.6 Å²	37.6	4%	0.037	25%	0.251	C	S	.	.	H	α-helix	trans	-59	-50.9	177.4	-172.5	13.8	0	0	0	110.9	N171 N174 G179 G180 G181 G182 C186 I187 H188	N171-D184 PolarHBondContact ND2-OD1 3.04Å; N171-D184 WeakPolarHBondContact OD1-CA 3.4Å; N171-D184 WeakPolarHBondContact OD1-CB 3.2Å; N174-D184 PolarHBondContact ND2-OD2 2.66Å; N174-D184 VanDerWaalsContact ND2-OD2 3.08Å; G179-D184 WeakPolarHBondContact CA-OD1 3.31Å; G179-D184 WeakPolarHBondContact CA-OD2 3.47Å; G180-D184 PolarHBondContact N-OD2 3.12Å; G181-D184 PolarHBondContact O-N 3.03Å; G182-D184 VanDerWaalsContact C-N 3.33Å; G182-D184 PolarHBondContact O-N 3.48Å; D184-C186 VanDerWaalsContact C-N 3.33Å; D184-C186 PolarHBondContact O-N 2.77Å; D184-I187 PolarHBondContact O-N 2.96Å; D184-H188 PolarHBondContact O-CD2 3.04Å; D184-H188 PolarHBondContact O-N 3.49Å; D184-H188 IonicContact OD1-CD2 3.19Å; D184-H188 PolarHBondContact OD1-CD2 3.44Å; D184-H188 IonicContact OD1-NE2 3.49Å
185	G	97.8	Very high	96.1	Very high	5 Å²	5	35.6 Å²	35.6	5%	0.052	24%	0.24	C	C	.	.	H	α-helix	trans	-60.8	-36.2	172.8	0	0	0	0	0	114.1	G180 G181 G182 R189	G180-G185 WeakPolarHBondContact O-CA 3.45Å; G180-G185 PolarHBondContact O-N 2.9Å; G181-G185 PolarHBondContact O-N 3.13Å; G181-G185 VanDerWaalsContact O-N 3.17Å; G182-G185 PolarHBondContact O-N 3.24Å; G185-R189 VanDerWaalsContact C-NH1 3.33Å; G185-R189 WeakPolarHBondContact O-CB 3.49Å; G185-R189 WeakPolarHBondContact O-CG 3.47Å; G185-R189 PolarHBondContact O-N 3.38Å; G185-R189 VanDerWaalsContact O-N 3.11Å; G185-R189 PolarHBondContact O-NH1 2.82Å; G185-R189 VanDerWaalsContact O-NH1 3.12Å
186	C	98.4	Very high	96.1	Very high	44 Å²	44	33.5 Å²	33.5	30%	0.297	22%	0.224	S	C	.	.	H	α-helix	trans	-65.1	-45.7	174.8	-67.7	0	0	0	0	111.6	T162 G182 V183 D184 R189 A190	T162-C186 HydrophobicContact CG2-CB 4.1Å; G182-C186 PolarHBondContact O-N 3.42Å; G182-C186 PolarHBondContact O-SG 3.3Å; G182-C186 VanDerWaalsContact O-SG 3.38Å; V183-C186 WeakPolarHBondContact O-CB 3.16Å; V183-C186 PolarHBondContact O-N 3.14Å; V183-C186 VanDerWaalsContact O-N 3.13Å; D184-C186 VanDerWaalsContact C-N 3.33Å; D184-C186 PolarHBondContact O-N 2.77Å; C186-R189 PolarHBondContact O-N 3.28Å; C186-R189 PolarHBondContact SG-NH2 2.91Å; C186-A190 VanDerWaalsContact O-CB 3.28Å; C186-A190 WeakPolarHBondContact O-CB 3.48Å; C186-A190 PolarHBondContact O-N 3.44Å
187	I	98.7	Very high	96.2	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61.5	-48.5	178.9	-72	171.5	0	0	0	110.7	I161 T162 I169 N171 V183 D184 R189 A190 A191 L195 L218 V223	I161-I187 HydrophobicContact CG2-CD1 4.36Å; I161-I187 HydrophobicContact CG2-CG1 4.47Å; T162-I187 HydrophobicContact CG2-CG1 3.92Å; I169-I187 HydrophobicContact CD1-CD1 4.04Å; I169-I187 HydrophobicContact CD1-CG1 3.94Å; N171-I187 HydrophobicContact CB-CD1 3.73Å; V183-I187 HydrophobicContact CG2-CD1 3.99Å; V183-I187 HydrophobicContact CG2-CG1 4.39Å; V183-I187 WeakPolarHBondContact O-CG1 3.35Å; V183-I187 PolarHBondContact O-N 2.81Å; D184-I187 PolarHBondContact O-N 2.96Å; I187-R189 PolarHBondContact O-N 3.2Å; I187-A190 PolarHBondContact O-N 3.21Å; I187-A191 VanDerWaalsContact O-CB 3.28Å; I187-A191 WeakPolarHBondContact O-CB 3.21Å; I187-A191 PolarHBondContact O-N 2.9Å; I187-L195 HydrophobicContact CG2-CD2 3.8Å; I187-L218 HydrophobicContact CG2-CD1 4.37Å; I187-V223 HydrophobicContact CG2-CG1 3.97Å; I187-V223 HydrophobicContact CG2-CG2 4.05Å
188	H	98.4	Very high	96.3	Very high	17 Å²	17	33.8 Å²	33.8	8%	0.079	22%	0.222	C	C	.	.	H	α-helix	trans	-61.9	-42	177.4	-83.8	-101.9	0	0	0	113.1	L177 D184 G192 T196 H225	L177-H188 PolarHBondContact O-CE1 3.35Å; D184-H188 PolarHBondContact O-CD2 3.04Å; D184-H188 PolarHBondContact O-N 3.49Å; D184-H188 IonicContact OD1-CD2 3.19Å; D184-H188 PolarHBondContact OD1-CD2 3.44Å; D184-H188 IonicContact OD1-NE2 3.49Å; H188-G192 PolarHBondContact O-N 3.49Å; H188-G192 VanDerWaalsContact O-N 3.12Å; H188-T196 PolarHBondContact ND1-OG1 3.5Å; H188-H225 AromaticContact CD2-CE1 3.89Å; H188-H225 AromaticContact CE1-CE1 3.86Å; H188-H225 AromaticContact NE2-CE1 3.14Å; H188-H225 PolarHBondContact NE2-CE1 3.26Å
189	R	98.3	Very high	96.5	Very high	168 Å²	168	29.7 Å²	29.7	63%	0.634	20%	0.201	S	C	*	.	H	α-helix	trans	-65.9	-39.7	176.5	-73.6	-172.6	-57	-86	-0.4	112.9	G185 C186 I187	G185-R189 VanDerWaalsContact C-NH1 3.33Å; G185-R189 WeakPolarHBondContact O-CB 3.49Å; G185-R189 WeakPolarHBondContact O-CG 3.47Å; G185-R189 PolarHBondContact O-N 3.38Å; G185-R189 VanDerWaalsContact O-N 3.11Å; G185-R189 PolarHBondContact O-NH1 2.82Å; G185-R189 VanDerWaalsContact O-NH1 3.12Å; C186-R189 PolarHBondContact O-N 3.28Å; C186-R189 PolarHBondContact SG-NH2 2.91Å; I187-R189 PolarHBondContact O-N 3.2Å
190	A	98.4	Very high	96.7	Very high	6 Å²	6	35.9 Å²	35.9	5%	0.05	22%	0.22	C	C	.	.	H	α-helix	trans	-73.5	-42.2	-178.7	0	0	0	0	0	112.4	F115 T162 C186 I187 R217 L218	F115-A190 WeakPolarHBondContact CB-O 3.16Å; F115-A190 HydrophobicContact CD1-CB 3.96Å; F115-A190 HydrophobicContact CD2-CB 3.98Å; F115-A190 HydrophobicContact CE1-CB 3.8Å; F115-A190 HydrophobicContact CE2-CB 3.81Å; F115-A190 HydrophobicContact CG-CB 4.06Å; F115-A190 HydrophobicContact CZ-CB 3.72Å; T162-A190 HydrophobicContact CG2-CB 4.01Å; C186-A190 VanDerWaalsContact O-CB 3.28Å; C186-A190 WeakPolarHBondContact O-CB 3.48Å; C186-A190 PolarHBondContact O-N 3.44Å; I187-A190 PolarHBondContact O-N 3.21Å; A190-R217 WeakPolarHBondContact O-CB 3.45Å; A190-L218 HydrophobicContact CB-CD2 3.62Å
191	A	98.1	Very high	96.9	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-69.7	-35.3	178.6	0	0	0	0	0	113.2	I187 L195 Y216 R217 L218	I187-A191 VanDerWaalsContact O-CB 3.28Å; I187-A191 WeakPolarHBondContact O-CB 3.21Å; I187-A191 PolarHBondContact O-N 2.9Å; A191-L195 HydrophobicContact CB-CB 3.77Å; A191-L195 HydrophobicContact CB-CD2 3.51Å; A191-L195 HydrophobicContact CB-CG 4.23Å; A191-Y216 VanDerWaalsContact O-CB 3.28Å; A191-Y216 WeakPolarHBondContact O-CB 3.49Å; A191-R217 WeakPolarHBondContact O-CB 3.33Å; A191-R217 WeakPolarHBondContact O-CG 3.33Å; A191-R217 PolarHBondContact O-N 2.82Å; A191-L218 HydrophobicContact CB-CD1 3.92Å; A191-L218 HydrophobicContact CB-CG 3.95Å
192	G	96.7	Very high	97	Very high	7 Å²	7	36.3 Å²	36.3	7%	0.072	20%	0.2	C	C	.	.			trans	97.9	177.7	-177.1	0	0	0	0	0	113.8	H188 L194 L195	H188-G192 PolarHBondContact O-N 3.49Å; H188-G192 VanDerWaalsContact O-N 3.12Å; G192-L194 VanDerWaalsContact C-N 3.27Å; G192-L194 PolarHBondContact O-N 3.4Å; G192-L195 PolarHBondContact O-N 3.13Å
193	P	95.4	Very high	96.7	Very high	69 Å²	69	41 Å²	41	45%	0.448	21%	0.206	S	C	.	.	H	α-helix	trans	-60.6	-34.7	-170.5	23.8	-33.7	0	0	0	113.3	L195 T196 D197	P193-L195 PolarHBondContact O-N 3.45Å; P193-L195 VanDerWaalsContact O-N 3.13Å; P193-T196 WeakPolarHBondContact O-CA 3.33Å; P193-T196 VanDerWaalsContact O-CB 3.28Å; P193-T196 WeakPolarHBondContact O-CB 3.27Å; P193-T196 PolarHBondContact O-N 2.8Å; P193-D197 PolarHBondContact O-N 3.44Å
194	L	96.4	Very high	96.5	Very high	1 Å²	1	42 Å²	42	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-56.7	-29.1	-179.7	-62	177	0	0	0	114.1	L89 S92 W95 A98 G192 D197 E198 Y216	L89-L194 HydrophobicContact CD2-CD1 4.48Å; S92-L194 WeakPolarHBondContact O-CD2 3.22Å; W95-L194 HydrophobicContact CB-CB 4.12Å; W95-L194 HydrophobicContact CB-CD2 4.11Å; A98-L194 HydrophobicContact CB-CD1 3.56Å; G192-L194 VanDerWaalsContact C-N 3.27Å; G192-L194 PolarHBondContact O-N 3.4Å; L194-D197 PolarHBondContact O-N 2.88Å; L194-E198 PolarHBondContact O-N 2.87Å; L194-Y216 HydrophobicContact CB-CD1 3.43Å; L194-Y216 VanDerWaalsContact CB-CD1 3.43Å; L194-Y216 HydrophobicContact CB-CE1 3.55Å; L194-Y216 HydrophobicContact CB-CG 3.95Å; L194-Y216 HydrophobicContact CD1-CD1 3.87Å; L194-Y216 HydrophobicContact CD1-CE1 4.29Å; L194-Y216 HydrophobicContact CG-CD1 4.32Å
195	L	97.5	Very high	96.5	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.7	-44.9	172.7	178.7	59.3	0	0	0	111.1	I187 A191 G192 P193 D197 E198 C199 T213 Y216 V223 H225	I187-L195 HydrophobicContact CG2-CD2 3.8Å; A191-L195 HydrophobicContact CB-CB 3.77Å; A191-L195 HydrophobicContact CB-CD2 3.51Å; A191-L195 HydrophobicContact CB-CG 4.23Å; G192-L195 PolarHBondContact O-N 3.13Å; P193-L195 PolarHBondContact O-N 3.45Å; P193-L195 VanDerWaalsContact O-N 3.13Å; L195-D197 VanDerWaalsContact C-N 3.3Å; L195-D197 PolarHBondContact O-N 2.88Å; L195-E198 PolarHBondContact O-N 2.81Å; L195-C199 WeakPolarHBondContact O-CB 3.34Å; L195-C199 PolarHBondContact O-N 2.82Å; L195-C199 PolarHBondContact O-SG 2.94Å; L195-T213 HydrophobicContact CD1-CG2 4.25Å; L195-T213 VanDerWaalsContact CD1-OG1 3.23Å; L195-T213 WeakPolarHBondContact CD1-OG1 3.36Å; L195-Y216 HydrophobicContact CB-CD2 3.79Å; L195-Y216 HydrophobicContact CB-CE2 4.12Å; L195-Y216 HydrophobicContact CD1-CD2 4.21Å; L195-Y216 HydrophobicContact CD1-CE2 4.08Å; L195-V223 HydrophobicContact CD2-CG2 4.43Å; L195-H225 WeakPolarHBondContact CD1-NE2 3.29Å; L195-H225 VanDerWaalsContact CD2-CE1 3.41Å; L195-H225 WeakPolarHBondContact CD2-CE1 3.12Å
196	T	95.6	Very high	96.5	Very high	28 Å²	28	48.2 Å²	48.2	17%	0.172	24%	0.242	C	C	.	.	H	α-helix	trans	-64.7	-37.8	176.5	-49.2	0	0	0	0	111	H188 P193 C199 R200	H188-T196 PolarHBondContact ND1-OG1 3.5Å; P193-T196 WeakPolarHBondContact O-CA 3.33Å; P193-T196 VanDerWaalsContact O-CB 3.28Å; P193-T196 WeakPolarHBondContact O-CB 3.27Å; P193-T196 PolarHBondContact O-N 2.8Å; T196-C199 PolarHBondContact O-N 3.37Å; T196-R200 WeakPolarHBondContact O-CG 3.44Å; T196-R200 PolarHBondContact O-N 2.92Å
197	D	95.3	Very high	96.5	Very high	41 Å²	41	49.4 Å²	49.4	22%	0.219	25%	0.248	C	C	.	.	H	α-helix	trans	-66	-41.1	178.2	-58.1	-33.1	0	0	0	111.9	P193 L194 L195 R200	P193-D197 PolarHBondContact O-N 3.44Å; L194-D197 PolarHBondContact O-N 2.88Å; L195-D197 VanDerWaalsContact C-N 3.3Å; L195-D197 PolarHBondContact O-N 2.88Å; D197-R200 IonicContact OD1-CZ 3.45Å; D197-R200 IonicContact OD1-NH1 2.63Å; D197-R200 PolarHBondContact OD1-NH1 2.96Å; D197-R200 IonicContact OD1-NH2 3.71Å
198	E	97.5	Very high	96.5	Very high	7 Å²	7	49.4 Å²	49.4	3%	0.033	25%	0.249	C	C	.	.	H	α-helix	trans	-65.5	-45.2	171.1	-174.5	173.4	-161.5	0	0	111.6	W95 K99 L194 L195 R200 T201 T213 G214 Y216	W95-E198 HydrophobicContact CD2-CB 3.75Å; W95-E198 HydrophobicContact CD2-CG 4.01Å; W95-E198 HydrophobicContact CE3-CB 3.86Å; W95-E198 HydrophobicContact CE3-CG 3.72Å; W95-E198 HydrophobicContact CG-CB 4.05Å; W95-E198 HydrophobicContact CH2-CG 3.94Å; W95-E198 HydrophobicContact CZ2-CG 4.21Å; W95-E198 HydrophobicContact CZ3-CB 4.34Å; W95-E198 HydrophobicContact CZ3-CG 3.68Å; W95-E198 WeakPolarHBondContact CZ3-OE1 3.3Å; K99-E198 IonicContact NZ-OE1 2.75Å; K99-E198 PolarHBondContact NZ-OE1 3Å; K99-E198 IonicContact NZ-OE2 3.64Å; L194-E198 PolarHBondContact O-N 2.87Å; L195-E198 PolarHBondContact O-N 2.81Å; E198-R200 VanDerWaalsContact C-N 3.27Å; E198-R200 PolarHBondContact O-N 3.49Å; E198-T201 WeakPolarHBondContact O-CB 3.36Å; E198-T201 PolarHBondContact O-N 3.02Å; E198-T201 PolarHBondContact O-OG1 3.44Å; E198-T213 HydrophobicContact CG-CG2 3.95Å; E198-T213 WeakPolarHBondContact OE2-CA 3.12Å; E198-T213 VanDerWaalsContact OE2-CB 3.25Å; E198-T213 WeakPolarHBondContact OE2-CB 3.33Å; E198-G214 PolarHBondContact OE2-N 2.85Å; E198-Y216 WeakPolarHBondContact CB-OH 3.38Å; E198-Y216 VanDerWaalsContact CD-OH 3.32Å; E198-Y216 WeakPolarHBondContact OE2-CE2 3.45Å; E198-Y216 PolarHBondContact OE2-OH 3.22Å
199	C	97.3	Very high	96.5	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-56.4	-38.1	177.1	-76.5	0	0	0	0	112.7	L177 L195 T196 T201 L202 Q203 H225	L177-C199 HydrophobicContact CB-CB 4.06Å; L177-C199 WeakPolarHBondContact O-CB 3.36Å; L177-C199 PolarHBondContact O-SG 2.99Å; L177-C199 VanDerWaalsContact O-SG 3.33Å; L195-C199 WeakPolarHBondContact O-CB 3.34Å; L195-C199 PolarHBondContact O-N 2.82Å; L195-C199 PolarHBondContact O-SG 2.94Å; T196-C199 PolarHBondContact O-N 3.37Å; C199-T201 PolarHBondContact O-N 2.82Å; C199-L202 WeakPolarHBondContact O-CB 3.36Å; C199-L202 PolarHBondContact O-N 3Å; C199-Q203 PolarHBondContact O-N 2.58Å; C199-H225 VanDerWaalsContact SG-CE1 3.53Å
200	R	95.4	Very high	96.5	Very high	145 Å²	145	46.4 Å²	46.4	55%	0.547	24%	0.243	S	C	.	.	H	α-helix	trans	-58	-31.7	174.8	-73.6	-179.6	-159.2	126.4	12.8	112.9	L178 T196 D197 E198 L202 Q203	L178-R200 HydrophobicContact CD2-CG 3.62Å; T196-R200 WeakPolarHBondContact O-CG 3.44Å; T196-R200 PolarHBondContact O-N 2.92Å; D197-R200 IonicContact OD1-CZ 3.45Å; D197-R200 IonicContact OD1-NH1 2.63Å; D197-R200 PolarHBondContact OD1-NH1 2.96Å; D197-R200 IonicContact OD1-NH2 3.71Å; E198-R200 VanDerWaalsContact C-N 3.27Å; E198-R200 PolarHBondContact O-N 3.49Å; R200-L202 VanDerWaalsContact C-N 3.28Å; R200-L202 PolarHBondContact O-N 3.36Å; R200-Q203 PolarHBondContact O-N 2.83Å
201	T	96.4	Very high	96.5	Very high	76 Å²	76	49.4 Å²	49.4	47%	0.466	26%	0.255	S	S	.	.	H	α-helix	trans	-73.7	-20.6	176.4	75.2	0	0	0	0	113.3	W95 E198 C199	W95-T201 HydrophobicContact CZ2-CG2 3.89Å; E198-T201 WeakPolarHBondContact O-CB 3.36Å; E198-T201 PolarHBondContact O-N 3.02Å; E198-T201 PolarHBondContact O-OG1 3.44Å; C199-T201 PolarHBondContact O-N 2.82Å
