A0A096N875_PAPAN Loading...

N-lysine methyltransferase KMT5A

Protein-lysine N-methyltransferase that monomethylates both histones and non-histone proteins. Specifically monomethylates 'Lys-20' of histone H4 (H4K20me1). H4K20me1 is enriched during mitosis and represents a specific tag for epigenetic transcriptional repression. Mainly functions in euchromatin regions, thereby playing a central role in the silencing of euchromatic genes. Required for cell proliferation, probably by contributing to the maintenance of proper higher-order structure of DNA during mitosis. Involved in chromosome condensation and proper cytokinesis. Nucleosomes are preferred as substrate compared to free histones. Mediates monomethylation of p53/TP53 at 'Lys-382', leading to repress p53/TP53-target genes. Plays a negative role in TGF-beta response regulation and a positive role in cell migration.

AlphaFold DB (A0A2K6E573), UniProt , Accession A0A096N875, Species PAPAN (Papio anubis, Olive baboon), Gene KMT5A, Length 352 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	44.1	Very low	45.3	Very low	240 Å²	240	177.8 Å²	177.8	100%	1.182	89%	0.885	S	S	*	*				0	111.9	0	-53.3	171.8	-172.9	0	0	105.4
2	A	40.7	Very low	45.3	Very low	95 Å²	95	170.5 Å²	170.5	79%	0.785	87%	0.874	S	S	*	*				55.6	116.8	60.9	0	0	0	0	0	110.8
3	R	44.1	Very low	45	Very low	247 Å²	247	167.6 Å²	167.6	93%	0.932	87%	0.868	S	S	*	*			cis	-130.7	167.5	9.2	-56.8	168.1	179.1	166.4	-1.9	108.1
4	G	39.2	Very low	44.3	Very low	70 Å²	70	168.5 Å²	168.5	72%	0.722	87%	0.866	S	S	*	*			cis	87.4	125.8	28.9	0	0	0	0	0	110.8
5	R	45.5	Very low	43.9	Very low	225 Å²	225	163.7 Å²	163.7	85%	0.849	86%	0.862	S	S	*	*			cis	-163.2	149.6	6.4	-101.8	-176.6	172.5	-175.8	0.5	111.8
6	K	43.2	Very low	43.3	Very low	191 Å²	191	159.1 Å²	159.1	83%	0.83	86%	0.855	S	S	*	*			trans	54.6	152.7	141.4	-65.7	-167	173.1	-168	0	122.7
7	M	50.1	Low	42.9	Very low	187 Å²	187	155.6 Å²	155.6	92%	0.921	85%	0.853	S	S	*	*			trans	-93.9	165.2	172.4	-49.6	-162	-59.6	0	0	113.2
8	S	41.8	Very low	42.5	Very low	121 Å²	121	152.7 Å²	152.7	85%	0.846	85%	0.853	S	S	*	*			trans	-145.8	143.7	159.3	51.5	0	0	0	0	111.6
9	K	53.9	Low	42	Very low	201 Å²	201	150 Å²	150	87%	0.874	85%	0.852	S	S	*	*			trans	-88.5	156.2	172.2	-68.1	-174.9	178	-177.2	0	110.4
10	P	54.1	Low	41.7	Very low	135 Å²	135	147.6 Å²	147.6	88%	0.877	85%	0.852	S	S	*	*			trans	-70.7	155.6	167.7	31.5	-35.6	0	0	0	111.9
11	R	41.9	Very low	41.4	Very low	244 Å²	244	144.6 Å²	144.6	92%	0.921	84%	0.844	S	S	*	*			trans	-140.1	143	169.2	-175.9	177.5	179.8	179.6	0.8	108.8
12	A	44.6	Very low	41.1	Very low	90 Å²	90	140.2 Å²	140.2	74%	0.744	83%	0.83	S	S	*	*			trans	-94.9	151.3	-174.8	0	0	0	0	0	114.1
13	V	42.2	Very low	40.8	Very low	133 Å²	133	139.6 Å²	139.6	81%	0.806	83%	0.825	S	S	*	*			trans	-155.7	127.8	156.7	-167	0	0	0	0	103.3
14	E	35.4	Very low	40.3	Very low	180 Å²	180	132.1 Å²	132.1	84%	0.841	82%	0.817	S	S	*	*			cis	96	145.4	29.9	-168.7	172.4	-156.2	0	0	114.3
15	A	37	Very low	40	Very low	97 Å²	97	135.7 Å²	135.7	80%	0.802	83%	0.825	S	S	*	*			trans	68.3	148.6	177.7	0	0	0	0	0	116.9
16	A	35.3	Very low	39.7	Very low	90 Å²	90	129 Å²	129	74%	0.744	82%	0.817	S	S	*	*			cis	-150.3	153.1	-12.7	0	0	0	0	0	107.5
17	A	36.2	Very low	40.1	Very low	100 Å²	100	125.8 Å²	125.8	83%	0.826	82%	0.816	S	S	*	*			cis	85	93.2	31.9	0	0	0	0	0	115.3
18	A	35.1	Very low	39.2	Very low	102 Å²	102	120.5 Å²	120.5	84%	0.843	81%	0.81	S	S	*	*			trans	-156.5	119.8	161.5	0	0	0	0	0	107.4
19	A	34.2	Very low	39.9	Very low	102 Å²	102	120.4 Å²	120.4	84%	0.843	81%	0.806	S	S	*	*			cis	83.8	79.2	8.5	0	0	0	0	0	117.4
20	A	35.4	Very low	38.9	Very low	102 Å²	102	119 Å²	119	84%	0.843	80%	0.803	S	S	*	*			trans	-169.7	157.4	143.5	0	0	0	0	0	110.5
21	A	35.8	Very low	38	Very low	84 Å²	84	119.9 Å²	119.9	69%	0.694	80%	0.797	S	S	*	*			cis	178.2	137.4	-44	0	0	0	0	0	109.8
22	V	36.6	Very low	37.7	Very low	148 Å²	148	114.3 Å²	114.3	90%	0.897	79%	0.79	S	S	*	*			trans	66.2	146.4	144.7	174.6	0	0	0	0	117.6
23	A	34.7	Very low	37.3	Very low	82 Å²	82	116 Å²	116	68%	0.678	78%	0.782	S	S	*	*			cis	-136	146.7	-1.3	0	0	0	0	0	108.7
24	A	34.1	Very low	37	Very low	91 Å²	91	121.2 Å²	121.2	75%	0.752	79%	0.788	S	S	*	*				69.5	121.7	72.9	0	0	0	0	0	116.3
25	T	33.1	Very low	36.8	Very low	145 Å²	145	122.5 Å²	122.5	89%	0.89	79%	0.785	S	S	*	*			trans	151.6	148.5	136.7	-59	0	0	0	0	112.2
26	A	37.9	Very low	36.7	Very low	84 Å²	84	121.2 Å²	121.2	69%	0.694	78%	0.78	S	S	*	*			trans	-143.8	-167.6	177.5	0	0	0	0	0	108.8
27	P	52	Low	37.2	Very low	123 Å²	123	123.7 Å²	123.7	80%	0.799	79%	0.789	S	S	*	*			cis	-138.7	152.9	-12.9	38.3	-19.9	0	0	0	117.2
28	G	32.2	Very low	37	Very low	77 Å²	77	122.5 Å²	122.5	79%	0.794	79%	0.786	S	S	*	*			trans	62.9	-173.9	157.9	0	0	0	0	0	119.1
29	P	55.6	Low	37.1	Very low	119 Å²	119	129 Å²	129	77%	0.773	79%	0.789	S	S	*	*			cis	-129.1	-165.3	-20.2	42.7	-26.3	0	0	0	113.7
30	E	34.2	Very low	37.4	Very low	171 Å²	171	129.8 Å²	129.8	80%	0.799	79%	0.785	S	S	*	*			trans	63.5	169.3	164.1	-78	-158.6	109.6	0	0	119.7
31	M	33.9	Very low	37.3	Very low	154 Å²	154	135.8 Å²	135.8	76%	0.759	79%	0.786	S	S	*	*				-161	-170.1	-50.7	-137.6	-178.8	71.3	0	0	110.5
32	V	36.4	Very low	37.5	Very low	126 Å²	126	137.4 Å²	137.4	76%	0.764	79%	0.788	S	S	*	*			trans	98.7	129.8	160.8	-172.4	0	0	0	0	120.6
33	E	36.1	Very low	37.3	Very low	125 Å²	125	137.3 Å²	137.3	58%	0.584	78%	0.782	S	S	*	*			trans	-76.5	154.8	176.4	178.5	-155.2	152.1	0	0	114.5	R35	E33-R35 IonicContact OE1-CZ 3.69Å; E33-R35 IonicContact OE1-NE 2.96Å; E33-R35 PolarHBondContact OE1-NE 2.96Å; E33-R35 IonicContact OE1-NH2 3.51Å
34	R	35	Very low	37.3	Very low	244 Å²	244	136.7 Å²	136.7	92%	0.921	78%	0.783	S	S	*	*			trans	-159.8	166.6	139	-108.2	150	-155.6	-124.7	2.2	115.2
35	R	31.9	Very low	37.6	Very low	207 Å²	207	141.1 Å²	141.1	78%	0.781	79%	0.789	S	S	*	*			trans	-108.9	164.2	-158.6	-54.8	173.2	-174.5	178.1	-1.8	113.6	E33	E33-R35 IonicContact OE1-CZ 3.69Å; E33-R35 IonicContact OE1-NE 2.96Å; E33-R35 PolarHBondContact OE1-NE 2.96Å; E33-R35 IonicContact OE1-NH2 3.51Å
36	G	34.1	Very low	37.8	Very low	69 Å²	69	142.1 Å²	142.1	71%	0.711	79%	0.788	S	S	*	*			trans	-72.4	173.4	161.5	0	0	0	0	0	113.2
37	P	47.1	Very low	38	Very low	143 Å²	143	143.9 Å²	143.9	93%	0.929	79%	0.791	S	S	*	*				-138.7	-172.5	90	41	-27.2	0	0	0	111.9
38	G	31.1	Very low	37.2	Very low	74 Å²	74	147.5 Å²	147.5	76%	0.763	79%	0.794	S	S	*	*			cis	-177.1	-176.3	3.6	0	0	0	0	0	112.2
39	R	37.4	Very low	37.8	Very low	238 Å²	238	149.5 Å²	149.5	90%	0.898	79%	0.791	S	S	*	*			trans	-96.6	157.2	174.8	-78.8	-170.2	179.8	-142.3	5.7	112.3
40	P	41	Very low	36.7	Very low	119 Å²	119	147.4 Å²	147.4	77%	0.773	79%	0.791	S	S	*	*			trans	-90.1	155.7	140.9	-14.6	31.8	0	0	0	113.5
41	R	33.4	Very low	37.3	Very low	229 Å²	229	147.8 Å²	147.8	86%	0.864	79%	0.793	S	S	*	*			trans	-107.1	-177.9	156.8	-61.5	-179.2	174.2	-172.2	-1.6	106.6
42	T	39.4	Very low	37.7	Very low	117 Å²	117	146.3 Å²	146.3	72%	0.718	80%	0.798	S	S	*	*			cis	-121.6	-141.6	7.3	42.2	0	0	0	0	108.9
43	D	33	Very low	38	Very low	147 Å²	147	149.8 Å²	149.8	79%	0.786	80%	0.802	S	S	*	*			cis	-159.6	177.8	-0.7	-137.2	-49.7	0	0	0	111.9
44	G	34.5	Very low	38.6	Very low	68 Å²	68	152.1 Å²	152.1	70%	0.701	82%	0.817	S	S	*	*			trans	117.9	101	161.2	0	0	0	0	0	115.5
45	E	40.2	Very low	38.6	Very low	184 Å²	184	151 Å²	151	86%	0.86	82%	0.815	S	S	*	*			trans	-84	147.9	176.5	-56.7	-176.1	130.6	0	0	113.1
46	N	36.9	Very low	38.7	Very low	166 Å²	166	146.5 Å²	146.5	89%	0.888	82%	0.815	S	S	*	*			trans	-160.6	148.4	136.1	-119.9	-49.2	0	0	0	112.5
47	V	41.7	Very low	38.8	Very low	122 Å²	122	152.4 Å²	152.4	74%	0.739	82%	0.817	S	S	*	*			trans	-111.1	127.6	-172.2	175.8	0	0	0	0	110.8
48	F	35.5	Very low	38.3	Very low	198 Å²	198	152.6 Å²	152.6	87%	0.868	81%	0.807	S	S	*	*			trans	-148.7	150	145.5	-143.3	-100.3	0	0	0	113
49	T	44.7	Very low	38.6	Very low	119 Å²	119	153.6 Å²	153.6	73%	0.73	80%	0.802	S	S	*	*			trans	-91.3	132	-168.3	51.8	0	0	0	0	113.3
50	G	34	Very low	39.4	Very low	75 Å²	75	147.1 Å²	147.1	77%	0.773	79%	0.791	S	S	*	*			trans	-151.4	109.5	167.2	0	0	0	0	0	111.2
51	Q	45.5	Very low	39.1	Very low	179 Å²	179	148.4 Å²	148.4	84%	0.836	79%	0.791	S	S	*	*			trans	-79.9	135.5	-179.9	-63.7	-175.1	9.1	0	0	111.7
52	S	42.7	Very low	39.3	Very low	124 Å²	124	147.9 Å²	147.9	87%	0.867	80%	0.795	S	S	*	*			trans	-154.9	107.1	156.7	-82.1	0	0	0	0	109.7
53	K	43.5	Very low	39.3	Very low	198 Å²	198	148.6 Å²	148.6	86%	0.861	80%	0.804	S	S	*	*			trans	-91.1	113.4	179.6	-65.2	177.1	-178.7	176.8	0	110.5
54	I	48.1	Very low	39.4	Very low	175 Å²	175	147 Å²	147	90%	0.897	80%	0.804	S	S	*	*			trans	-133.1	135.3	153.3	-52.9	-178.8	0	0	0	107.1
55	Y	34.2	Very low	39.4	Very low	221 Å²	221	147.4 Å²	147.4	87%	0.867	81%	0.809	S	S	*	*			trans	-99.9	140.3	-159.8	-164.6	-93.5	0	0	0	112.3
56	S	34.7	Very low	39.3	Very low	112 Å²	112	146.4 Å²	146.4	78%	0.783	81%	0.806	S	S	*	*			trans	-113.8	100	-179	-164.5	0	0	0	0	112.7
57	Y	35.9	Very low	39.3	Very low	193 Å²	193	150 Å²	150	76%	0.757	81%	0.807	S	S	*	*			trans	43.7	151.9	139.3	-119	-111.4	0	0	0	124.2
58	M	37.5	Very low	39	Very low	147 Å²	147	152.1 Å²	152.1	72%	0.724	81%	0.806	S	S	*	*			trans	73.6	143	174.2	-49.1	-81.8	59.5	0	0	114.8
59	S	36.7	Very low	39.1	Very low	94 Å²	94	148.3 Å²	148.3	66%	0.657	80%	0.802	S	S	*	*			cis	-166.3	-172.4	0.5	-117.6	0	0	0	0	108.5
60	P	54.3	Low	38.7	Very low	102 Å²	102	151.4 Å²	151.4	66%	0.662	81%	0.813	S	S	*	*			cis	-129.3	-163.5	-36.3	38.5	-21.1	0	0	0	112
61	N	35.5	Very low	38.7	Very low	146 Å²	146	155.1 Å²	155.1	78%	0.781	81%	0.81	S	S	*	*			trans	66.5	100.5	158.9	-64.1	-9.6	0	0	0	120.5
62	K	37.3	Very low	38.3	Very low	218 Å²	218	155.1 Å²	155.1	95%	0.948	81%	0.81	S	S	*	*				-165	148.4	125.6	-105.3	156	-172.7	175.3	0	111
63	C	38.3	Very low	37.8	Very low	133 Å²	133	154.9 Å²	154.9	90%	0.899	80%	0.795	S	S	*	*			trans	-109.9	133.3	-177.5	177.7	0	0	0	0	110.6
64	S	36.9	Very low	37.4	Very low	113 Å²	113	152.4 Å²	152.4	79%	0.79	79%	0.791	S	S	*	*			trans	-164.2	131.8	169.1	58.3	0	0	0	0	112.6
65	G	34.2	Very low	36.9	Very low	77 Å²	77	147.8 Å²	147.8	79%	0.794	78%	0.775	S	S	*	*			trans	73.3	90.3	156.3	0	0	0	0	0	117.2
66	M	37.6	Very low	37.1	Very low	162 Å²	162	143.4 Å²	143.4	80%	0.798	77%	0.771	S	S	*	*			trans	-64.7	139.2	159.4	-71.5	-171.2	72.1	0	0	110.5	F68	M66-F68 HydrophobicContact CE-CE1 3.91Å; M66-F68 HydrophobicContact CE-CZ 4Å
67	R	35.7	Very low	37	Very low	243 Å²	243	143.9 Å²	143.9	92%	0.917	77%	0.769	S	S	*	*			trans	-131.5	112.3	166	-157.9	178.3	-161.6	174	5.9	107.6
68	F	35.5	Very low	36.8	Very low	165 Å²	165	143.3 Å²	143.3	72%	0.724	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-68.4	139.5	-176	-66.8	-88.3	0	0	0	111.1	M66	M66-F68 HydrophobicContact CE-CE1 3.91Å; M66-F68 HydrophobicContact CE-CZ 4Å
69	P	38.2	Very low	36.5	Very low	118 Å²	118	144.7 Å²	144.7	77%	0.766	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-63.7	149.6	164.3	-17.8	31.9	0	0	0	110.8	Q71	P69-Q71 PolarHBondContact O-N 3.3Å
70	L	35.6	Very low	36.2	Very low	184 Å²	184	148 Å²	148	96%	0.963	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-68.4	125.4	170.7	-78.9	157.2	0	0	0	109.8
71	Q	35.1	Very low	35.3	Very low	154 Å²	154	148.9 Å²	148.9	72%	0.72	79%	0.785	S	S	*	*			trans	-105	113.6	173.7	-177.2	170.1	-33.7	0	0	108	P69 E73	P69-Q71 PolarHBondContact O-N 3.3Å; Q71-E73 HydrophobicContact CG-CG 4.36Å; Q71-E73 PolarHBondContact NE2-OE1 3.48Å; Q71-E73 PolarHBondContact O-N 3.28Å; Q71-E73 VanDerWaalsContact O-N 3.13Å
72	E	36.1	Very low	35.2	Very low	179 Å²	179	149.5 Å²	149.5	84%	0.836	78%	0.781	S	S	*	*			trans	-87	81.5	-174.1	-166.4	163.6	-145.7	0	0	110.8	N74	E72-N74 PolarHBondContact O-N 3.1Å
73	E	33.7	Very low	34.9	Very low	119 Å²	119	144.7 Å²	144.7	56%	0.556	77%	0.773	S	S	*	*			trans	-69.4	84.5	-178.6	-77.5	-70.3	134.7	0	0	113.1	Q71 S75	Q71-E73 HydrophobicContact CG-CG 4.36Å; Q71-E73 PolarHBondContact NE2-OE1 3.48Å; Q71-E73 PolarHBondContact O-N 3.28Å; Q71-E73 VanDerWaalsContact O-N 3.13Å; E73-S75 PolarHBondContact O-N 3.32Å; E73-S75 PolarHBondContact OE2-OG 2.96Å
74	N	34.8	Very low	34.6	Very low	146 Å²	146	146.8 Å²	146.8	78%	0.781	77%	0.77	S	S	*	*			trans	-78.6	58.6	166.1	-85.4	-59.6	0	0	0	111.9	E72	E72-N74 PolarHBondContact O-N 3.1Å
75	S	37.1	Very low	34.3	Very low	78 Å²	78	144.8 Å²	144.8	55%	0.545	77%	0.768	S	S	.	*			trans	-93.7	98.2	-177.3	-75.7	0	0	0	0	111.1	E73 T77	E73-S75 PolarHBondContact O-N 3.32Å; E73-S75 PolarHBondContact OE2-OG 2.96Å; S75-T77 PolarHBondContact O-N 3.42Å; S75-T77 VanDerWaalsContact O-N 3.13Å
76	V	39.3	Very low	34.4	Very low	129 Å²	129	151.2 Å²	151.2	78%	0.782	77%	0.774	S	S	*	*			trans	-70.8	104.9	-177.2	179.7	0	0	0	0	111.3
77	T	32.2	Very low	34.8	Very low	121 Å²	121	149.1 Å²	149.1	74%	0.742	77%	0.772	S	S	*	*			trans	-84.3	119.7	172.6	49.7	0	0	0	0	110.9	S75 H79	S75-T77 PolarHBondContact O-N 3.42Å; S75-T77 VanDerWaalsContact O-N 3.13Å; T77-H79 PolarHBondContact O-N 2.98Å
78	H	32.1	Very low	34.7	Very low	182 Å²	182	146.2 Å²	146.2	84%	0.843	77%	0.774	S	S	*	*			trans	-68.4	127.2	171	-72.9	-99.2	0	0	0	110.1
79	H	30.4	Very low	34.4	Very low	176 Å²	176	143.2 Å²	143.2	82%	0.815	78%	0.779	S	S	*	*			trans	-103.5	110	175.6	-134.8	70.1	0	0	0	110.3	T77 V81	T77-H79 PolarHBondContact O-N 2.98Å; H79-V81 PolarHBondContact O-N 3.3Å
80	E	30.1	Very low	34.1	Very low	164 Å²	164	140.8 Å²	140.8	77%	0.766	78%	0.776	S	S	*	*			trans	-84.3	100.3	-176.4	-168.2	-169.8	166	0	0	110.8	K82	E80-K82 PolarHBondContact O-N 3.18Å
81	V	36.2	Very low	34.1	Very low	120 Å²	120	139.6 Å²	139.6	73%	0.727	77%	0.769	S	S	*	*			trans	-77.3	91.3	-179.3	-175.6	0	0	0	0	110.8	H79 C83	H79-V81 PolarHBondContact O-N 3.3Å; V81-C83 PolarHBondContact O-N 2.99Å
82	K	33.1	Very low	33.7	Very low	158 Å²	158	142 Å²	142	69%	0.687	77%	0.773	S	S	*	*			trans	-82.4	77.5	-175.8	-163.1	166.2	-165.8	153.1	0	112.9	E80 Q84	E80-K82 PolarHBondContact O-N 3.18Å; K82-Q84 PolarHBondContact O-N 2.89Å
83	C	30.3	Very low	33.6	Very low	117 Å²	117	145.7 Å²	145.7	79%	0.791	78%	0.779	S	S	*	*			trans	-63.4	104	176.6	-68.2	0	0	0	0	112.5	V81	V81-C83 PolarHBondContact O-N 2.99Å
84	Q	32.5	Very low	33.4	Very low	177 Å²	177	146.6 Å²	146.6	83%	0.827	78%	0.782	S	S	*	*			trans	-98.1	123.6	159.9	-67	-165.3	16	0	0	109.7	K82	K82-Q84 PolarHBondContact O-N 2.89Å