202	L	93.8	Very high	96.6	Very high	39 Å²	39	50.5 Å²	50.5	20%	0.204	26%	0.261	C	S	.	.	H	α-helix	trans	-84.3	-11.6	177.8	-58.9	-179.3	0	0	0	113.7	L177 C199 R200 S204 K211 T213	L177-L202 HydrophobicContact CD1-CB 3.82Å; L177-L202 HydrophobicContact CD1-CD1 4.18Å; C199-L202 WeakPolarHBondContact O-CB 3.36Å; C199-L202 PolarHBondContact O-N 3Å; R200-L202 VanDerWaalsContact C-N 3.28Å; R200-L202 PolarHBondContact O-N 3.36Å; L202-S204 VanDerWaalsContact C-N 3.3Å; L202-S204 PolarHBondContact O-N 3.36Å; L202-K211 HydrophobicContact CB-CD 4.01Å; L202-K211 HydrophobicContact CD1-CB 4.02Å; L202-K211 HydrophobicContact CD1-CD 4.37Å; L202-K211 HydrophobicContact CD2-CD 4.48Å; L202-K211 PolarHBondContact O-NZ 3.14Å; L202-T213 HydrophobicContact CD1-CG2 3.55Å
203	Q	89.3	Confident	96.7	Very high	158 Å²	158	50.2 Å²	50.2	74%	0.738	26%	0.257	S	S	*	.			trans	63.5	-68.4	179.6	-54.7	176.9	15.2	0	0	115.4	C199 R200	C199-Q203 PolarHBondContact O-N 2.58Å; R200-Q203 PolarHBondContact O-N 2.83Å
204	S	94.9	Very high	96.8	Very high	63 Å²	63	47.1 Å²	47.1	44%	0.441	24%	0.238	S	C	.	.			trans	-153.1	168.4	-175.2	65.1	0	0	0	0	112	S175 L202 K211	S175-S204 CarbonylContact O-C 3.57Å; S175-S204 WeakPolarHBondContact O-CA 3.39Å; S175-S204 VanDerWaalsContact O-CB 3.25Å; S175-S204 WeakPolarHBondContact O-CB 3.3Å; L202-S204 VanDerWaalsContact C-N 3.3Å; L202-S204 PolarHBondContact O-N 3.36Å; S204-K211 VanDerWaalsContact O-CE 3.3Å; S204-K211 WeakPolarHBondContact O-CE 3.29Å; S204-K211 PolarHBondContact O-NZ 3.41Å
205	C	97.6	Very high	96.9	Very high	6 Å²	6	47.1 Å²	47.1	4%	0.041	24%	0.238	C	C	.	.			trans	-136.3	136.7	169.4	-171.4	0	0	0	0	111	S175 L177 K209 V227	S175-C205 WeakPolarHBondContact CA-O 3.31Å; S175-C205 WeakPolarHBondContact CB-O 3.35Å; S175-C205 PolarHBondContact O-N 2.93Å; L177-C205 HydrophobicContact CD1-CB 4.13Å; L177-C205 HydrophobicContact CD2-CB 3.77Å; L177-C205 HydrophobicContact CG-CB 4.1Å; C205-K209 VanDerWaalsContact SG-C 3.6Å; C205-K209 PolarHBondContact SG-O 2.87Å; C205-V227 HydrophobicContact CB-CG2 3.7Å
206	E	98.1	Very high	96.9	Very high	138 Å²	138	47.4 Å²	47.4	65%	0.645	24%	0.24	S	C	*	.			trans	-75.9	153.5	175.2	-65.7	172.5	-175.1	0	0	111.1	G208 K209	E206-G208 PolarHBondContact O-N 2.97Å; E206-K209 HydrophobicContact CB-CB 4.27Å; E206-K209 HydrophobicContact CB-CG 3.81Å; E206-K209 WeakPolarHBondContact O-CB 3.18Å; E206-K209 PolarHBondContact O-N 3.24Å; E206-K209 VanDerWaalsContact O-N 3.11Å
207	T	98.3	Very high	97.1	Very high	68 Å²	68	49.8 Å²	49.8	42%	0.417	25%	0.245	S	C	.	.	B	Isolated β-bridge	trans	-56.9	135.5	172.7	-50.9	0	0	0	0	110.7	K209 V227 P229 E242	T207-K209 PolarHBondContact O-N 3.44Å; T207-V227 CarbonylContact C-O 3.59Å; T207-V227 WeakPolarHBondContact CA-O 3.48Å; T207-P229 HydrophobicContact CG2-CB 4.28Å; T207-E242 HydrophobicContact CG2-CB 4.1Å; T207-E242 HydrophobicContact CG2-CG 4.17Å
208	G	98	Very high	97.2	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.01	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.2	-0.7	-178.1	0	0	0	0	0	114.8	E206 V227 E242 S245 S249	E206-G208 PolarHBondContact O-N 2.97Å; G208-V227 PolarHBondContact N-O 2.7Å; G208-E242 WeakPolarHBondContact CA-O 2.88Å; G208-S245 CarbonylContact O-C 3.45Å; G208-S245 VanDerWaalsContact O-CB 3.32Å; G208-S245 WeakPolarHBondContact O-CB 3.38Å; G208-S245 PolarHBondContact O-OG 2.87Å; G208-S249 PolarHBondContact O-OG 2.9Å
209	K	98.6	Very high	97.3	Very high	103 Å²	103	47.5 Å²	47.5	45%	0.448	23%	0.233	S	C	.	.			trans	-103.6	167.6	173.8	-57.2	-56.9	-177.3	-175.9	0	111.3	C205 E206 T207 T226 V227	C205-K209 VanDerWaalsContact SG-C 3.6Å; C205-K209 PolarHBondContact SG-O 2.87Å; E206-K209 HydrophobicContact CB-CB 4.27Å; E206-K209 HydrophobicContact CB-CG 3.81Å; E206-K209 WeakPolarHBondContact O-CB 3.18Å; E206-K209 PolarHBondContact O-N 3.24Å; E206-K209 VanDerWaalsContact O-N 3.11Å; T207-K209 PolarHBondContact O-N 3.44Å; K209-T226 VanDerWaalsContact O-CA 3.32Å; K209-T226 WeakPolarHBondContact O-CA 3.36Å; K209-T226 WeakPolarHBondContact O-CB 3.35Å; K209-T226 PolarHBondContact O-OG1 3.49Å; K209-V227 PolarHBondContact O-N 3.29Å
210	A	98.6	Very high	97.4	Very high	18 Å²	18	47.5 Å²	47.5	15%	0.149	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	156.2	178	0	0	0	0	0	112.3	I224 H225 L253	A210-I224 HydrophobicContact CB-CG2 4.01Å; A210-H225 CarbonylContact C-O 3.59Å; A210-H225 WeakPolarHBondContact CA-O 3.16Å; A210-L253 HydrophobicContact CB-CD1 3.69Å
211	K	98.7	Very high	97.5	Very high	70 Å²	70	43.8 Å²	43.8	30%	0.304	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	150.9	171.9	-65.4	-171.9	173	175.9	0	110.4	L177 L202 S204 I224 H225	L177-K211 HydrophobicContact CD1-CD 4.13Å; L202-K211 HydrophobicContact CB-CD 4.01Å; L202-K211 HydrophobicContact CD1-CB 4.02Å; L202-K211 HydrophobicContact CD1-CD 4.37Å; L202-K211 HydrophobicContact CD2-CD 4.48Å; L202-K211 PolarHBondContact O-NZ 3.14Å; S204-K211 VanDerWaalsContact O-CE 3.3Å; S204-K211 WeakPolarHBondContact O-CE 3.29Å; S204-K211 PolarHBondContact O-NZ 3.41Å; K211-I224 CarbonylContact O-C 3.41Å; K211-H225 PolarHBondContact N-O 3.05Å; K211-H225 PolarHBondContact O-N 2.66Å
212	I	98.7	Very high	97.6	Very high	23 Å²	23	42.3 Å²	42.3	12%	0.118	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	141.4	-174.4	-168.8	170.5	0	0	0	113	Y222 V223 I224 L253 H257 L259	I212-Y222 HydrophobicContact CD1-CD1 3.96Å; I212-Y222 HydrophobicContact CD1-CG 4.01Å; I212-Y222 HydrophobicContact CG1-CD1 4.06Å; I212-Y222 HydrophobicContact CG1-CG 4.35Å; I212-V223 WeakPolarHBondContact CA-O 3.38Å; I212-I224 HydrophobicContact CB-CG1 4.25Å; I212-I224 HydrophobicContact CD1-CD1 4.27Å; I212-I224 HydrophobicContact CD1-CG1 3.84Å; I212-I224 HydrophobicContact CG1-CG1 3.83Å; I212-L253 HydrophobicContact CB-CD1 4.32Å; I212-L253 HydrophobicContact CG2-CD2 4.19Å; I212-H257 HydrophobicContact CD1-CB 4.29Å; I212-H257 WeakPolarHBondContact CG2-NE2 3.36Å; I212-L259 HydrophobicContact CD1-CD1 4Å
213	T	98.8	Very high	97.9	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	167.6	-179.1	55.4	0	0	0	0	110.3	L195 E198 L202 Y222 V223 H225	L195-T213 HydrophobicContact CD1-CG2 4.25Å; L195-T213 VanDerWaalsContact CD1-OG1 3.23Å; L195-T213 WeakPolarHBondContact CD1-OG1 3.36Å; E198-T213 HydrophobicContact CG-CG2 3.95Å; E198-T213 WeakPolarHBondContact OE2-CA 3.12Å; E198-T213 VanDerWaalsContact OE2-CB 3.25Å; E198-T213 WeakPolarHBondContact OE2-CB 3.33Å; L202-T213 HydrophobicContact CD1-CG2 3.55Å; T213-Y222 VanDerWaalsContact O-CA 3.3Å; T213-Y222 WeakPolarHBondContact O-CA 3.44Å; T213-Y222 WeakPolarHBondContact O-CB 3.3Å; T213-Y222 WeakPolarHBondContact O-CD1 3.46Å; T213-V223 PolarHBondContact N-O 3.08Å; T213-V223 PolarHBondContact O-N 2.71Å; T213-V223 PolarHBondContact OG1-O 2.74Å; T213-H225 WeakPolarHBondContact CB-NE2 3.35Å; T213-H225 WeakPolarHBondContact CG2-NE2 3.36Å; T213-H225 PolarHBondContact OG1-CD2 3.33Å; T213-H225 PolarHBondContact OG1-NE2 3.1Å
214	G	98.6	Very high	98.3	Very high	4 Å²	4	33 Å²	33	4%	0.041	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	153.9	169.6	0	0	0	0	0	112.6	E198 Y216	E198-G214 PolarHBondContact OE2-N 2.85Å; G214-Y216 WeakPolarHBondContact O-CD2 3.27Å; G214-Y216 WeakPolarHBondContact O-CE2 3.28Å
215	G	98.4	Very high	98.5	Very high	1 Å²	1	30 Å²	30	1%	0.01	14%	0.142	C	C	.	.			trans	-81.1	-16.1	173.6	0	0	0	0	0	114.6	R217 L218 K221	G215-R217 PolarHBondContact O-N 3.37Å; G215-R217 VanDerWaalsContact O-N 3.12Å; G215-L218 VanDerWaalsContact O-CB 3.23Å; G215-L218 WeakPolarHBondContact O-CB 3.3Å; G215-L218 WeakPolarHBondContact O-CD1 3.26Å; G215-L218 VanDerWaalsContact O-CG 3.31Å; G215-L218 WeakPolarHBondContact O-CG 3.26Å; G215-L218 PolarHBondContact O-N 2.64Å; G215-K221 PolarHBondContact N-O 3.49Å
216	Y	98.1	Very high	98.6	Very high	7 Å²	7	29.7 Å²	29.7	3%	0.027	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	-112.8	-179.1	-59.1	-79.2	0	0	0	112.4	W95 A98 L102 A191 L194 L195 E198 G214 L218	W95-Y216 HydrophobicContact CB-CE1 4.01Å; A98-Y216 HydrophobicContact CB-CD1 4.36Å; A98-Y216 HydrophobicContact CB-CE1 4.33Å; L102-Y216 WeakPolarHBondContact CD1-O 3.28Å; A191-Y216 VanDerWaalsContact O-CB 3.28Å; A191-Y216 WeakPolarHBondContact O-CB 3.49Å; L194-Y216 HydrophobicContact CB-CD1 3.43Å; L194-Y216 VanDerWaalsContact CB-CD1 3.43Å; L194-Y216 HydrophobicContact CB-CE1 3.55Å; L194-Y216 HydrophobicContact CB-CG 3.95Å; L194-Y216 HydrophobicContact CD1-CD1 3.87Å; L194-Y216 HydrophobicContact CD1-CE1 4.29Å; L194-Y216 HydrophobicContact CG-CD1 4.32Å; L195-Y216 HydrophobicContact CB-CD2 3.79Å; L195-Y216 HydrophobicContact CB-CE2 4.12Å; L195-Y216 HydrophobicContact CD1-CD2 4.21Å; L195-Y216 HydrophobicContact CD1-CE2 4.08Å; E198-Y216 WeakPolarHBondContact CB-OH 3.38Å; E198-Y216 VanDerWaalsContact CD-OH 3.32Å; E198-Y216 WeakPolarHBondContact OE2-CE2 3.45Å; E198-Y216 PolarHBondContact OE2-OH 3.22Å; G214-Y216 WeakPolarHBondContact O-CD2 3.27Å; G214-Y216 WeakPolarHBondContact O-CE2 3.28Å; Y216-L218 VanDerWaalsContact C-N 3.27Å; Y216-L218 PolarHBondContact O-N 3.03Å
217	R	98.1	Very high	98.6	Very high	77 Å²	77	23.4 Å²	23.4	29%	0.291	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-0.9	179.3	-59	172.6	64.2	-144.3	1	113.6	L89 Y114 F115 A190 A191 G215	L89-R217 HydrophobicContact CB-CG 3.73Å; L89-R217 HydrophobicContact CD1-CG 4.03Å; Y114-R217 CarbonylContact C-O 3.55Å; Y114-R217 VanDerWaalsContact CA-O 3.3Å; Y114-R217 WeakPolarHBondContact CA-O 3.25Å; F115-R217 HydrophobicContact CB-CB 4.09Å; F115-R217 WeakPolarHBondContact CD1-O 3.36Å; F115-R217 PolarHBondContact N-O 3.19Å; A190-R217 WeakPolarHBondContact O-CB 3.45Å; A191-R217 WeakPolarHBondContact O-CB 3.33Å; A191-R217 WeakPolarHBondContact O-CG 3.33Å; A191-R217 PolarHBondContact O-N 2.82Å; G215-R217 PolarHBondContact O-N 3.37Å; G215-R217 VanDerWaalsContact O-N 3.12Å
218	L	98.8	Very high	98.6	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	9%	0.092	C	C	.	.	S	Bend	trans	-71.2	149	173.6	-66.6	165.4	0	0	0	111.6	F115 T162 I169 I187 A190 A191 G215 Y216 A220 V223	F115-L218 HydrophobicContact CD1-CD2 4.38Å; F115-L218 HydrophobicContact CE1-CD2 4.07Å; T162-L218 HydrophobicContact CG2-CD2 4.32Å; T162-L218 WeakPolarHBondContact O-CD2 3.38Å; I169-L218 HydrophobicContact CD1-CD1 3.79Å; I169-L218 HydrophobicContact CD1-CD2 4.34Å; I169-L218 HydrophobicContact CG1-CD1 4.4Å; I187-L218 HydrophobicContact CG2-CD1 4.37Å; A190-L218 HydrophobicContact CB-CD2 3.62Å; A191-L218 HydrophobicContact CB-CD1 3.92Å; A191-L218 HydrophobicContact CB-CG 3.95Å; G215-L218 VanDerWaalsContact O-CB 3.23Å; G215-L218 WeakPolarHBondContact O-CB 3.3Å; G215-L218 WeakPolarHBondContact O-CD1 3.26Å; G215-L218 VanDerWaalsContact O-CG 3.31Å; G215-L218 WeakPolarHBondContact O-CG 3.26Å; G215-L218 PolarHBondContact O-N 2.64Å; Y216-L218 VanDerWaalsContact C-N 3.27Å; Y216-L218 PolarHBondContact O-N 3.03Å; L218-A220 HydrophobicContact CB-CB 4.17Å; L218-A220 PolarHBondContact O-N 3.4Å; L218-V223 HydrophobicContact CD1-CG2 3.45Å; L218-V223 VanDerWaalsContact CD1-CG2 3.45Å
219	P	98.7	Very high	98.6	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	9%	0.092	C	C	.	.	S	Bend	trans	-56.3	-32.6	161.3	-23.9	34.4	0	0	0	113	R110 Y114 F119 T162 E165	R110-P219 PolarHBondContact NH1-O 3.14Å; R110-P219 PolarHBondContact NH2-O 3.03Å; Y114-P219 HydrophobicContact CD1-CB 4.45Å; Y114-P219 HydrophobicContact CD2-CB 3.95Å; Y114-P219 HydrophobicContact CD2-CG 3.86Å; Y114-P219 VanDerWaalsContact CE1-CA 3.5Å; Y114-P219 HydrophobicContact CE1-CB 4.35Å; Y114-P219 HydrophobicContact CE2-CB 3.83Å; Y114-P219 HydrophobicContact CE2-CG 4.27Å; Y114-P219 HydrophobicContact CG-CB 4.29Å; Y114-P219 HydrophobicContact CG-CG 4.01Å; F119-P219 HydrophobicContact CB-CB 4.09Å; F119-P219 HydrophobicContact CB-CG 3.64Å; T162-P219 VanDerWaalsContact O-CD 3.3Å; T162-P219 WeakPolarHBondContact O-CD 3.25Å; E165-P219 HydrophobicContact CB-CB 3.94Å
220	A	98.9	Very high	98.5	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.008	9%	0.088	C	C	.	.	S	Bend	trans	-65	137.8	172.2	0	0	0	0	0	112.1	L164 V166 I169 L218	L164-A220 PolarHBondContact O-N 3.49Å; V166-A220 HydrophobicContact CG2-CB 4.45Å; V166-A220 VanDerWaalsContact O-CA 3.28Å; V166-A220 WeakPolarHBondContact O-CA 3.46Å; I169-A220 HydrophobicContact CB-CB 4.34Å; I169-A220 HydrophobicContact CD1-CB 4.42Å; I169-A220 HydrophobicContact CG1-CB 3.97Å; I169-A220 HydrophobicContact CG2-CB 3.75Å; L218-A220 HydrophobicContact CB-CB 4.17Å; L218-A220 PolarHBondContact O-N 3.4Å
221	K	98.8	Very high	98.1	Very high	66 Å²	66	18.2 Å²	18.2	29%	0.287	8%	0.083	S	C	.	.	S	Bend	trans	-73.3	-34	179.7	-63.9	168.3	-173.9	160.9	0	112.4	D107 V166 D167 G215	D107-K221 WeakPolarHBondContact OD1-CE 3.35Å; D107-K221 IonicContact OD1-NZ 2.74Å; D107-K221 PolarHBondContact OD1-NZ 2.7Å; D107-K221 IonicContact OD2-NZ 3.91Å; D107-K221 PolarHBondContact OD2-NZ 2.76Å; V166-K221 PolarHBondContact O-N 3.11Å; D167-K221 CarbonylContact O-C 3.54Å; D167-K221 WeakPolarHBondContact O-CB 3.45Å; D167-K221 PolarHBondContact O-N 2.78Å; D167-K221 WeakPolarHBondContact OD1-CD 3.44Å; D167-K221 IonicContact OD1-NZ 2.76Å; D167-K221 PolarHBondContact OD1-NZ 3Å; G215-K221 PolarHBondContact N-O 3.49Å