85	G	31.5	Very low	33.2	Very low	72 Å²	72	150.7 Å²	150.7	74%	0.742	79%	0.786	S	S	*	*			trans	-100.1	148.6	176.6	0	0	0	0	0	113.1
86	K	36.2	Very low	32.9	Very low	212 Å²	212	152.2 Å²	152.2	92%	0.922	78%	0.784	S	S	*	*			trans	-158.6	156	149.9	-107.8	154.5	-173.1	177	0	110.3
87	P	45.4	Very low	32.6	Very low	117 Å²	117	154.4 Å²	154.4	76%	0.76	79%	0.786	S	S	*	*			trans	-102	164.8	-159.1	38.9	-35.9	0	0	0	114.4
88	L	32.9	Very low	32.7	Very low	182 Å²	182	155.8 Å²	155.8	95%	0.953	78%	0.782	S	S	*	*			trans	-143.4	157.3	156.7	-104.4	166.4	0	0	0	109.1
89	A	30.4	Very low	33	Very low	102 Å²	102	156.8 Å²	156.8	84%	0.843	78%	0.778	S	S	*	*			trans	-137.4	155.2	-158.8	0	0	0	0	0	115.1
90	G	31.2	Very low	33	Very low	68 Å²	68	155 Å²	155	70%	0.701	77%	0.774	S	S	*	*			trans	101.7	160.1	165.6	0	0	0	0	0	115.8
91	I	36.3	Very low	33.1	Very low	159 Å²	159	151.5 Å²	151.5	82%	0.815	77%	0.774	S	S	*	*			cis	-152.5	144.3	-7.4	-108.4	159.4	0	0	0	109
92	Y	26.2	Very low	32.8	Very low	203 Å²	203	149.1 Å²	149.1	80%	0.796	77%	0.773	S	S	*	*			trans	8.8	136.9	163.1	-73.9	-100.9	0	0	0	121.4
93	R	32.8	Very low	32.7	Very low	257 Å²	257	149.9 Å²	149.9	97%	0.97	79%	0.785	S	S	*	*				-149.9	152.4	103.5	-108.7	-175	-147.7	-151.8	9.4	114.6
94	K	30.3	Very low	33	Very low	139 Å²	139	149 Å²	149	60%	0.604	79%	0.786	S	S	*	*			trans	-102.1	145.1	-167	165.6	-169.8	178.9	-178.7	0	111.4	E96	K94-E96 WeakPolarHBondContact CE-OE1 3.32Å; K94-E96 WeakPolarHBondContact CE-OE2 3.18Å; K94-E96 HydrophobicContact CG-CG 4.47Å; K94-E96 IonicContact NZ-OE1 2.93Å; K94-E96 PolarHBondContact NZ-OE1 2.85Å; K94-E96 IonicContact NZ-OE2 3.91Å; K94-E96 PolarHBondContact NZ-OE2 2.81Å
95	R	30	Very low	33.1	Very low	231 Å²	231	147.2 Å²	147.2	87%	0.872	79%	0.787	S	S	*	*			trans	-144.4	146.6	140.7	-164.6	164.5	-175.8	156	2.9	110.3
96	E	32.6	Very low	33.3	Very low	110 Å²	110	155.5 Å²	155.5	51%	0.514	80%	0.796	S	S	.	*			trans	-111.5	151.1	-177.9	-65.9	157.1	143.8	0	0	110.6	K94	K94-E96 WeakPolarHBondContact CE-OE1 3.32Å; K94-E96 WeakPolarHBondContact CE-OE2 3.18Å; K94-E96 HydrophobicContact CG-CG 4.47Å; K94-E96 IonicContact NZ-OE1 2.93Å; K94-E96 PolarHBondContact NZ-OE1 2.85Å; K94-E96 IonicContact NZ-OE2 3.91Å; K94-E96 PolarHBondContact NZ-OE2 2.81Å
97	E	32.3	Very low	33	Very low	176 Å²	176	151.3 Å²	151.3	82%	0.822	79%	0.793	S	S	*	*				-172.1	110.4	129.5	-101.9	151.6	-156	0	0	107.6
98	K	34.8	Very low	32.4	Very low	149 Å²	149	149.4 Å²	149.4	65%	0.648	79%	0.788	S	S	*	*				87.7	108.8	56.9	-94.6	-170.9	168.1	170.1	0	115.2
99	R	37.3	Very low	32.3	Very low	203 Å²	203	149 Å²	149	77%	0.766	78%	0.783	S	S	*	*			trans	74.7	153.2	147.1	-63.1	-176.8	-63.8	-176.8	3.3	116.4
100	N	29.7	Very low	32.3	Very low	138 Å²	138	152.8 Å²	152.8	74%	0.738	78%	0.78	S	S	*	*			cis	-146.5	138.2	-3.6	-111.5	3.2	0	0	0	107.2
101	A	32.8	Very low	32.3	Very low	92 Å²	92	153.6 Å²	153.6	76%	0.76	78%	0.775	S	S	*	*				84.5	123.1	68.9	0	0	0	0	0	115.3
102	G	29.6	Very low	31.9	Very low	69 Å²	69	155.3 Å²	155.3	71%	0.711	78%	0.78	S	S	*	*			trans	103.4	141.7	163.1	0	0	0	0	0	115.8
103	N	32.8	Very low	32.1	Very low	175 Å²	175	152.4 Å²	152.4	94%	0.936	77%	0.773	S	S	*	*			cis	-150.4	162.4	-6.8	-100.7	-14.9	0	0	0	110.3
104	A	35.7	Very low	32.1	Very low	97 Å²	97	149.7 Å²	149.7	80%	0.802	77%	0.772	S	S	*	*			trans	-101.6	144.4	175.5	0	0	0	0	0	112.1
105	V	34.8	Very low	32.1	Very low	141 Å²	141	150.8 Å²	150.8	86%	0.855	78%	0.776	S	S	*	*			trans	-138	133.2	160.8	177.2	0	0	0	0	108.6
106	R	36.1	Very low	32.3	Very low	246 Å²	246	146.3 Å²	146.3	93%	0.928	77%	0.768	S	S	*	*			trans	-101.8	140	162.9	-76.9	-180	170.5	-178.8	-3.4	108.6
107	S	29.8	Very low	32.2	Very low	124 Å²	124	149.9 Å²	149.9	87%	0.867	78%	0.782	S	S	*	*			trans	-149.2	165.1	154.1	-163.5	0	0	0	0	109.5
108	A	33	Very low	32.1	Very low	77 Å²	77	147.3 Å²	147.3	64%	0.636	77%	0.774	S	S	*	*			trans	-140.2	-177.1	-173.9	0	0	0	0	0	110.8
109	M	30.5	Very low	31.9	Very low	173 Å²	173	145 Å²	145	85%	0.852	78%	0.783	S	S	*	*			trans	73.6	145.5	-176	-46.3	-69.4	177	0	0	113.1
110	K	28.9	Very low	31.8	Very low	181 Å²	181	145.4 Å²	145.4	79%	0.787	79%	0.785	S	S	*	*			cis	-153.8	177.9	-11.1	-135	-173.4	176.4	-170.9	0	110.3
111	S	31.7	Very low	31.8	Very low	86 Å²	86	150.1 Å²	150.1	60%	0.601	79%	0.792	S	S	*	*			trans	-56.5	152.3	164.3	52.4	0	0	0	0	114.1
112	E	28.6	Very low	31.5	Very low	195 Å²	195	149 Å²	149	91%	0.911	79%	0.789	S	S	*	*				-165.1	-179.6	100.9	-129	167.4	107.5	0	0	114.4
113	E	30.6	Very low	32.8	Very low	141 Å²	141	151.6 Å²	151.6	66%	0.659	79%	0.794	S	S	*	*			trans	-98.6	150.2	-168.7	176.4	-178.3	144.7	0	0	112.4	K115	E113-K115 WeakPolarHBondContact OE1-CD 3.43Å
114	Q	32.4	Very low	32.6	Very low	200 Å²	200	151.8 Å²	151.8	94%	0.935	79%	0.794	S	S	*	*			trans	-141.8	147.1	155.4	-111.7	179.7	11.3	0	0	112.3
115	K	30	Very low	32.7	Very low	162 Å²	162	151.2 Å²	151.2	70%	0.704	79%	0.789	S	S	*	*			trans	-154.7	174.4	-159.6	-178	179.6	173	179	0	109.2	E113	E113-K115 WeakPolarHBondContact OE1-CD 3.43Å
116	I	34.9	Very low	33	Very low	137 Å²	137	150.1 Å²	150.1	70%	0.703	79%	0.785	S	S	*	*			trans	80.4	137	171	-47.5	173.4	0	0	0	111.9
117	K	30.2	Very low	33.1	Very low	186 Å²	186	147.8 Å²	147.8	81%	0.809	78%	0.782	S	S	*	*			cis	-126.4	142.4	4.7	-116.6	135.6	-171.1	176.2	0	108.2
118	D	29.1	Very low	33.7	Very low	122 Å²	122	147.9 Å²	147.9	65%	0.652	78%	0.78	S	S	*	*			cis	82.3	101.7	34.8	-162.7	8.8	0	0	0	114.4
119	A	32.4	Very low	33.5	Very low	101 Å²	101	151.4 Å²	151.4	84%	0.835	79%	0.787	S	S	*	*			trans	-148.4	114.5	166.4	0	0	0	0	0	109.9
120	R	33.3	Very low	33.7	Very low	211 Å²	211	152.8 Å²	152.8	80%	0.796	79%	0.792	S	S	*	*			trans	-80.2	167.5	179.2	-51.5	173.1	-176.7	179	-2.7	110
121	R	30.4	Very low	33.6	Very low	237 Å²	237	152 Å²	152	89%	0.894	79%	0.789	S	S	*	*			cis	-156.1	163.1	29.7	-59.1	173.8	172.5	-169.4	-2.8	111.3
122	G	27.4	Very low	33.6	Very low	68 Å²	68	152.1 Å²	152.1	70%	0.701	79%	0.789	S	S	*	*			trans	-117	-152.1	145.2	0	0	0	0	0	109.2
123	P	55.6	Low	33.6	Very low	124 Å²	124	149.5 Å²	149.5	81%	0.805	78%	0.777	S	S	*	*			cis	-122.9	-176.2	-29.4	40.8	-27.7	0	0	0	111
124	L	29.1	Very low	33.5	Very low	178 Å²	178	147.3 Å²	147.3	93%	0.932	78%	0.783	S	S	*	*			trans	173.3	159.4	141.3	-96.6	163.3	0	0	0	112.3
125	A	39	Very low	33.4	Very low	85 Å²	85	142.7 Å²	142.7	70%	0.702	78%	0.779	S	S	*	*			trans	-108.6	-176.1	171.5	0	0	0	0	0	109
126	P	40.8	Very low	33.3	Very low	118 Å²	118	143.7 Å²	143.7	77%	0.766	79%	0.786	S	S	*	*			cis	-143.4	-160.7	20.9	44.2	-22.2	0	0	0	116.3
127	F	36.7	Very low	34.2	Very low	197 Å²	197	141.8 Å²	141.8	86%	0.864	78%	0.783	S	S	*	*			trans	-62.3	168.4	171.4	-61.9	-92.5	0	0	0	114.8
128	P	43.3	Very low	34.9	Very low	127 Å²	127	137.7 Å²	137.7	83%	0.825	78%	0.775	S	S	*	*				-129.3	153.8	129.9	37.6	-30	0	0	0	115.1
129	N	29	Very low	34.8	Very low	150 Å²	150	141.7 Å²	141.7	80%	0.802	79%	0.787	S	S	*	*			trans	-85.8	160.4	171.7	-75.5	-35.9	0	0	0	112.6
130	Q	33.7	Very low	34.6	Very low	203 Å²	203	143.2 Å²	143.2	95%	0.949	79%	0.786	S	S	*	*				-140.1	166.1	128.2	-72.5	-153.2	9.5	0	0	110.2
131	K	28.2	Very low	35.2	Very low	164 Å²	164	138.8 Å²	138.8	71%	0.713	78%	0.784	S	S	*	*			trans	-149.7	167.9	-158.4	-162.3	-152	165	-144.7	0	112.7	E133	K131-E133 WeakPolarHBondContact CE-OE2 3.42Å; K131-E133 IonicContact NZ-OE1 3.66Å; K131-E133 PolarHBondContact NZ-OE1 2.82Å; K131-E133 IonicContact NZ-OE2 3.31Å; K131-E133 PolarHBondContact NZ-OE2 2.85Å
132	S	31.5	Very low	36	Very low	88 Å²	88	132.6 Å²	132.6	62%	0.615	78%	0.775	S	S	*	*			trans	104.8	139.4	150.4	-62.3	0	0	0	0	117.8
133	E	28.1	Very low	36.2	Very low	140 Å²	140	134 Å²	134	65%	0.654	77%	0.774	S	S	*	*			cis	-155.5	-46.8	-8.4	-143.3	66.2	90.3	0	0	118.1	K131	K131-E133 WeakPolarHBondContact CE-OE2 3.42Å; K131-E133 IonicContact NZ-OE1 3.66Å; K131-E133 PolarHBondContact NZ-OE1 2.82Å; K131-E133 IonicContact NZ-OE2 3.31Å; K131-E133 PolarHBondContact NZ-OE2 2.85Å
134	A	29.6	Very low	34.8	Very low	96 Å²	96	133.1 Å²	133.1	79%	0.793	77%	0.771	S	S	*	*			trans	-153.3	162.7	-154.4	0	0	0	0	0	115.4
135	A	29.7	Very low	34.7	Very low	103 Å²	103	129.8 Å²	129.8	85%	0.851	76%	0.761	S	S	*	*			cis	-167.7	-180	-14.4	0	0	0	0	0	112.3
136	E	27.3	Very low	34.2	Very low	182 Å²	182	132.3 Å²	132.3	85%	0.85	76%	0.763	S	S	*	*			trans	-91.4	-168.8	-180	-116.3	-157.4	151.9	0	0	114
137	P	54.8	Low	33.7	Very low	97 Å²	97	131 Å²	131	63%	0.63	76%	0.757	S	S	*	*			cis	-126.7	-58.9	-15.3	21	-2.1	0	0	0	125.6
138	P	44.6	Very low	33.4	Very low	100 Å²	100	127.4 Å²	127.4	65%	0.649	75%	0.751	S	S	*	*				-126.4	132	-103.7	33.1	-15.7	0	0	0	122.2
139	K	26.3	Very low	32.8	Very low	207 Å²	207	128.6 Å²	128.6	90%	0.9	75%	0.75	S	S	*	*			trans	77.5	161.2	132.8	-63.6	179.6	-179.5	176.6	0	123.5
140	T	29	Very low	32.8	Very low	133 Å²	133	125.6 Å²	125.6	82%	0.816	75%	0.746	S	S	*	*			trans	-101.5	-172.9	-167.5	44.1	0	0	0	0	113.5
141	P	44.9	Very low	32.7	Very low	117 Å²	117	120.1 Å²	120.1	76%	0.76	74%	0.736	S	S	*	*			cis	-133.2	-139.2	15.4	37.4	-10.7	0	0	0	112.9
142	P	48.4	Very low	32.9	Very low	107 Å²	107	119.3 Å²	119.3	70%	0.695	74%	0.738	S	S	*	*			cis	-142.8	177	-11.1	41.1	-19.2	0	0	0	120.1
143	S	30.8	Very low	33	Very low	97 Å²	97	122.3 Å²	122.3	68%	0.678	75%	0.753	S	S	*	*			trans	58.2	110.3	139.1	66.9	0	0	0	0	127.2
144	S	27.1	Very low	33.4	Very low	106 Å²	106	123.2 Å²	123.2	74%	0.741	76%	0.755	S	S	*	*				69.2	144.8	118.7	70.2	0	0	0	0	127.5
145	C	26.6	Very low	33.6	Very low	108 Å²	108	127.4 Å²	127.4	73%	0.73	76%	0.757	S	S	*	*			trans	86.4	123.5	141.3	77.7	0	0	0	0	125.4
146	D	28.1	Very low	33.8	Very low	139 Å²	139	127.4 Å²	127.4	74%	0.743	76%	0.757	S	S	*	*			trans	77.1	107.4	134.6	-81.8	-68.3	0	0	0	126.7
147	S	30.9	Very low	34.2	Very low	91 Å²	91	125.9 Å²	125.9	64%	0.636	75%	0.754	S	S	*	*				71.3	156.3	111.9	-65.6	0	0	0	0	125.1
148	T	29.5	Very low	33.3	Very low	120 Å²	120	131.2 Å²	131.2	74%	0.736	77%	0.768	S	S	*	*			trans	81.7	119.6	168.3	77.1	0	0	0	0	116.7
149	N	30.7	Very low	32.9	Very low	152 Å²	152	135 Å²	135	81%	0.813	77%	0.774	S	S	*	*				81.7	148.8	88.9	-68.3	-26.9	0	0	0	114.4
150	A	29.3	Very low	33.8	Very low	87 Å²	87	130.8 Å²	130.8	72%	0.719	77%	0.768	S	S	*	*			cis	-171.1	-168.2	-18	0	0	0	0	0	108.8
151	A	32.1	Very low	34.2	Very low	88 Å²	88	132.9 Å²	132.9	73%	0.727	77%	0.772	S	S	*	*			trans	70.5	116.6	170.2	0	0	0	0	0	116.8
152	I	31.2	Very low	33.7	Very low	147 Å²	147	137.2 Å²	137.2	75%	0.754	78%	0.779	S	S	*	*				83.5	111.2	61.9	-66	158.7	0	0	0	113.6	K154	I152-K154 HydrophobicContact CG2-CG 4.39Å
153	T	34.6	Very low	33.1	Very low	151 Å²	151	135.5 Å²	135.5	93%	0.926	78%	0.781	S	S	*	*			trans	-129.1	151.1	153.5	-52.4	0	0	0	0	108.9
154	K	36.3	Very low	33.5	Very low	160 Å²	160	141.1 Å²	141.1	70%	0.696	79%	0.793	S	S	*	*			trans	-107.5	145.9	-159.5	-69.7	176.1	-178.1	171.2	0	114.7	I152	I152-K154 HydrophobicContact CG2-CG 4.39Å
155	Q	33.9	Very low	34	Very low	183 Å²	183	145.5 Å²	145.5	86%	0.855	80%	0.802	S	S	*	*			trans	55.4	132.2	136.1	-65.8	168.9	-9.1	0	0	121.8
156	A	33.3	Very low	34.9	Very low	103 Å²	103	144.6 Å²	144.6	85%	0.851	80%	0.802	S	S	*	*				-156.2	149	126.1	0	0	0	0	0	110.7
157	L	35.8	Very low	35.6	Very low	150 Å²	150	143.9 Å²	143.9	79%	0.785	81%	0.805	S	S	*	*			trans	-113.9	140.9	-178.6	-128.5	81.2	0	0	0	111.4
158	K	36.3	Very low	36.2	Very low	209 Å²	209	151.4 Å²	151.4	91%	0.909	82%	0.82	S	S	*	*			trans	-140.5	149.1	154	-70.3	-166.6	178.2	-179.7	0	110.9
159	K	36	Very low	37	Very low	181 Å²	181	155.3 Å²	155.3	79%	0.787	83%	0.826	S	S	*	*			trans	-134.9	-178.3	176.6	-63.5	-176.7	178.3	177.8	0	107.9
160	P	44.8	Very low	37.5	Very low	118 Å²	118	157.6 Å²	157.6	77%	0.766	83%	0.829	S	S	*	*				-129	171	-66.1	38.8	-24.8	0	0	0	111.9
161	I	37.4	Very low	38.3	Very low	177 Å²	177	158.2 Å²	158.2	91%	0.908	83%	0.834	S	S	*	*			trans	-130.5	143.6	165.9	-62.3	-177	0	0	0	110.2
162	K	34.9	Very low	39.1	Very low	207 Å²	207	162.9 Å²	162.9	90%	0.9	84%	0.841	S	S	*	*			trans	-82.5	147.7	-177.7	-60.3	173.7	-180	174.4	0	111.5
163	G	35.2	Very low	39.7	Very low	71 Å²	71	158.9 Å²	158.9	73%	0.732	84%	0.836	S	S	*	*			trans	-175.5	85.2	171.2	0	0	0	0	0	118.5
164	K	38.6	Very low	40.5	Very low	216 Å²	216	161.3 Å²	161.3	94%	0.939	83%	0.834	S	S	*	*			trans	63.6	149.2	157.8	-60.6	-179	178.8	179	0	118.5
165	Q	39.3	Very low	41.4	Very low	197 Å²	197	159.1 Å²	159.1	92%	0.921	83%	0.834	S	S	*	*			trans	-101	151.5	178.7	-59.7	178.7	11.5	0	0	110.7
166	A	44.8	Very low	42.7	Very low	89 Å²	89	158.7 Å²	158.7	74%	0.736	83%	0.832	S	S	*	*			trans	-113.7	147.3	167.2	0	0	0	0	0	110.1
167	P	42.5	Very low	44.1	Very low	125 Å²	125	160.7 Å²	160.7	81%	0.812	82%	0.824	S	S	*	*			trans	-70.5	136	-169.4	27	-34.7	0	0	0	113	K169	P167-K169 PolarHBondContact O-N 3.49Å
168	R	43.3	Very low	45.4	Very low	249 Å²	249	158.5 Å²	158.5	94%	0.94	81%	0.813	S	S	*	*			trans	-62.9	100.4	172.6	-73.1	177.1	169.7	172.1	-4.6	110.5	K170	R168-K170 PolarHBondContact O-N 2.76Å
169	K	47.1	Very low	46.9	Very low	202 Å²	202	158.8 Å²	158.8	88%	0.878	81%	0.808	S	S	*	*			trans	-58.6	126.4	159.1	-75.4	-172.3	176.3	-178.4	0	107.8	P167 A171	P167-K169 PolarHBondContact O-N 3.49Å; K169-A171 PolarHBondContact O-N 2.88Å; K169-A171 VanDerWaalsContact O-N 3.16Å
170	K	41.9	Very low	48.7	Very low	200 Å²	200	157.1 Å²	157.1	87%	0.87	80%	0.801	S	S	*	*			trans	-58.9	119.8	176.7	-68.1	-178.9	-179.9	179.3	0	108.4	R168 Q172	R168-K170 PolarHBondContact O-N 2.76Å; K170-Q172 PolarHBondContact O-N 3.36Å
171	A	45.2	Very low	49.7	Very low	100 Å²	100	158.4 Å²	158.4	83%	0.826	80%	0.801	S	S	*	*			trans	-67.1	97.6	168.8	0	0	0	0	0	108	K169 G173	K169-A171 PolarHBondContact O-N 2.88Å; K169-A171 VanDerWaalsContact O-N 3.16Å; A171-G173 PolarHBondContact O-N 3.4Å
172	Q	48	Very low	51.2	Low	185 Å²	185	154.3 Å²	154.3	86%	0.864	78%	0.784	S	S	*	*			trans	-61.6	108.3	162.3	-77.6	-179.7	-37.2	0	0	106.7	K170 K174	K170-Q172 PolarHBondContact O-N 3.36Å; Q172-K174 PolarHBondContact O-N 3.29Å
173	G	44.4	Very low	53	Low	64 Å²	64	148.1 Å²	148.1	66%	0.66	76%	0.761	S	S	*	*			trans	-57.8	111.8	173	0	0	0	0	0	108.6	A171 T175	A171-G173 PolarHBondContact O-N 3.4Å; G173-T175 PolarHBondContact O-N 2.81Å; G173-T175 PolarHBondContact O-OG1 3Å
174	K	51.4	Low	55	Low	201 Å²	201	152 Å²	152	87%	0.874	76%	0.758	S	S	*	*			trans	-70.9	80.9	166.1	-78	-171.3	175.1	-176.6	0	107.5	Q172 Q176	Q172-K174 PolarHBondContact O-N 3.29Å; K174-Q176 PolarHBondContact O-N 3.16Å
175	T	54.4	Low	56.9	Low	114 Å²	114	149.1 Å²	149.1	70%	0.699	74%	0.742	S	S	*	*			trans	-65.7	86.8	171.3	-46.2	0	0	0	0	107.8	G173 Q177	G173-T175 PolarHBondContact O-N 2.81Å; G173-T175 PolarHBondContact O-OG1 3Å; T175-Q177 HydrophobicContact CG2-CG 3.97Å; T175-Q177 PolarHBondContact O-N 3.43Å
176	Q	61.7	Low	58.9	Low	175 Å²	175	145.3 Å²	145.3	82%	0.818	73%	0.734	S	S	*	*			trans	-65.6	88	167.2	-79.9	-172.9	-73.2	0	0	107.8	K174 N178	K174-Q176 PolarHBondContact O-N 3.16Å; Q176-N178 PolarHBondContact O-N 3.04Å
177	Q	63.1	Low	60.6	Low	144 Å²	144	146.9 Å²	146.9	67%	0.673	74%	0.735	S	S	*	*			trans	-70	83	167.7	-67.1	-173.4	-8	0	0	108.2	T175 R179	T175-Q177 HydrophobicContact CG2-CG 3.97Å; T175-Q177 PolarHBondContact O-N 3.43Å; Q177-R179 PolarHBondContact O-N 2.94Å
178	N	63.2	Low	62.2	Low	104 Å²	104	152.7 Å²	152.7	56%	0.556	74%	0.74	S	S	*	*			trans	-60.2	92.6	155.4	-84.4	7.4	0	0	0	106.4	Q176 K180 D183	Q176-N178 PolarHBondContact O-N 3.04Å; N178-K180 VanDerWaalsContact C-N 3.26Å; N178-K180 PolarHBondContact O-N 3.3Å; N178-D183 HydrophobicContact CB-CB 3.98Å
179	R	68.3	Low	63.8	Low	216 Å²	216	151.6 Å²	151.6	82%	0.815	74%	0.736	S	S	*	*			trans	-84.8	-2.9	-165.6	-171.2	167.2	170.3	176.2	-3.4	111.9	Q177 D183	Q177-R179 PolarHBondContact O-N 2.94Å; R179-D183 PolarHBondContact N-OD2 2.85Å
180	K	72.8	Confident	65.3	Low	146 Å²	146	146.2 Å²	146.2	64%	0.635	72%	0.724	S	S	*	*	S	Bend	trans	-134.3	143.1	174.6	-58.4	178.7	-178.1	178.8	0	110.7	N178 T182 D183	N178-K180 VanDerWaalsContact C-N 3.26Å; N178-K180 PolarHBondContact O-N 3.3Å; K180-T182 WeakPolarHBondContact CB-OG1 3.46Å; K180-T182 PolarHBondContact O-N 2.66Å; K180-T182 VanDerWaalsContact O-N 3.1Å; K180-D183 PolarHBondContact N-OD2 3.33Å; K180-D183 VanDerWaalsContact O-CB 3.32Å; K180-D183 WeakPolarHBondContact O-CB 3.44Å; K180-D183 PolarHBondContact O-N 3.22Å
181	L	66.1	Low	67.3	Low	145 Å²	145	142.5 Å²	142.5	76%	0.759	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-58.8	-23.3	174.6	-177.3	61	0	0	0	112.7	D183 F184	L181-D183 PolarHBondContact O-N 2.82Å; L181-F184 PolarHBondContact O-N 2.96Å
182	T	69.4	Low	69.3	Low	91 Å²	91	148.2 Å²	148.2	56%	0.558	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-61.1	-26.4	172.7	49.6	0	0	0	0	113.8	K180 F184 Y185	K180-T182 WeakPolarHBondContact CB-OG1 3.46Å; K180-T182 PolarHBondContact O-N 2.66Å; K180-T182 VanDerWaalsContact O-N 3.1Å; T182-F184 PolarHBondContact O-N 2.94Å; T182-Y185 PolarHBondContact O-N 2.85Å; T182-Y185 VanDerWaalsContact O-O 3.1Å
183	D	72.6	Confident	71.5	Confident	77 Å²	77	144.5 Å²	144.5	41%	0.412	70%	0.704	S	S	.	*	G	3₁₀ helix	trans	-75.8	-12.6	-172.2	-48.1	-20.6	0	0	0	111.8	N178 R179 K180 L181	N178-D183 HydrophobicContact CB-CB 3.98Å; R179-D183 PolarHBondContact N-OD2 2.85Å; K180-D183 PolarHBondContact N-OD2 3.33Å; K180-D183 VanDerWaalsContact O-CB 3.32Å; K180-D183 WeakPolarHBondContact O-CB 3.44Å; K180-D183 PolarHBondContact O-N 3.22Å; L181-D183 PolarHBondContact O-N 2.82Å
184	F	77.8	Confident	73.9	Confident	153 Å²	153	144 Å²	144	67%	0.671	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-86.6	-23.5	175.8	-176.8	-97	0	0	0	113.3	L181 T182	L181-F184 PolarHBondContact O-N 2.96Å; T182-F184 PolarHBondContact O-N 2.94Å
185	Y	78.1	Confident	76	Confident	154 Å²	154	142 Å²	142	60%	0.604	68%	0.682	S	S	*	*	S	Bend	trans	-108.5	127.9	-176.5	-70.3	-76.5	0	0	0	111	T182 V187	T182-Y185 PolarHBondContact O-N 2.85Å; T182-Y185 VanDerWaalsContact O-O 3.1Å; Y185-V187 PolarHBondContact O-N 3.41Å
186	P	80.7	Confident	77.9	Confident	117 Å²	117	139.8 Å²	139.8	76%	0.76	68%	0.676	S	S	*	*			trans	-61.8	129.9	177.7	25.6	-33.5	0	0	0	110.4	R188	P186-R188 PolarHBondContact O-N 3.4Å
187	V	79.5	Confident	79.6	Confident	123 Å²	123	136.5 Å²	136.5	75%	0.745	66%	0.66	S	S	*	*			trans	-60.9	108.2	-176	179.2	0	0	0	0	110	Y185 R189	Y185-V187 PolarHBondContact O-N 3.41Å; V187-R189 HydrophobicContact CG1-CG 4.16Å; V187-R189 PolarHBondContact O-N 3.06Å
188	R	78	Confident	81.1	Confident	247 Å²	247	133.9 Å²	133.9	93%	0.932	65%	0.651	S	S	*	*			trans	-68.7	78.9	172.9	-67	-172.6	178.8	-160.3	0.4	110.4	P186	P186-R188 PolarHBondContact O-N 3.4Å
189	R	75.9	Confident	82.6	Confident	226 Å²	226	134.7 Å²	134.7	85%	0.853	65%	0.651	S	S	*	*			trans	-61.5	137.7	167.5	-64	-171.7	179.5	-138.4	0.2	108.6	V187	V187-R189 HydrophobicContact CG1-CG 4.16Å; V187-R189 PolarHBondContact O-N 3.06Å
190	S	79.5	Confident	83.9	Confident	88 Å²	88	127 Å²	127	62%	0.615	63%	0.63	S	S	*	*			trans	-72.9	136.7	-179.6	97.2	0	0	0	0	110.3	R192	S190-R192 PolarHBondContact O-N 3.19Å; S190-R192 PolarHBondContact OG-N 2.82Å
191	S	83.6	Confident	85	Confident	123 Å²	123	123.3 Å²	123.3	86%	0.86	62%	0.615	S	S	*	*			trans	-78.2	9.4	171.1	50.9	0	0	0	0	113.7	K193	S191-K193 PolarHBondContact O-N 2.93Å
192	R	87.2	Confident	86.4	Confident	219 Å²	219	119.8 Å²	119.8	83%	0.826	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-74.3	117.2	177.9	-62.7	179.5	176.2	176.9	-2	109.5	S190	S190-R192 PolarHBondContact O-N 3.19Å; S190-R192 PolarHBondContact OG-N 2.82Å
193	K	93.1	Very high	87.6	Confident	107 Å²	107	120.7 Å²	120.7	47%	0.465	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-72.7	147.3	166.7	-54.7	-169.8	-171.9	-170.6	0	109.9	S191 E197 L198 E201	S191-K193 PolarHBondContact O-N 2.93Å; K193-E197 HydrophobicContact CB-CB 4.3Å; K193-L198 HydrophobicContact CB-CD2 4.07Å; K193-L198 HydrophobicContact CB-CG 3.94Å; K193-L198 HydrophobicContact CD-CD2 3.98Å; K193-E201 WeakPolarHBondContact CD-OE1 3.3Å; K193-E201 WeakPolarHBondContact CD-OE2 3.37Å; K193-E201 WeakPolarHBondContact CE-OE1 3.43Å; K193-E201 IonicContact NZ-OE1 2.66Å; K193-E201 PolarHBondContact NZ-OE1 2.76Å; K193-E201 IonicContact NZ-OE2 3.19Å; K193-E201 PolarHBondContact NZ-OE2 2.98Å
194	S	94.8	Very high	88.8	Confident	55 Å²	55	123.3 Å²	123.3	39%	0.385	60%	0.596	S	S	.	*	P	Polyproline II helix	trans	-71.7	163.1	169.5	70.1	0	0	0	0	111.2	A196 E197 L198	S194-A196 PolarHBondContact O-N 3.49Å; S194-E197 WeakPolarHBondContact CA-OE2 3.44Å; S194-E197 WeakPolarHBondContact CB-OE2 3.49Å; S194-E197 PolarHBondContact N-OE2 2.65Å; S194-E197 PolarHBondContact O-N 3.1Å; S194-E197 WeakPolarHBondContact OG-CG 3.28Å; S194-E197 PolarHBondContact OG-N 2.88Å; S194-E197 PolarHBondContact OG-OE2 2.64Å; S194-L198 WeakPolarHBondContact O-CG 3.47Å; S194-L198 PolarHBondContact O-N 3.34Å; S194-L198 VanDerWaalsContact O-N 3.1Å
195	K	95.7	Very high	89.7	Confident	157 Å²	157	122.5 Å²	122.5	68%	0.683	59%	0.589	S	S	*	*	H	α-helix	trans	-58.5	-38	174.5	-174.3	-177.6	172.9	-177.7	0	111.9	L198 Q199	K195-L198 PolarHBondContact O-N 3.34Å; K195-Q199 HydrophobicContact CG-CG 4.48Å; K195-Q199 WeakPolarHBondContact O-CB 3.45Å; K195-Q199 VanDerWaalsContact O-CG 3.27Å; K195-Q199 WeakPolarHBondContact O-CG 3.29Å; K195-Q199 PolarHBondContact O-N 2.61Å
196	A	95.7	Very high	90.6	Very high	69 Å²	69	115.9 Å²	115.9	57%	0.57	56%	0.564	S	S	*	*	H	α-helix	trans	-68.7	-40.9	-179.7	0	0	0	0	0	112.4	S194 Q199 S200	S194-A196 PolarHBondContact O-N 3.49Å; A196-Q199 PolarHBondContact O-N 2.74Å; A196-S200 WeakPolarHBondContact O-CB 3.31Å; A196-S200 PolarHBondContact O-N 2.99Å
197	E	95.7	Very high	91.4	Very high	105 Å²	105	111.7 Å²	111.7	49%	0.491	54%	0.535	S	S	.	.	H	α-helix	trans	-62.8	-46.3	174.2	-71.9	158.7	128.2	0	0	111	K193 S194 Q199 S200 E201	K193-E197 HydrophobicContact CB-CB 4.3Å; S194-E197 WeakPolarHBondContact CA-OE2 3.44Å; S194-E197 WeakPolarHBondContact CB-OE2 3.49Å; S194-E197 PolarHBondContact N-OE2 2.65Å; S194-E197 PolarHBondContact O-N 3.1Å; S194-E197 WeakPolarHBondContact OG-CG 3.28Å; S194-E197 PolarHBondContact OG-N 2.88Å; S194-E197 PolarHBondContact OG-OE2 2.64Å; E197-Q199 VanDerWaalsContact C-N 3.33Å; E197-Q199 PolarHBondContact O-N 3.22Å; E197-S200 PolarHBondContact O-N 3.1Å; E197-S200 VanDerWaalsContact O-N 3.17Å; E197-E201 WeakPolarHBondContact O-CG 3.4Å; E197-E201 PolarHBondContact O-N 3.13Å
198	L	95	Very high	92.3	Very high	90 Å²	90	112.2 Å²	112.2	47%	0.471	53%	0.529	S	S	.	.	H	α-helix	trans	-60	-41.2	175.9	-69	169.2	0	0	0	112.5	K193 S194 K195 E202	K193-L198 HydrophobicContact CB-CD2 4.07Å; K193-L198 HydrophobicContact CB-CG 3.94Å; K193-L198 HydrophobicContact CD-CD2 3.98Å; S194-L198 WeakPolarHBondContact O-CG 3.47Å; S194-L198 PolarHBondContact O-N 3.34Å; S194-L198 VanDerWaalsContact O-N 3.1Å; K195-L198 PolarHBondContact O-N 3.34Å; L198-E202 WeakPolarHBondContact O-CB 3.27Å; L198-E202 PolarHBondContact O-N 3.45Å
199	Q	94.6	Very high	93.2	Very high	120 Å²	120	103 Å²	103	56%	0.561	50%	0.498	S	S	*	.	H	α-helix	trans	-69.7	-31.5	176.6	-72.1	179.9	-68.8	0	0	112.8	K195 A196 E197 R203	K195-Q199 HydrophobicContact CG-CG 4.48Å; K195-Q199 WeakPolarHBondContact O-CB 3.45Å; K195-Q199 VanDerWaalsContact O-CG 3.27Å; K195-Q199 WeakPolarHBondContact O-CG 3.29Å; K195-Q199 PolarHBondContact O-N 2.61Å; A196-Q199 PolarHBondContact O-N 2.74Å; E197-Q199 VanDerWaalsContact C-N 3.33Å; E197-Q199 PolarHBondContact O-N 3.22Å; Q199-R203 WeakPolarHBondContact O-CB 3.45Å; Q199-R203 PolarHBondContact O-N 2.75Å
200	S	95.4	Very high	94.2	Very high	54 Å²	54	92.8 Å²	92.8	38%	0.378	46%	0.46	S	S	.	.	H	α-helix	trans	-74.6	-37.3	174.6	-176.5	0	0	0	0	112.4	A196 E197 K204	A196-S200 WeakPolarHBondContact O-CB 3.31Å; A196-S200 PolarHBondContact O-N 2.99Å; E197-S200 PolarHBondContact O-N 3.1Å; E197-S200 VanDerWaalsContact O-N 3.17Å; S200-K204 VanDerWaalsContact O-CG 3.31Å; S200-K204 WeakPolarHBondContact O-CG 3.39Å; S200-K204 PolarHBondContact O-N 3.49Å; S200-K204 VanDerWaalsContact O-N 3.11Å
201	E	96.1	Very high	95	Very high	69 Å²	69	95.7 Å²	95.7	32%	0.322	46%	0.464	S	S	.	.	H	α-helix	trans	-65.1	-42.7	173.7	-73.8	176.4	-179.2	0	0	111.6	K193 E197 K204 R205	K193-E201 WeakPolarHBondContact CD-OE1 3.3Å; K193-E201 WeakPolarHBondContact CD-OE2 3.37Å; K193-E201 WeakPolarHBondContact CE-OE1 3.43Å; K193-E201 IonicContact NZ-OE1 2.66Å; K193-E201 PolarHBondContact NZ-OE1 2.76Å; K193-E201 IonicContact NZ-OE2 3.19Å; K193-E201 PolarHBondContact NZ-OE2 2.98Å; E197-E201 WeakPolarHBondContact O-CG 3.4Å; E197-E201 PolarHBondContact O-N 3.13Å; E201-K204 PolarHBondContact O-N 2.8Å; E201-R205 WeakPolarHBondContact O-CG 3.37Å; E201-R205 PolarHBondContact O-N 3.48Å
202	E	94.9	Very high	95.7	Very high	72 Å²	72	93.3 Å²	93.3	34%	0.336	45%	0.447	S	S	.	.	H	α-helix	trans	-69.9	-39.9	178.8	-165.1	56.7	-153.1	0	0	112.3	L198 K204 R205 I206	L198-E202 WeakPolarHBondContact O-CB 3.27Å; L198-E202 PolarHBondContact O-N 3.45Å; E202-K204 PolarHBondContact O-N 2.65Å; E202-R205 PolarHBondContact O-N 3.02Å; E202-R205 WeakPolarHBondContact OE2-CD 3.45Å; E202-R205 IonicContact OE2-CZ 3.72Å; E202-R205 IonicContact OE2-NE 3.74Å; E202-R205 IonicContact OE2-NH1 2.77Å; E202-R205 PolarHBondContact OE2-NH1 2.89Å; E202-I206 WeakPolarHBondContact O-CG1 3.33Å; E202-I206 PolarHBondContact O-N 2.8Å
203	R	96.3	Very high	96	Very high	109 Å²	109	84 Å²	84	41%	0.411	42%	0.419	S	S	.	.	H	α-helix	trans	-54.1	-51.4	170.8	167.1	166.1	-75.5	-82.1	7.6	111.4	Q199 R205 I206 D207 H310 D311	Q199-R203 WeakPolarHBondContact O-CB 3.45Å; Q199-R203 PolarHBondContact O-N 2.75Å; R203-R205 VanDerWaalsContact C-N 3.27Å; R203-R205 PolarHBondContact O-N 2.88Å; R203-I206 WeakPolarHBondContact O-CA 3.5Å; R203-I206 WeakPolarHBondContact O-CB 3.42Å; R203-I206 PolarHBondContact O-N 3.35Å; R203-D207 WeakPolarHBondContact CG-OD2 3.16Å; R203-D207 IonicContact NH1-OD1 2.74Å; R203-D207 PolarHBondContact O-N 3.19Å; R203-H310 PolarHBondContact NH1-CE1 2.77Å; R203-H310 VanDerWaalsContact NH1-CE1 3.34Å; R203-D311 PolarHBondContact NH1-O 3.06Å
204	K	96.9	Very high	96.1	Very high	133 Å²	133	83.7 Å²	83.7	58%	0.578	42%	0.418	S	S	*	.	H	α-helix	trans	-60.4	-32.1	-178.4	-74.9	174.6	178.5	-175.9	0	114.3	S200 E201 E202 D207 E208	S200-K204 VanDerWaalsContact O-CG 3.31Å; S200-K204 WeakPolarHBondContact O-CG 3.39Å; S200-K204 PolarHBondContact O-N 3.49Å; S200-K204 VanDerWaalsContact O-N 3.11Å; E201-K204 PolarHBondContact O-N 2.8Å; E202-K204 PolarHBondContact O-N 2.65Å; K204-D207 VanDerWaalsContact CA-OD2 3.28Å; K204-D207 WeakPolarHBondContact CA-OD2 3.48Å; K204-D207 PolarHBondContact N-OD2 2.81Å; K204-E208 WeakPolarHBondContact O-CB 3.3Å; K204-E208 PolarHBondContact O-N 3.24Å
205	R	96.6	Very high	96.2	Very high	136 Å²	136	82.9 Å²	82.9	51%	0.513	41%	0.408	S	S	.	.	H	α-helix	trans	-68.7	-39.9	173.1	-68.9	163.6	172.4	-177.4	-8.4	112	E201 E202 R203 L209	E201-R205 WeakPolarHBondContact O-CG 3.37Å; E201-R205 PolarHBondContact O-N 3.48Å; E202-R205 PolarHBondContact O-N 3.02Å; E202-R205 WeakPolarHBondContact OE2-CD 3.45Å; E202-R205 IonicContact OE2-CZ 3.72Å; E202-R205 IonicContact OE2-NE 3.74Å; E202-R205 IonicContact OE2-NH1 2.77Å; E202-R205 PolarHBondContact OE2-NH1 2.89Å; R203-R205 VanDerWaalsContact C-N 3.27Å; R203-R205 PolarHBondContact O-N 2.88Å; R205-L209 WeakPolarHBondContact O-CB 3.48Å; R205-L209 WeakPolarHBondContact O-CD1 3.38Å; R205-L209 WeakPolarHBondContact O-CG 3.33Å; R205-L209 PolarHBondContact O-N 2.9Å
206	I	97.1	Very high	96.2	Very high	15 Å²	15	80.5 Å²	80.5	8%	0.077	40%	0.4	C	S	.	.	H	α-helix	trans	-67.8	-42.2	176.2	-64.6	170.5	0	0	0	109.8	E202 R203 L209 I210 F241 I319	E202-I206 WeakPolarHBondContact O-CG1 3.33Å; E202-I206 PolarHBondContact O-N 2.8Å; R203-I206 WeakPolarHBondContact O-CA 3.5Å; R203-I206 WeakPolarHBondContact O-CB 3.42Å; R203-I206 PolarHBondContact O-N 3.35Å; I206-L209 PolarHBondContact O-N 3.13Å; I206-I210 HydrophobicContact CG2-CD1 3.72Å; I206-I210 HydrophobicContact CG2-CG1 4.45Å; I206-I210 WeakPolarHBondContact O-CD1 3.37Å; I206-I210 VanDerWaalsContact O-CG1 3.26Å; I206-I210 WeakPolarHBondContact O-CG1 3.5Å; I206-I210 PolarHBondContact O-N 3.14Å; I206-F241 HydrophobicContact CG1-CB 4.4Å; I206-F241 HydrophobicContact CG2-CD2 4.02Å; I206-F241 HydrophobicContact CG2-CE2 4.36Å; I206-I319 HydrophobicContact CG2-CD1 3.81Å