222	Y	98.9	Very high	97.5	Very high	45 Å²	45	24.4 Å²	24.4	18%	0.176	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	156.5	-177.7	-63.4	-86.5	0	0	0	111.9	D167 A168 I169 I212 T213 L259	D167-Y222 PolarHBondContact O-N 2.86Å; A168-Y222 WeakPolarHBondContact CA-O 3.4Å; I169-Y222 PolarHBondContact N-O 2.98Å; I169-Y222 VanDerWaalsContact N-O 3.13Å; I212-Y222 HydrophobicContact CD1-CD1 3.96Å; I212-Y222 HydrophobicContact CD1-CG 4.01Å; I212-Y222 HydrophobicContact CG1-CD1 4.06Å; I212-Y222 HydrophobicContact CG1-CG 4.35Å; T213-Y222 VanDerWaalsContact O-CA 3.3Å; T213-Y222 WeakPolarHBondContact O-CA 3.44Å; T213-Y222 WeakPolarHBondContact O-CB 3.3Å; T213-Y222 WeakPolarHBondContact O-CD1 3.46Å; Y222-L259 HydrophobicContact CD2-CD1 3.59Å; Y222-L259 HydrophobicContact CD2-CD2 3.74Å; Y222-L259 HydrophobicContact CD2-CG 4.34Å; Y222-L259 HydrophobicContact CE2-CD1 4.24Å; Y222-L259 HydrophobicContact CE2-CD2 3.6Å; Y222-L259 HydrophobicContact CG-CD1 4.02Å
223	V	98.9	Very high	96.8	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	126.3	163.9	-177.8	0	0	0	0	108.7	I169 N171 I187 L195 I212 T213 L218	I169-V223 HydrophobicContact CD1-CG2 4.46Å; I169-V223 HydrophobicContact CG1-CG2 4.06Å; I169-V223 WeakPolarHBondContact O-CA 3.23Å; N171-V223 HydrophobicContact CB-CG1 3.73Å; I187-V223 HydrophobicContact CG2-CG1 3.97Å; I187-V223 HydrophobicContact CG2-CG2 4.05Å; L195-V223 HydrophobicContact CD2-CG2 4.43Å; I212-V223 WeakPolarHBondContact CA-O 3.38Å; T213-V223 PolarHBondContact N-O 3.08Å; T213-V223 PolarHBondContact O-N 2.71Å; T213-V223 PolarHBondContact OG1-O 2.74Å; L218-V223 HydrophobicContact CD1-CG2 3.45Å; L218-V223 VanDerWaalsContact CD1-CG2 3.45Å
224	I	98.9	Very high	96.4	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	107.3	173.4	-62.7	173.5	0	0	0	107.6	A168 I169 V170 N171 A210 K211 I212 L253 L254	A168-I224 HydrophobicContact CB-CD1 3.74Å; A168-I224 HydrophobicContact CB-CG1 4.1Å; I169-I224 PolarHBondContact O-N 2.83Å; V170-I224 CarbonylContact C-O 3.56Å; V170-I224 VanDerWaalsContact CA-O 3.24Å; V170-I224 WeakPolarHBondContact CA-O 3.32Å; V170-I224 WeakPolarHBondContact CG1-O 3.39Å; V170-I224 HydrophobicContact CG2-CB 4.3Å; N171-I224 PolarHBondContact N-O 3.16Å; A210-I224 HydrophobicContact CB-CG2 4.01Å; K211-I224 CarbonylContact O-C 3.41Å; I212-I224 HydrophobicContact CB-CG1 4.25Å; I212-I224 HydrophobicContact CD1-CD1 4.27Å; I212-I224 HydrophobicContact CD1-CG1 3.84Å; I212-I224 HydrophobicContact CG1-CG1 3.83Å; I224-L253 HydrophobicContact CD1-CB 4.32Å; I224-L253 HydrophobicContact CG2-CD1 3.98Å; I224-L254 HydrophobicContact CD1-CD1 4.1Å
225	H	98.8	Very high	96.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	127.6	-179.8	-54.5	-101	0	0	0	109.7	N171 A173 L177 H188 L195 C199 A210 K211 T213	N171-H225 HydrophobicContact CB-CB 4.49Å; N171-H225 PolarHBondContact ND2-ND1 3.15Å; A173-H225 HydrophobicContact CB-CB 4.11Å; L177-H225 HydrophobicContact CD2-CB 3.69Å; H188-H225 AromaticContact CD2-CE1 3.89Å; H188-H225 AromaticContact CE1-CE1 3.86Å; H188-H225 AromaticContact NE2-CE1 3.14Å; H188-H225 PolarHBondContact NE2-CE1 3.26Å; L195-H225 WeakPolarHBondContact CD1-NE2 3.29Å; L195-H225 VanDerWaalsContact CD2-CE1 3.41Å; L195-H225 WeakPolarHBondContact CD2-CE1 3.12Å; C199-H225 VanDerWaalsContact SG-CE1 3.53Å; A210-H225 CarbonylContact C-O 3.59Å; A210-H225 WeakPolarHBondContact CA-O 3.16Å; K211-H225 PolarHBondContact N-O 3.05Å; K211-H225 PolarHBondContact O-N 2.66Å; T213-H225 WeakPolarHBondContact CB-NE2 3.35Å; T213-H225 WeakPolarHBondContact CG2-NE2 3.36Å; T213-H225 PolarHBondContact OG1-CD2 3.33Å; T213-H225 PolarHBondContact OG1-NE2 3.1Å
226	T	98.8	Very high	96.2	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	145.1	175.6	-172.2	0	0	0	0	110.5	V170 N171 A173 K209 C246 I267	V170-T226 HydrophobicContact CG1-CG2 3.65Å; N171-T226 PolarHBondContact O-N 2.81Å; A173-T226 PolarHBondContact N-O 3.4Å; K209-T226 VanDerWaalsContact O-CA 3.32Å; K209-T226 WeakPolarHBondContact O-CA 3.36Å; K209-T226 WeakPolarHBondContact O-CB 3.35Å; K209-T226 PolarHBondContact O-OG1 3.49Å; T226-C246 HydrophobicContact CG2-CB 3.98Å; T226-C246 WeakPolarHBondContact OG1-CA 3.45Å; T226-C246 VanDerWaalsContact OG1-CB 3.32Å; T226-C246 WeakPolarHBondContact OG1-CB 3.28Å; T226-I267 HydrophobicContact CG2-CD1 3.58Å
227	V	98.6	Very high	96.1	Very high	6 Å²	6	41.6 Å²	41.6	4%	0.036	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	110	-174.6	-178.6	0	0	0	0	109.3	C205 T207 G208 K209 C246	C205-V227 HydrophobicContact CB-CG2 3.7Å; T207-V227 CarbonylContact C-O 3.59Å; T207-V227 WeakPolarHBondContact CA-O 3.48Å; G208-V227 PolarHBondContact N-O 2.7Å; K209-V227 PolarHBondContact O-N 3.29Å; V227-C246 PolarHBondContact O-SG 2.79Å
228	G	97.9	Very high	96	Very high	2 Å²	2	41.2 Å²	41.2	2%	0.021	23%	0.229	C	C	.	.			trans	-76.6	156.1	-179.7	0	0	0	0	0	113.8	S268	G228-S268 VanDerWaalsContact C-OG 3.27Å; G228-S268 VanDerWaalsContact CA-OG 3.26Å; G228-S268 WeakPolarHBondContact CA-OG 3.12Å
229	P	97.6	Very high	96	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.013	24%	0.238	C	C	.	.			trans	-66.1	152.8	173.7	30	-38.3	0	0	0	112.3	T207 Q239 E242 L243 S268 F272 Y274	T207-P229 HydrophobicContact CG2-CB 4.28Å; P229-Q239 HydrophobicContact CB-CB 3.99Å; P229-Q239 HydrophobicContact CB-CG 4.09Å; P229-Q239 HydrophobicContact CG-CB 4.49Å; P229-Q239 WeakPolarHBondContact CG-O 3.23Å; P229-E242 HydrophobicContact CB-CB 4.02Å; P229-E242 WeakPolarHBondContact CB-OE2 3.31Å; P229-E242 HydrophobicContact CG-CB 4.21Å; P229-L243 HydrophobicContact CG-CB 3.92Å; P229-S268 WeakPolarHBondContact CD-OG 3.4Å; P229-S268 VanDerWaalsContact O-CB 3.29Å; P229-S268 WeakPolarHBondContact O-CB 3.24Å; P229-S268 PolarHBondContact O-OG 3.13Å; P229-F272 WeakPolarHBondContact O-CB 3.46Å; P229-Y274 HydrophobicContact CG-CD2 4.08Å; P229-Y274 HydrophobicContact CG-CE2 4.18Å
230	I	96.8	Very high	95.9	Very high	71 Å²	71	44.5 Å²	44.5	36%	0.364	25%	0.249	S	C	.	.			trans	-103.4	109	174.7	-55	172.7	0	0	0	108.6	Y232 Q239 F272	I230-Y232 HydrophobicContact CG2-CD1 4.25Å; I230-Y232 HydrophobicContact CG2-CD2 4.02Å; I230-Y232 HydrophobicContact CG2-CE1 3.82Å; I230-Y232 HydrophobicContact CG2-CE2 3.57Å; I230-Y232 HydrophobicContact CG2-CG 4.35Å; I230-Y232 VanDerWaalsContact CG2-CZ 3.46Å; I230-Q239 PolarHBondContact O-NE2 2.82Å; I230-F272 HydrophobicContact CD1-CD1 4.38Å; I230-F272 HydrophobicContact CD1-CE1 4.47Å; I230-F272 HydrophobicContact CG1-CB 4.21Å; I230-F272 HydrophobicContact CG1-CD1 3.89Å; I230-F272 HydrophobicContact CG1-CD2 4.34Å; I230-F272 HydrophobicContact CG1-CE1 4.33Å; I230-F272 HydrophobicContact CG1-CG 3.9Å
231	A	90.6	Very high	95.9	Very high	6 Å²	6	47.2 Å²	47.2	5%	0.05	27%	0.272	C	S	.	.			trans	-103.1	-17.7	-167.5	0	0	0	0	0	115.1	G233 E234 P235 F272 Y274	A231-G233 PolarHBondContact O-N 3.18Å; A231-E234 PolarHBondContact O-N 3.12Å; A231-P235 HydrophobicContact CB-CB 3.85Å; A231-F272 PolarHBondContact N-O 3.23Å; A231-Y274 HydrophobicContact CB-CD2 3.77Å; A231-Y274 HydrophobicContact CB-CE2 4.47Å; A231-Y274 HydrophobicContact CB-CG 4.13Å
232	Y	86.5	Confident	95.9	Very high	200 Å²	200	47.2 Å²	47.2	78%	0.784	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	28.8	-178.6	-59.7	-65.8	0	0	0	115.6	I230	I230-Y232 HydrophobicContact CG2-CD1 4.25Å; I230-Y232 HydrophobicContact CG2-CD2 4.02Å; I230-Y232 HydrophobicContact CG2-CE1 3.82Å; I230-Y232 HydrophobicContact CG2-CE2 3.57Å; I230-Y232 HydrophobicContact CG2-CG 4.35Å; I230-Y232 VanDerWaalsContact CG2-CZ 3.46Å
233	G	83.8	Confident	95.9	Very high	38 Å²	38	45 Å²	45	39%	0.392	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.7	-31.4	178.5	0	0	0	0	0	115.6	A231 P235 G273 P275	A231-G233 PolarHBondContact O-N 3.18Å; G233-P235 WeakPolarHBondContact O-CD 3.43Å; G233-G273 WeakPolarHBondContact CA-O 3.42Å; G233-G273 PolarHBondContact N-O 3.07Å; G233-P275 WeakPolarHBondContact O-CG 3.32Å
234	E	90.6	Very high	95.9	Very high	176 Å²	176	50.3 Å²	50.3	82%	0.822	28%	0.284	S	S	*	.	S	Bend	trans	-124	85.3	-177.6	-70.2	-172.6	178.1	0	0	110.8	A231 S236	A231-E234 PolarHBondContact O-N 3.12Å; E234-S236 PolarHBondContact O-N 2.93Å
235	P	95.1	Very high	95.9	Very high	41 Å²	41	51.9 Å²	51.9	27%	0.266	30%	0.296	S	S	.	.			trans	-69.7	131.2	-175.9	27.5	-34.1	0	0	0	112.2	A231 G233 Q239 Y274 P275	A231-P235 HydrophobicContact CB-CB 3.85Å; G233-P235 WeakPolarHBondContact O-CD 3.43Å; P235-Q239 VanDerWaalsContact CA-OE1 3.32Å; P235-Q239 HydrophobicContact CB-CB 4.34Å; P235-Y274 HydrophobicContact CB-CD2 4.06Å; P235-Y274 HydrophobicContact CB-CE1 4.06Å; P235-Y274 HydrophobicContact CB-CE2 3.5Å; P235-Y274 VanDerWaalsContact CB-CZ 3.49Å; P235-Y274 HydrophobicContact CG-CD1 4.31Å; P235-Y274 HydrophobicContact CG-CE1 3.79Å; P235-Y274 HydrophobicContact CG-CE2 4.18Å; P235-P275 HydrophobicContact CG-CG 4.46Å
236	S	96.4	Very high	95.9	Very high	51 Å²	51	51.9 Å²	51.9	36%	0.357	30%	0.296	S	S	.	.			trans	-70.8	166.3	171.2	82.5	0	0	0	0	112.1	E234 S238 Q239 A240	E234-S236 PolarHBondContact O-N 2.93Å; S236-S238 PolarHBondContact O-N 3.15Å; S236-S238 PolarHBondContact OG-N 3.12Å; S236-S238 PolarHBondContact OG-OG 2.66Å; S236-Q239 PolarHBondContact O-N 2.95Å; S236-Q239 VanDerWaalsContact O-N 3.13Å; S236-Q239 WeakPolarHBondContact OG-CG 3.37Å; S236-Q239 PolarHBondContact OG-N 3.18Å; S236-Q239 VanDerWaalsContact OG-N 3.11Å; S236-A240 PolarHBondContact O-N 2.94Å
237	A	96	Very high	95.9	Very high	90 Å²	90	52 Å²	52	74%	0.744	30%	0.296	S	S	*	.	H	α-helix	trans	-60.1	-31.7	171.8	0	0	0	0	0	113.2	A241	A237-A241 PolarHBondContact O-N 2.7Å; A237-A241 VanDerWaalsContact O-N 3.16Å
238	S	96.9	Very high	95.9	Very high	69 Å²	69	54.3 Å²	54.3	48%	0.483	31%	0.308	S	S	.	.	H	α-helix	trans	-70.1	-39.4	174.4	71.5	0	0	0	0	111.2	S236 A240 A241 E242	S236-S238 PolarHBondContact O-N 3.15Å; S236-S238 PolarHBondContact OG-N 3.12Å; S236-S238 PolarHBondContact OG-OG 2.66Å; S238-A240 PolarHBondContact O-N 2.86Å; S238-A241 CarbonylContact O-C 3.46Å; S238-A241 WeakPolarHBondContact O-CB 3.47Å; S238-A241 PolarHBondContact O-N 2.78Å; S238-A241 VanDerWaalsContact O-N 3.13Å; S238-E242 WeakPolarHBondContact O-CG 3.46Å; S238-E242 PolarHBondContact O-N 3.3Å
239	Q	97.8	Very high	95.9	Very high	41 Å²	41	55.1 Å²	55.1	19%	0.192	31%	0.313	C	S	.	.	H	α-helix	trans	-68	-34.5	177.2	-69.6	169	-25.6	0	0	111.9	P229 I230 P235 S236 A241 E242 L243	P229-Q239 HydrophobicContact CB-CB 3.99Å; P229-Q239 HydrophobicContact CB-CG 4.09Å; P229-Q239 HydrophobicContact CG-CB 4.49Å; P229-Q239 WeakPolarHBondContact CG-O 3.23Å; I230-Q239 PolarHBondContact O-NE2 2.82Å; P235-Q239 VanDerWaalsContact CA-OE1 3.32Å; P235-Q239 HydrophobicContact CB-CB 4.34Å; S236-Q239 PolarHBondContact O-N 2.95Å; S236-Q239 VanDerWaalsContact O-N 3.13Å; S236-Q239 WeakPolarHBondContact OG-CG 3.37Å; S236-Q239 PolarHBondContact OG-N 3.18Å; S236-Q239 VanDerWaalsContact OG-N 3.11Å; Q239-A241 VanDerWaalsContact C-N 3.34Å; Q239-E242 PolarHBondContact O-N 3.46Å; Q239-L243 WeakPolarHBondContact O-CB 3.13Å; Q239-L243 PolarHBondContact O-N 3.19Å
240	A	97.8	Very high	96	Very high	29 Å²	29	55.1 Å²	55.1	24%	0.24	31%	0.313	C	S	.	.	H	α-helix	trans	-62.8	-40.1	169.8	0	0	0	0	0	112.2	S236 S238 R244 Y274 V282	S236-A240 PolarHBondContact O-N 2.94Å; S238-A240 PolarHBondContact O-N 2.86Å; A240-R244 PolarHBondContact O-N 3.41Å; A240-Y274 WeakPolarHBondContact CA-OH 3.44Å; A240-Y274 WeakPolarHBondContact CB-OH 3.3Å; A240-V282 HydrophobicContact CB-CG2 4.46Å
241	A	98.3	Very high	96.1	Very high	58 Å²	58	51.7 Å²	51.7	48%	0.479	30%	0.296	S	S	.	.	H	α-helix	trans	-69	-38.1	174.9	0	0	0	0	0	112.8	A237 S238 Q239 R244 S245	A237-A241 PolarHBondContact O-N 2.7Å; A237-A241 VanDerWaalsContact O-N 3.16Å; S238-A241 CarbonylContact O-C 3.46Å; S238-A241 WeakPolarHBondContact O-CB 3.47Å; S238-A241 PolarHBondContact O-N 2.78Å; S238-A241 VanDerWaalsContact O-N 3.13Å; Q239-A241 VanDerWaalsContact C-N 3.34Å; A241-R244 PolarHBondContact O-N 3.12Å; A241-S245 WeakPolarHBondContact O-CB 3.49Å; A241-S245 PolarHBondContact O-N 3.16Å
242	E	98.6	Very high	96.5	Very high	65 Å²	65	55.5 Å²	55.5	30%	0.304	32%	0.315	S	S	.	.	H	α-helix	trans	-63.3	-43.7	173.5	-75.4	162.6	-170.8	0	0	111.5	T207 G208 P229 S238 Q239 S245 C246	T207-E242 HydrophobicContact CG2-CB 4.1Å; T207-E242 HydrophobicContact CG2-CG 4.17Å; G208-E242 WeakPolarHBondContact CA-O 2.88Å; P229-E242 HydrophobicContact CB-CB 4.02Å; P229-E242 WeakPolarHBondContact CB-OE2 3.31Å; P229-E242 HydrophobicContact CG-CB 4.21Å; S238-E242 WeakPolarHBondContact O-CG 3.46Å; S238-E242 PolarHBondContact O-N 3.3Å; Q239-E242 PolarHBondContact O-N 3.46Å; E242-S245 WeakPolarHBondContact O-CB 3.19Å; E242-S245 PolarHBondContact O-N 3.39Å; E242-C246 PolarHBondContact O-N 2.79Å; E242-C246 PolarHBondContact O-SG 1.96Å
243	L	98.7	Very high	97.1	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-60.2	-49	174	-175.9	61.9	0	0	0	110.5	P229 Q239 S245 C246 Y247 I267 Y274 A279 V282	P229-L243 HydrophobicContact CG-CB 3.92Å; Q239-L243 WeakPolarHBondContact O-CB 3.13Å; Q239-L243 PolarHBondContact O-N 3.19Å; L243-S245 VanDerWaalsContact C-N 3.28Å; L243-S245 PolarHBondContact O-N 2.94Å; L243-C246 VanDerWaalsContact O-CB 3.28Å; L243-C246 WeakPolarHBondContact O-CB 3.28Å; L243-C246 PolarHBondContact O-N 2.58Å; L243-C246 VanDerWaalsContact O-N 3.11Å; L243-Y247 HydrophobicContact CD1-CE2 3.96Å; L243-Y247 HydrophobicContact CG-CE2 4.34Å; L243-Y247 WeakPolarHBondContact O-CD2 3.37Å; L243-I267 HydrophobicContact CD1-CB 4.08Å; L243-I267 HydrophobicContact CD1-CG2 3.85Å; L243-Y274 HydrophobicContact CB-CE2 4.2Å; L243-Y274 HydrophobicContact CD2-CD1 4.22Å; L243-Y274 HydrophobicContact CD2-CD2 4.13Å; L243-Y274 HydrophobicContact CD2-CE1 3.94Å; L243-Y274 HydrophobicContact CD2-CE2 3.84Å; L243-Y274 HydrophobicContact CD2-CG 4.32Å; L243-A279 HydrophobicContact CD2-CB 3.98Å; L243-V282 HydrophobicContact CB-CG1 4.29Å; L243-V282 HydrophobicContact CD2-CB 4.14Å; L243-V282 HydrophobicContact CD2-CG1 4.14Å; L243-V282 HydrophobicContact CG-CG1 4.12Å