207	D	97.8	Very high	96.3	Very high	29 Å²	29	78 Å²	78	16%	0.155	38%	0.38	C	S	.	.	H	α-helix	trans	-54.2	-54.3	173	-51.6	-30.1	0	0	0	110.2	R203 K204 L209 I210 E211 H310 I312	R203-D207 WeakPolarHBondContact CG-OD2 3.16Å; R203-D207 IonicContact NH1-OD1 2.74Å; R203-D207 PolarHBondContact O-N 3.19Å; K204-D207 VanDerWaalsContact CA-OD2 3.28Å; K204-D207 WeakPolarHBondContact CA-OD2 3.48Å; K204-D207 PolarHBondContact N-OD2 2.81Å; D207-L209 PolarHBondContact O-N 3.27Å; D207-I210 PolarHBondContact O-N 3.33Å; D207-E211 WeakPolarHBondContact O-CG 3.44Å; D207-E211 PolarHBondContact O-N 2.78Å; D207-H310 IonicContact OD1-CD2 2.67Å; D207-H310 IonicContact OD1-CE1 3.02Å; D207-H310 PolarHBondContact OD1-CE1 2.93Å; D207-H310 IonicContact OD1-NE2 2.77Å; D207-H310 PolarHBondContact OD1-NE2 3.41Å; D207-I312 HydrophobicContact CB-CD1 4.38Å
208	E	97.6	Very high	96.4	Very high	133 Å²	133	73.8 Å²	73.8	62%	0.621	36%	0.361	S	S	*	.	H	α-helix	trans	-60.7	-37.2	178.5	-175.3	179.1	-172.9	0	0	113.5	K204 S212	K204-E208 WeakPolarHBondContact O-CB 3.3Å; K204-E208 PolarHBondContact O-N 3.24Å; E208-S212 VanDerWaalsContact O-CB 3.23Å; E208-S212 WeakPolarHBondContact O-CB 3.3Å; E208-S212 PolarHBondContact O-N 2.96Å; E208-S212 PolarHBondContact O-OG 2.96Å
209	L	97.2	Very high	96.5	Very high	55 Å²	55	74 Å²	74	29%	0.288	36%	0.357	S	S	.	.	H	α-helix	trans	-71.5	-32.4	177.9	-75.8	168.3	0	0	0	113.1	R205 I206 D207 G213 K214 F241	R205-L209 WeakPolarHBondContact O-CB 3.48Å; R205-L209 WeakPolarHBondContact O-CD1 3.38Å; R205-L209 WeakPolarHBondContact O-CG 3.33Å; R205-L209 PolarHBondContact O-N 2.9Å; I206-L209 PolarHBondContact O-N 3.13Å; D207-L209 PolarHBondContact O-N 3.27Å; L209-G213 PolarHBondContact O-N 3.17Å; L209-K214 HydrophobicContact CD2-CB 4.41Å; L209-K214 PolarHBondContact O-N 2.98Å; L209-F241 HydrophobicContact CB-CD1 4.22Å; L209-F241 HydrophobicContact CB-CE1 4.02Å; L209-F241 HydrophobicContact CB-CZ 4.3Å; L209-F241 HydrophobicContact CD1-CB 4.21Å; L209-F241 HydrophobicContact CD1-CD1 3.85Å; L209-F241 HydrophobicContact CD1-CE1 4.45Å; L209-F241 HydrophobicContact CD1-CG 4.13Å
210	I	97.2	Very high	96.7	Very high	10 Å²	10	72.4 Å²	72.4	5%	0.051	35%	0.352	C	S	.	.	H	α-helix	trans	-71.7	-52.8	173.2	-67.7	161.2	0	0	0	109.5	I206 D207 S212 G213 F241 H310 I312 H317 I319	I206-I210 HydrophobicContact CG2-CD1 3.72Å; I206-I210 HydrophobicContact CG2-CG1 4.45Å; I206-I210 WeakPolarHBondContact O-CD1 3.37Å; I206-I210 VanDerWaalsContact O-CG1 3.26Å; I206-I210 WeakPolarHBondContact O-CG1 3.5Å; I206-I210 PolarHBondContact O-N 3.14Å; D207-I210 PolarHBondContact O-N 3.33Å; I210-S212 PolarHBondContact O-N 3.31Å; I210-G213 WeakPolarHBondContact O-CA 3.45Å; I210-G213 PolarHBondContact O-N 2.87Å; I210-F241 HydrophobicContact CG1-CE2 4.04Å; I210-F241 HydrophobicContact CG1-CZ 4.34Å; I210-H310 VanDerWaalsContact CD1-CD2 3.48Å; I210-H310 WeakPolarHBondContact CD1-CD2 3.49Å; I210-I312 HydrophobicContact CB-CD1 4.05Å; I210-I312 HydrophobicContact CD1-CD1 3.87Å; I210-I312 HydrophobicContact CG2-CD1 3.88Å; I210-H317 HydrophobicContact CD1-CB 4.25Å; I210-H317 WeakPolarHBondContact CG2-ND1 3.45Å; I210-I319 HydrophobicContact CD1-CG2 3.84Å; I210-I319 HydrophobicContact CG1-CG2 4.21Å
211	E	96.9	Very high	96.9	Very high	150 Å²	150	72.7 Å²	72.7	70%	0.701	35%	0.35	S	S	*	.	H	α-helix	trans	-59.1	-42.7	-179.4	-73.6	178.9	-166.5	0	0	113	D207 G213	D207-E211 WeakPolarHBondContact O-CG 3.44Å; D207-E211 PolarHBondContact O-N 2.78Å; E211-G213 PolarHBondContact O-N 3.05Å
212	S	97.2	Very high	97	Very high	73 Å²	73	76 Å²	76	51%	0.51	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-11.1	175.6	62.7	0	0	0	0	113.7	E208 I210 K214	E208-S212 VanDerWaalsContact O-CB 3.23Å; E208-S212 WeakPolarHBondContact O-CB 3.3Å; E208-S212 PolarHBondContact O-N 2.96Å; E208-S212 PolarHBondContact O-OG 2.96Å; I210-S212 PolarHBondContact O-N 3.31Å; S212-K214 PolarHBondContact O-N 2.67Å; S212-K214 WeakPolarHBondContact OG-CB 3.45Å
213	G	94.8	Very high	97.1	Very high	23 Å²	23	74.1 Å²	74.1	24%	0.237	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.8	26.6	-177.8	0	0	0	0	0	114.2	L209 I210 E211 E215 R292	L209-G213 PolarHBondContact O-N 3.17Å; I210-G213 WeakPolarHBondContact O-CA 3.45Å; I210-G213 PolarHBondContact O-N 2.87Å; E211-G213 PolarHBondContact O-N 3.05Å; G213-E215 PolarHBondContact O-N 2.77Å; G213-R292 PolarHBondContact O-NH1 2.77Å
214	K	95.3	Very high	97.1	Very high	100 Å²	100	76.8 Å²	76.8	44%	0.435	38%	0.383	S	S	.	.			trans	-85.4	99.8	-161.3	-162.1	-168.4	-168.7	-150.4	0	114.1	L209 S212 E216	L209-K214 HydrophobicContact CD2-CB 4.41Å; L209-K214 PolarHBondContact O-N 2.98Å; S212-K214 PolarHBondContact O-N 2.67Å; S212-K214 WeakPolarHBondContact OG-CB 3.45Å; K214-E216 HydrophobicContact CD-CG 4.4Å; K214-E216 WeakPolarHBondContact CE-OE1 3.38Å; K214-E216 WeakPolarHBondContact CE-OE2 3.39Å; K214-E216 HydrophobicContact CG-CG 4.28Å; K214-E216 IonicContact NZ-OE1 2.81Å; K214-E216 PolarHBondContact NZ-OE1 2.87Å; K214-E216 IonicContact NZ-OE2 2.77Å; K214-E216 PolarHBondContact NZ-OE2 3.4Å; K214-E216 PolarHBondContact O-N 3.07Å
215	E	96.7	Very high	97.1	Very high	39 Å²	39	74.4 Å²	74.4	18%	0.182	40%	0.396	C	S	.	.			trans	-91.8	63.3	-174.6	-52.6	-172	170.2	0	0	113.6	G213 M218 V243 R292 L293	G213-E215 PolarHBondContact O-N 2.77Å; E215-M218 HydrophobicContact CB-CE 3.81Å; E215-V243 HydrophobicContact CB-CG2 4.37Å; E215-V243 HydrophobicContact CG-CG2 3.81Å; E215-R292 VanDerWaalsContact CD-NH1 3.32Å; E215-R292 WeakPolarHBondContact OE1-CA 3.48Å; E215-R292 WeakPolarHBondContact OE1-CD 3.44Å; E215-R292 IonicContact OE1-CZ 2.83Å; E215-R292 IonicContact OE1-NE 3.66Å; E215-R292 PolarHBondContact OE1-NE 2.82Å; E215-R292 IonicContact OE1-NH1 2.7Å; E215-R292 PolarHBondContact OE1-NH1 2.73Å; E215-L293 HydrophobicContact CB-CD1 4.28Å; E215-L293 PolarHBondContact OE1-N 3.44Å; E215-L293 VanDerWaalsContact OE2-CB 3.27Å; E215-L293 WeakPolarHBondContact OE2-CB 3.01Å; E215-L293 WeakPolarHBondContact OE2-CG 3.36Å; E215-L293 PolarHBondContact OE2-N 2.76Å
216	E	95.3	Very high	97.1	Very high	107 Å²	107	72.3 Å²	72.3	50%	0.5	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	141.5	-176.9	-90	-178.9	163.5	0	0	115.1	K214 K234	K214-E216 HydrophobicContact CD-CG 4.4Å; K214-E216 WeakPolarHBondContact CE-OE1 3.38Å; K214-E216 WeakPolarHBondContact CE-OE2 3.39Å; K214-E216 HydrophobicContact CG-CG 4.28Å; K214-E216 IonicContact NZ-OE1 2.81Å; K214-E216 PolarHBondContact NZ-OE1 2.87Å; K214-E216 IonicContact NZ-OE2 2.77Å; K214-E216 PolarHBondContact NZ-OE2 3.4Å; K214-E216 PolarHBondContact O-N 3.07Å; E216-K234 PolarHBondContact O-NZ 3.01Å
217	G	97.3	Very high	97	Very high	15 Å²	15	73.6 Å²	73.6	16%	0.155	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.1	22.9	172.9	0	0	0	0	0	114.4	T233 K234 F236	G217-T233 VanDerWaalsContact CA-OG1 3.3Å; G217-T233 WeakPolarHBondContact CA-OG1 3.31Å; G217-T233 PolarHBondContact O-N 2.93Å; G217-T233 PolarHBondContact O-OG1 3.3Å; G217-K234 PolarHBondContact O-N 2.99Å; G217-F236 WeakPolarHBondContact O-CE2 3.38Å
218	M	98.4	Very high	97	Very high	18 Å²	18	76.4 Å²	76.4	9%	0.089	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	158.7	-179.3	-67.9	173.1	-78.7	0	0	110.4	E215 V230 I231 T233 F236 V242 V243 L293 L332	E215-M218 HydrophobicContact CB-CE 3.81Å; M218-V230 HydrophobicContact CB-CG1 3.73Å; M218-V230 HydrophobicContact CG-CG1 4.03Å; M218-V230 HydrophobicContact SD-CG1 4.21Å; M218-I231 CarbonylContact C-O 3.45Å; M218-I231 WeakPolarHBondContact CA-O 3.42Å; M218-T233 PolarHBondContact N-OG1 2.74Å; M218-F236 HydrophobicContact CG-CZ 4.21Å; M218-V242 WeakPolarHBondContact CE-O 3.12Å; M218-V242 HydrophobicContact SD-CG1 4.02Å; M218-V243 HydrophobicContact CE-CB 3.9Å; M218-V243 HydrophobicContact CE-CG2 3.98Å; M218-V243 HydrophobicContact SD-CB 4.03Å; M218-V243 HydrophobicContact SD-CG2 4.43Å; M218-L293 HydrophobicContact CB-CD1 3.58Å; M218-L293 HydrophobicContact CE-CD1 4.41Å; M218-L293 HydrophobicContact SD-CD1 4.41Å; M218-L332 HydrophobicContact CG-CD1 3.77Å; M218-L332 HydrophobicContact SD-CD1 3.74Å
219	K	98.1	Very high	97.1	Very high	93 Å²	93	70.1 Å²	70.1	40%	0.404	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	154.8	166.1	65	168.1	178.7	153	0	110.4	D221 V230 I231 T233	K219-D221 WeakPolarHBondContact CE-OD2 3.33Å; K219-D221 IonicContact NZ-OD2 3.23Å; K219-D221 PolarHBondContact NZ-OD2 3.17Å; K219-V230 CarbonylContact O-C 3.56Å; K219-V230 VanDerWaalsContact O-CA 3.31Å; K219-V230 WeakPolarHBondContact O-CA 3.41Å; K219-V230 WeakPolarHBondContact O-CG1 3.38Å; K219-I231 HydrophobicContact CG-CB 3.96Å; K219-I231 PolarHBondContact N-O 2.84Å; K219-I231 PolarHBondContact O-N 2.88Å; K219-T233 HydrophobicContact CB-CG2 3.86Å; K219-T233 HydrophobicContact CD-CG2 4.04Å; K219-T233 HydrophobicContact CG-CG2 3.64Å
220	I	98.4	Very high	97.1	Very high	87 Å²	87	67.5 Å²	67.5	45%	0.446	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	140.7	163.3	-54	176	0	0	0	108.1	G229 L293 L296	I220-G229 WeakPolarHBondContact CA-O 3.45Å; I220-L293 HydrophobicContact CD1-CD2 3.87Å; I220-L293 HydrophobicContact CG1-CD2 3.35Å; I220-L296 HydrophobicContact CD1-CD1 3.58Å; I220-L296 HydrophobicContact CG1-CD1 3.92Å
221	D	98.2	Very high	97.2	Very high	61 Å²	61	67.8 Å²	67.8	33%	0.326	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	171	168.3	-141.8	-33.2	0	0	0	110.6	K219 I223 G229 I231	K219-D221 WeakPolarHBondContact CE-OD2 3.33Å; K219-D221 IonicContact NZ-OD2 3.23Å; K219-D221 PolarHBondContact NZ-OD2 3.17Å; D221-I223 HydrophobicContact CB-CD1 4.4Å; D221-G229 PolarHBondContact N-O 3.37Å; D221-G229 PolarHBondContact O-N 2.97Å; D221-I231 HydrophobicContact CB-CG1 3.57Å
222	L	98.3	Very high	97.3	Very high	139 Å²	139	60.7 Å²	60.7	73%	0.728	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.7	121.2	173.9	-66.5	179.6	0	0	0	110.3	G227 R228	L222-G227 CarbonylContact C-O 3.49Å; L222-G227 WeakPolarHBondContact CA-O 3.45Å; L222-R228 HydrophobicContact CD2-CG 4.47Å
223	I	97.9	Very high	97.3	Very high	32 Å²	32	60.9 Å²	60.9	16%	0.164	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	127.6	-175.6	-48.3	-59.4	0	0	0	109.3	D221 K226 G227 I231 E331	D221-I223 HydrophobicContact CB-CD1 4.4Å; I223-K226 HydrophobicContact CB-CB 4.23Å; I223-K226 HydrophobicContact CB-CD 4.45Å; I223-K226 HydrophobicContact CG2-CB 4.35Å; I223-K226 HydrophobicContact CG2-CD 3.84Å; I223-K226 HydrophobicContact CG2-CG 4.18Å; I223-K226 PolarHBondContact O-N 2.78Å; I223-K226 VanDerWaalsContact O-N 3.11Å; I223-G227 PolarHBondContact N-O 2.91Å; I223-G227 PolarHBondContact O-N 2.95Å; I223-I231 HydrophobicContact CD1-CD1 3.71Å; I223-I231 HydrophobicContact CD1-CG1 4.35Å; I223-E331 HydrophobicContact CD1-CG 4.4Å; I223-E331 HydrophobicContact CG1-CG 4.41Å
224	D	97.1	Very high	97.5	Very high	164 Å²	164	64 Å²	64	88%	0.877	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	139.7	-179	-171.8	27.1	0	0	0	111.7	K226	D224-K226 PolarHBondContact O-N 3Å
225	G	95.5	Very high	97.6	Very high	83 Å²	83	65.9 Å²	65.9	86%	0.856	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.4	-9.2	-173.8	0	0	0	0	0	117
226	K	96.4	Very high	97.7	Very high	93 Å²	93	64 Å²	64	40%	0.404	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.2	-25.2	-176.2	-51.8	-175.6	-165.6	176.4	0	114.6	I223 D224 N298 E331	I223-K226 HydrophobicContact CB-CB 4.23Å; I223-K226 HydrophobicContact CB-CD 4.45Å; I223-K226 HydrophobicContact CG2-CB 4.35Å; I223-K226 HydrophobicContact CG2-CD 3.84Å; I223-K226 HydrophobicContact CG2-CG 4.18Å; I223-K226 PolarHBondContact O-N 2.78Å; I223-K226 VanDerWaalsContact O-N 3.11Å; D224-K226 PolarHBondContact O-N 3Å; K226-N298 HydrophobicContact CD-CB 3.94Å; K226-E331 WeakPolarHBondContact CD-OE1 3.37Å; K226-E331 IonicContact NZ-OE1 2.85Å; K226-E331 PolarHBondContact NZ-OE1 2.97Å; K226-E331 IonicContact NZ-OE2 2.72Å; K226-E331 PolarHBondContact NZ-OE2 3.06Å
227	G	96.5	Very high	97.9	Very high	41 Å²	41	61.7 Å²	61.7	42%	0.423	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	91.2	-115.4	-176.4	0	0	0	0	0	111.5	L222 I223	L222-G227 CarbonylContact C-O 3.49Å; L222-G227 WeakPolarHBondContact CA-O 3.45Å; I223-G227 PolarHBondContact N-O 2.91Å; I223-G227 PolarHBondContact O-N 2.95Å
228	R	97.8	Very high	97.9	Very high	89 Å²	89	69.9 Å²	69.9	34%	0.336	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	148.6	173.3	-68	-175.3	-67.8	-170.7	-0.3	110.1	L222 Y271 E289 N298	L222-R228 HydrophobicContact CD2-CG 4.47Å; R228-Y271 PolarHBondContact NH2-OH 2.6Å; R228-E289 IonicContact CZ-OE1 3.8Å; R228-E289 IonicContact CZ-OE2 3.74Å; R228-E289 IonicContact NH1-OE1 2.74Å; R228-E289 IonicContact NH1-OE2 2.6Å; R228-E289 PolarHBondContact NH1-OE2 2.85Å; R228-E289 VanDerWaalsContact NH2-CD 3.34Å; R228-E289 IonicContact NH2-OE1 2.76Å; R228-E289 PolarHBondContact NH2-OE1 3Å; R228-E289 IonicContact NH2-OE2 3.97Å; R228-E289 PolarHBondContact NH2-OE2 2.86Å; R228-E289 VanDerWaalsContact NH2-OE2 3.09Å; R228-N298 PolarHBondContact O-ND2 2.71Å; R228-N298 PolarHBondContact O-OD1 3.11Å
229	G	98.1	Very high	97.8	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	175.6	165.6	0	0	0	0	0	110.9	I220 D221 L296 N298	I220-G229 WeakPolarHBondContact CA-O 3.45Å; D221-G229 PolarHBondContact N-O 3.37Å; D221-G229 PolarHBondContact O-N 2.97Å; G229-L296 WeakPolarHBondContact CA-O 3.32Å; G229-N298 WeakPolarHBondContact CA-ND2 3.4Å
230	V	98.6	Very high	97.8	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	128	175.9	-172.4	0	0	0	0	109.5	M218 K219 L293 L296 I297 L332	M218-V230 HydrophobicContact CB-CG1 3.73Å; M218-V230 HydrophobicContact CG-CG1 4.03Å; M218-V230 HydrophobicContact SD-CG1 4.21Å; K219-V230 CarbonylContact O-C 3.56Å; K219-V230 VanDerWaalsContact O-CA 3.31Å; K219-V230 WeakPolarHBondContact O-CA 3.41Å; K219-V230 WeakPolarHBondContact O-CG1 3.38Å; V230-L293 HydrophobicContact CG2-CB 4.28Å; V230-L296 HydrophobicContact CG2-CB 3.79Å; V230-I297 HydrophobicContact CB-CG1 3.95Å; V230-I297 HydrophobicContact CG2-CG1 3.7Å; V230-L332 HydrophobicContact CB-CD1 4.41Å; V230-L332 HydrophobicContact CG1-CD1 3.9Å; V230-L332 PolarHBondContact O-N 2.95Å
231	I	98.6	Very high	97.8	Very high	16 Å²	16	66 Å²	66	8%	0.082	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	136.1	177.7	-59.6	-59	0	0	0	109.5	M218 K219 D221 I223 T233 E330 E331	M218-I231 CarbonylContact C-O 3.45Å; M218-I231 WeakPolarHBondContact CA-O 3.42Å; K219-I231 HydrophobicContact CG-CB 3.96Å; K219-I231 PolarHBondContact N-O 2.84Å; K219-I231 PolarHBondContact O-N 2.88Å; D221-I231 HydrophobicContact CB-CG1 3.57Å; I223-I231 HydrophobicContact CD1-CD1 3.71Å; I223-I231 HydrophobicContact CD1-CG1 4.35Å; I231-T233 PolarHBondContact O-N 3.25Å; I231-E330 WeakPolarHBondContact CA-O 3.48Å; I231-E331 HydrophobicContact CD1-CB 3.82Å; I231-E331 HydrophobicContact CD1-CG 4.23Å
232	A	98.6	Very high	97.8	Very high	1 Å²	1	63.3 Å²	63.3	1%	0.008	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	127	171.6	0	0	0	0	0	110.9	F236 I326 A328 G329 E330 L332	A232-F236 HydrophobicContact CB-CD2 4.24Å; A232-F236 HydrophobicContact CB-CE2 4.01Å; A232-I326 HydrophobicContact CB-CG2 4.27Å; A232-A328 CarbonylContact O-C 3.57Å; A232-A328 WeakPolarHBondContact O-CA 3.47Å; A232-G329 PolarHBondContact O-N 2.83Å; A232-E330 PolarHBondContact N-O 3.46Å; A232-L332 HydrophobicContact CB-CD2 4.25Å
233	T	98.4	Very high	97.8	Very high	77 Å²	77	56.8 Å²	56.8	47%	0.472	31%	0.314	S	S	.	.	S	Bend	trans	-102.9	-10.2	174.7	61.6	0	0	0	0	113.3	G217 M218 K219 I231	G217-T233 VanDerWaalsContact CA-OG1 3.3Å; G217-T233 WeakPolarHBondContact CA-OG1 3.31Å; G217-T233 PolarHBondContact O-N 2.93Å; G217-T233 PolarHBondContact O-OG1 3.3Å; M218-T233 PolarHBondContact N-OG1 2.74Å; K219-T233 HydrophobicContact CB-CG2 3.86Å; K219-T233 HydrophobicContact CD-CG2 4.04Å; K219-T233 HydrophobicContact CG-CG2 3.64Å; I231-T233 PolarHBondContact O-N 3.25Å
234	K	97.9	Very high	97.8	Very high	88 Å²	88	55.9 Å²	55.9	38%	0.383	31%	0.31	S	S	.	.	S	Bend	trans	-122.6	164.9	167.5	75.1	-174.2	-171.3	-146.7	0	109.9	E216 G217 F236	E216-K234 PolarHBondContact O-NZ 3.01Å; G217-K234 PolarHBondContact O-N 2.99Å; K234-F236 HydrophobicContact CD-CZ 4.32Å; K234-F236 VanDerWaalsContact CE-CZ 3.41Å; K234-F236 HydrophobicContact CG-CD2 4.11Å; K234-F236 HydrophobicContact CG-CE2 3.76Å; K234-F236 HydrophobicContact CG-CZ 4.07Å; K234-F236 WeakPolarHBondContact O-CD2 3.36Å
235	Q	98.1	Very high	97.9	Very high	140 Å²	140	48.6 Å²	48.6	65%	0.654	27%	0.27	S	S	*	.			trans	-73.3	137.9	166.4	-174.8	176	-1.4	0	0	109.9	I326	Q235-I326 CarbonylContact C-O 3.59Å; Q235-I326 VanDerWaalsContact CA-O 3.3Å; Q235-I326 WeakPolarHBondContact CA-O 3.45Å; Q235-I326 WeakPolarHBondContact CG-O 3.46Å
236	F	98.4	Very high	98	Very high	1 Å²	1	47.9 Å²	47.9	0%	0.004	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-113.6	141.9	168.4	-63.7	-105	0	0	0	109.2	G217 M218 A232 K234 D240 V242 A322 D325 I326	G217-F236 WeakPolarHBondContact O-CE2 3.38Å; M218-F236 HydrophobicContact CG-CZ 4.21Å; A232-F236 HydrophobicContact CB-CD2 4.24Å; A232-F236 HydrophobicContact CB-CE2 4.01Å; K234-F236 HydrophobicContact CD-CZ 4.32Å; K234-F236 VanDerWaalsContact CE-CZ 3.41Å; K234-F236 HydrophobicContact CG-CD2 4.11Å; K234-F236 HydrophobicContact CG-CE2 3.76Å; K234-F236 HydrophobicContact CG-CZ 4.07Å; K234-F236 WeakPolarHBondContact O-CD2 3.36Å; F236-D240 HydrophobicContact CD1-CB 4.48Å; F236-V242 HydrophobicContact CD1-CG2 4.02Å; F236-V242 HydrophobicContact CE1-CB 4.32Å; F236-V242 HydrophobicContact CE1-CG1 4.18Å; F236-V242 HydrophobicContact CE1-CG2 4.24Å; F236-V242 HydrophobicContact CZ-CG1 4.29Å; F236-A322 HydrophobicContact CB-CB 4.37Å; F236-D325 WeakPolarHBondContact O-CA 3.3Å; F236-I326 HydrophobicContact CB-CB 4.2Å; F236-I326 HydrophobicContact CB-CD1 4.41Å; F236-I326 HydrophobicContact CB-CG1 4.31Å; F236-I326 PolarHBondContact N-O 3.3Å; F236-I326 PolarHBondContact O-N 3.33Å
237	S	98.4	Very high	98.1	Very high	58 Å²	58	44.5 Å²	44.5	41%	0.406	24%	0.235	S	C	.	.			trans	-92	152.9	176.6	-26.7	0	0	0	0	110.3	G239 D240 A322	S237-G239 PolarHBondContact O-N 3.1Å; S237-G239 VanDerWaalsContact O-N 3.1Å; S237-D240 WeakPolarHBondContact CA-OD2 3.35Å; S237-D240 VanDerWaalsContact CB-OD2 3.28Å; S237-D240 WeakPolarHBondContact CB-OD2 3.5Å; S237-D240 PolarHBondContact N-OD2 2.95Å; S237-D240 VanDerWaalsContact O-CB 3.29Å; S237-D240 WeakPolarHBondContact O-CB 3.43Å; S237-D240 VanDerWaalsContact O-CG 3.24Å; S237-D240 PolarHBondContact O-N 2.79Å; S237-D240 PolarHBondContact OG-OD2 3.26Å; S237-A322 VanDerWaalsContact O-CB 3.31Å; S237-A322 WeakPolarHBondContact O-CB 3.11Å
238	R	98.1	Very high	98.1	Very high	187 Å²	187	44.4 Å²	44.4	71%	0.706	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	116	174.7	-177.8	174.3	-171.1	-134.6	-3.7	111.5	S323 D325	R238-S323 WeakPolarHBondContact CD-O 3.24Å; R238-S323 WeakPolarHBondContact CG-O 3.42Å; R238-S323 PolarHBondContact NE-O 2.7Å; R238-D325 WeakPolarHBondContact CB-OD1 3.39Å; R238-D325 PolarHBondContact N-OD1 3.02Å
239	G	97	Very high	98.2	Very high	38 Å²	38	43.5 Å²	43.5	39%	0.392	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	106.3	-13.6	-177.5	0	0	0	0	0	114.5	S237 I321 A322	S237-G239 PolarHBondContact O-N 3.1Å; S237-G239 VanDerWaalsContact O-N 3.1Å; G239-I321 WeakPolarHBondContact O-CG2 3.24Å; G239-A322 PolarHBondContact N-O 3.25Å
240	D	97.8	Very high	98.1	Very high	57 Å²	57	44.5 Å²	44.5	31%	0.305	23%	0.232	S	C	.	.			trans	-64.7	143.5	178.5	-66.7	-2.2	0	0	0	111.4	F236 S237 I321 A322	F236-D240 HydrophobicContact CD1-CB 4.48Å; S237-D240 WeakPolarHBondContact CA-OD2 3.35Å; S237-D240 VanDerWaalsContact CB-OD2 3.28Å; S237-D240 WeakPolarHBondContact CB-OD2 3.5Å; S237-D240 PolarHBondContact N-OD2 2.95Å; S237-D240 VanDerWaalsContact O-CB 3.29Å; S237-D240 WeakPolarHBondContact O-CB 3.43Å; S237-D240 VanDerWaalsContact O-CG 3.24Å; S237-D240 PolarHBondContact O-N 2.79Å; S237-D240 PolarHBondContact OG-OD2 3.26Å; D240-I321 WeakPolarHBondContact O-CA 3.22Å; D240-A322 PolarHBondContact O-N 3.15Å
241	F	98.1	Very high	98.1	Very high	22 Å²	22	48 Å²	48	10%	0.096	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	130.8	165.8	176.5	-85.2	0	0	0	110.1	I206 L209 I210 I319	I206-F241 HydrophobicContact CG1-CB 4.4Å; I206-F241 HydrophobicContact CG2-CD2 4.02Å; I206-F241 HydrophobicContact CG2-CE2 4.36Å; L209-F241 HydrophobicContact CB-CD1 4.22Å; L209-F241 HydrophobicContact CB-CE1 4.02Å; L209-F241 HydrophobicContact CB-CZ 4.3Å; L209-F241 HydrophobicContact CD1-CB 4.21Å; L209-F241 HydrophobicContact CD1-CD1 3.85Å; L209-F241 HydrophobicContact CD1-CE1 4.45Å; L209-F241 HydrophobicContact CD1-CG 4.13Å; I210-F241 HydrophobicContact CG1-CE2 4.04Å; I210-F241 HydrophobicContact CG1-CZ 4.34Å; F241-I319 HydrophobicContact CD2-CB 4.32Å; F241-I319 HydrophobicContact CD2-CD1 4.25Å; F241-I319 HydrophobicContact CD2-CG2 4.47Å; F241-I319 HydrophobicContact CE2-CB 4.01Å; F241-I319 HydrophobicContact CE2-CG2 3.8Å
242	V	98.3	Very high	98	Very high	4 Å²	4	49.9 Å²	49.9	2%	0.024	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-61.7	178.4	-178.4	0	0	0	0	110	M218 F236 L320 A322 L332	M218-V242 WeakPolarHBondContact CE-O 3.12Å; M218-V242 HydrophobicContact SD-CG1 4.02Å; F236-V242 HydrophobicContact CD1-CG2 4.02Å; F236-V242 HydrophobicContact CE1-CB 4.32Å; F236-V242 HydrophobicContact CE1-CG1 4.18Å; F236-V242 HydrophobicContact CE1-CG2 4.24Å; F236-V242 HydrophobicContact CZ-CG1 4.29Å; V242-L320 WeakPolarHBondContact CB-O 3.48Å; V242-L320 PolarHBondContact N-O 3.47Å; V242-A322 HydrophobicContact CG2-CB 4.07Å; V242-L332 HydrophobicContact CG1-CD1 3.6Å; V242-L332 HydrophobicContact CG1-CD2 4.28Å
243	V	98.5	Very high	97.8	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.006	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	160.7	-180	75.4	0	0	0	0	111.1	E215 M218 I297 L320	E215-V243 HydrophobicContact CB-CG2 4.37Å; E215-V243 HydrophobicContact CG-CG2 3.81Å; M218-V243 HydrophobicContact CE-CB 3.9Å; M218-V243 HydrophobicContact CE-CG2 3.98Å; M218-V243 HydrophobicContact SD-CB 4.03Å; M218-V243 HydrophobicContact SD-CG2 4.43Å; V243-I297 HydrophobicContact CG1-CD1 3.48Å; V243-I297 VanDerWaalsContact CG1-CD1 3.48Å; V243-L320 HydrophobicContact CG1-CB 4.26Å; V243-L320 HydrophobicContact CG1-CD1 3.88Å; V243-L320 PolarHBondContact N-O 2.81Å; V243-L320 PolarHBondContact O-N 3.39Å
244	E	98.5	Very high	97.7	Very high	14 Å²	14	53.4 Å²	53.4	7%	0.065	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	137.8	165.4	-173.6	-171.4	-151.8	0	0	110.5	H246 R292 H317	E244-H246 HydrophobicContact CG-CB 4.15Å; E244-H246 PolarHBondContact O-N 3.06Å; E244-H246 WeakPolarHBondContact OE2-CB 3.45Å; E244-H246 IonicContact OE2-CD2 3.41Å; E244-H246 PolarHBondContact OE2-CD2 3.38Å; E244-H246 VanDerWaalsContact OE2-CD2 3.24Å; E244-H246 IonicContact OE2-CG 3.37Å; E244-R292 IonicContact OE2-CZ 3.39Å; E244-R292 IonicContact OE2-NH2 3.16Å; E244-R292 PolarHBondContact OE2-NH2 2.68Å; E244-H317 IonicContact OE1-CE1 3.62Å; E244-H317 IonicContact OE1-CG 2.68Å; E244-H317 IonicContact OE1-ND1 3.83Å; E244-H317 PolarHBondContact OE1-ND1 3.25Å
245	Y	98.4	Very high	97.7	Very high	11 Å²	11	49.2 Å²	49.2	4%	0.043	26%	0.259	C	S	.	.			trans	-78.3	79.9	161.6	-167.1	-85	0	0	0	108.1	Y271 Y273 V284 A286 G294 L318 Y334	Y245-Y271 PolarHBondContact OH-O 2.82Å; Y245-Y273 HydrophobicContact CD1-CD2 4.47Å; Y245-Y273 HydrophobicContact CD2-CD2 4.48Å; Y245-Y273 HydrophobicContact CE1-CD2 4.44Å; Y245-Y273 HydrophobicContact CE2-CD2 4.43Å; Y245-Y273 HydrophobicContact CG-CD2 4.5Å; Y245-V284 HydrophobicContact CD1-CB 4.04Å; Y245-V284 HydrophobicContact CD1-CG1 4.05Å; Y245-V284 HydrophobicContact CE1-CB 4.32Å; Y245-V284 HydrophobicContact CE1-CG1 4.37Å; Y245-V284 WeakPolarHBondContact O-CG1 3.45Å; Y245-A286 HydrophobicContact CE1-CB 3.98Å; Y245-G294 WeakPolarHBondContact CD2-O 3.48Å; Y245-L318 HydrophobicContact CD1-CD2 4.14Å; Y245-L318 HydrophobicContact CG-CD2 4.17Å; Y245-L318 PolarHBondContact N-O 3.37Å; Y245-Y334 WeakPolarHBondContact CE2-OH 3.39Å
246	H	98.1	Very high	97.5	Very high	67 Å²	67	48.4 Å²	48.4	31%	0.31	25%	0.253	S	S	.	.			trans	-84.6	135	-173.3	178.4	-73.2	0	0	0	112.8	E244 R292	E244-H246 HydrophobicContact CG-CB 4.15Å; E244-H246 PolarHBondContact O-N 3.06Å; E244-H246 WeakPolarHBondContact OE2-CB 3.45Å; E244-H246 IonicContact OE2-CD2 3.41Å; E244-H246 PolarHBondContact OE2-CD2 3.38Å; E244-H246 VanDerWaalsContact OE2-CD2 3.24Å; E244-H246 IonicContact OE2-CG 3.37Å; H246-R292 HydrophobicContact CB-CB 4.28Å; H246-R292 HydrophobicContact CB-CG 3.96Å; H246-R292 PolarHBondContact CD2-NE 2.86Å
247	G	97.6	Very high	97.4	Very high	22 Å²	22	54.4 Å²	54.4	23%	0.227	28%	0.279	C	S	.	.	S	Bend	trans	-171.8	-165.4	173.7	0	0	0	0	0	111.3	L249 V284 D285	G247-L249 PolarHBondContact O-N 3.43Å; G247-V284 VanDerWaalsContact CA-CG1 3.46Å; G247-V284 VanDerWaalsContact N-CG1 3.26Å; G247-D285 CarbonylContact C-O 3.56Å; G247-D285 WeakPolarHBondContact CA-O 3.37Å
248	D	97.8	Very high	97.3	Very high	40 Å²	40	54.9 Å²	54.9	21%	0.214	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	113.2	174.6	-67	10.5	0	0	0	109.7	I250 R258 D285 R288	D248-I250 HydrophobicContact CB-CG2 4.43Å; D248-I250 PolarHBondContact O-N 3.12Å; D248-R258 IonicContact OD2-CZ 2.83Å; D248-R258 VanDerWaalsContact OD2-CZ 3.31Å; D248-R258 IonicContact OD2-NH1 2.72Å; D248-R258 PolarHBondContact OD2-NH1 3.24Å; D248-R258 IonicContact OD2-NH2 3.09Å; D248-R258 PolarHBondContact OD2-NH2 3.24Å; D248-D285 HydrophobicContact CB-CB 4.39Å; D248-D285 PolarHBondContact N-O 2.98Å; D248-D285 PolarHBondContact O-N 3.34Å; D248-R288 IonicContact OD1-CZ 3.93Å; D248-R288 IonicContact OD1-NE 3.37Å; D248-R288 IonicContact OD1-NH2 3.83Å; D248-R288 PolarHBondContact OD1-NH2 2.81Å
249	L	97.9	Very high	97.1	Very high	69 Å²	69	50.4 Å²	50.4	36%	0.361	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	119.6	172.7	178.1	63.3	0	0	0	110.6	G247 F275 Y282 V315 P316	G247-L249 PolarHBondContact O-N 3.43Å; L249-F275 HydrophobicContact CD1-CE1 3.99Å; L249-F275 HydrophobicContact CD1-CZ 3.72Å; L249-Y282 HydrophobicContact CD1-CD1 4.01Å; L249-Y282 HydrophobicContact CD1-CG 4.3Å; L249-Y282 HydrophobicContact CG-CD1 4.42Å; L249-V315 HydrophobicContact CD2-CG1 4.08Å; L249-P316 HydrophobicContact CD2-CG 4.11Å
250	I	97.6	Very high	97	Very high	22 Å²	22	51.4 Å²	51.4	11%	0.113	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	157.6	-175.3	59.3	-177.8	0	0	0	112.1	D248 A255 Y282 C283 D285	D248-I250 HydrophobicContact CB-CG2 4.43Å; D248-I250 PolarHBondContact O-N 3.12Å; I250-A255 HydrophobicContact CD1-CB 3.91Å; I250-A255 HydrophobicContact CG1-CB 4.15Å; I250-Y282 CarbonylContact O-C 3.59Å; I250-Y282 WeakPolarHBondContact O-CA 3.31Å; I250-C283 HydrophobicContact CG1-CB 4.01Å; I250-C283 PolarHBondContact N-O 2.96Å; I250-C283 PolarHBondContact O-N 2.97Å; I250-D285 HydrophobicContact CD1-CB 3.9Å
251	E	97.1	Very high	96.8	Very high	72 Å²	72	53.8 Å²	53.8	34%	0.336	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	155.2	172.8	-64.4	-163.1	164.9	0	0	111.8	T253 D254 A255 K280 Y282	E251-T253 PolarHBondContact O-N 3.48Å; E251-D254 PolarHBondContact O-N 3.02Å; E251-A255 PolarHBondContact O-N 3.19Å; E251-K280 IonicContact OE1-NZ 2.65Å; E251-K280 PolarHBondContact OE1-NZ 2.9Å; E251-Y282 HydrophobicContact CG-CD1 4.18Å; E251-Y282 HydrophobicContact CG-CE1 3.81Å
252	I	96.4	Very high	96.6	Very high	56 Å²	56	56 Å²	56	29%	0.287	28%	0.284	S	S	.	.	H	α-helix	trans	-50.8	-29.9	179.6	-172.5	174	0	0	0	114.4	K256 Y274 T281	I252-K256 HydrophobicContact CG1-CD 4.19Å; I252-K256 WeakPolarHBondContact O-CG 3.2Å; I252-K256 PolarHBondContact O-N 2.88Å; I252-K256 VanDerWaalsContact O-N 3.15Å; I252-Y274 HydrophobicContact CG1-CE1 4.33Å; I252-T281 HydrophobicContact CB-CG2 4.29Å; I252-T281 WeakPolarHBondContact CB-O 3.36Å; I252-T281 HydrophobicContact CD1-CG2 4.01Å; I252-T281 PolarHBondContact N-O 3.16Å; I252-T281 VanDerWaalsContact N-O 3.09Å
253	T	96.1	Very high	96.2	Very high	81 Å²	81	59.8 Å²	59.8	50%	0.497	32%	0.316	S	S	.	.	H	α-helix	trans	-68.7	-34.9	178.5	43.5	0	0	0	0	113.1	E251 K257	E251-T253 PolarHBondContact O-N 3.48Å; T253-K257 VanDerWaalsContact O-CE 3.29Å; T253-K257 WeakPolarHBondContact O-CE 3.46Å; T253-K257 WeakPolarHBondContact O-CG 3.44Å