244	R	98.8	Very high	97.7	Very high	110 Å²	110	45.3 Å²	45.3	42%	0.415	27%	0.265	S	S	.	.	H	α-helix	trans	-55.4	-43.1	173.6	177.6	163.3	-171.6	-136.7	10.1	112.1	A240 A241 C246 Y247 L248 V282 T286 E289	A240-R244 PolarHBondContact O-N 3.41Å; A241-R244 PolarHBondContact O-N 3.12Å; R244-C246 VanDerWaalsContact C-N 3.29Å; R244-C246 PolarHBondContact O-N 2.94Å; R244-Y247 PolarHBondContact O-N 3.36Å; R244-L248 HydrophobicContact CG-CD1 3.91Å; R244-L248 HydrophobicContact CG-CG 4.37Å; R244-L248 WeakPolarHBondContact O-CG 3.3Å; R244-L248 PolarHBondContact O-N 3.04Å; R244-V282 HydrophobicContact CB-CG1 3.91Å; R244-T286 HydrophobicContact CG-CG2 4.05Å; R244-T286 WeakPolarHBondContact CG-OG1 3.35Å; R244-E289 IonicContact CZ-OE2 2.66Å; R244-E289 IonicContact NE-OE2 2.86Å; R244-E289 IonicContact NH2-OE2 3.69Å; R244-E289 PolarHBondContact NH2-OE2 3.14Å
245	S	98.8	Very high	98.1	Very high	35 Å²	35	39.3 Å²	39.3	25%	0.245	24%	0.238	C	C	.	.	H	α-helix	trans	-62.1	-32.6	178.1	-170.1	0	0	0	0	112.8	G208 A241 E242 L243 S249	G208-S245 CarbonylContact O-C 3.45Å; G208-S245 VanDerWaalsContact O-CB 3.32Å; G208-S245 WeakPolarHBondContact O-CB 3.38Å; G208-S245 PolarHBondContact O-OG 2.87Å; A241-S245 WeakPolarHBondContact O-CB 3.49Å; A241-S245 PolarHBondContact O-N 3.16Å; E242-S245 WeakPolarHBondContact O-CB 3.19Å; E242-S245 PolarHBondContact O-N 3.39Å; L243-S245 VanDerWaalsContact C-N 3.28Å; L243-S245 PolarHBondContact O-N 2.94Å; S245-S249 VanDerWaalsContact O-CB 3.26Å; S245-S249 WeakPolarHBondContact O-CB 3.41Å; S245-S249 PolarHBondContact O-N 2.8Å; S245-S249 PolarHBondContact O-OG 3.17Å
246	C	98.8	Very high	98.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.1	-47.7	174	-60.4	0	0	0	0	111.6	T226 V227 E242 L243 R244 S250 I267	T226-C246 HydrophobicContact CG2-CB 3.98Å; T226-C246 WeakPolarHBondContact OG1-CA 3.45Å; T226-C246 VanDerWaalsContact OG1-CB 3.32Å; T226-C246 WeakPolarHBondContact OG1-CB 3.28Å; V227-C246 PolarHBondContact O-SG 2.79Å; E242-C246 PolarHBondContact O-N 2.79Å; E242-C246 PolarHBondContact O-SG 1.96Å; L243-C246 VanDerWaalsContact O-CB 3.28Å; L243-C246 WeakPolarHBondContact O-CB 3.28Å; L243-C246 PolarHBondContact O-N 2.58Å; L243-C246 VanDerWaalsContact O-N 3.11Å; R244-C246 VanDerWaalsContact C-N 3.29Å; R244-C246 PolarHBondContact O-N 2.94Å; C246-S250 VanDerWaalsContact O-CB 3.28Å; C246-S250 WeakPolarHBondContact O-CB 3.29Å; C246-S250 PolarHBondContact O-N 3.09Å; C246-S250 VanDerWaalsContact O-N 3.1Å; C246-S250 PolarHBondContact O-OG 2.86Å; C246-I267 HydrophobicContact CB-CD1 4.31Å
247	Y	98.9	Very high	98.4	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.008	26%	0.257	C	S	.	.	H	α-helix	trans	-67.3	-46.3	179.3	-72.6	-94.9	0	0	0	110.9	L243 R244 S250 L251 F264 P265 I267 V283 L287	L243-Y247 HydrophobicContact CD1-CE2 3.96Å; L243-Y247 HydrophobicContact CG-CE2 4.34Å; L243-Y247 WeakPolarHBondContact O-CD2 3.37Å; R244-Y247 PolarHBondContact O-N 3.36Å; Y247-S250 PolarHBondContact O-N 3.43Å; Y247-L251 WeakPolarHBondContact O-CB 3.42Å; Y247-L251 WeakPolarHBondContact O-CD1 3.36Å; Y247-L251 WeakPolarHBondContact O-CG 3.48Å; Y247-L251 PolarHBondContact O-N 2.77Å; Y247-F264 HydrophobicContact CD1-CB 4.45Å; Y247-F264 AromaticContact CD1-CD1 3.29Å; Y247-F264 HydrophobicContact CD1-CD1 3.29Å; Y247-F264 AromaticContact CD1-CE1 3.58Å; Y247-F264 HydrophobicContact CD1-CE1 3.58Å; Y247-F264 AromaticContact CD1-CG 3.91Å; Y247-F264 HydrophobicContact CD1-CG 3.91Å; Y247-F264 HydrophobicContact CD1-CZ 4.41Å; Y247-F264 HydrophobicContact CE1-CB 3.75Å; Y247-F264 AromaticContact CE1-CD1 3.37Å; Y247-F264 HydrophobicContact CE1-CD1 3.37Å; Y247-F264 HydrophobicContact CE1-CE1 4.14Å; Y247-F264 AromaticContact CE1-CG 3.72Å; Y247-F264 HydrophobicContact CE1-CG 3.72Å; Y247-F264 HydrophobicContact CG-CD1 4.31Å; Y247-F264 HydrophobicContact CG-CE1 4.33Å; Y247-P265 PolarHBondContact OH-O 3.05Å; Y247-P265 VanDerWaalsContact OH-O 3.09Å; Y247-I267 HydrophobicContact CD2-CD1 4.37Å; Y247-I267 HydrophobicContact CE1-CD1 4.25Å; Y247-I267 HydrophobicContact CE2-CB 4.14Å; Y247-I267 HydrophobicContact CE2-CD1 3.78Å; Y247-I267 HydrophobicContact CE2-CG1 4.35Å; Y247-I267 PolarHBondContact OH-N 2.66Å; Y247-V283 HydrophobicContact CD1-CG1 4.3Å; Y247-V283 HydrophobicContact CD2-CG2 4.18Å; Y247-V283 HydrophobicContact CE1-CB 4.42Å; Y247-V283 HydrophobicContact CE1-CG1 3.78Å; Y247-V283 HydrophobicContact CE1-CG2 3.82Å; Y247-V283 HydrophobicContact CE2-CG2 3.47Å; Y247-V283 VanDerWaalsContact CE2-CG2 3.47Å; Y247-V283 WeakPolarHBondContact OH-CG2 3.46Å; Y247-L287 HydrophobicContact CD1-CD2 4.34Å
248	L	98.9	Very high	98.5	Very high	54 Å²	54	51.7 Å²	51.7	28%	0.283	26%	0.262	S	S	.	.	H	α-helix	trans	-61.5	-52.1	178.2	-67.2	176.8	0	0	0	112.3	R244 S250 L251 D252 T286	R244-L248 HydrophobicContact CG-CD1 3.91Å; R244-L248 HydrophobicContact CG-CG 4.37Å; R244-L248 WeakPolarHBondContact O-CG 3.3Å; R244-L248 PolarHBondContact O-N 3.04Å; L248-S250 PolarHBondContact O-N 2.86Å; L248-L251 CarbonylContact O-C 3.49Å; L248-L251 WeakPolarHBondContact O-CA 3.19Å; L248-L251 WeakPolarHBondContact O-CB 3.25Å; L248-L251 PolarHBondContact O-N 2.98Å; L248-D252 VanDerWaalsContact O-CG 3.27Å; L248-D252 PolarHBondContact O-N 3.04Å; L248-T286 HydrophobicContact CD2-CG2 3.68Å; L248-T286 HydrophobicContact CG-CG2 3.8Å
249	S	98.8	Very high	98.6	Very high	20 Å²	20	49 Å²	49	14%	0.14	24%	0.242	C	C	.	.	H	α-helix	trans	-59.8	-32.9	178.4	-54.9	0	0	0	0	112.6	G208 S245 L253	G208-S249 PolarHBondContact O-OG 2.9Å; S245-S249 VanDerWaalsContact O-CB 3.26Å; S245-S249 WeakPolarHBondContact O-CB 3.41Å; S245-S249 PolarHBondContact O-N 2.8Å; S245-S249 PolarHBondContact O-OG 3.17Å; S249-L253 PolarHBondContact O-N 3.49Å
250	S	98.9	Very high	98.6	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.007	25%	0.25	C	C	.	.	H	α-helix	trans	-71.5	-36.2	175	-60.1	0	0	0	0	112.4	C246 Y247 L248 L254	C246-S250 VanDerWaalsContact O-CB 3.28Å; C246-S250 WeakPolarHBondContact O-CB 3.29Å; C246-S250 PolarHBondContact O-N 3.09Å; C246-S250 VanDerWaalsContact O-N 3.1Å; C246-S250 PolarHBondContact O-OG 2.86Å; Y247-S250 PolarHBondContact O-N 3.43Å; L248-S250 PolarHBondContact O-N 2.86Å; S250-L254 PolarHBondContact O-N 2.98Å
251	L	98.8	Very high	98.7	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-73.2	-33.4	175.9	-69.4	162.8	0	0	0	112	Y247 L248 L254 L255 F264 L287 W290 L301	Y247-L251 WeakPolarHBondContact O-CB 3.42Å; Y247-L251 WeakPolarHBondContact O-CD1 3.36Å; Y247-L251 WeakPolarHBondContact O-CG 3.48Å; Y247-L251 PolarHBondContact O-N 2.77Å; L248-L251 CarbonylContact O-C 3.49Å; L248-L251 WeakPolarHBondContact O-CA 3.19Å; L248-L251 WeakPolarHBondContact O-CB 3.25Å; L248-L251 PolarHBondContact O-N 2.98Å; L251-L254 HydrophobicContact CD2-CD2 4.31Å; L251-L254 WeakPolarHBondContact O-CB 3.23Å; L251-L254 PolarHBondContact O-N 3.17Å; L251-L254 VanDerWaalsContact O-N 3.16Å; L251-L255 WeakPolarHBondContact O-CG 3.25Å; L251-L255 PolarHBondContact O-N 3.09Å; L251-F264 HydrophobicContact CD2-CE2 4.12Å; L251-F264 HydrophobicContact CD2-CZ 3.77Å; L251-F264 HydrophobicContact CG-CZ 3.88Å; L251-L287 HydrophobicContact CD1-CD2 4.07Å; L251-W290 HydrophobicContact CB-CD2 4.25Å; L251-W290 HydrophobicContact CB-CZ2 3.85Å; L251-W290 HydrophobicContact CD1-CB 4.18Å; L251-W290 HydrophobicContact CD1-CD2 3.82Å; L251-W290 HydrophobicContact CD1-CE3 4.36Å; L251-W290 HydrophobicContact CD1-CG 3.71Å; L251-W290 HydrophobicContact CD2-CD2 4.23Å; L251-W290 HydrophobicContact CD2-CE3 4.21Å; L251-W290 HydrophobicContact CD2-CH2 4.13Å; L251-W290 HydrophobicContact CD2-CZ2 4.12Å; L251-W290 HydrophobicContact CD2-CZ3 4.18Å; L251-W290 HydrophobicContact CG-CD2 4.32Å; L251-W290 HydrophobicContact CG-CZ2 4.46Å; L251-L301 HydrophobicContact CD2-CD1 3.91Å; L251-L301 HydrophobicContact CD2-CD2 3.79Å
252	D	98.8	Very high	98.7	Very high	85 Å²	85	47.7 Å²	47.7	46%	0.455	22%	0.218	S	C	.	.	H	α-helix	trans	-62.9	-45.9	174.5	-65.6	-25.7	0	0	0	110.9	L248 L254 L255 E256	L248-D252 VanDerWaalsContact O-CG 3.27Å; L248-D252 PolarHBondContact O-N 3.04Å; D252-L254 VanDerWaalsContact C-N 3.27Å; D252-L254 PolarHBondContact O-N 2.94Å; D252-L255 WeakPolarHBondContact O-CB 2.89Å; D252-L255 PolarHBondContact O-N 2.88Å; D252-L255 VanDerWaalsContact O-N 3.14Å; D252-E256 PolarHBondContact O-N 3.26Å
253	L	98.8	Very high	98.7	Very high	24 Å²	24	44.6 Å²	44.6	13%	0.126	20%	0.204	C	C	.	.	H	α-helix	trans	-61.3	-34.5	172.1	-73.4	171.1	0	0	0	112.6	A210 I212 I224 S249 L255 H257	A210-L253 HydrophobicContact CB-CD1 3.69Å; I212-L253 HydrophobicContact CB-CD1 4.32Å; I212-L253 HydrophobicContact CG2-CD2 4.19Å; I224-L253 HydrophobicContact CD1-CB 4.32Å; I224-L253 HydrophobicContact CG2-CD1 3.98Å; S249-L253 PolarHBondContact O-N 3.49Å; L253-L255 VanDerWaalsContact C-N 3.34Å; L253-H257 WeakPolarHBondContact O-CB 2.89Å; L253-H257 PolarHBondContact O-CD2 3.44Å; L253-H257 VanDerWaalsContact O-CD2 3.32Å; L253-H257 PolarHBondContact O-N 2.71Å
254	L	98.4	Very high	98.7	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-61.7	-42.9	174.6	-157.9	77.8	0	0	0	111.1	A168 I224 S250 L251 D252 R258 L259 A262 V298 L301	A168-L254 HydrophobicContact CB-CD1 3.84Å; I224-L254 HydrophobicContact CD1-CD1 4.1Å; S250-L254 PolarHBondContact O-N 2.98Å; L251-L254 HydrophobicContact CD2-CD2 4.31Å; L251-L254 WeakPolarHBondContact O-CB 3.23Å; L251-L254 PolarHBondContact O-N 3.17Å; L251-L254 VanDerWaalsContact O-N 3.16Å; D252-L254 VanDerWaalsContact C-N 3.27Å; D252-L254 PolarHBondContact O-N 2.94Å; L254-R258 PolarHBondContact O-N 3.45Å; L254-L259 HydrophobicContact CD1-CB 3.55Å; L254-L259 HydrophobicContact CD1-CD1 4.12Å; L254-L259 HydrophobicContact CD1-CG 4.42Å; L254-L259 HydrophobicContact CG-CB 3.89Å; L254-L259 PolarHBondContact O-N 3.26Å; L254-A262 HydrophobicContact CD1-CB 3.75Å; L254-A262 HydrophobicContact CD2-CB 3.71Å; L254-A262 HydrophobicContact CG-CB 4.4Å; L254-V298 HydrophobicContact CD2-CG1 3.73Å; L254-L301 HydrophobicContact CD2-CD2 4.09Å
255	L	98.4	Very high	98.7	Very high	49 Å²	49	40 Å²	40	26%	0.257	19%	0.187	S	C	.	.	H	α-helix	trans	-69	-46.8	176.5	-65.1	178	0	0	0	112.5	L251 D252 L253 H257 R258 W290 K297	L251-L255 WeakPolarHBondContact O-CG 3.25Å; L251-L255 PolarHBondContact O-N 3.09Å; D252-L255 WeakPolarHBondContact O-CB 2.89Å; D252-L255 PolarHBondContact O-N 2.88Å; D252-L255 VanDerWaalsContact O-N 3.14Å; L253-L255 VanDerWaalsContact C-N 3.34Å; L255-H257 VanDerWaalsContact C-N 3.32Å; L255-H257 PolarHBondContact O-N 3.38Å; L255-R258 PolarHBondContact O-N 3.11Å; L255-W290 HydrophobicContact CD1-CZ2 3.77Å; L255-W290 HydrophobicContact CD2-CH2 4.05Å; L255-W290 HydrophobicContact CD2-CZ2 3.82Å; L255-W290 HydrophobicContact CG-CH2 4.45Å; L255-W290 HydrophobicContact CG-CZ2 3.75Å; L255-K297 HydrophobicContact CD2-CB 3.47Å; L255-K297 VanDerWaalsContact CD2-CB 3.47Å; L255-K297 HydrophobicContact CD2-CD 4.49Å; L255-K297 HydrophobicContact CD2-CG 3.72Å
256	E	98.5	Very high	98.7	Very high	142 Å²	142	39.2 Å²	39.2	66%	0.664	18%	0.182	S	C	*	.	H	α-helix	trans	-56.9	-46.5	179.7	-177.2	178.9	179.3	0	0	111.1	D252 R258	D252-E256 PolarHBondContact O-N 3.26Å; E256-R258 PolarHBondContact O-N 3.32Å
257	H	98.4	Very high	98.6	Very high	77 Å²	77	39.3 Å²	39.3	36%	0.356	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	2.8	178.2	-72	-96.5	0	0	0	114	I212 L253 L255 L259	I212-H257 HydrophobicContact CD1-CB 4.29Å; I212-H257 WeakPolarHBondContact CG2-NE2 3.36Å; L253-H257 WeakPolarHBondContact O-CB 2.89Å; L253-H257 PolarHBondContact O-CD2 3.44Å; L253-H257 VanDerWaalsContact O-CD2 3.32Å; L253-H257 PolarHBondContact O-N 2.71Å; L255-H257 VanDerWaalsContact C-N 3.32Å; L255-H257 PolarHBondContact O-N 3.38Å; H257-L259 HydrophobicContact CB-CD1 4.06Å; H257-L259 HydrophobicContact CB-CD2 4.23Å; H257-L259 HydrophobicContact CB-CG 3.76Å; H257-L259 WeakPolarHBondContact O-CD2 2.93Å; H257-L259 PolarHBondContact O-N 3.17Å
258	R	98.4	Very high	98.5	Very high	223 Å²	223	39.4 Å²	39.4	84%	0.842	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.5	31.2	179	-49	-179.5	-170.8	175.6	2.2	113.9	L254 L255 E256	L254-R258 PolarHBondContact O-N 3.45Å; L255-R258 PolarHBondContact O-N 3.11Å; E256-R258 PolarHBondContact O-N 3.32Å
259	L	98.6	Very high	98.2	Very high	14 Å²	14	37.4 Å²	37.4	7%	0.073	17%	0.174	C	C	.	.			trans	-80.1	146.4	178.2	-52.6	-175.2	0	0	0	109.1	D167 A168 I212 Y222 L254 H257	D167-L259 HydrophobicContact CB-CB 3.83Å; D167-L259 HydrophobicContact CB-CD1 4.49Å; D167-L259 HydrophobicContact CB-CD2 4.18Å; D167-L259 HydrophobicContact CB-CG 4.36Å; A168-L259 HydrophobicContact CB-CD1 4.06Å; I212-L259 HydrophobicContact CD1-CD1 4Å; Y222-L259 HydrophobicContact CD2-CD1 3.59Å; Y222-L259 HydrophobicContact CD2-CD2 3.74Å; Y222-L259 HydrophobicContact CD2-CG 4.34Å; Y222-L259 HydrophobicContact CE2-CD1 4.24Å; Y222-L259 HydrophobicContact CE2-CD2 3.6Å; Y222-L259 HydrophobicContact CG-CD1 4.02Å; L254-L259 HydrophobicContact CD1-CB 3.55Å; L254-L259 HydrophobicContact CD1-CD1 4.12Å; L254-L259 HydrophobicContact CD1-CG 4.42Å; L254-L259 HydrophobicContact CG-CB 3.89Å; L254-L259 PolarHBondContact O-N 3.26Å; H257-L259 HydrophobicContact CB-CD1 4.06Å; H257-L259 HydrophobicContact CB-CD2 4.23Å; H257-L259 HydrophobicContact CB-CG 3.76Å; H257-L259 WeakPolarHBondContact O-CD2 2.93Å; H257-L259 PolarHBondContact O-N 3.17Å