254	D	96.6	Very high	96	Very high	72 Å²	72	66.8 Å²	66.8	39%	0.385	35%	0.349	S	S	.	.	H	α-helix	trans	-90.9	-32.9	177.2	-71	-37.6	0	0	0	111.8	E251 K256 K257 R258	E251-D254 PolarHBondContact O-N 3.02Å; D254-K256 PolarHBondContact O-N 2.82Å; D254-K257 WeakPolarHBondContact O-CB 3.47Å; D254-K257 PolarHBondContact O-N 3.19Å; D254-K257 VanDerWaalsContact O-N 3.09Å; D254-K257 WeakPolarHBondContact OD1-CD 3.37Å; D254-K257 WeakPolarHBondContact OD1-CE 3.47Å; D254-K257 IonicContact OD1-NZ 2.79Å; D254-K257 PolarHBondContact OD1-NZ 3.12Å; D254-R258 PolarHBondContact O-N 3.45Å
255	A	96.3	Very high	95.7	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-52.6	-53	169.7	0	0	0	0	0	111.1	I250 E251 K257 R258 E259 M272 Y274 C283	I250-A255 HydrophobicContact CD1-CB 3.91Å; I250-A255 HydrophobicContact CG1-CB 4.15Å; E251-A255 PolarHBondContact O-N 3.19Å; A255-K257 PolarHBondContact O-N 2.98Å; A255-K257 VanDerWaalsContact O-N 3.15Å; A255-R258 PolarHBondContact O-N 3.31Å; A255-E259 WeakPolarHBondContact O-CB 3.46Å; A255-E259 PolarHBondContact O-N 3.42Å; A255-M272 HydrophobicContact CB-CE 3.7Å; A255-M272 WeakPolarHBondContact O-CE 3.44Å; A255-Y274 HydrophobicContact CB-CE1 3.56Å; A255-C283 HydrophobicContact CB-CB 3.65Å
256	K	95.4	Very high	95.2	Very high	123 Å²	123	75 Å²	75	54%	0.535	40%	0.401	S	S	.	.	H	α-helix	trans	-62.4	-24.1	178.4	-72.6	178.2	176.6	-177.2	0	114.4	I252 D254 A260	I252-K256 HydrophobicContact CG1-CD 4.19Å; I252-K256 WeakPolarHBondContact O-CG 3.2Å; I252-K256 PolarHBondContact O-N 2.88Å; I252-K256 VanDerWaalsContact O-N 3.15Å; D254-K256 PolarHBondContact O-N 2.82Å; K256-A260 WeakPolarHBondContact O-CB 3.43Å; K256-A260 PolarHBondContact O-N 3.38Å
257	K	96.1	Very high	94.7	Very high	126 Å²	126	76.7 Å²	76.7	55%	0.548	42%	0.42	S	S	.	.	H	α-helix	trans	-73.5	-44.7	171.6	-63.4	168.1	-163.3	164.6	0	110.8	T253 D254 A255 A260 L261	T253-K257 VanDerWaalsContact O-CE 3.29Å; T253-K257 WeakPolarHBondContact O-CE 3.46Å; T253-K257 WeakPolarHBondContact O-CG 3.44Å; D254-K257 WeakPolarHBondContact O-CB 3.47Å; D254-K257 PolarHBondContact O-N 3.19Å; D254-K257 VanDerWaalsContact O-N 3.09Å; D254-K257 WeakPolarHBondContact OD1-CD 3.37Å; D254-K257 WeakPolarHBondContact OD1-CE 3.47Å; D254-K257 IonicContact OD1-NZ 2.79Å; D254-K257 PolarHBondContact OD1-NZ 3.12Å; A255-K257 PolarHBondContact O-N 2.98Å; A255-K257 VanDerWaalsContact O-N 3.15Å; K257-A260 PolarHBondContact O-N 3.41Å; K257-L261 WeakPolarHBondContact O-CG 3.39Å; K257-L261 PolarHBondContact O-N 3.11Å
258	R	96	Very high	94.3	Very high	68 Å²	68	77.8 Å²	77.8	26%	0.257	42%	0.423	S	S	.	.	H	α-helix	trans	-63.1	-45.6	176.1	-65.1	-167.5	-175.3	-159.5	1.7	111.3	D248 D254 A255 A260 L261 Y262 D285	D248-R258 IonicContact OD2-CZ 2.83Å; D248-R258 VanDerWaalsContact OD2-CZ 3.31Å; D248-R258 IonicContact OD2-NH1 2.72Å; D248-R258 PolarHBondContact OD2-NH1 3.24Å; D248-R258 IonicContact OD2-NH2 3.09Å; D248-R258 PolarHBondContact OD2-NH2 3.24Å; D254-R258 PolarHBondContact O-N 3.45Å; A255-R258 PolarHBondContact O-N 3.31Å; R258-A260 VanDerWaalsContact C-N 3.33Å; R258-A260 PolarHBondContact O-N 3.34Å; R258-L261 WeakPolarHBondContact O-CA 3.3Å; R258-L261 WeakPolarHBondContact O-CB 3.4Å; R258-L261 PolarHBondContact O-N 3.48Å; R258-Y262 HydrophobicContact CB-CD2 4.29Å; R258-Y262 HydrophobicContact CB-CE2 3.74Å; R258-Y262 WeakPolarHBondContact O-CD2 3.42Å; R258-Y262 VanDerWaalsContact O-CG 3.31Å; R258-Y262 PolarHBondContact O-N 2.93Å; R258-D285 WeakPolarHBondContact CD-OD2 3.23Å; R258-D285 IonicContact CZ-OD2 2.87Å; R258-D285 IonicContact NE-OD2 2.65Å; R258-D285 IonicContact NH1-OD2 2.78Å; R258-D285 PolarHBondContact NH1-OD2 3.34Å
259	E	93.9	Very high	93.7	Very high	94 Å²	94	77.4 Å²	77.4	44%	0.439	43%	0.428	S	S	.	.	H	α-helix	trans	-55.7	-44.7	175.8	-168	179.4	156.5	0	0	111.9	A255 L261 Y262 A263 M272 Y274	A255-E259 WeakPolarHBondContact O-CB 3.46Å; A255-E259 PolarHBondContact O-N 3.42Å; E259-L261 VanDerWaalsContact C-N 3.25Å; E259-L261 PolarHBondContact O-N 3.13Å; E259-Y262 PolarHBondContact O-N 2.94Å; E259-A263 VanDerWaalsContact O-CB 3.31Å; E259-A263 WeakPolarHBondContact O-CB 3.36Å; E259-A263 PolarHBondContact O-N 3.09Å; E259-M272 HydrophobicContact CB-CE 4.25Å; E259-M272 HydrophobicContact CB-SD 4.1Å; E259-Y274 PolarHBondContact OE2-OH 2.65Å
260	A	93.7	Very high	93.3	Very high	59 Å²	59	79.7 Å²	79.7	49%	0.488	45%	0.448	S	S	.	.	H	α-helix	trans	-71.1	-12.7	175.8	0	0	0	0	0	114.9	K256 K257 R258 Q264	K256-A260 WeakPolarHBondContact O-CB 3.43Å; K256-A260 PolarHBondContact O-N 3.38Å; K257-A260 PolarHBondContact O-N 3.41Å; R258-A260 VanDerWaalsContact C-N 3.33Å; R258-A260 PolarHBondContact O-N 3.34Å; A260-Q264 PolarHBondContact O-NE2 3.18Å
261	L	94.1	Very high	93.2	Very high	107 Å²	107	81.3 Å²	81.3	56%	0.56	45%	0.453	S	S	*	.	H	α-helix	trans	-89.1	-46.5	169.3	-67.6	168.1	0	0	0	110.6	K257 R258 E259 A263 Q264	K257-L261 WeakPolarHBondContact O-CG 3.39Å; K257-L261 PolarHBondContact O-N 3.11Å; R258-L261 WeakPolarHBondContact O-CA 3.3Å; R258-L261 WeakPolarHBondContact O-CB 3.4Å; R258-L261 PolarHBondContact O-N 3.48Å; E259-L261 VanDerWaalsContact C-N 3.25Å; E259-L261 PolarHBondContact O-N 3.13Å; L261-A263 VanDerWaalsContact C-N 3.3Å; L261-A263 PolarHBondContact O-N 2.9Å; L261-Q264 WeakPolarHBondContact O-CB 3.46Å; L261-Q264 PolarHBondContact O-N 3.34Å
262	Y	94.1	Very high	93.2	Very high	67 Å²	67	79.8 Å²	79.8	26%	0.263	45%	0.447	S	S	.	.	H	α-helix	trans	-62	-36	177.6	-59	-33	0	0	0	112.2	R258 E259 Q264 D265 T268 M272 D285 T287	R258-Y262 HydrophobicContact CB-CD2 4.29Å; R258-Y262 HydrophobicContact CB-CE2 3.74Å; R258-Y262 WeakPolarHBondContact O-CD2 3.42Å; R258-Y262 VanDerWaalsContact O-CG 3.31Å; R258-Y262 PolarHBondContact O-N 2.93Å; E259-Y262 PolarHBondContact O-N 2.94Å; Y262-Q264 PolarHBondContact O-N 3.13Å; Y262-D265 CarbonylContact O-C 3.54Å; Y262-D265 PolarHBondContact O-N 2.75Å; Y262-D265 VanDerWaalsContact O-O 3.11Å; Y262-T268 HydrophobicContact CD1-CG2 3.8Å; Y262-T268 HydrophobicContact CG-CG2 3.82Å; Y262-M272 HydrophobicContact CD2-SD 4.03Å; Y262-M272 HydrophobicContact CE2-SD 4.15Å; Y262-D285 PolarHBondContact OH-OD2 3.48Å; Y262-T287 HydrophobicContact CD1-CG2 4.29Å; Y262-T287 HydrophobicContact CD2-CG2 4.09Å; Y262-T287 HydrophobicContact CE1-CG2 4.04Å; Y262-T287 HydrophobicContact CE2-CG2 3.82Å; Y262-T287 WeakPolarHBondContact CE2-OG1 3.32Å; Y262-T287 HydrophobicContact CG-CG2 4.32Å
263	A	90.9	Very high	93.3	Very high	85 Å²	85	78.9 Å²	78.9	70%	0.702	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-8.4	174	0	0	0	0	0	115.1	E259 L261	E259-A263 VanDerWaalsContact O-CB 3.31Å; E259-A263 WeakPolarHBondContact O-CB 3.36Å; E259-A263 PolarHBondContact O-N 3.09Å; L261-A263 VanDerWaalsContact C-N 3.3Å; L261-A263 PolarHBondContact O-N 2.9Å
264	Q	93.3	Very high	93.4	Very high	148 Å²	148	78.8 Å²	78.8	69%	0.692	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-15.6	173.9	-57.7	173.4	40.9	0	0	112.6	A260 L261 Y262	A260-Q264 PolarHBondContact O-NE2 3.18Å; L261-Q264 WeakPolarHBondContact O-CB 3.46Å; L261-Q264 PolarHBondContact O-N 3.34Å; Y262-Q264 PolarHBondContact O-N 3.13Å
265	D	92.4	Very high	93.4	Very high	65 Å²	65	76.4 Å²	76.4	35%	0.348	42%	0.417	S	S	.	.			trans	-121.9	98.9	177.2	167.9	28.9	0	0	0	110.4	Y262 S267 T268	Y262-D265 CarbonylContact O-C 3.54Å; Y262-D265 PolarHBondContact O-N 2.75Å; Y262-D265 VanDerWaalsContact O-O 3.11Å; D265-S267 VanDerWaalsContact CG-OG 3.24Å; D265-S267 PolarHBondContact O-N 3.28Å; D265-S267 WeakPolarHBondContact OD1-CB 3.31Å; D265-S267 PolarHBondContact OD1-N 3.23Å; D265-S267 PolarHBondContact OD1-OG 2.78Å; D265-S267 PolarHBondContact OD2-OG 2.93Å; D265-T268 PolarHBondContact O-N 3.43Å; D265-T268 PolarHBondContact OD2-N 3.22Å; D265-T268 PolarHBondContact OD2-OG1 2.94Å
266	P	87.3	Confident	93.4	Very high	132 Å²	132	83.8 Å²	83.8	86%	0.857	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-5.7	177.4	-24.4	35.3	0	0	0	115.8
267	S	88.6	Confident	93.5	Very high	103 Å²	103	79.4 Å²	79.4	72%	0.72	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-16.3	171.9	78	0	0	0	0	113.5	D265 G269	D265-S267 VanDerWaalsContact CG-OG 3.24Å; D265-S267 PolarHBondContact O-N 3.28Å; D265-S267 WeakPolarHBondContact OD1-CB 3.31Å; D265-S267 PolarHBondContact OD1-N 3.23Å; D265-S267 PolarHBondContact OD1-OG 2.78Å; D265-S267 PolarHBondContact OD2-OG 2.93Å; S267-G269 PolarHBondContact O-N 3.26Å
268	T	88.3	Confident	93.4	Very high	45 Å²	45	80.2 Å²	80.2	28%	0.276	44%	0.442	S	S	.	.	S	Bend	trans	-79.8	115.5	174.4	-69.7	0	0	0	0	110.6	Y262 D265 T287	Y262-T268 HydrophobicContact CD1-CG2 3.8Å; Y262-T268 HydrophobicContact CG-CG2 3.82Å; D265-T268 PolarHBondContact O-N 3.43Å; D265-T268 PolarHBondContact OD2-N 3.22Å; D265-T268 PolarHBondContact OD2-OG1 2.94Å; T268-T287 HydrophobicContact CG2-CG2 3.4Å
269	G	85.4	Confident	93.4	Very high	31 Å²	31	83.2 Å²	83.2	32%	0.32	47%	0.473	S	S	.	.			trans	-76.7	159.5	-179.3	0	0	0	0	0	114.6	S267 Y271	S267-G269 PolarHBondContact O-N 3.26Å; G269-Y271 WeakPolarHBondContact O-CD2 3.49Å; G269-Y271 PolarHBondContact O-N 3.46Å
270	C	89.6	Confident	93.5	Very high	117 Å²	117	83.7 Å²	83.7	79%	0.791	47%	0.474	S	S	*	.			trans	-82	99.1	-178.9	-53.4	0	0	0	0	112
271	Y	96.4	Very high	93.6	Very high	56 Å²	56	83.1 Å²	83.1	22%	0.22	46%	0.464	C	S	.	.			trans	-121.5	35	178.9	-57.5	-85	0	0	0	112.8	R228 Y245 G269 A286 R295	R228-Y271 PolarHBondContact NH2-OH 2.6Å; Y245-Y271 PolarHBondContact OH-O 2.82Å; G269-Y271 WeakPolarHBondContact O-CD2 3.49Å; G269-Y271 PolarHBondContact O-N 3.46Å; Y271-A286 VanDerWaalsContact CB-C 3.46Å; Y271-A286 WeakPolarHBondContact CB-O 3.28Å; Y271-A286 WeakPolarHBondContact O-CA 3.35Å; Y271-A286 PolarHBondContact O-N 3.03Å; Y271-R295 HydrophobicContact CD1-CB 4.45Å; Y271-R295 WeakPolarHBondContact CD1-O 3.41Å
272	M	97	Very high	93.8	Very high	41 Å²	41	80 Å²	80	20%	0.202	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	118	-177.2	-70.7	-178.1	64.7	0	0	110.7	A255 E259 Y262 Y274 D285	A255-M272 HydrophobicContact CB-CE 3.7Å; A255-M272 WeakPolarHBondContact O-CE 3.44Å; E259-M272 HydrophobicContact CB-CE 4.25Å; E259-M272 HydrophobicContact CB-SD 4.1Å; Y262-M272 HydrophobicContact CD2-SD 4.03Å; Y262-M272 HydrophobicContact CE2-SD 4.15Å; M272-Y274 HydrophobicContact CE-CE2 4.5Å; M272-D285 HydrophobicContact CG-CB 4.31Å
273	Y	97.8	Very high	94	Very high	37 Å²	37	76.8 Å²	76.8	15%	0.145	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	107.2	179.9	-158.5	-56.1	0	0	0	111.4	Y245 C283 V284 T307 L318 Y334	Y245-Y273 HydrophobicContact CD1-CD2 4.47Å; Y245-Y273 HydrophobicContact CD2-CD2 4.48Å; Y245-Y273 HydrophobicContact CE1-CD2 4.44Å; Y245-Y273 HydrophobicContact CE2-CD2 4.43Å; Y245-Y273 HydrophobicContact CG-CD2 4.5Å; Y273-C283 CarbonylContact O-C 3.6Å; Y273-C283 VanDerWaalsContact O-CA 3.24Å; Y273-C283 WeakPolarHBondContact O-CA 3.18Å; Y273-V284 PolarHBondContact N-O 2.82Å; Y273-V284 PolarHBondContact O-N 3.45Å; Y273-T307 HydrophobicContact CE2-CG2 3.75Å; Y273-T307 WeakPolarHBondContact OH-CG2 3.4Å; Y273-T307 PolarHBondContact OH-OG1 2.86Å; Y273-L318 HydrophobicContact CD1-CD2 3.36Å; Y273-L318 HydrophobicContact CD2-CD2 3.53Å; Y273-L318 HydrophobicContact CE1-CD1 4.44Å; Y273-L318 HydrophobicContact CE1-CD2 3.79Å; Y273-L318 HydrophobicContact CE2-CD2 3.89Å; Y273-L318 HydrophobicContact CG-CD2 3.27Å; Y273-Y334 HydrophobicContact CD2-CE2 4.32Å; Y273-Y334 HydrophobicContact CE2-CD2 4.45Å; Y273-Y334 AromaticContact CE2-CE2 3.64Å; Y273-Y334 HydrophobicContact CE2-CE2 3.64Å
274	Y	97.1	Very high	94.3	Very high	78 Å²	78	73.1 Å²	73.1	31%	0.306	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	135.1	175.7	-72	-75.4	0	0	0	113	I252 A255 E259 M272 Y282 C283	I252-Y274 HydrophobicContact CG1-CE1 4.33Å; A255-Y274 HydrophobicContact CB-CE1 3.56Å; E259-Y274 PolarHBondContact OE2-OH 2.65Å; M272-Y274 HydrophobicContact CE-CE2 4.5Å; Y274-Y282 WeakPolarHBondContact CA-O 3.39Å; Y274-C283 HydrophobicContact CD1-CB 3.8Å; Y274-C283 HydrophobicContact CE1-CB 3.88Å
275	F	97	Very high	94.6	Very high	22 Å²	22	66.1 Å²	66.1	10%	0.096	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	163.6	176	68.7	-85.1	0	0	0	112.5	L249 T281 Y282 V284 L309 P316	L249-F275 HydrophobicContact CD1-CE1 3.99Å; L249-F275 HydrophobicContact CD1-CZ 3.72Å; F275-T281 WeakPolarHBondContact O-CA 3.35Å; F275-T281 WeakPolarHBondContact O-CG2 3.42Å; F275-Y282 HydrophobicContact CZ-CG 4.36Å; F275-Y282 PolarHBondContact N-O 3.22Å; F275-Y282 PolarHBondContact O-N 3.3Å; F275-Y282 VanDerWaalsContact O-O 3.11Å; F275-V284 HydrophobicContact CD1-CG2 4.49Å; F275-V284 HydrophobicContact CE1-CG2 3.79Å; F275-L309 HydrophobicContact CD2-CD1 3.73Å; F275-L309 HydrophobicContact CD2-CG 4.34Å; F275-L309 HydrophobicContact CE2-CD1 3.96Å; F275-L309 HydrophobicContact CE2-CG 4.35Å; F275-P316 HydrophobicContact CE2-CB 3.77Å; F275-P316 HydrophobicContact CE2-CG 3.98Å; F275-P316 HydrophobicContact CZ-CB 4.1Å; F275-P316 HydrophobicContact CZ-CG 4.03Å
276	Q	96.8	Very high	94.8	Very high	155 Å²	155	63.2 Å²	63.2	72%	0.724	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.9	136.6	175.3	-64.7	-177.6	49.2	0	0	110.4	K280 L309	Q276-K280 WeakPolarHBondContact CA-O 3.27Å; Q276-L309 VanDerWaalsContact O-CD1 3.25Å; Q276-L309 WeakPolarHBondContact O-CD1 3.49Å
277	Y	96.8	Very high	95.2	Very high	31 Å²	31	57.8 Å²	57.8	12%	0.122	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	124.3	174.5	177	-111.4	0	0	0	109.3	S279 K280 Y282 L309 D311 G314 P316	Y277-S279 PolarHBondContact O-N 3Å; Y277-K280 PolarHBondContact N-O 3.36Å; Y277-K280 PolarHBondContact O-N 3.25Å; Y277-K280 VanDerWaalsContact O-O 3.1Å; Y277-Y282 AromaticContact CD1-CE2 3.99Å; Y277-Y282 HydrophobicContact CD1-CE2 3.99Å; Y277-L309 HydrophobicContact CD2-CD1 3.82Å; Y277-L309 HydrophobicContact CD2-CD2 3.81Å; Y277-L309 HydrophobicContact CD2-CG 4.46Å; Y277-L309 HydrophobicContact CE2-CD2 4.15Å; Y277-L309 HydrophobicContact CG-CD1 4.37Å; Y277-D311 HydrophobicContact CE2-CB 4.45Å; Y277-D311 WeakPolarHBondContact CE2-OD1 3.44Å; Y277-D311 VanDerWaalsContact CZ-OD1 3.29Å; Y277-D311 PolarHBondContact OH-OD1 3Å; Y277-G314 WeakPolarHBondContact OH-CA 3.43Å; Y277-G314 PolarHBondContact OH-O 2.88Å; Y277-P316 HydrophobicContact CD1-CB 4.09Å; Y277-P316 HydrophobicContact CD1-CG 3.77Å; Y277-P316 HydrophobicContact CD2-CB 3.69Å; Y277-P316 HydrophobicContact CD2-CG 4.3Å; Y277-P316 HydrophobicContact CE1-CB 4.41Å; Y277-P316 HydrophobicContact CE1-CG 4.17Å; Y277-P316 HydrophobicContact CE2-CB 4Å; Y277-P316 HydrophobicContact CG-CB 3.72Å; Y277-P316 HydrophobicContact CG-CG 3.84Å