260	R	98.8	Very high	97.8	Very high	93 Å²	93	38.9 Å²	38.9	35%	0.351	19%	0.191	S	C	.	.			trans	-116.2	-12.9	-171.2	-59.7	-170.5	62	78.9	2.8	113.7	D167 D296 K297 V298 D299 R300	D167-R260 PolarHBondContact OD2-N 3.32Å; R260-D296 PolarHBondContact NH1-O 3.11Å; R260-D296 PolarHBondContact NH2-O 3.35Å; R260-K297 PolarHBondContact NH1-O 3.02Å; R260-V298 CarbonylContact O-C 3.56Å; R260-V298 WeakPolarHBondContact O-CA 3.43Å; R260-V298 WeakPolarHBondContact O-CB 3.45Å; R260-D299 WeakPolarHBondContact CB-OD2 3.47Å; R260-D299 WeakPolarHBondContact CD-OD2 3.22Å; R260-D299 IonicContact CZ-OD1 3.89Å; R260-D299 IonicContact CZ-OD2 3.63Å; R260-D299 VanDerWaalsContact NE-CG 3.35Å; R260-D299 IonicContact NE-OD1 3.74Å; R260-D299 PolarHBondContact NE-OD1 3.46Å; R260-D299 IonicContact NE-OD2 2.66Å; R260-D299 PolarHBondContact NE-OD2 2.97Å; R260-D299 IonicContact NH2-OD1 2.58Å; R260-D299 PolarHBondContact NH2-OD1 2.96Å; R260-D299 IonicContact NH2-OD2 3.62Å; R260-D299 PolarHBondContact O-N 3.27Å; R260-R300 PolarHBondContact O-N 3.31Å
261	S	98.9	Very high	97.3	Very high	6 Å²	6	45.4 Å²	45.4	4%	0.042	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	129.8	178.7	54.1	0	0	0	0	112.5	D167 A168 R300	D167-S261 WeakPolarHBondContact CB-O 3.47Å; D167-S261 VanDerWaalsContact CG-OG 3.28Å; D167-S261 PolarHBondContact N-O 3.17Å; D167-S261 PolarHBondContact N-OG 3.21Å; D167-S261 PolarHBondContact OD2-N 3.04Å; D167-S261 PolarHBondContact OD2-OG 3.14Å; A168-S261 PolarHBondContact N-O 3.03Å; S261-R300 VanDerWaalsContact CA-O 3.31Å; S261-R300 WeakPolarHBondContact CA-O 3.46Å
262	A	98.8	Very high	97	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.008	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	142.5	-178.8	0	0	0	0	0	112	A168 L254 F264 R300 L301 I302	A168-A262 CarbonylContact O-C 3.14Å; A168-A262 VanDerWaalsContact O-CA 3.28Å; A168-A262 WeakPolarHBondContact O-CA 3.14Å; L254-A262 HydrophobicContact CD1-CB 3.75Å; L254-A262 HydrophobicContact CD2-CB 3.71Å; L254-A262 HydrophobicContact CG-CB 4.4Å; A262-F264 HydrophobicContact CB-CE2 3.95Å; A262-R300 PolarHBondContact N-O 2.7Å; A262-L301 HydrophobicContact CB-CD2 4.01Å; A262-L301 CarbonylContact O-C 3.56Å; A262-L301 WeakPolarHBondContact O-CA 3.43Å; A262-I302 PolarHBondContact O-N 3.35Å
263	A	98.9	Very high	96.8	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	134.1	168.8	0	0	0	0	0	112	I161 L164 A168 I169 V170 I302 C304	I161-A263 HydrophobicContact CD1-CB 4.18Å; I161-A263 HydrophobicContact CG1-CB 4.11Å; L164-A263 HydrophobicContact CD1-CB 3.53Å; A168-A263 PolarHBondContact O-N 3.36Å; I169-A263 HydrophobicContact CG2-CB 4.27Å; V170-A263 PolarHBondContact N-O 3.17Å; A263-I302 CarbonylContact C-O 3.58Å; A263-I302 WeakPolarHBondContact CA-O 3.26Å; A263-I302 HydrophobicContact CB-CB 3.96Å; A263-I302 HydrophobicContact CB-CD1 4.38Å; A263-I302 HydrophobicContact CB-CG2 4.47Å; A263-C304 HydrophobicContact CB-CB 4.42Å
264	F	98.9	Very high	96.7	Very high	2 Å²	2	44 Å²	44	1%	0.009	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	130.2	-179.5	-67.1	-97.7	0	0	0	110.9	V170 Y247 L251 A262 L287 L301 I302 C304	V170-F264 HydrophobicContact CB-CD1 4.02Å; V170-F264 HydrophobicContact CB-CE1 4.42Å; V170-F264 HydrophobicContact CG1-CD1 4.17Å; V170-F264 HydrophobicContact CG1-CE1 4.48Å; V170-F264 HydrophobicContact CG2-CD1 3.65Å; V170-F264 HydrophobicContact CG2-CE1 3.63Å; V170-F264 HydrophobicContact CG2-CG 4.14Å; V170-F264 HydrophobicContact CG2-CZ 4.06Å; Y247-F264 HydrophobicContact CD1-CB 4.45Å; Y247-F264 AromaticContact CD1-CD1 3.29Å; Y247-F264 HydrophobicContact CD1-CD1 3.29Å; Y247-F264 AromaticContact CD1-CE1 3.58Å; Y247-F264 HydrophobicContact CD1-CE1 3.58Å; Y247-F264 AromaticContact CD1-CG 3.91Å; Y247-F264 HydrophobicContact CD1-CG 3.91Å; Y247-F264 HydrophobicContact CD1-CZ 4.41Å; Y247-F264 HydrophobicContact CE1-CB 3.75Å; Y247-F264 AromaticContact CE1-CD1 3.37Å; Y247-F264 HydrophobicContact CE1-CD1 3.37Å; Y247-F264 HydrophobicContact CE1-CE1 4.14Å; Y247-F264 AromaticContact CE1-CG 3.72Å; Y247-F264 HydrophobicContact CE1-CG 3.72Å; Y247-F264 HydrophobicContact CG-CD1 4.31Å; Y247-F264 HydrophobicContact CG-CE1 4.33Å; L251-F264 HydrophobicContact CD2-CE2 4.12Å; L251-F264 HydrophobicContact CD2-CZ 3.77Å; L251-F264 HydrophobicContact CG-CZ 3.88Å; A262-F264 HydrophobicContact CB-CE2 3.95Å; F264-L287 HydrophobicContact CE2-CD2 4.44Å; F264-L301 HydrophobicContact CE2-CD2 4.46Å; F264-I302 PolarHBondContact N-O 2.7Å; F264-C304 PolarHBondContact O-N 2.92Å
265	P	98.7	Very high	96.6	Very high	10 Å²	10	46.1 Å²	46.1	7%	0.065	24%	0.242	C	C	.	.			trans	-77.2	174	166.4	34.7	-33.7	0	0	0	110.2	I161 V170 A172 V183 Y247 I267	I161-P265 HydrophobicContact CD1-CB 4.14Å; I161-P265 HydrophobicContact CD1-CG 4.28Å; V170-P265 WeakPolarHBondContact O-CD 3.43Å; V170-P265 WeakPolarHBondContact O-CG 3.2Å; A172-P265 HydrophobicContact CB-CG 4.19Å; V183-P265 HydrophobicContact CG1-CB 4.44Å; V183-P265 HydrophobicContact CG1-CG 4.5Å; V183-P265 HydrophobicContact CG2-CB 4.36Å; Y247-P265 PolarHBondContact OH-O 3.05Å; Y247-P265 VanDerWaalsContact OH-O 3.09Å; P265-I267 VanDerWaalsContact C-N 3.28Å; P265-I267 HydrophobicContact CG-CG1 4.23Å; P265-I267 PolarHBondContact O-N 3.39Å
266	C	97.8	Very high	96.5	Very high	19 Å²	19	44.6 Å²	44.6	13%	0.128	24%	0.235	C	C	.	.			trans	-74.7	76.8	172	-53.4	0	0	0	0	111.2	T269	C266-T269 HydrophobicContact CB-CG2 4.12Å; C266-T269 WeakPolarHBondContact CB-OG1 3.37Å; C266-T269 PolarHBondContact O-N 2.9Å; C266-T269 PolarHBondContact O-OG1 2.95Å
267	I	97.9	Very high	96.4	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.01	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	138.5	-178.1	-62.5	168.5	0	0	0	110.4	V170 A172 T226 L243 C246 Y247 P265 T269	V170-I267 HydrophobicContact CG1-CD1 4.07Å; A172-I267 HydrophobicContact CB-CB 4.48Å; A172-I267 HydrophobicContact CB-CG1 4.07Å; T226-I267 HydrophobicContact CG2-CD1 3.58Å; L243-I267 HydrophobicContact CD1-CB 4.08Å; L243-I267 HydrophobicContact CD1-CG2 3.85Å; C246-I267 HydrophobicContact CB-CD1 4.31Å; Y247-I267 HydrophobicContact CD2-CD1 4.37Å; Y247-I267 HydrophobicContact CE1-CD1 4.25Å; Y247-I267 HydrophobicContact CE2-CB 4.14Å; Y247-I267 HydrophobicContact CE2-CD1 3.78Å; Y247-I267 HydrophobicContact CE2-CG1 4.35Å; Y247-I267 PolarHBondContact OH-N 2.66Å; P265-I267 VanDerWaalsContact C-N 3.28Å; P265-I267 HydrophobicContact CG-CG1 4.23Å; P265-I267 PolarHBondContact O-N 3.39Å; I267-T269 PolarHBondContact O-N 3.16Å
268	S	95.9	Very high	96.4	Very high	5 Å²	5	41.4 Å²	41.4	4%	0.035	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	60	-8.7	-176.5	-64.7	0	0	0	0	119.2	G228 P229 G270 F272 G273 Y274	G228-S268 VanDerWaalsContact C-OG 3.27Å; G228-S268 VanDerWaalsContact CA-OG 3.26Å; G228-S268 WeakPolarHBondContact CA-OG 3.12Å; P229-S268 WeakPolarHBondContact CD-OG 3.4Å; P229-S268 VanDerWaalsContact O-CB 3.29Å; P229-S268 WeakPolarHBondContact O-CB 3.24Å; P229-S268 PolarHBondContact O-OG 3.13Å; S268-G270 PolarHBondContact O-N 2.63Å; S268-F272 CarbonylContact O-C 3.57Å; S268-G273 PolarHBondContact O-N 3.39Å; S268-Y274 WeakPolarHBondContact O-CB 3.07Å; S268-Y274 PolarHBondContact O-N 2.8Å
269	T	93.7	Very high	96.4	Very high	12 Å²	12	30.8 Å²	30.8	7%	0.074	19%	0.187	C	C	.	.	S	Bend	trans	-79.8	3	-177.1	69.3	0	0	0	0	115.9	C266 I267 Y274 A279 R307	C266-T269 HydrophobicContact CB-CG2 4.12Å; C266-T269 WeakPolarHBondContact CB-OG1 3.37Å; C266-T269 PolarHBondContact O-N 2.9Å; C266-T269 PolarHBondContact O-OG1 2.95Å; I267-T269 PolarHBondContact O-N 3.16Å; T269-Y274 WeakPolarHBondContact CA-O 3.32Å; T269-A279 HydrophobicContact CG2-CB 3.52Å; T269-R307 PolarHBondContact O-NH1 3.49Å; T269-R307 PolarHBondContact O-NH2 3.13Å
270	G	90.1	Very high	96.3	Very high	50 Å²	50	30.1 Å²	30.1	52%	0.515	18%	0.184	S	C	.	.	S	Bend	trans	-100.7	-122.4	173.9	0	0	0	0	0	111.5	S268 F272 G273	S268-G270 PolarHBondContact O-N 2.63Å; G270-F272 PolarHBondContact O-N 3.17Å; G270-F272 VanDerWaalsContact O-N 3.13Å; G270-G273 PolarHBondContact O-N 2.64Å
271	V	88.6	Confident	96.3	Very high	138 Å²	138	27.7 Å²	27.7	84%	0.836	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-27.5	-176.8	179.9	0	0	0	0	113.5	G273	V271-G273 VanDerWaalsContact C-N 3.29Å; V271-G273 PolarHBondContact O-N 2.84Å
272	F	91.7	Very high	96.3	Very high	45 Å²	45	28.6 Å²	28.6	20%	0.197	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-3.4	178.3	-63.2	-10.5	0	0	0	114.2	N174 P229 I230 A231 S268 G270 Y274	N174-F272 HydrophobicContact CB-CZ 4.5Å; P229-F272 WeakPolarHBondContact O-CB 3.46Å; I230-F272 HydrophobicContact CD1-CD1 4.38Å; I230-F272 HydrophobicContact CD1-CE1 4.47Å; I230-F272 HydrophobicContact CG1-CB 4.21Å; I230-F272 HydrophobicContact CG1-CD1 3.89Å; I230-F272 HydrophobicContact CG1-CD2 4.34Å; I230-F272 HydrophobicContact CG1-CE1 4.33Å; I230-F272 HydrophobicContact CG1-CG 3.9Å; A231-F272 PolarHBondContact N-O 3.23Å; S268-F272 CarbonylContact O-C 3.57Å; G270-F272 PolarHBondContact O-N 3.17Å; G270-F272 VanDerWaalsContact O-N 3.13Å; F272-Y274 PolarHBondContact O-N 3.12Å
273	G	93.7	Very high	96.2	Very high	28 Å²	28	28.6 Å²	28.6	29%	0.289	18%	0.181	S	C	.	.			trans	70.7	23.3	163.2	0	0	0	0	0	116.7	G233 S268 G270 V271	G233-G273 WeakPolarHBondContact CA-O 3.42Å; G233-G273 PolarHBondContact N-O 3.07Å; S268-G273 PolarHBondContact O-N 3.39Å; G270-G273 PolarHBondContact O-N 2.64Å; V271-G273 VanDerWaalsContact C-N 3.29Å; V271-G273 PolarHBondContact O-N 2.84Å
274	Y	97.2	Very high	96.2	Very high	8 Å²	8	28.6 Å²	28.6	3%	0.031	18%	0.181	C	C	.	.			trans	-76.8	128.4	174.9	-152.5	-66.3	0	0	0	110.7	P229 A231 P235 A240 L243 S268 T269 F272 C276 A278 A279	P229-Y274 HydrophobicContact CG-CD2 4.08Å; P229-Y274 HydrophobicContact CG-CE2 4.18Å; A231-Y274 HydrophobicContact CB-CD2 3.77Å; A231-Y274 HydrophobicContact CB-CE2 4.47Å; A231-Y274 HydrophobicContact CB-CG 4.13Å; P235-Y274 HydrophobicContact CB-CD2 4.06Å; P235-Y274 HydrophobicContact CB-CE1 4.06Å; P235-Y274 HydrophobicContact CB-CE2 3.5Å; P235-Y274 VanDerWaalsContact CB-CZ 3.49Å; P235-Y274 HydrophobicContact CG-CD1 4.31Å; P235-Y274 HydrophobicContact CG-CE1 3.79Å; P235-Y274 HydrophobicContact CG-CE2 4.18Å; A240-Y274 WeakPolarHBondContact CA-OH 3.44Å; A240-Y274 WeakPolarHBondContact CB-OH 3.3Å; L243-Y274 HydrophobicContact CB-CE2 4.2Å; L243-Y274 HydrophobicContact CD2-CD1 4.22Å; L243-Y274 HydrophobicContact CD2-CD2 4.13Å; L243-Y274 HydrophobicContact CD2-CE1 3.94Å; L243-Y274 HydrophobicContact CD2-CE2 3.84Å; L243-Y274 HydrophobicContact CD2-CG 4.32Å; S268-Y274 WeakPolarHBondContact O-CB 3.07Å; S268-Y274 PolarHBondContact O-N 2.8Å; T269-Y274 WeakPolarHBondContact CA-O 3.32Å; F272-Y274 PolarHBondContact O-N 3.12Å; Y274-C276 PolarHBondContact O-N 2.89Å; Y274-A278 HydrophobicContact CE1-CB 3.98Å; Y274-A279 HydrophobicContact CD1-CB 3.72Å; Y274-A279 HydrophobicContact CE1-CB 4.13Å
275	P	97.1	Very high	96.2	Very high	45 Å²	45	29.4 Å²	29.4	29%	0.292	19%	0.188	S	C	.	.			trans	-57.2	128.9	178.6	-26.6	35	0	0	0	112.7	G233 P235 E277 A278 A279	G233-P275 WeakPolarHBondContact O-CG 3.32Å; P235-P275 HydrophobicContact CG-CG 4.46Å; P275-E277 VanDerWaalsContact C-N 3.35Å; P275-E277 PolarHBondContact O-N 3.33Å; P275-A278 HydrophobicContact CB-CB 4.18Å; P275-A278 PolarHBondContact O-N 2.95Å; P275-A279 WeakPolarHBondContact O-CB 3.36Å; P275-A279 PolarHBondContact O-N 3.46Å
276	C	96.7	Very high	96.2	Very high	17 Å²	17	29 Å²	29	12%	0.115	19%	0.186	C	C	.	.	H	α-helix	trans	-62.7	-39.2	-168.9	-44.6	0	0	0	0	113	Y274 A280 R307 I313	Y274-C276 PolarHBondContact O-N 2.89Å; C276-A280 WeakPolarHBondContact O-CB 3.28Å; C276-A280 PolarHBondContact O-N 3.22Å; C276-R307 PolarHBondContact SG-NH2 3.31Å; C276-I313 HydrophobicContact CB-CD1 3.65Å
277	E	96.5	Very high	96.3	Very high	111 Å²	111	28.1 Å²	28.1	52%	0.519	18%	0.179	S	C	.	.	H	α-helix	trans	-64.5	-50.8	175.9	-69.9	133.2	-123.1	0	0	111.5	P275 A279 A280 E281 K309 I313	P275-E277 VanDerWaalsContact C-N 3.35Å; P275-E277 PolarHBondContact O-N 3.33Å; E277-A279 VanDerWaalsContact C-N 3.31Å; E277-A279 PolarHBondContact O-N 3.11Å; E277-A280 PolarHBondContact O-N 3.01Å; E277-E281 PolarHBondContact O-N 3.24Å; E277-E281 VanDerWaalsContact O-N 3.14Å; E277-K309 IonicContact OE1-NZ 2.97Å; E277-K309 PolarHBondContact OE1-NZ 2.89Å; E277-I313 HydrophobicContact CG-CD1 3.8Å; E277-I313 HydrophobicContact CG-CG1 3.96Å; E277-I313 HydrophobicContact CG-CG2 4.3Å
278	A	97.1	Very high	96.3	Very high	40 Å²	40	28.3 Å²	28.3	33%	0.331	18%	0.18	S	C	.	.	H	α-helix	trans	-64	-34.5	178.2	0	0	0	0	0	112.7	Y274 P275 V282	Y274-A278 HydrophobicContact CE1-CB 3.98Å; P275-A278 HydrophobicContact CB-CB 4.18Å; P275-A278 PolarHBondContact O-N 2.95Å; A278-V282 WeakPolarHBondContact O-CG2 3.42Å; A278-V282 PolarHBondContact O-N 2.98Å