278	L	94.8	Very high	95.6	Very high	143 Å²	143	60.3 Å²	60.3	75%	0.749	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	-124.7	-170.4	-52.7	176.4	0	0	0	109.8
279	S	95.6	Very high	95.9	Very high	131 Å²	131	63.1 Å²	63.1	92%	0.916	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	21.3	178.2	-47.5	0	0	0	0	114	Y277	Y277-S279 PolarHBondContact O-N 3Å
280	K	95.8	Very high	96.5	Very high	105 Å²	105	63.9 Å²	63.9	46%	0.457	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	153.8	-175.7	-79.3	-173.8	172.3	-169.1	0	112.3	E251 Q276 Y277 Y282	E251-K280 IonicContact OE1-NZ 2.65Å; E251-K280 PolarHBondContact OE1-NZ 2.9Å; Q276-K280 WeakPolarHBondContact CA-O 3.27Å; Y277-K280 PolarHBondContact N-O 3.36Å; Y277-K280 PolarHBondContact O-N 3.25Å; Y277-K280 VanDerWaalsContact O-O 3.1Å; K280-Y282 HydrophobicContact CB-CD2 4.09Å; K280-Y282 HydrophobicContact CB-CE2 3.5Å; K280-Y282 VanDerWaalsContact CB-CE2 3.5Å; K280-Y282 HydrophobicContact CD-CE2 4.02Å; K280-Y282 VanDerWaalsContact CD-OH 3.31Å; K280-Y282 WeakPolarHBondContact CD-OH 3.35Å; K280-Y282 HydrophobicContact CG-CE2 4.43Å
281	T	97.2	Very high	96.8	Very high	47 Å²	47	66.1 Å²	66.1	29%	0.288	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	124.8	170.6	-48.2	0	0	0	0	110.1	I252 F275	I252-T281 HydrophobicContact CB-CG2 4.29Å; I252-T281 WeakPolarHBondContact CB-O 3.36Å; I252-T281 HydrophobicContact CD1-CG2 4.01Å; I252-T281 PolarHBondContact N-O 3.16Å; I252-T281 VanDerWaalsContact N-O 3.09Å; F275-T281 WeakPolarHBondContact O-CA 3.35Å; F275-T281 WeakPolarHBondContact O-CG2 3.42Å
282	Y	97.6	Very high	96.9	Very high	41 Å²	41	65.3 Å²	65.3	16%	0.161	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	166.6	178.5	-72	-89.2	0	0	0	110.3	L249 I250 E251 Y274 F275 Y277 K280	L249-Y282 HydrophobicContact CD1-CD1 4.01Å; L249-Y282 HydrophobicContact CD1-CG 4.3Å; L249-Y282 HydrophobicContact CG-CD1 4.42Å; I250-Y282 CarbonylContact O-C 3.59Å; I250-Y282 WeakPolarHBondContact O-CA 3.31Å; E251-Y282 HydrophobicContact CG-CD1 4.18Å; E251-Y282 HydrophobicContact CG-CE1 3.81Å; Y274-Y282 WeakPolarHBondContact CA-O 3.39Å; F275-Y282 HydrophobicContact CZ-CG 4.36Å; F275-Y282 PolarHBondContact N-O 3.22Å; F275-Y282 PolarHBondContact O-N 3.3Å; F275-Y282 VanDerWaalsContact O-O 3.11Å; Y277-Y282 AromaticContact CD1-CE2 3.99Å; Y277-Y282 HydrophobicContact CD1-CE2 3.99Å; K280-Y282 HydrophobicContact CB-CD2 4.09Å; K280-Y282 HydrophobicContact CB-CE2 3.5Å; K280-Y282 VanDerWaalsContact CB-CE2 3.5Å; K280-Y282 HydrophobicContact CD-CE2 4.02Å; K280-Y282 VanDerWaalsContact CD-OH 3.31Å; K280-Y282 WeakPolarHBondContact CD-OH 3.35Å; K280-Y282 HydrophobicContact CG-CE2 4.43Å
283	C	97.9	Very high	97	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	139.3	169.6	-172.5	0	0	0	0	108.8	I250 A255 Y273 Y274	I250-C283 HydrophobicContact CG1-CB 4.01Å; I250-C283 PolarHBondContact N-O 2.96Å; I250-C283 PolarHBondContact O-N 2.97Å; A255-C283 HydrophobicContact CB-CB 3.65Å; Y273-C283 CarbonylContact O-C 3.6Å; Y273-C283 VanDerWaalsContact O-CA 3.24Å; Y273-C283 WeakPolarHBondContact O-CA 3.18Å; Y274-C283 HydrophobicContact CD1-CB 3.8Å; Y274-C283 HydrophobicContact CE1-CB 3.88Å
284	V	98.4	Very high	97	Very high	7 Å²	7	62.4 Å²	62.4	4%	0.042	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	118.1	156.4	-171.8	0	0	0	0	107.5	Y245 G247 Y273 F275 L318	Y245-V284 HydrophobicContact CD1-CB 4.04Å; Y245-V284 HydrophobicContact CD1-CG1 4.05Å; Y245-V284 HydrophobicContact CE1-CB 4.32Å; Y245-V284 HydrophobicContact CE1-CG1 4.37Å; Y245-V284 WeakPolarHBondContact O-CG1 3.45Å; G247-V284 VanDerWaalsContact CA-CG1 3.46Å; G247-V284 VanDerWaalsContact N-CG1 3.26Å; Y273-V284 PolarHBondContact N-O 2.82Å; Y273-V284 PolarHBondContact O-N 3.45Å; F275-V284 HydrophobicContact CD1-CG2 4.49Å; F275-V284 HydrophobicContact CE1-CG2 3.79Å; V284-L318 HydrophobicContact CG2-CB 4.16Å
285	D	98.1	Very high	97	Very high	2 Å²	2	59 Å²	59	1%	0.011	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	103.9	173.8	176.2	15.2	0	0	0	110.5	G247 D248 I250 R258 Y262 M272 T287	G247-D285 CarbonylContact C-O 3.56Å; G247-D285 WeakPolarHBondContact CA-O 3.37Å; D248-D285 HydrophobicContact CB-CB 4.39Å; D248-D285 PolarHBondContact N-O 2.98Å; D248-D285 PolarHBondContact O-N 3.34Å; I250-D285 HydrophobicContact CD1-CB 3.9Å; R258-D285 WeakPolarHBondContact CD-OD2 3.23Å; R258-D285 IonicContact CZ-OD2 2.87Å; R258-D285 IonicContact NE-OD2 2.65Å; R258-D285 IonicContact NH1-OD2 2.78Å; R258-D285 PolarHBondContact NH1-OD2 3.34Å; Y262-D285 PolarHBondContact OH-OD2 3.48Å; M272-D285 HydrophobicContact CG-CB 4.31Å; D285-T287 WeakPolarHBondContact OD1-CB 2.78Å; D285-T287 PolarHBondContact OD1-N 3.04Å; D285-T287 PolarHBondContact OD1-OG1 2.73Å
286	A	97.8	Very high	97.1	Very high	3 Å²	3	58.4 Å²	58.4	3%	0.025	29%	0.294	C	S	.	.			trans	-100	22.6	175.9	0	0	0	0	0	112.6	Y245 Y271 R288 R295	Y245-A286 HydrophobicContact CE1-CB 3.98Å; Y271-A286 VanDerWaalsContact CB-C 3.46Å; Y271-A286 WeakPolarHBondContact CB-O 3.28Å; Y271-A286 WeakPolarHBondContact O-CA 3.35Å; Y271-A286 PolarHBondContact O-N 3.03Å; A286-R288 PolarHBondContact O-N 2.59Å; A286-R295 HydrophobicContact CB-CB 3.72Å; A286-R295 VanDerWaalsContact O-CZ 3.29Å; A286-R295 PolarHBondContact O-NE 3.49Å; A286-R295 PolarHBondContact O-NH2 3.09Å
287	T	95.9	Very high	97.2	Very high	19 Å²	19	51 Å²	51	12%	0.117	26%	0.259	C	S	.	.			trans	-63.9	-30.9	-178.3	-53.8	0	0	0	0	112.4	Y262 T268 D285 E289 R295	Y262-T287 HydrophobicContact CD1-CG2 4.29Å; Y262-T287 HydrophobicContact CD2-CG2 4.09Å; Y262-T287 HydrophobicContact CE1-CG2 4.04Å; Y262-T287 HydrophobicContact CE2-CG2 3.82Å; Y262-T287 WeakPolarHBondContact CE2-OG1 3.32Å; Y262-T287 HydrophobicContact CG-CG2 4.32Å; T268-T287 HydrophobicContact CG2-CG2 3.4Å; D285-T287 WeakPolarHBondContact OD1-CB 2.78Å; D285-T287 PolarHBondContact OD1-N 3.04Å; D285-T287 PolarHBondContact OD1-OG1 2.73Å; T287-E289 PolarHBondContact O-N 3.39Å; T287-R295 PolarHBondContact O-NH2 3.46Å
288	R	95.8	Very high	97.2	Very high	156 Å²	156	50.6 Å²	50.6	59%	0.589	26%	0.259	S	S	*	.	S	Bend	trans	-64.2	119.8	171.3	177.5	164.1	54	131.1	-6.3	111.2	D248 A286 T290	D248-R288 IonicContact OD1-CZ 3.93Å; D248-R288 IonicContact OD1-NE 3.37Å; D248-R288 IonicContact OD1-NH2 3.83Å; D248-R288 PolarHBondContact OD1-NH2 2.81Å; A286-R288 PolarHBondContact O-N 2.59Å; R288-T290 HydrophobicContact CG-CG2 4.13Å; R288-T290 PolarHBondContact O-N 2.86Å
289	E	95.9	Very high	97.4	Very high	103 Å²	103	44.5 Å²	44.5	48%	0.481	23%	0.226	S	C	.	.			trans	-58.7	126.6	171.2	-71.6	-67.3	128.9	0	0	110.7	R228 T287 R295	R228-E289 IonicContact CZ-OE1 3.8Å; R228-E289 IonicContact CZ-OE2 3.74Å; R228-E289 IonicContact NH1-OE1 2.74Å; R228-E289 IonicContact NH1-OE2 2.6Å; R228-E289 PolarHBondContact NH1-OE2 2.85Å; R228-E289 VanDerWaalsContact NH2-CD 3.34Å; R228-E289 IonicContact NH2-OE1 2.76Å; R228-E289 PolarHBondContact NH2-OE1 3Å; R228-E289 IonicContact NH2-OE2 3.97Å; R228-E289 PolarHBondContact NH2-OE2 2.86Å; R228-E289 VanDerWaalsContact NH2-OE2 3.09Å; T287-E289 PolarHBondContact O-N 3.39Å; E289-R295 IonicContact OE1-CZ 2.72Å; E289-R295 VanDerWaalsContact OE1-CZ 3.23Å; E289-R295 IonicContact OE1-NH1 3.53Å; E289-R295 PolarHBondContact OE1-NH1 2.94Å; E289-R295 IonicContact OE1-NH2 3.79Å; E289-R295 PolarHBondContact OE1-NH2 2.92Å; E289-R295 IonicContact OE2-NH1 2.7Å; E289-R295 PolarHBondContact OE2-NH1 2.94Å; E289-R295 VanDerWaalsContact OE2-NH1 3.15Å
290	T	96.8	Very high	97.5	Very high	48 Å²	48	39 Å²	39	29%	0.294	19%	0.188	S	C	.	.			trans	-148.4	169.4	179.8	58.8	0	0	0	0	109.4	R288 R292	R288-T290 HydrophobicContact CG-CG2 4.13Å; R288-T290 PolarHBondContact O-N 2.86Å; T290-R292 PolarHBondContact O-N 3Å
291	N	97.2	Very high	97.5	Very high	164 Å²	164	38.3 Å²	38.3	88%	0.877	19%	0.185	S	C	*	.	S	Bend	trans	-75.1	0.8	177.8	-61.7	-10.9	0	0	0	114
292	R	97.9	Very high	97.5	Very high	38 Å²	38	41 Å²	41	14%	0.143	21%	0.205	C	C	.	.			trans	-73	129.3	-179.9	-55.6	-68.1	-84.6	158.7	-14.9	109.9	G213 E215 E244 H246 T290 R295	G213-R292 PolarHBondContact O-NH1 2.77Å; E215-R292 VanDerWaalsContact CD-NH1 3.32Å; E215-R292 WeakPolarHBondContact OE1-CA 3.48Å; E215-R292 WeakPolarHBondContact OE1-CD 3.44Å; E215-R292 IonicContact OE1-CZ 2.83Å; E215-R292 IonicContact OE1-NE 3.66Å; E215-R292 PolarHBondContact OE1-NE 2.82Å; E215-R292 IonicContact OE1-NH1 2.7Å; E215-R292 PolarHBondContact OE1-NH1 2.73Å; E244-R292 IonicContact OE2-CZ 3.39Å; E244-R292 IonicContact OE2-NH2 3.16Å; E244-R292 PolarHBondContact OE2-NH2 2.68Å; H246-R292 HydrophobicContact CB-CB 4.28Å; H246-R292 HydrophobicContact CB-CG 3.96Å; H246-R292 PolarHBondContact CD2-NE 2.86Å; T290-R292 PolarHBondContact O-N 3Å; R292-R295 WeakPolarHBondContact O-CG 3.4Å
293	L	98.2	Very high	97.5	Very high	18 Å²	18	39.8 Å²	39.8	9%	0.094	21%	0.205	C	C	.	.	S	Bend	trans	-79.9	-27.2	-175.5	-65.2	177.3	0	0	0	113.3	E215 M218 I220 V230 R295 L296	E215-L293 HydrophobicContact CB-CD1 4.28Å; E215-L293 PolarHBondContact OE1-N 3.44Å; E215-L293 VanDerWaalsContact OE2-CB 3.27Å; E215-L293 WeakPolarHBondContact OE2-CB 3.01Å; E215-L293 WeakPolarHBondContact OE2-CG 3.36Å; E215-L293 PolarHBondContact OE2-N 2.76Å; M218-L293 HydrophobicContact CB-CD1 3.58Å; M218-L293 HydrophobicContact CE-CD1 4.41Å; M218-L293 HydrophobicContact SD-CD1 4.41Å; I220-L293 HydrophobicContact CD1-CD2 3.87Å; I220-L293 HydrophobicContact CG1-CD2 3.35Å; V230-L293 HydrophobicContact CG2-CB 4.28Å; L293-R295 PolarHBondContact O-N 2.83Å; L293-R295 VanDerWaalsContact O-N 3.13Å; L293-L296 HydrophobicContact CD2-CD1 4.5Å; L293-L296 WeakPolarHBondContact O-CB 3.26Å; L293-L296 PolarHBondContact O-N 2.72Å
294	G	97.9	Very high	97.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-56.1	-33.9	-174.8	0	0	0	0	0	115	Y245 L296	Y245-G294 WeakPolarHBondContact CD2-O 3.48Å; G294-L296 PolarHBondContact O-N 2.74Å
295	R	97.9	Very high	97.5	Very high	6 Å²	6	39.9 Å²	39.9	2%	0.023	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-73.7	-7.6	176.4	70.2	-174.8	-67.9	-83	1.9	115	Y271 A286 T287 E289 R292 L293	Y271-R295 HydrophobicContact CD1-CB 4.45Å; Y271-R295 WeakPolarHBondContact CD1-O 3.41Å; A286-R295 HydrophobicContact CB-CB 3.72Å; A286-R295 VanDerWaalsContact O-CZ 3.29Å; A286-R295 PolarHBondContact O-NE 3.49Å; A286-R295 PolarHBondContact O-NH2 3.09Å; T287-R295 PolarHBondContact O-NH2 3.46Å; E289-R295 IonicContact OE1-CZ 2.72Å; E289-R295 VanDerWaalsContact OE1-CZ 3.23Å; E289-R295 IonicContact OE1-NH1 3.53Å; E289-R295 PolarHBondContact OE1-NH1 2.94Å; E289-R295 IonicContact OE1-NH2 3.79Å; E289-R295 PolarHBondContact OE1-NH2 2.92Å; E289-R295 IonicContact OE2-NH1 2.7Å; E289-R295 PolarHBondContact OE2-NH1 2.94Å; E289-R295 VanDerWaalsContact OE2-NH1 3.15Å; R292-R295 WeakPolarHBondContact O-CG 3.4Å; L293-R295 PolarHBondContact O-N 2.83Å; L293-R295 VanDerWaalsContact O-N 3.13Å
296	L	98.2	Very high	97.5	Very high	10 Å²	10	44 Å²	44	5%	0.052	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-107.6	3.2	-178.6	-56.4	-179.9	0	0	0	112.5	I220 G229 V230 L293 G294	I220-L296 HydrophobicContact CD1-CD1 3.58Å; I220-L296 HydrophobicContact CG1-CD1 3.92Å; G229-L296 WeakPolarHBondContact CA-O 3.32Å; V230-L296 HydrophobicContact CG2-CB 3.79Å; L293-L296 HydrophobicContact CD2-CD1 4.5Å; L293-L296 WeakPolarHBondContact O-CB 3.26Å; L293-L296 PolarHBondContact O-N 2.72Å; G294-L296 PolarHBondContact O-N 2.74Å
297	I	98.4	Very high	97.5	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-82.5	125.3	179.9	-61.8	-174.7	0	0	0	108.7	V230 V243 L320 L332 Y334 Y336	V230-I297 HydrophobicContact CB-CG1 3.95Å; V230-I297 HydrophobicContact CG2-CG1 3.7Å; V243-I297 HydrophobicContact CG1-CD1 3.48Å; V243-I297 VanDerWaalsContact CG1-CD1 3.48Å; I297-L320 HydrophobicContact CB-CD1 4.45Å; I297-L320 HydrophobicContact CD1-CD1 3.71Å; I297-L320 HydrophobicContact CG2-CD1 4.49Å; I297-L332 HydrophobicContact CD1-CB 4.24Å; I297-L332 HydrophobicContact CD1-CD1 4.11Å; I297-L332 HydrophobicContact CG1-CB 4.4Å; I297-L332 HydrophobicContact CG2-CB 3.87Å; I297-L332 VanDerWaalsContact CG2-O 3.24Å; I297-L332 WeakPolarHBondContact CG2-O 3.11Å; I297-Y334 HydrophobicContact CB-CD1 4.16Å; I297-Y334 HydrophobicContact CB-CE1 4.09Å; I297-Y334 HydrophobicContact CG2-CD1 3.64Å; I297-Y334 HydrophobicContact CG2-CE1 4.08Å; I297-Y334 WeakPolarHBondContact O-CE1 3.44Å; I297-Y336 PolarHBondContact O-OH 2.93Å; I297-Y336 VanDerWaalsContact O-OH 3.09Å
298	N	98.3	Very high	97.5	Very high	21 Å²	21	48.7 Å²	48.7	11%	0.112	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	169	-167.2	-79.4	-42	0	0	0	114	K226 R228 G229 E331 L333 Y334	K226-N298 HydrophobicContact CD-CB 3.94Å; R228-N298 PolarHBondContact O-ND2 2.71Å; R228-N298 PolarHBondContact O-OD1 3.11Å; G229-N298 WeakPolarHBondContact CA-ND2 3.4Å; N298-E331 WeakPolarHBondContact CB-OE1 3.19Å; N298-E331 PolarHBondContact ND2-OE1 3.07Å; N298-L333 HydrophobicContact CB-CD2 3.52Å; N298-L333 WeakPolarHBondContact O-CA 3.46Å; N298-L333 WeakPolarHBondContact O-CD2 3.41Å; N298-Y334 PolarHBondContact O-N 3.41Å; N298-Y334 VanDerWaalsContact O-N 3.1Å
299	H	98.1	Very high	97.6	Very high	15 Å²	15	44.6 Å²	44.6	7%	0.069	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	135.6	178.7	-174.6	76.5	0	0	0	113.9	Y334 D335 Y336 W349 H352	H299-Y334 WeakPolarHBondContact CA-O 3.37Å; H299-D335 IonicContact CE1-OD1 2.65Å; H299-D335 PolarHBondContact CE1-OD1 3.32Å; H299-Y336 HydrophobicContact CB-CD1 3.79Å; H299-Y336 HydrophobicContact CB-CD2 4.16Å; H299-Y336 HydrophobicContact CB-CE1 3.76Å; H299-Y336 HydrophobicContact CB-CE2 4.13Å; H299-Y336 HydrophobicContact CB-CG 4.01Å; H299-Y336 PolarHBondContact CE1-N 3.28Å; H299-Y336 VanDerWaalsContact ND1-CB 3.31Å; H299-Y336 WeakPolarHBondContact ND1-CB 3.25Å; H299-Y336 AromaticContact ND1-CD1 3.51Å; H299-Y336 AromaticContact ND1-CG 3.33Å; H299-Y336 VanDerWaalsContact ND1-CG 3.33Å; H299-Y336 PolarHBondContact ND1-N 2.81Å; H299-Y336 VanDerWaalsContact ND1-N 3.12Å; H299-W349 HydrophobicContact CB-CE3 3.67Å; H299-W349 HydrophobicContact CB-CZ3 3.47Å; H299-W349 VanDerWaalsContact CB-CZ3 3.47Å; H299-W349 AromaticContact CD2-CE3 3.95Å; H299-W349 AromaticContact CG-CE3 3.87Å; H299-W349 AromaticContact CG-CZ3 3.78Å; H299-H352 PolarHBondContact CD2-O 2.65Å; H299-H352 VanDerWaalsContact CD2-O 3.27Å; H299-H352 PolarHBondContact NE2-O 2.87Å; H299-H352 VanDerWaalsContact NE2-O 3.13Å