279	A	97.9	Very high	96.4	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.008	19%	0.191	C	C	.	.	H	α-helix	trans	-64.6	-47.4	172.3	0	0	0	0	0	111.1	L243 T269 Y274 P275 E277 E281 V282 V283	L243-A279 HydrophobicContact CD2-CB 3.98Å; T269-A279 HydrophobicContact CG2-CB 3.52Å; Y274-A279 HydrophobicContact CD1-CB 3.72Å; Y274-A279 HydrophobicContact CE1-CB 4.13Å; P275-A279 WeakPolarHBondContact O-CB 3.36Å; P275-A279 PolarHBondContact O-N 3.46Å; E277-A279 VanDerWaalsContact C-N 3.31Å; E277-A279 PolarHBondContact O-N 3.11Å; A279-E281 VanDerWaalsContact C-N 3.28Å; A279-E281 PolarHBondContact O-N 2.88Å; A279-V282 PolarHBondContact O-N 3.4Å; A279-V282 VanDerWaalsContact O-N 3.09Å; A279-V283 WeakPolarHBondContact O-CG2 3.47Å; A279-V283 PolarHBondContact O-N 3.38Å
280	A	98.1	Very high	96.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-59.2	-36.8	-179.5	0	0	0	0	0	112.8	C276 E277 V283 L284 I313 Y314	C276-A280 WeakPolarHBondContact O-CB 3.28Å; C276-A280 PolarHBondContact O-N 3.22Å; E277-A280 PolarHBondContact O-N 3.01Å; A280-V283 PolarHBondContact O-N 3.39Å; A280-L284 WeakPolarHBondContact O-CB 3.48Å; A280-L284 VanDerWaalsContact O-CG 3.3Å; A280-L284 WeakPolarHBondContact O-CG 3.32Å; A280-L284 PolarHBondContact O-N 3.19Å; A280-I313 HydrophobicContact CB-CG2 3.53Å; A280-Y314 HydrophobicContact CB-CD1 4.1Å; A280-Y314 HydrophobicContact CB-CD2 4.5Å; A280-Y314 HydrophobicContact CB-CE1 3.72Å; A280-Y314 HydrophobicContact CB-CE2 4.16Å; A280-Y314 HydrophobicContact CB-CG 4.48Å
281	E	97.6	Very high	97.1	Very high	42 Å²	42	28.1 Å²	28.1	20%	0.196	16%	0.164	C	C	.	.	H	α-helix	trans	-59.5	-48.5	172.4	-66.9	-61.2	98.8	0	0	112.6	R143 E277 A279 V283 A285 R317 Y321	R143-E281 IonicContact NH1-OE2 2.78Å; E277-E281 PolarHBondContact O-N 3.24Å; E277-E281 VanDerWaalsContact O-N 3.14Å; A279-E281 VanDerWaalsContact C-N 3.28Å; A279-E281 PolarHBondContact O-N 2.88Å; E281-V283 VanDerWaalsContact C-N 3.33Å; E281-V283 PolarHBondContact O-N 3.23Å; E281-A285 VanDerWaalsContact O-CB 3.27Å; E281-A285 WeakPolarHBondContact O-CB 3.34Å; E281-A285 PolarHBondContact O-N 3.42Å; E281-R317 IonicContact OE1-CZ 3.73Å; E281-R317 VanDerWaalsContact OE1-CZ 3.31Å; E281-R317 IonicContact OE1-NE 2.7Å; E281-R317 PolarHBondContact OE1-NE 3.24Å; E281-R317 IonicContact OE1-NH2 3.18Å; E281-R317 PolarHBondContact OE1-NH2 3.04Å; E281-R317 VanDerWaalsContact OE1-NH2 3.08Å; E281-R317 IonicContact OE2-CZ 2.74Å; E281-R317 IonicContact OE2-NE 3.73Å; E281-R317 IonicContact OE2-NH2 2.89Å; E281-R317 PolarHBondContact OE2-NH2 3.45Å; E281-Y321 PolarHBondContact O-OH 3.13Å; E281-Y321 PolarHBondContact OE2-OH 3.46Å
282	V	98.3	Very high	97.5	Very high	25 Å²	25	25.8 Å²	25.8	15%	0.152	14%	0.144	C	C	.	.	H	α-helix	trans	-61.9	-43.8	178.6	173.9	0	0	0	0	110.3	A240 L243 R244 A278 A279 T286	A240-V282 HydrophobicContact CB-CG2 4.46Å; L243-V282 HydrophobicContact CB-CG1 4.29Å; L243-V282 HydrophobicContact CD2-CB 4.14Å; L243-V282 HydrophobicContact CD2-CG1 4.14Å; L243-V282 HydrophobicContact CG-CG1 4.12Å; R244-V282 HydrophobicContact CB-CG1 3.91Å; A278-V282 WeakPolarHBondContact O-CG2 3.42Å; A278-V282 PolarHBondContact O-N 2.98Å; A279-V282 PolarHBondContact O-N 3.4Å; A279-V282 VanDerWaalsContact O-N 3.09Å; V282-T286 VanDerWaalsContact O-CB 3.25Å; V282-T286 WeakPolarHBondContact O-CB 3.48Å; V282-T286 PolarHBondContact O-N 2.74Å; V282-T286 PolarHBondContact O-OG1 3.1Å
283	V	98.6	Very high	97.9	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.006	17%	0.167	C	C	.	.	H	α-helix	trans	-64.5	-52.6	179.6	176	0	0	0	0	111.4	Y247 A279 A280 E281 A285 T286 L287 I303 Y314	Y247-V283 HydrophobicContact CD1-CG1 4.3Å; Y247-V283 HydrophobicContact CD2-CG2 4.18Å; Y247-V283 HydrophobicContact CE1-CB 4.42Å; Y247-V283 HydrophobicContact CE1-CG1 3.78Å; Y247-V283 HydrophobicContact CE1-CG2 3.82Å; Y247-V283 HydrophobicContact CE2-CG2 3.47Å; Y247-V283 VanDerWaalsContact CE2-CG2 3.47Å; Y247-V283 WeakPolarHBondContact OH-CG2 3.46Å; A279-V283 WeakPolarHBondContact O-CG2 3.47Å; A279-V283 PolarHBondContact O-N 3.38Å; A280-V283 PolarHBondContact O-N 3.39Å; E281-V283 VanDerWaalsContact C-N 3.33Å; E281-V283 PolarHBondContact O-N 3.23Å; V283-A285 PolarHBondContact O-N 2.88Å; V283-T286 PolarHBondContact O-N 3.36Å; V283-L287 HydrophobicContact CG1-CD1 3.77Å; V283-L287 HydrophobicContact CG1-CG 4.13Å; V283-L287 WeakPolarHBondContact O-CB 3.48Å; V283-L287 VanDerWaalsContact O-CG 3.31Å; V283-L287 WeakPolarHBondContact O-CG 3.35Å; V283-L287 PolarHBondContact O-N 3.13Å; V283-I303 HydrophobicContact CG1-CD1 4.45Å; V283-Y314 HydrophobicContact CB-CE1 4.15Å; V283-Y314 HydrophobicContact CG1-CE1 4.03Å; V283-Y314 WeakPolarHBondContact CG2-OH 3.49Å
284	L	98.6	Very high	98.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-65.3	-38.9	-176	-70.7	172.5	0	0	0	112.1	A280 R288 I303 Y314 R317 L318 Y321 F322	A280-L284 WeakPolarHBondContact O-CB 3.48Å; A280-L284 VanDerWaalsContact O-CG 3.3Å; A280-L284 WeakPolarHBondContact O-CG 3.32Å; A280-L284 PolarHBondContact O-N 3.19Å; L284-R288 WeakPolarHBondContact O-CB 3.33Å; L284-R288 PolarHBondContact O-N 3.3Å; L284-I303 HydrophobicContact CD2-CD1 3.68Å; L284-Y314 HydrophobicContact CD1-CD1 4.12Å; L284-Y314 HydrophobicContact CD2-CD1 4.1Å; L284-Y314 HydrophobicContact CD2-CE1 4.4Å; L284-Y314 HydrophobicContact CG-CD1 4.03Å; L284-Y314 HydrophobicContact CG-CE1 4.1Å; L284-R317 HydrophobicContact CD1-CB 3.53Å; L284-L318 HydrophobicContact CD2-CD2 3.63Å; L284-L318 HydrophobicContact CD2-CG 3.91Å; L284-Y321 HydrophobicContact CB-CD1 3.93Å; L284-Y321 HydrophobicContact CB-CD2 3.54Å; L284-Y321 HydrophobicContact CB-CE1 4.28Å; L284-Y321 HydrophobicContact CB-CE2 3.92Å; L284-Y321 HydrophobicContact CB-CG 3.55Å; L284-Y321 HydrophobicContact CD1-CD2 3.83Å; L284-Y321 HydrophobicContact CD1-CE2 4.28Å; L284-Y321 HydrophobicContact CG-CD2 4.31Å; L284-F322 HydrophobicContact CD2-CE2 4.42Å
285	A	98.6	Very high	98.1	Very high	18 Å²	18	33.6 Å²	33.6	15%	0.149	17%	0.173	C	C	.	.	H	α-helix	trans	-59.7	-51.9	171.8	0	0	0	0	0	111.3	E281 V283 L287 R288 E289 Y321	E281-A285 VanDerWaalsContact O-CB 3.27Å; E281-A285 WeakPolarHBondContact O-CB 3.34Å; E281-A285 PolarHBondContact O-N 3.42Å; V283-A285 PolarHBondContact O-N 2.88Å; A285-L287 PolarHBondContact O-N 3.42Å; A285-R288 PolarHBondContact O-N 3.33Å; A285-E289 WeakPolarHBondContact O-CG 3.34Å; A285-E289 PolarHBondContact O-N 2.92Å; A285-Y321 VanDerWaalsContact CA-CE1 3.47Å; A285-Y321 HydrophobicContact CB-CD1 4.4Å; A285-Y321 HydrophobicContact CB-CE1 3.66Å
286	T	98.8	Very high	98.1	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.012	18%	0.182	C	C	.	.	H	α-helix	trans	-62.8	-46.1	-176.3	-56.2	0	0	0	0	111.9	R244 L248 V282 V283 R288 W290	R244-T286 HydrophobicContact CG-CG2 4.05Å; R244-T286 WeakPolarHBondContact CG-OG1 3.35Å; L248-T286 HydrophobicContact CD2-CG2 3.68Å; L248-T286 HydrophobicContact CG-CG2 3.8Å; V282-T286 VanDerWaalsContact O-CB 3.25Å; V282-T286 WeakPolarHBondContact O-CB 3.48Å; V282-T286 PolarHBondContact O-N 2.74Å; V282-T286 PolarHBondContact O-OG1 3.1Å; V283-T286 PolarHBondContact O-N 3.36Å; T286-R288 VanDerWaalsContact C-N 3.34Å; T286-R288 PolarHBondContact O-N 3.34Å; T286-W290 WeakPolarHBondContact O-CB 3.28Å; T286-W290 PolarHBondContact O-N 3.02Å
287	L	98.8	Very high	98.2	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-66.3	-35.9	178.1	-65.3	-175.6	0	0	0	111.8	I154 Y247 L251 F264 V283 A285 L291 L301 I303	I154-L287 HydrophobicContact CD1-CB 4.43Å; I154-L287 HydrophobicContact CD1-CD1 4.2Å; Y247-L287 HydrophobicContact CD1-CD2 4.34Å; L251-L287 HydrophobicContact CD1-CD2 4.07Å; F264-L287 HydrophobicContact CE2-CD2 4.44Å; V283-L287 HydrophobicContact CG1-CD1 3.77Å; V283-L287 HydrophobicContact CG1-CG 4.13Å; V283-L287 WeakPolarHBondContact O-CB 3.48Å; V283-L287 VanDerWaalsContact O-CG 3.31Å; V283-L287 WeakPolarHBondContact O-CG 3.35Å; V283-L287 PolarHBondContact O-N 3.13Å; A285-L287 PolarHBondContact O-N 3.42Å; L287-L291 WeakPolarHBondContact O-CB 3.42Å; L287-L291 VanDerWaalsContact O-CG 3.23Å; L287-L291 WeakPolarHBondContact O-CG 3.28Å; L287-L291 PolarHBondContact O-N 3.48Å; L287-L301 HydrophobicContact CD2-CD1 4.02Å; L287-I303 HydrophobicContact CD1-CD1 4.06Å; L287-I303 HydrophobicContact CD1-CG1 3.9Å
288	R	98.6	Very high	98.3	Very high	6 Å²	6	35.7 Å²	35.7	2%	0.023	18%	0.178	C	C	.	.	H	α-helix	trans	-65.2	-54.7	176.8	174.6	56.4	-168.5	-122.2	8.9	111.7	Y144 K145 L284 A285 T286 W290 L291 E292 Y321 F322	Y144-R288 HydrophobicContact CD1-CG 3.52Å; Y144-R288 HydrophobicContact CD2-CG 4.39Å; Y144-R288 HydrophobicContact CE1-CG 3.59Å; Y144-R288 HydrophobicContact CE2-CG 4.46Å; Y144-R288 HydrophobicContact CG-CG 3.96Å; K145-R288 VanDerWaalsContact O-CZ 3.3Å; K145-R288 PolarHBondContact O-NH1 2.78Å; K145-R288 PolarHBondContact O-NH2 3.34Å; L284-R288 WeakPolarHBondContact O-CB 3.33Å; L284-R288 PolarHBondContact O-N 3.3Å; A285-R288 PolarHBondContact O-N 3.33Å; T286-R288 VanDerWaalsContact C-N 3.34Å; T286-R288 PolarHBondContact O-N 3.34Å; R288-W290 VanDerWaalsContact C-N 3.32Å; R288-W290 PolarHBondContact O-N 3.45Å; R288-L291 PolarHBondContact O-N 3.34Å; R288-E292 IonicContact CZ-OE1 2.63Å; R288-E292 IonicContact NE-OE1 3.08Å; R288-E292 PolarHBondContact NE-OE1 2.86Å; R288-E292 IonicContact NH2-OE1 3.31Å; R288-E292 PolarHBondContact NH2-OE1 3.27Å; R288-E292 PolarHBondContact O-N 3.49Å; R288-Y321 VanDerWaalsContact CD-O 3.3Å; R288-Y321 WeakPolarHBondContact CD-O 3.49Å; R288-Y321 PolarHBondContact NH1-O 2.98Å; R288-F322 HydrophobicContact CB-CE1 4.42Å; R288-F322 HydrophobicContact CB-CE2 3.87Å; R288-F322 HydrophobicContact CB-CZ 3.71Å; R288-F322 HydrophobicContact CG-CZ 4.44Å
289	E	98.6	Very high	98.4	Very high	56 Å²	56	37.4 Å²	37.4	26%	0.262	18%	0.182	S	C	.	.	H	α-helix	trans	-60.8	-39.8	180	-69.6	167.3	-178.1	0	0	112.3	R244 A285 Q293	R244-E289 IonicContact CZ-OE2 2.66Å; R244-E289 IonicContact NE-OE2 2.86Å; R244-E289 IonicContact NH2-OE2 3.69Å; R244-E289 PolarHBondContact NH2-OE2 3.14Å; A285-E289 WeakPolarHBondContact O-CG 3.34Å; A285-E289 PolarHBondContact O-N 2.92Å; E289-Q293 PolarHBondContact O-NE2 2.97Å
290	W	98.8	Very high	98.4	Very high	7 Å²	7	39 Å²	39	3%	0.027	19%	0.188	C	C	.	.	H	α-helix	trans	-69.7	-41.3	178.1	-173.4	97	0	0	0	111.7	L251 L255 T286 R288 Q293 H294 V298 L301	L251-W290 HydrophobicContact CB-CD2 4.25Å; L251-W290 HydrophobicContact CB-CZ2 3.85Å; L251-W290 HydrophobicContact CD1-CB 4.18Å; L251-W290 HydrophobicContact CD1-CD2 3.82Å; L251-W290 HydrophobicContact CD1-CE3 4.36Å; L251-W290 HydrophobicContact CD1-CG 3.71Å; L251-W290 HydrophobicContact CD2-CD2 4.23Å; L251-W290 HydrophobicContact CD2-CE3 4.21Å; L251-W290 HydrophobicContact CD2-CH2 4.13Å; L251-W290 HydrophobicContact CD2-CZ2 4.12Å; L251-W290 HydrophobicContact CD2-CZ3 4.18Å; L251-W290 HydrophobicContact CG-CD2 4.32Å; L251-W290 HydrophobicContact CG-CZ2 4.46Å; L255-W290 HydrophobicContact CD1-CZ2 3.77Å; L255-W290 HydrophobicContact CD2-CH2 4.05Å; L255-W290 HydrophobicContact CD2-CZ2 3.82Å; L255-W290 HydrophobicContact CG-CH2 4.45Å; L255-W290 HydrophobicContact CG-CZ2 3.75Å; T286-W290 WeakPolarHBondContact O-CB 3.28Å; T286-W290 PolarHBondContact O-N 3.02Å; R288-W290 VanDerWaalsContact C-N 3.32Å; R288-W290 PolarHBondContact O-N 3.45Å; W290-Q293 PolarHBondContact O-N 2.82Å; W290-H294 AromaticContact CD1-ND1 3.58Å; W290-H294 HydrophobicContact CD2-CB 3.89Å; W290-H294 AromaticContact CD2-ND1 3.65Å; W290-H294 AromaticContact CE2-CG 3.68Å; W290-H294 AromaticContact CE2-ND1 3.48Å; W290-H294 HydrophobicContact CE3-CB 3.82Å; W290-H294 AromaticContact CG-ND1 3.73Å; W290-H294 HydrophobicContact CH2-CB 3.57Å; W290-H294 HydrophobicContact CZ2-CB 3.64Å; W290-H294 AromaticContact CZ2-CG 3.85Å; W290-H294 HydrophobicContact CZ3-CB 3.65Å; W290-H294 AromaticContact NE1-CE1 3.83Å; W290-H294 AromaticContact NE1-CG 4Å; W290-H294 AromaticContact NE1-ND1 3.41Å; W290-H294 PolarHBondContact NE1-ND1 3.35Å; W290-H294 WeakPolarHBondContact O-CB 3.4Å; W290-H294 PolarHBondContact O-N 3.32Å; W290-H294 PolarHBondContact O-ND1 3.32Å; W290-V298 HydrophobicContact CH2-CG1 3.76Å; W290-V298 HydrophobicContact CH2-CG2 4.3Å; W290-V298 HydrophobicContact CZ3-CG1 4.08Å; W290-V298 HydrophobicContact CZ3-CG2 3.81Å; W290-L301 HydrophobicContact CE3-CD1 3.95Å; W290-L301 HydrophobicContact CZ3-CD1 3.96Å
291	L	98.8	Very high	98.5	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-65.8	-36.6	177.2	-82.5	172.6	0	0	0	112.4	L150 K153 I154 L287 R288 Q293 H294 K295 V298 L301 F322	L150-L291 HydrophobicContact CD1-CB 4.48Å; L150-L291 HydrophobicContact CD2-CB 4.04Å; K153-L291 HydrophobicContact CB-CD2 4.16Å; I154-L291 HydrophobicContact CB-CD1 4.38Å; L287-L291 WeakPolarHBondContact O-CB 3.42Å; L287-L291 VanDerWaalsContact O-CG 3.23Å; L287-L291 WeakPolarHBondContact O-CG 3.28Å; L287-L291 PolarHBondContact O-N 3.48Å; R288-L291 PolarHBondContact O-N 3.34Å; L291-Q293 PolarHBondContact O-N 3.32Å; L291-H294 PolarHBondContact O-N 2.77Å; L291-K295 WeakPolarHBondContact O-CA 3.41Å; L291-K295 WeakPolarHBondContact O-CB 3.38Å; L291-K295 PolarHBondContact O-N 3.35Å; L291-V298 HydrophobicContact CD2-CG2 3.74Å; L291-L301 HydrophobicContact CD1-CD1 4.1Å; L291-L301 HydrophobicContact CD2-CD1 3.83Å; L291-L301 HydrophobicContact CD2-CG 4.26Å; L291-L301 HydrophobicContact CG-CD1 3.81Å; L291-F322 HydrophobicContact CD1-CE1 3.94Å; L291-F322 HydrophobicContact CD1-CZ 4.05Å
292	E	98.4	Very high	98.5	Very high	90 Å²	90	37 Å²	37	42%	0.421	18%	0.179	S	C	.	.	H	α-helix	trans	-55.5	-35.3	173.7	-76.9	178.6	166.9	0	0	112.5	L150 R288	L150-E292 HydrophobicContact CD1-CG 3.67Å; R288-E292 IonicContact CZ-OE1 2.63Å; R288-E292 IonicContact NE-OE1 3.08Å; R288-E292 PolarHBondContact NE-OE1 2.86Å; R288-E292 IonicContact NH2-OE1 3.31Å; R288-E292 PolarHBondContact NH2-OE1 3.27Å; R288-E292 PolarHBondContact O-N 3.49Å
293	Q	98.4	Very high	98.6	Very high	144 Å²	144	36 Å²	36	67%	0.673	17%	0.172	S	C	*	.	H	α-helix	trans	-87.8	-32.4	179.5	-66.2	167	71.9	0	0	113.4	E289 W290 L291	E289-Q293 PolarHBondContact O-NE2 2.97Å; W290-Q293 PolarHBondContact O-N 2.82Å; L291-Q293 PolarHBondContact O-N 3.32Å
294	H	98.6	Very high	98.6	Very high	49 Å²	49	36.2 Å²	36.2	23%	0.227	17%	0.173	C	C	.	.	H	α-helix	trans	-123.3	8.9	-166.5	-56.9	99.8	0	0	0	115.1	W290 L291 D296 K297	W290-H294 AromaticContact CD1-ND1 3.58Å; W290-H294 HydrophobicContact CD2-CB 3.89Å; W290-H294 AromaticContact CD2-ND1 3.65Å; W290-H294 AromaticContact CE2-CG 3.68Å; W290-H294 AromaticContact CE2-ND1 3.48Å; W290-H294 HydrophobicContact CE3-CB 3.82Å; W290-H294 AromaticContact CG-ND1 3.73Å; W290-H294 HydrophobicContact CH2-CB 3.57Å; W290-H294 HydrophobicContact CZ2-CB 3.64Å; W290-H294 AromaticContact CZ2-CG 3.85Å; W290-H294 HydrophobicContact CZ3-CB 3.65Å; W290-H294 AromaticContact NE1-CE1 3.83Å; W290-H294 AromaticContact NE1-CG 4Å; W290-H294 AromaticContact NE1-ND1 3.41Å; W290-H294 PolarHBondContact NE1-ND1 3.35Å; W290-H294 WeakPolarHBondContact O-CB 3.4Å; W290-H294 PolarHBondContact O-N 3.32Å; W290-H294 PolarHBondContact O-ND1 3.32Å; L291-H294 PolarHBondContact O-N 2.77Å; H294-D296 PolarHBondContact O-N 3.48Å; H294-K297 HydrophobicContact CB-CG 4.28Å; H294-K297 VanDerWaalsContact O-CB 3.25Å; H294-K297 WeakPolarHBondContact O-CB 3.44Å; H294-K297 WeakPolarHBondContact O-CG 3.18Å; H294-K297 PolarHBondContact O-N 2.95Å
295	K	97.2	Very high	98.6	Very high	51 Å²	51	36.2 Å²	36.2	22%	0.222	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-43	-43	-176.3	56.9	-167.5	-175	60.7	0	114.7	L150 K153 L291 K297 V298	L150-K295 HydrophobicContact CD2-CB 3.66Å; L150-K295 HydrophobicContact CD2-CD 3.86Å; L150-K295 HydrophobicContact CD2-CG 4.38Å; K153-K295 HydrophobicContact CD-CB 3.72Å; K153-K295 VanDerWaalsContact CD-O 3.28Å; K153-K295 WeakPolarHBondContact CD-O 3.42Å; K153-K295 WeakPolarHBondContact CE-O 3.28Å; K153-K295 PolarHBondContact NZ-O 3.47Å; L291-K295 WeakPolarHBondContact O-CA 3.41Å; L291-K295 WeakPolarHBondContact O-CB 3.38Å; L291-K295 PolarHBondContact O-N 3.35Å; K295-K297 VanDerWaalsContact C-N 3.27Å; K295-K297 PolarHBondContact O-N 2.69Å; K295-V298 PolarHBondContact O-N 2.95Å
296	D	98	Very high	98.4	Very high	92 Å²	92	42.8 Å²	42.8	49%	0.492	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-78.6	-11.5	-174.5	-55.5	-55	0	0	0	113.3	Q149 R260 H294	Q149-D296 PolarHBondContact NE2-OD1 3.01Å; R260-D296 PolarHBondContact NH1-O 3.11Å; R260-D296 PolarHBondContact NH2-O 3.35Å; H294-D296 PolarHBondContact O-N 3.48Å
297	K	98.3	Very high	98.3	Very high	125 Å²	125	47.4 Å²	47.4	54%	0.543	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-77.4	-26.3	175	-54.3	-62.1	-175.1	179.1	0	113.4	L255 R260 H294 K295	L255-K297 HydrophobicContact CD2-CB 3.47Å; L255-K297 VanDerWaalsContact CD2-CB 3.47Å; L255-K297 HydrophobicContact CD2-CD 4.49Å; L255-K297 HydrophobicContact CD2-CG 3.72Å; R260-K297 PolarHBondContact NH1-O 3.02Å; H294-K297 HydrophobicContact CB-CG 4.28Å; H294-K297 VanDerWaalsContact O-CB 3.25Å; H294-K297 WeakPolarHBondContact O-CB 3.44Å; H294-K297 WeakPolarHBondContact O-CG 3.18Å; H294-K297 PolarHBondContact O-N 2.95Å; K295-K297 VanDerWaalsContact C-N 3.27Å; K295-K297 PolarHBondContact O-N 2.69Å
298	V	98.6	Very high	98.3	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	24%	0.242	C	C	.	.			trans	-123.8	152.8	-176.7	-65.9	0	0	0	0	112.6	K153 L254 R260 W290 L291 K295 L301	K153-V298 PolarHBondContact NZ-O 3.21Å; L254-V298 HydrophobicContact CD2-CG1 3.73Å; R260-V298 CarbonylContact O-C 3.56Å; R260-V298 WeakPolarHBondContact O-CA 3.43Å; R260-V298 WeakPolarHBondContact O-CB 3.45Å; W290-V298 HydrophobicContact CH2-CG1 3.76Å; W290-V298 HydrophobicContact CH2-CG2 4.3Å; W290-V298 HydrophobicContact CZ3-CG1 4.08Å; W290-V298 HydrophobicContact CZ3-CG2 3.81Å; L291-V298 HydrophobicContact CD2-CG2 3.74Å; K295-V298 PolarHBondContact O-N 2.95Å; V298-L301 HydrophobicContact CB-CD2 4.47Å; V298-L301 HydrophobicContact CG1-CD2 4.27Å; V298-L301 HydrophobicContact CG2-CD2 4.38Å; V298-L301 HydrophobicContact CG2-CG 4.34Å
299	D	98.6	Very high	98.2	Very high	76 Å²	76	57.9 Å²	57.9	41%	0.406	26%	0.264	S	S	.	.	S	Bend	trans	-99.3	-31.3	173.4	-58.4	-38.5	0	0	0	111.5	R260	R260-D299 WeakPolarHBondContact CB-OD2 3.47Å; R260-D299 WeakPolarHBondContact CD-OD2 3.22Å; R260-D299 IonicContact CZ-OD1 3.89Å; R260-D299 IonicContact CZ-OD2 3.63Å; R260-D299 VanDerWaalsContact NE-CG 3.35Å; R260-D299 IonicContact NE-OD1 3.74Å; R260-D299 PolarHBondContact NE-OD1 3.46Å; R260-D299 IonicContact NE-OD2 2.66Å; R260-D299 PolarHBondContact NE-OD2 2.97Å; R260-D299 IonicContact NH2-OD1 2.58Å; R260-D299 PolarHBondContact NH2-OD1 2.96Å; R260-D299 IonicContact NH2-OD2 3.62Å; R260-D299 PolarHBondContact O-N 3.27Å
300	R	98.8	Very high	98.1	Very high	36 Å²	36	55.5 Å²	55.5	14%	0.136	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	133.4	173.8	-158	64.9	57.6	77.6	5.7	114.8	L122 I125 T127 E152 K153 S155 R260 S261 A262 I302	L122-R300 HydrophobicContact CD1-CB 3.69Å; L122-R300 HydrophobicContact CD1-CG 3.93Å; I125-R300 PolarHBondContact O-NH1 2.83Å; T127-R300 VanDerWaalsContact CG2-NH2 3.3Å; E152-R300 PolarHBondContact O-NE 3.22Å; E152-R300 VanDerWaalsContact O-NE 3.15Å; K153-R300 CarbonylContact O-C 3.55Å; K153-R300 WeakPolarHBondContact O-CA 3.44Å; S155-R300 WeakPolarHBondContact OG-CD 3.38Å; S155-R300 PolarHBondContact OG-NH1 3.19Å; R260-R300 PolarHBondContact O-N 3.31Å; S261-R300 VanDerWaalsContact CA-O 3.31Å; S261-R300 WeakPolarHBondContact CA-O 3.46Å; A262-R300 PolarHBondContact N-O 2.7Å; R300-I302 HydrophobicContact CB-CG1 4.48Å; R300-I302 HydrophobicContact CG-CD1 4.41Å; R300-I302 HydrophobicContact CG-CG1 3.68Å
301	L	98.9	Very high	98.1	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	130.1	157.8	-53.8	-176.7	0	0	0	108.5	K153 I154 S155 L251 L254 A262 F264 L287 W290 L291 V298	K153-L301 PolarHBondContact O-N 2.97Å; I154-L301 CarbonylContact C-O 3.5Å; I154-L301 VanDerWaalsContact CA-O 3.32Å; I154-L301 WeakPolarHBondContact CA-O 3.43Å; S155-L301 PolarHBondContact N-O 2.8Å; L251-L301 HydrophobicContact CD2-CD1 3.91Å; L251-L301 HydrophobicContact CD2-CD2 3.79Å; L254-L301 HydrophobicContact CD2-CD2 4.09Å; A262-L301 HydrophobicContact CB-CD2 4.01Å; A262-L301 CarbonylContact O-C 3.56Å; A262-L301 WeakPolarHBondContact O-CA 3.43Å; F264-L301 HydrophobicContact CE2-CD2 4.46Å; L287-L301 HydrophobicContact CD2-CD1 4.02Å; W290-L301 HydrophobicContact CE3-CD1 3.95Å; W290-L301 HydrophobicContact CZ3-CD1 3.96Å; L291-L301 HydrophobicContact CD1-CD1 4.1Å; L291-L301 HydrophobicContact CD2-CD1 3.83Å; L291-L301 HydrophobicContact CD2-CG 4.26Å; L291-L301 HydrophobicContact CG-CD1 3.81Å; V298-L301 HydrophobicContact CB-CD2 4.47Å; V298-L301 HydrophobicContact CG1-CD2 4.27Å; V298-L301 HydrophobicContact CG2-CD2 4.38Å; V298-L301 HydrophobicContact CG2-CG 4.34Å
302	I	98.9	Very high	98	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	125.3	-175.4	-52.6	168.2	0	0	0	108.8	L122 I125 S155 F157 V166 A262 A263 F264 R300 C304	L122-I302 HydrophobicContact CD1-CD1 4.04Å; I125-I302 HydrophobicContact CD1-CD1 3.66Å; S155-I302 WeakPolarHBondContact O-CA 3.34Å; F157-I302 HydrophobicContact CB-CG2 3.78Å; V166-I302 HydrophobicContact CG1-CD1 3.79Å; A262-I302 PolarHBondContact O-N 3.35Å; A263-I302 CarbonylContact C-O 3.58Å; A263-I302 WeakPolarHBondContact CA-O 3.26Å; A263-I302 HydrophobicContact CB-CB 3.96Å; A263-I302 HydrophobicContact CB-CD1 4.38Å; A263-I302 HydrophobicContact CB-CG2 4.47Å; F264-I302 PolarHBondContact N-O 2.7Å; R300-I302 HydrophobicContact CB-CG1 4.48Å; R300-I302 HydrophobicContact CG-CD1 4.41Å; R300-I302 HydrophobicContact CG-CG1 3.68Å; I302-C304 PolarHBondContact O-N 3.49Å
303	I	98.9	Very high	97.9	Very high	2 Å²	2	57.6 Å²	57.6	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	104.1	166.1	-53.4	178.2	0	0	0	106.3	I154 S155 L156 F157 V283 L284 L287 V305 Y314	I154-I303 HydrophobicContact CD1-CD1 4.19Å; S155-I303 PolarHBondContact O-N 3.19Å; L156-I303 HydrophobicContact CD1-CB 4.18Å; L156-I303 HydrophobicContact CD1-CG2 4.16Å; F157-I303 PolarHBondContact N-O 2.79Å; V283-I303 HydrophobicContact CG1-CD1 4.45Å; L284-I303 HydrophobicContact CD2-CD1 3.68Å; L287-I303 HydrophobicContact CD1-CD1 4.06Å; L287-I303 HydrophobicContact CD1-CG1 3.9Å; I303-V305 HydrophobicContact CG2-CG1 4.04Å; I303-V305 PolarHBondContact O-N 2.88Å; I303-Y314 HydrophobicContact CD1-CD1 3.71Å; I303-Y314 HydrophobicContact CD1-CE1 3.82Å; I303-Y314 HydrophobicContact CG2-CD1 3.89Å; I303-Y314 HydrophobicContact CG2-CD2 3.98Å; I303-Y314 HydrophobicContact CG2-CE1 3.8Å; I303-Y314 HydrophobicContact CG2-CE2 3.9Å; I303-Y314 HydrophobicContact CG2-CG 3.98Å
304	C	98.8	Very high	97.9	Very high	6 Å²	6	51 Å²	51	4%	0.041	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	90.2	-178.1	-170.2	0	0	0	0	109.9	F157 I161 L164 A263 F264 I302	F157-C304 CarbonylContact O-C 3.57Å; F157-C304 VanDerWaalsContact O-CA 3.29Å; F157-C304 WeakPolarHBondContact O-CA 3.47Å; I161-C304 HydrophobicContact CB-CB 4.27Å; I161-C304 VanDerWaalsContact CB-SG 3.59Å; I161-C304 HydrophobicContact CD1-CB 3.99Å; I161-C304 HydrophobicContact CG1-CB 3.93Å; L164-C304 HydrophobicContact CD1-CB 4.27Å; A263-C304 HydrophobicContact CB-CB 4.42Å; F264-C304 PolarHBondContact O-N 2.92Å; I302-C304 PolarHBondContact O-N 3.49Å
305	V	98.4	Very high	97.8	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.006	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	155.6	176.7	-57.9	0	0	0	0	110.9	L156 F157 R158 G159 I303 D310 E311 Y314	L156-V305 HydrophobicContact CD1-CG1 3.74Å; L156-V305 HydrophobicContact CD1-CG2 4.09Å; F157-V305 PolarHBondContact O-N 3.49Å; R158-V305 VanDerWaalsContact CA-O 3.31Å; R158-V305 WeakPolarHBondContact CA-O 3.4Å; R158-V305 HydrophobicContact CB-CG2 3.7Å; R158-V305 HydrophobicContact CG-CG2 4.11Å; G159-V305 PolarHBondContact N-O 2.91Å; I303-V305 HydrophobicContact CG2-CG1 4.04Å; I303-V305 PolarHBondContact O-N 2.88Å; V305-D310 HydrophobicContact CB-CB 3.97Å; V305-D310 HydrophobicContact CG1-CB 3.99Å; V305-E311 HydrophobicContact CG2-CB 3.81Å; V305-E311 HydrophobicContact CG2-CG 4.32Å; V305-Y314 HydrophobicContact CG1-CD2 3.55Å; V305-Y314 HydrophobicContact CG1-CE2 4.04Å; V305-Y314 HydrophobicContact CG1-CG 4.36Å
306	F	96.1	Very high	97.6	Very high	155 Å²	155	54.4 Å²	54.4	68%	0.68	26%	0.255	S	S	*	.			trans	-114.4	-46	176.4	-173.9	-102.8	0	0	0	112.5
307	R	96.9	Very high	97.4	Very high	100 Å²	100	53.9 Å²	53.9	38%	0.377	25%	0.246	S	C	.	.	S	Bend	trans	-86.6	148.5	180	-52.5	175	-66.5	-156.5	-3.2	110.7	T269 C276 K309 D310 E311	T269-R307 PolarHBondContact O-NH1 3.49Å; T269-R307 PolarHBondContact O-NH2 3.13Å; C276-R307 PolarHBondContact SG-NH2 3.31Å; R307-K309 VanDerWaalsContact C-N 3.32Å; R307-K309 PolarHBondContact O-N 2.87Å; R307-D310 WeakPolarHBondContact CB-OD2 3.45Å; R307-D310 IonicContact CZ-OD1 2.82Å; R307-D310 IonicContact CZ-OD2 3.34Å; R307-D310 IonicContact NE-OD1 2.89Å; R307-D310 IonicContact NE-OD2 3.64Å; R307-D310 PolarHBondContact NE-OD2 2.98Å; R307-D310 IonicContact NH2-OD1 3.35Å; R307-D310 PolarHBondContact NH2-OD1 2.63Å; R307-D310 IonicContact NH2-OD2 3.67Å; R307-D310 PolarHBondContact NH2-OD2 3.37Å; R307-D310 VanDerWaalsContact NH2-OD2 3.1Å; R307-D310 PolarHBondContact O-N 3.11Å; R307-D310 VanDerWaalsContact O-N 3.12Å; R307-E311 PolarHBondContact O-N 3.17Å
308	E	97	Very high	97.3	Very high	114 Å²	114	48 Å²	48	53%	0.533	22%	0.22	S	C	.	.	H	α-helix	trans	-54.6	-46.6	172.6	-161.1	144.4	127	0	0	112	R158 D310 E311 D312	R158-E308 IonicContact CZ-OE2 3.17Å; R158-E308 IonicContact NH1-OE2 3.9Å; R158-E308 PolarHBondContact NH1-OE2 3.16Å; R158-E308 IonicContact NH2-OE2 3.95Å; R158-E308 PolarHBondContact NH2-OE2 3.39Å; E308-D310 PolarHBondContact O-N 3.22Å; E308-D310 VanDerWaalsContact O-N 3.16Å; E308-E311 WeakPolarHBondContact O-CA 3.45Å; E308-E311 VanDerWaalsContact O-CB 3.3Å; E308-E311 WeakPolarHBondContact O-CB 3.45Å; E308-E311 PolarHBondContact O-N 3.46Å; E308-D312 PolarHBondContact O-N 3.23Å
309	K	97.1	Very high	97.1	Very high	111 Å²	111	48.1 Å²	48.1	48%	0.483	22%	0.221	S	C	.	.	H	α-helix	trans	-51.4	-42.3	175.8	177.1	172.4	178.3	171.8	0	112.8	E277 R307 I313	E277-K309 IonicContact OE1-NZ 2.97Å; E277-K309 PolarHBondContact OE1-NZ 2.89Å; R307-K309 VanDerWaalsContact C-N 3.32Å; R307-K309 PolarHBondContact O-N 2.87Å; K309-I313 HydrophobicContact CD-CD1 4.44Å; K309-I313 HydrophobicContact CG-CD1 3.83Å; K309-I313 VanDerWaalsContact O-CD1 3.29Å; K309-I313 WeakPolarHBondContact O-CD1 3.1Å; K309-I313 WeakPolarHBondContact O-CG1 3.29Å; K309-I313 PolarHBondContact O-N 3.48Å; K309-I313 VanDerWaalsContact O-N 3.17Å
310	D	97.4	Very high	96.9	Very high	6 Å²	6	47 Å²	47	3%	0.032	21%	0.214	C	C	.	.	H	α-helix	trans	-71.6	-38.3	179.3	-56.7	-54.7	0	0	0	110.7	V305 R307 E308 I313 Y314	V305-D310 HydrophobicContact CB-CB 3.97Å; V305-D310 HydrophobicContact CG1-CB 3.99Å; R307-D310 WeakPolarHBondContact CB-OD2 3.45Å; R307-D310 IonicContact CZ-OD1 2.82Å; R307-D310 IonicContact CZ-OD2 3.34Å; R307-D310 IonicContact NE-OD1 2.89Å; R307-D310 IonicContact NE-OD2 3.64Å; R307-D310 PolarHBondContact NE-OD2 2.98Å; R307-D310 IonicContact NH2-OD1 3.35Å; R307-D310 PolarHBondContact NH2-OD1 2.63Å; R307-D310 IonicContact NH2-OD2 3.67Å; R307-D310 PolarHBondContact NH2-OD2 3.37Å; R307-D310 VanDerWaalsContact NH2-OD2 3.1Å; R307-D310 PolarHBondContact O-N 3.11Å; R307-D310 VanDerWaalsContact O-N 3.12Å; E308-D310 PolarHBondContact O-N 3.22Å; E308-D310 VanDerWaalsContact O-N 3.16Å; D310-I313 PolarHBondContact O-N 3.12Å; D310-Y314 VanDerWaalsContact O-CD2 3.26Å; D310-Y314 WeakPolarHBondContact O-CD2 3.03Å; D310-Y314 PolarHBondContact O-N 3.04Å
311	E	97.8	Very high	96.8	Very high	36 Å²	36	45.5 Å²	45.5	17%	0.168	21%	0.208	C	C	.	.	H	α-helix	trans	-57.9	-48.3	174.1	-171.8	-179.1	-164.5	0	0	111.8	L156 R158 V305 R307 E308 I313 Y314 R315	L156-E311 HydrophobicContact CD2-CG 4.34Å; R158-E311 WeakPolarHBondContact CD-OE2 3.35Å; R158-E311 IonicContact CZ-OE2 3.34Å; R158-E311 IonicContact NE-OE2 3.71Å; R158-E311 IonicContact NH1-OE2 3.1Å; R158-E311 PolarHBondContact NH1-OE2 3.08Å; V305-E311 HydrophobicContact CG2-CB 3.81Å; V305-E311 HydrophobicContact CG2-CG 4.32Å; R307-E311 PolarHBondContact O-N 3.17Å; E308-E311 WeakPolarHBondContact O-CA 3.45Å; E308-E311 VanDerWaalsContact O-CB 3.3Å; E308-E311 WeakPolarHBondContact O-CB 3.45Å; E308-E311 PolarHBondContact O-N 3.46Å; E311-I313 PolarHBondContact O-N 3.47Å; E311-Y314 PolarHBondContact O-N 2.84Å; E311-R315 WeakPolarHBondContact O-CB 3.33Å; E311-R315 PolarHBondContact O-N 3.4Å
312	D	96.8	Very high	96.7	Very high	89 Å²	89	45.5 Å²	45.5	48%	0.476	21%	0.208	S	C	.	.	H	α-helix	trans	-63.7	-41.3	179.8	-66.1	-36.9	0	0	0	112.3	E308 S316	E308-D312 PolarHBondContact O-N 3.23Å; D312-S316 WeakPolarHBondContact O-CB 3.42Å; D312-S316 PolarHBondContact O-N 3.47Å; D312-S316 PolarHBondContact O-OG 3.11Å
313	I	97.4	Very high	96.5	Very high	16 Å²	16	46 Å²	46	8%	0.082	21%	0.211	C	C	.	.	H	α-helix	trans	-61	-55	174.1	-69.5	163.5	0	0	0	110	C276 E277 A280 K309 D310 E311 R315 S316 R317	C276-I313 HydrophobicContact CB-CD1 3.65Å; E277-I313 HydrophobicContact CG-CD1 3.8Å; E277-I313 HydrophobicContact CG-CG1 3.96Å; E277-I313 HydrophobicContact CG-CG2 4.3Å; A280-I313 HydrophobicContact CB-CG2 3.53Å; K309-I313 HydrophobicContact CD-CD1 4.44Å; K309-I313 HydrophobicContact CG-CD1 3.83Å; K309-I313 VanDerWaalsContact O-CD1 3.29Å; K309-I313 WeakPolarHBondContact O-CD1 3.1Å; K309-I313 WeakPolarHBondContact O-CG1 3.29Å; K309-I313 PolarHBondContact O-N 3.48Å; K309-I313 VanDerWaalsContact O-N 3.17Å; D310-I313 PolarHBondContact O-N 3.12Å; E311-I313 PolarHBondContact O-N 3.47Å; I313-R315 VanDerWaalsContact C-N 3.32Å; I313-R315 PolarHBondContact O-N 2.64Å; I313-S316 PolarHBondContact O-N 3.14Å; I313-S316 PolarHBondContact O-OG 3.19Å; I313-R317 HydrophobicContact CG2-CG 4.48Å; I313-R317 WeakPolarHBondContact O-CB 3.39Å; I313-R317 VanDerWaalsContact O-CG 3.27Å; I313-R317 WeakPolarHBondContact O-CG 3.48Å; I313-R317 PolarHBondContact O-N 3.03Å
314	Y	97.7	Very high	96.1	Very high	5 Å²	5	47.9 Å²	47.9	2%	0.02	22%	0.223	C	C	.	.	H	α-helix	trans	-64.3	-37.5	-178.4	-83	-74.8	0	0	0	112.1	L156 A280 V283 L284 I303 V305 D310 E311 R317 L318	L156-Y314 HydrophobicContact CD1-CG 4.34Å; A280-Y314 HydrophobicContact CB-CD1 4.1Å; A280-Y314 HydrophobicContact CB-CD2 4.5Å; A280-Y314 HydrophobicContact CB-CE1 3.72Å; A280-Y314 HydrophobicContact CB-CE2 4.16Å; A280-Y314 HydrophobicContact CB-CG 4.48Å; V283-Y314 HydrophobicContact CB-CE1 4.15Å; V283-Y314 HydrophobicContact CG1-CE1 4.03Å; V283-Y314 WeakPolarHBondContact CG2-OH 3.49Å; L284-Y314 HydrophobicContact CD1-CD1 4.12Å; L284-Y314 HydrophobicContact CD2-CD1 4.1Å; L284-Y314 HydrophobicContact CD2-CE1 4.4Å; L284-Y314 HydrophobicContact CG-CD1 4.03Å; L284-Y314 HydrophobicContact CG-CE1 4.1Å; I303-Y314 HydrophobicContact CD1-CD1 3.71Å; I303-Y314 HydrophobicContact CD1-CE1 3.82Å; I303-Y314 HydrophobicContact CG2-CD1 3.89Å; I303-Y314 HydrophobicContact CG2-CD2 3.98Å; I303-Y314 HydrophobicContact CG2-CE1 3.8Å; I303-Y314 HydrophobicContact CG2-CE2 3.9Å; I303-Y314 HydrophobicContact CG2-CG 3.98Å; V305-Y314 HydrophobicContact CG1-CD2 3.55Å; V305-Y314 HydrophobicContact CG1-CE2 4.04Å; V305-Y314 HydrophobicContact CG1-CG 4.36Å; D310-Y314 VanDerWaalsContact O-CD2 3.26Å; D310-Y314 WeakPolarHBondContact O-CD2 3.03Å; D310-Y314 PolarHBondContact O-N 3.04Å; E311-Y314 PolarHBondContact O-N 2.84Å; Y314-R317 PolarHBondContact O-N 2.98Å; Y314-L318 WeakPolarHBondContact O-CB 3.44Å; Y314-L318 WeakPolarHBondContact O-CD1 3.46Å; Y314-L318 VanDerWaalsContact O-CG 3.23Å; Y314-L318 WeakPolarHBondContact O-CG 3.32Å; Y314-L318 PolarHBondContact O-N 3.13Å
315	R	95.3	Very high	95.2	Very high	104 Å²	104	53 Å²	53	39%	0.392	27%	0.266	S	S	.	.	H	α-helix	trans	-67.4	-37.2	179	-172.2	176.1	-173.6	172.4	1.9	113	L156 E311 I313 P319	L156-R315 HydrophobicContact CD2-CB 3.97Å; E311-R315 WeakPolarHBondContact O-CB 3.33Å; E311-R315 PolarHBondContact O-N 3.4Å; I313-R315 VanDerWaalsContact C-N 3.32Å; I313-R315 PolarHBondContact O-N 2.64Å; R315-P319 VanDerWaalsContact O-CD 3.32Å; R315-P319 WeakPolarHBondContact O-CD 3.08Å
316	S	93.6	Very high	95.1	Very high	69 Å²	69	55.7 Å²	55.7	48%	0.483	28%	0.279	S	S	.	.	H	α-helix	trans	-75.5	-33.5	175.7	57.8	0	0	0	0	112.8	D312 I313	D312-S316 WeakPolarHBondContact O-CB 3.42Å; D312-S316 PolarHBondContact O-N 3.47Å; D312-S316 PolarHBondContact O-OG 3.11Å; I313-S316 PolarHBondContact O-N 3.14Å; I313-S316 PolarHBondContact O-OG 3.19Å
317	R	94.9	Very high	95	Very high	81 Å²	81	50.4 Å²	50.4	31%	0.306	26%	0.258	S	S	.	.	H	α-helix	trans	-86.8	-30.8	-178.4	-58	-57.1	-70.7	174.5	-8.6	114.4	E281 L284 I313 Y314 P319 H320	E281-R317 IonicContact OE1-CZ 3.73Å; E281-R317 VanDerWaalsContact OE1-CZ 3.31Å; E281-R317 IonicContact OE1-NE 2.7Å; E281-R317 PolarHBondContact OE1-NE 3.24Å; E281-R317 IonicContact OE1-NH2 3.18Å; E281-R317 PolarHBondContact OE1-NH2 3.04Å; E281-R317 VanDerWaalsContact OE1-NH2 3.08Å; E281-R317 IonicContact OE2-CZ 2.74Å; E281-R317 IonicContact OE2-NE 3.73Å; E281-R317 IonicContact OE2-NH2 2.89Å; E281-R317 PolarHBondContact OE2-NH2 3.45Å; L284-R317 HydrophobicContact CD1-CB 3.53Å; I313-R317 HydrophobicContact CG2-CG 4.48Å; I313-R317 WeakPolarHBondContact O-CB 3.39Å; I313-R317 VanDerWaalsContact O-CG 3.27Å; I313-R317 WeakPolarHBondContact O-CG 3.48Å; I313-R317 PolarHBondContact O-N 3.03Å; Y314-R317 PolarHBondContact O-N 2.98Å; R317-P319 VanDerWaalsContact C-CD 3.45Å; R317-H320 WeakPolarHBondContact O-CB 3.48Å; R317-H320 PolarHBondContact O-N 2.88Å
318	L	95.2	Very high	94.9	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-46.7	-46.6	178.3	-95.4	163.8	0	0	0	114.6	W128 I154 L156 L284 Y314 H320 Y321 F322	W128-L318 HydrophobicContact CD2-CB 4.28Å; W128-L318 HydrophobicContact CD2-CD1 4.24Å; W128-L318 HydrophobicContact CD2-CD2 4.42Å; W128-L318 HydrophobicContact CE3-CB 4.36Å; W128-L318 HydrophobicContact CE3-CD1 3.84Å; W128-L318 HydrophobicContact CH2-CB 3.85Å; W128-L318 HydrophobicContact CZ2-CB 3.75Å; W128-L318 HydrophobicContact CZ3-CB 4.15Å; W128-L318 HydrophobicContact CZ3-CD1 4.02Å; I154-L318 HydrophobicContact CD1-CD2 4.3Å; L156-L318 HydrophobicContact CB-CD1 3.87Å; L156-L318 HydrophobicContact CD2-CD1 4.07Å; L156-L318 HydrophobicContact CG-CD1 4.5Å; L284-L318 HydrophobicContact CD2-CD2 3.63Å; L284-L318 HydrophobicContact CD2-CG 3.91Å; Y314-L318 WeakPolarHBondContact O-CB 3.44Å; Y314-L318 WeakPolarHBondContact O-CD1 3.46Å; Y314-L318 VanDerWaalsContact O-CG 3.23Å; Y314-L318 WeakPolarHBondContact O-CG 3.32Å; Y314-L318 PolarHBondContact O-N 3.13Å; L318-H320 PolarHBondContact O-N 3.36Å; L318-H320 VanDerWaalsContact O-N 3.17Å; L318-Y321 PolarHBondContact O-N 2.97Å; L318-Y321 VanDerWaalsContact O-N 3.11Å; L318-F322 HydrophobicContact CD2-CB 4.48Å; L318-F322 HydrophobicContact CD2-CD2 3.86Å; L318-F322 HydrophobicContact CD2-CG 4.45Å; L318-F322 PolarHBondContact O-N 2.9Å
319	P	94.6	Very high	94.8	Very high	3 Å²	3	43.8 Å²	43.8	2%	0.019	24%	0.235	C	C	.	.	H	α-helix	trans	-56.7	-28.2	178.1	-25.8	32.6	0	0	0	115.7	W128 V137 V139 R315 R317 P323	W128-P319 HydrophobicContact CH2-CG 3.99Å; W128-P319 HydrophobicContact CZ2-CB 4.48Å; W128-P319 HydrophobicContact CZ2-CG 3.77Å; V137-P319 HydrophobicContact CB-CB 4.21Å; V137-P319 HydrophobicContact CB-CG 4.15Å; V137-P319 HydrophobicContact CG1-CB 3.72Å; V137-P319 HydrophobicContact CG1-CG 3.8Å; V137-P319 HydrophobicContact CG2-CB 4.4Å; V137-P319 HydrophobicContact CG2-CG 3.81Å; V139-P319 HydrophobicContact CG2-CB 3.6Å; R315-P319 VanDerWaalsContact O-CD 3.32Å; R315-P319 WeakPolarHBondContact O-CD 3.08Å; R317-P319 VanDerWaalsContact C-CD 3.45Å; P319-P323 VanDerWaalsContact O-CA 3.31Å; P319-P323 WeakPolarHBondContact O-CA 3.43Å; P319-P323 WeakPolarHBondContact O-CG 3.47Å
320	H	94.4	Very high	94.6	Very high	54 Å²	54	39.6 Å²	39.6	25%	0.25	22%	0.219	C	C	.	.	H	α-helix	trans	-76.1	-29.1	179.3	-63	-96.3	0	0	0	112.5	V139 R143 R317 L318	V139-H320 WeakPolarHBondContact CG1-ND1 3.5Å; R143-H320 PolarHBondContact N-O 3.19Å; R317-H320 WeakPolarHBondContact O-CB 3.48Å; R317-H320 PolarHBondContact O-N 2.88Å; L318-H320 PolarHBondContact O-N 3.36Å; L318-H320 VanDerWaalsContact O-N 3.17Å
321	Y	96.5	Very high	94.5	Very high	4 Å²	4	41.8 Å²	41.8	2%	0.016	23%	0.232	C	C	.	.	H	α-helix	trans	-98.9	-31.3	-177.8	-72.8	-87.3	0	0	0	113	R143 Y144 E281 L284 A285 R288 L318	R143-Y321 PolarHBondContact NH1-OH 3.41Å; Y144-Y321 AromaticContact CD2-CD1 3.88Å; Y144-Y321 HydrophobicContact CD2-CD1 3.88Å; Y144-Y321 HydrophobicContact CD2-CE1 4.48Å; Y144-Y321 HydrophobicContact CD2-CG 4.45Å; Y144-Y321 AromaticContact CE2-CD1 3.32Å; Y144-Y321 HydrophobicContact CE2-CD1 3.32Å; Y144-Y321 AromaticContact CE2-CE1 3.6Å; Y144-Y321 HydrophobicContact CE2-CE1 3.6Å; Y144-Y321 HydrophobicContact CE2-CG 4.29Å; E281-Y321 PolarHBondContact O-OH 3.13Å; E281-Y321 PolarHBondContact OE2-OH 3.46Å; L284-Y321 HydrophobicContact CB-CD1 3.93Å; L284-Y321 HydrophobicContact CB-CD2 3.54Å; L284-Y321 HydrophobicContact CB-CE1 4.28Å; L284-Y321 HydrophobicContact CB-CE2 3.92Å; L284-Y321 HydrophobicContact CB-CG 3.55Å; L284-Y321 HydrophobicContact CD1-CD2 3.83Å; L284-Y321 HydrophobicContact CD1-CE2 4.28Å; L284-Y321 HydrophobicContact CG-CD2 4.31Å; A285-Y321 VanDerWaalsContact CA-CE1 3.47Å; A285-Y321 HydrophobicContact CB-CD1 4.4Å; A285-Y321 HydrophobicContact CB-CE1 3.66Å; R288-Y321 VanDerWaalsContact CD-O 3.3Å; R288-Y321 WeakPolarHBondContact CD-O 3.49Å; R288-Y321 PolarHBondContact NH1-O 2.98Å; L318-Y321 PolarHBondContact O-N 2.97Å; L318-Y321 VanDerWaalsContact O-N 3.11Å
322	F	96.3	Very high	94.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.236	C	C	.	.	S	Bend	trans	-131	71.6	-179.5	-67.8	-89.8	0	0	0	109.3	W128 L150 N151 I154 L284 R288 L291 L318	W128-F322 PolarHBondContact NE1-O 2.83Å; L150-F322 HydrophobicContact CB-CD1 4.2Å; L150-F322 HydrophobicContact CB-CE1 4.15Å; N151-F322 WeakPolarHBondContact OD1-CB 3.41Å; I154-F322 HydrophobicContact CB-CE1 4.45Å; I154-F322 HydrophobicContact CD1-CD2 4.14Å; I154-F322 HydrophobicContact CD1-CE1 4.22Å; I154-F322 HydrophobicContact CD1-CE2 3.52Å; I154-F322 HydrophobicContact CD1-CZ 3.55Å; I154-F322 HydrophobicContact CG2-CD1 3.88Å; I154-F322 HydrophobicContact CG2-CE1 4.03Å; I154-F322 HydrophobicContact CG2-CG 4.14Å; I154-F322 HydrophobicContact CG2-CZ 4.42Å; L284-F322 HydrophobicContact CD2-CE2 4.42Å; R288-F322 HydrophobicContact CB-CE1 4.42Å; R288-F322 HydrophobicContact CB-CE2 3.87Å; R288-F322 HydrophobicContact CB-CZ 3.71Å; R288-F322 HydrophobicContact CG-CZ 4.44Å; L291-F322 HydrophobicContact CD1-CE1 3.94Å; L291-F322 HydrophobicContact CD1-CZ 4.05Å; L318-F322 HydrophobicContact CD2-CB 4.48Å; L318-F322 HydrophobicContact CD2-CD2 3.86Å; L318-F322 HydrophobicContact CD2-CG 4.45Å; L318-F322 PolarHBondContact O-N 2.9Å
323	P	94.7	Very high	94	Very high	9 Å²	9	38.6 Å²	38.6	6%	0.058	22%	0.218	C	C	.	.			trans	-65.8	146	-175.7	-16.9	29.4	0	0	0	112.2	P142 Y144 K146 N151 P319	P142-P323 HydrophobicContact CB-CB 4.33Å; P142-P323 HydrophobicContact CB-CG 3.85Å; Y144-P323 WeakPolarHBondContact O-CG 3.49Å; K146-P323 HydrophobicContact CB-CB 4.21Å; K146-P323 WeakPolarHBondContact CG-O 3.41Å; N151-P323 PolarHBondContact ND2-O 3.32Å; P319-P323 VanDerWaalsContact O-CA 3.31Å; P319-P323 WeakPolarHBondContact O-CA 3.43Å; P319-P323 WeakPolarHBondContact O-CG 3.47Å
324	V	90.4	Very high	93.7	Very high	42 Å²	42	40.5 Å²	40.5	26%	0.255	23%	0.229	S	C	.	.			trans	-117.2	-24.4	-173.7	-67.3	0	0	0	0	113.3	W128 A132 K146	W128-V324 HydrophobicContact CZ2-CG1 4.4Å; A132-V324 HydrophobicContact CB-CB 4.13Å; A132-V324 HydrophobicContact CB-CG1 3.69Å; A132-V324 HydrophobicContact CB-CG2 4.03Å; K146-V324 VanDerWaalsContact CE-O 3.3Å; K146-V324 WeakPolarHBondContact CE-O 3.23Å; K146-V324 PolarHBondContact NZ-O 3.5Å
325	A	81.4	Confident	93.4	Very high	115 Å²	115	43.7 Å²	43.7	95%	0.95	25%	0.248	S	C	*	.			trans	-84.6	0	166.2	0	0	0	0	0	109.5	K146	K146-A325 VanDerWaalsContact CD-O 3.27Å; K146-A325 WeakPolarHBondContact CD-O 3.31Å; K146-A325 VanDerWaalsContact CD-OXT 3.22Å; K146-A325 WeakPolarHBondContact CD-OXT 3.25Å; K146-A325 WeakPolarHBondContact CE-OXT 3.19Å; K146-A325 VanDerWaalsContact NZ-C 3.3Å; K146-A325 PolarHBondContact NZ-OXT 2.89Å

Retrieved 325 of 325 residues in 184.1 ms (Link to these results)

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