300	S	97.9	Very high	97.7	Very high	16 Å²	16	40.4 Å²	40.4	11%	0.112	22%	0.215	C	C	.	.			trans	-161.7	141.9	144	172.8	0	0	0	0	111.3	C302 G303 Y334 D335 H352	S300-C302 PolarHBondContact O-N 3.45Å; S300-C302 PolarHBondContact OG-N 2.72Å; S300-C302 PolarHBondContact OG-SG 3.24Å; S300-C302 VanDerWaalsContact OG-SG 3.41Å; S300-G303 PolarHBondContact O-N 3.43Å; S300-G303 VanDerWaalsContact O-N 3.14Å; S300-Y334 PolarHBondContact N-O 2.85Å; S300-Y334 CarbonylContact O-C 3.6Å; S300-Y334 VanDerWaalsContact O-C 3.27Å; S300-D335 PolarHBondContact O-N 3.27Å; S300-H352 WeakPolarHBondContact CA-O 3.01Å; S300-H352 PolarHBondContact OG-OXT 2.79Å
301	K	96.3	Very high	97.7	Very high	90 Å²	90	40.6 Å²	40.6	39%	0.391	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-29.9	171.7	-67.5	179.5	-178.8	175.3	0	114.1	L350 K351 H352	K301-L350 WeakPolarHBondContact CE-O 3.29Å; K301-K351 WeakPolarHBondContact CD-O 3.42Å; K301-K351 VanDerWaalsContact CE-C 3.48Å; K301-K351 VanDerWaalsContact CE-O 3.3Å; K301-K351 WeakPolarHBondContact CE-O 3.49Å; K301-K351 VanDerWaalsContact NZ-C 3.28Å; K301-K351 PolarHBondContact NZ-O 2.98Å; K301-H352 WeakPolarHBondContact CG-O 3.34Å; K301-H352 PolarHBondContact N-O 2.65Å; K301-H352 PolarHBondContact N-OXT 2.93Å
302	C	96.5	Very high	97.7	Very high	105 Å²	105	33.9 Å²	33.9	71%	0.709	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.2	28.3	176.1	57.9	0	0	0	0	112.6	S300	S300-C302 PolarHBondContact O-N 3.45Å; S300-C302 PolarHBondContact OG-N 2.72Å; S300-C302 PolarHBondContact OG-SG 3.24Å; S300-C302 VanDerWaalsContact OG-SG 3.41Å
303	G	97.1	Very high	97.6	Very high	15 Å²	15	40 Å²	40	16%	0.155	21%	0.214	C	C	.	.			trans	-60.5	168.1	176.1	0	0	0	0	0	115.2	S300 S323 L333	S300-G303 PolarHBondContact O-N 3.43Å; S300-G303 VanDerWaalsContact O-N 3.14Å; G303-S323 PolarHBondContact O-OG 3.37Å; G303-L333 CarbonylContact C-O 3.27Å; G303-L333 WeakPolarHBondContact CA-O 3.44Å
304	N	98.5	Very high	97.4	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.011	23%	0.231	C	C	.	.	S	Bend	trans	-96	-8.5	-176.2	54.1	13.4	0	0	0	114	S323 R324 I326 E330 E331 L332 L333	N304-S323 VanDerWaalsContact C-OG 3.29Å; N304-S323 PolarHBondContact O-N 3.39Å; N304-S323 PolarHBondContact O-OG 3.31Å; N304-S323 VanDerWaalsContact O-OG 3.06Å; N304-R324 HydrophobicContact CB-CG 4.18Å; N304-I326 HydrophobicContact CB-CD1 3.93Å; N304-I326 HydrophobicContact CB-CG1 4.05Å; N304-E330 PolarHBondContact ND2-OE2 2.59Å; N304-E331 PolarHBondContact ND2-O 3.09Å; N304-L332 WeakPolarHBondContact OD1-CA 3.45Å; N304-L333 PolarHBondContact N-O 2.83Å; N304-L333 PolarHBondContact OD1-N 2.74Å; N304-L333 PolarHBondContact OD1-O 2.96Å
305	C	98.6	Very high	97.4	Very high	6 Å²	6	44.5 Å²	44.5	4%	0.041	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	147.1	170.8	-66.4	0	0	0	0	110.9	L320 I321 L333 Y334	C305-L320 HydrophobicContact CB-CB 4.44Å; C305-L320 HydrophobicContact CB-CD2 3.99Å; C305-I321 CarbonylContact C-O 3.54Å; C305-I321 WeakPolarHBondContact CA-O 3.49Å; C305-L333 WeakPolarHBondContact CB-O 3.48Å; C305-L333 PolarHBondContact N-O 3.03Å; C305-Y334 WeakPolarHBondContact O-CB 3.41Å
306	Q	97.9	Very high	97.4	Very high	88 Å²	88	44.6 Å²	44.6	41%	0.411	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	145.7	163.6	64.7	157.7	124.3	0	0	110.1	K308 L320 I321	Q306-K308 VanDerWaalsContact NE2-CE 3.3Å; Q306-L320 WeakPolarHBondContact O-CA 3.41Å; Q306-I321 PolarHBondContact N-O 3.39Å; Q306-I321 PolarHBondContact O-N 2.77Å
307	T	97.8	Very high	97.4	Very high	37 Å²	37	46 Å²	46	23%	0.227	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	146.6	167.4	50.6	0	0	0	0	111.3	Y273 L318 I319 L320 Y334	Y273-T307 HydrophobicContact CE2-CG2 3.75Å; Y273-T307 WeakPolarHBondContact OH-CG2 3.4Å; Y273-T307 PolarHBondContact OH-OG1 2.86Å; T307-L318 HydrophobicContact CG2-CD1 4.4Å; T307-I319 CarbonylContact C-O 3.54Å; T307-I319 VanDerWaalsContact CA-O 3.3Å; T307-I319 WeakPolarHBondContact CA-O 3.42Å; T307-L320 HydrophobicContact CG2-CD2 3.58Å; T307-L320 HydrophobicContact CG2-CG 4.36Å; T307-Y334 HydrophobicContact CG2-CD2 4.08Å; T307-Y334 HydrophobicContact CG2-CE2 4.4Å
308	K	97.1	Very high	97.4	Very high	85 Å²	85	46.3 Å²	46.3	37%	0.37	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	151.3	162.5	-60.2	-172.1	-161.8	163.7	0	109.6	Q306 I319 I321	Q306-K308 VanDerWaalsContact NE2-CE 3.3Å; K308-I319 HydrophobicContact CB-CG1 4.31Å; K308-I319 PolarHBondContact N-O 3.34Å; K308-I319 WeakPolarHBondContact O-CG1 3.48Å; K308-I319 PolarHBondContact O-N 2.99Å; K308-I321 HydrophobicContact CB-CD1 4.4Å; K308-I321 HydrophobicContact CD-CD1 3.7Å; K308-I321 HydrophobicContact CG-CD1 4.24Å
309	L	97.8	Very high	97.4	Very high	70 Å²	70	45.4 Å²	45.4	37%	0.366	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	127.8	167.3	-162.8	169.7	0	0	0	108.1	F275 Q276 Y277 P316	F275-L309 HydrophobicContact CD2-CD1 3.73Å; F275-L309 HydrophobicContact CD2-CG 4.34Å; F275-L309 HydrophobicContact CE2-CD1 3.96Å; F275-L309 HydrophobicContact CE2-CG 4.35Å; Q276-L309 VanDerWaalsContact O-CD1 3.25Å; Q276-L309 WeakPolarHBondContact O-CD1 3.49Å; Y277-L309 HydrophobicContact CD2-CD1 3.82Å; Y277-L309 HydrophobicContact CD2-CD2 3.81Å; Y277-L309 HydrophobicContact CD2-CG 4.46Å; Y277-L309 HydrophobicContact CE2-CD2 4.15Å; Y277-L309 HydrophobicContact CG-CD1 4.37Å; L309-P316 HydrophobicContact CD1-CB 4.49Å; L309-P316 HydrophobicContact CD2-CB 3.81Å; L309-P316 HydrophobicContact CG-CB 4.27Å
310	H	97.8	Very high	97.4	Very high	14 Å²	14	44.7 Å²	44.7	7%	0.065	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	135.6	173.9	-173.7	83.8	0	0	0	109.5	R203 D207 I210 H317 I319	R203-H310 PolarHBondContact NH1-CE1 2.77Å; R203-H310 VanDerWaalsContact NH1-CE1 3.34Å; D207-H310 IonicContact OD1-CD2 2.67Å; D207-H310 IonicContact OD1-CE1 3.02Å; D207-H310 PolarHBondContact OD1-CE1 2.93Å; D207-H310 IonicContact OD1-NE2 2.77Å; D207-H310 PolarHBondContact OD1-NE2 3.41Å; I210-H310 VanDerWaalsContact CD1-CD2 3.48Å; I210-H310 WeakPolarHBondContact CD1-CD2 3.49Å; H310-H317 PolarHBondContact N-O 2.58Å; H310-H317 PolarHBondContact O-N 2.91Å; H310-I319 HydrophobicContact CB-CD1 3.69Å; H310-I319 HydrophobicContact CB-CG1 3.98Å; H310-I319 HydrophobicContact CB-CG2 4.23Å
311	D	97.1	Very high	97.4	Very high	53 Å²	53	44.3 Å²	44.3	28%	0.283	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	127.8	-171.7	179.6	66.3	0	0	0	109.9	R203 Y277 G314	R203-D311 PolarHBondContact NH1-O 3.06Å; Y277-D311 HydrophobicContact CE2-CB 4.45Å; Y277-D311 WeakPolarHBondContact CE2-OD1 3.44Å; Y277-D311 VanDerWaalsContact CZ-OD1 3.29Å; Y277-D311 PolarHBondContact OH-OD1 3Å; D311-G314 WeakPolarHBondContact OD1-CA 3.39Å
312	I	96.9	Very high	97.5	Very high	23 Å²	23	40.1 Å²	40.1	12%	0.118	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	115.3	174.9	-53.7	179.4	0	0	0	107.3	D207 I210 G314 V315	D207-I312 HydrophobicContact CB-CD1 4.38Å; I210-I312 HydrophobicContact CB-CD1 4.05Å; I210-I312 HydrophobicContact CD1-CD1 3.87Å; I210-I312 HydrophobicContact CG2-CD1 3.88Å; I312-G314 PolarHBondContact O-N 2.83Å; I312-V315 PolarHBondContact N-O 3.36Å; I312-V315 WeakPolarHBondContact O-CB 3.49Å; I312-V315 PolarHBondContact O-N 2.87Å
313	D	94.9	Very high	97.6	Very high	167 Å²	167	36.8 Å²	36.8	89%	0.893	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.6	33.2	179.8	-67.8	-17.1	0	0	0	115.6
314	G	94.9	Very high	97.7	Very high	42 Å²	42	41 Å²	41	43%	0.433	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.2	4.5	-178.9	0	0	0	0	0	115.2	Y277 D311 I312	Y277-G314 WeakPolarHBondContact OH-CA 3.43Å; Y277-G314 PolarHBondContact OH-O 2.88Å; D311-G314 WeakPolarHBondContact OD1-CA 3.39Å; I312-G314 PolarHBondContact O-N 2.83Å
315	V	96.9	Very high	97.7	Very high	69 Å²	69	45.4 Å²	45.4	42%	0.418	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	121	171.7	-175.4	0	0	0	0	109.3	L249 I312 H317	L249-V315 HydrophobicContact CD2-CG1 4.08Å; I312-V315 PolarHBondContact N-O 3.36Å; I312-V315 WeakPolarHBondContact O-CB 3.49Å; I312-V315 PolarHBondContact O-N 2.87Å; V315-H317 PolarHBondContact O-CD2 2.99Å
316	P	97.8	Very high	97.7	Very high	8 Å²	8	45.2 Å²	45.2	5%	0.052	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	116.3	178.7	32.3	-34.5	0	0	0	112.3	L249 F275 Y277 L309	L249-P316 HydrophobicContact CD2-CG 4.11Å; F275-P316 HydrophobicContact CE2-CB 3.77Å; F275-P316 HydrophobicContact CE2-CG 3.98Å; F275-P316 HydrophobicContact CZ-CB 4.1Å; F275-P316 HydrophobicContact CZ-CG 4.03Å; Y277-P316 HydrophobicContact CD1-CB 4.09Å; Y277-P316 HydrophobicContact CD1-CG 3.77Å; Y277-P316 HydrophobicContact CD2-CB 3.69Å; Y277-P316 HydrophobicContact CD2-CG 4.3Å; Y277-P316 HydrophobicContact CE1-CB 4.41Å; Y277-P316 HydrophobicContact CE1-CG 4.17Å; Y277-P316 HydrophobicContact CE2-CB 4Å; Y277-P316 HydrophobicContact CG-CB 3.72Å; Y277-P316 HydrophobicContact CG-CG 3.84Å; L309-P316 HydrophobicContact CD1-CB 4.49Å; L309-P316 HydrophobicContact CD2-CB 3.81Å; L309-P316 HydrophobicContact CG-CB 4.27Å
317	H	98.2	Very high	97.7	Very high	40 Å²	40	43.4 Å²	43.4	19%	0.185	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	144.3	169.8	-65.7	-97.3	0	0	0	110.7	I210 E244 H310 V315	I210-H317 HydrophobicContact CD1-CB 4.25Å; I210-H317 WeakPolarHBondContact CG2-ND1 3.45Å; E244-H317 IonicContact OE1-CE1 3.62Å; E244-H317 IonicContact OE1-CG 2.68Å; E244-H317 IonicContact OE1-ND1 3.83Å; E244-H317 PolarHBondContact OE1-ND1 3.25Å; H310-H317 PolarHBondContact N-O 2.58Å; H310-H317 PolarHBondContact O-N 2.91Å; V315-H317 PolarHBondContact O-CD2 2.99Å
318	L	98.3	Very high	97.7	Very high	6 Å²	6	44.5 Å²	44.5	3%	0.031	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	116.9	175.2	-175.4	66.2	0	0	0	109.3	Y245 Y273 V284 T307	Y245-L318 HydrophobicContact CD1-CD2 4.14Å; Y245-L318 HydrophobicContact CG-CD2 4.17Å; Y245-L318 PolarHBondContact N-O 3.37Å; Y273-L318 HydrophobicContact CD1-CD2 3.36Å; Y273-L318 HydrophobicContact CD2-CD2 3.53Å; Y273-L318 HydrophobicContact CE1-CD1 4.44Å; Y273-L318 HydrophobicContact CE1-CD2 3.79Å; Y273-L318 HydrophobicContact CE2-CD2 3.89Å; Y273-L318 HydrophobicContact CG-CD2 3.27Å; V284-L318 HydrophobicContact CG2-CB 4.16Å; T307-L318 HydrophobicContact CG2-CD1 4.4Å
319	I	98.4	Very high	97.8	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.01	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	147.2	-173.8	64.4	168.2	0	0	0	112.2	I206 I210 F241 T307 K308 H310 I321	I206-I319 HydrophobicContact CG2-CD1 3.81Å; I210-I319 HydrophobicContact CD1-CG2 3.84Å; I210-I319 HydrophobicContact CG1-CG2 4.21Å; F241-I319 HydrophobicContact CD2-CB 4.32Å; F241-I319 HydrophobicContact CD2-CD1 4.25Å; F241-I319 HydrophobicContact CD2-CG2 4.47Å; F241-I319 HydrophobicContact CE2-CB 4.01Å; F241-I319 HydrophobicContact CE2-CG2 3.8Å; T307-I319 CarbonylContact C-O 3.54Å; T307-I319 VanDerWaalsContact CA-O 3.3Å; T307-I319 WeakPolarHBondContact CA-O 3.42Å; K308-I319 HydrophobicContact CB-CG1 4.31Å; K308-I319 PolarHBondContact N-O 3.34Å; K308-I319 WeakPolarHBondContact O-CG1 3.48Å; K308-I319 PolarHBondContact O-N 2.99Å; H310-I319 HydrophobicContact CB-CD1 3.69Å; H310-I319 HydrophobicContact CB-CG1 3.98Å; H310-I319 HydrophobicContact CB-CG2 4.23Å; I319-I321 HydrophobicContact CD1-CD1 3.57Å; I319-I321 HydrophobicContact CD1-CG1 4.11Å; I319-I321 HydrophobicContact CG1-CD1 4.17Å; I319-I321 HydrophobicContact CG1-CG1 4.49Å
320	L	98.6	Very high	97.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	126.2	172.8	-73.2	161.9	0	0	0	109.4	V242 V243 I297 C305 Q306 T307 Y334	V242-L320 WeakPolarHBondContact CB-O 3.48Å; V242-L320 PolarHBondContact N-O 3.47Å; V243-L320 HydrophobicContact CG1-CB 4.26Å; V243-L320 HydrophobicContact CG1-CD1 3.88Å; V243-L320 PolarHBondContact N-O 2.81Å; V243-L320 PolarHBondContact O-N 3.39Å; I297-L320 HydrophobicContact CB-CD1 4.45Å; I297-L320 HydrophobicContact CD1-CD1 3.71Å; I297-L320 HydrophobicContact CG2-CD1 4.49Å; C305-L320 HydrophobicContact CB-CB 4.44Å; C305-L320 HydrophobicContact CB-CD2 3.99Å; Q306-L320 WeakPolarHBondContact O-CA 3.41Å; T307-L320 HydrophobicContact CG2-CD2 3.58Å; T307-L320 HydrophobicContact CG2-CG 4.36Å; L320-Y334 HydrophobicContact CD1-CD1 4.05Å; L320-Y334 HydrophobicContact CD1-CE1 4.25Å; L320-Y334 HydrophobicContact CD2-CD1 3.74Å; L320-Y334 HydrophobicContact CD2-CD2 4.34Å; L320-Y334 HydrophobicContact CD2-CE1 4.45Å; L320-Y334 HydrophobicContact CD2-CG 3.68Å
321	I	98.4	Very high	97.8	Very high	9 Å²	9	43.3 Å²	43.3	5%	0.046	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	139.4	179.7	-76.4	165.2	0	0	0	109	G239 D240 C305 Q306 K308 I319 S323	G239-I321 WeakPolarHBondContact O-CG2 3.24Å; D240-I321 WeakPolarHBondContact O-CA 3.22Å; C305-I321 CarbonylContact C-O 3.54Å; C305-I321 WeakPolarHBondContact CA-O 3.49Å; Q306-I321 PolarHBondContact N-O 3.39Å; Q306-I321 PolarHBondContact O-N 2.77Å; K308-I321 HydrophobicContact CB-CD1 4.4Å; K308-I321 HydrophobicContact CD-CD1 3.7Å; K308-I321 HydrophobicContact CG-CD1 4.24Å; I319-I321 HydrophobicContact CD1-CD1 3.57Å; I319-I321 HydrophobicContact CD1-CG1 4.11Å; I319-I321 HydrophobicContact CG1-CD1 4.17Å; I319-I321 HydrophobicContact CG1-CG1 4.49Å; I321-S323 PolarHBondContact O-N 2.99Å
322	A	98.6	Very high	97.9	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.008	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	116.5	178	0	0	0	0	0	111.2	F236 S237 G239 D240 V242 I326	F236-A322 HydrophobicContact CB-CB 4.37Å; S237-A322 VanDerWaalsContact O-CB 3.31Å; S237-A322 WeakPolarHBondContact O-CB 3.11Å; G239-A322 PolarHBondContact N-O 3.25Å; D240-A322 PolarHBondContact O-N 3.15Å; V242-A322 HydrophobicContact CG2-CB 4.07Å; A322-I326 HydrophobicContact CB-CD1 3.89Å; A322-I326 HydrophobicContact CB-CG1 4.2Å
323	S	98.1	Very high	98	Very high	36 Å²	36	41 Å²	41	25%	0.252	25%	0.252	S	S	.	.	S	Bend	trans	-77.7	-26.2	-178.1	70.9	0	0	0	0	112.4	R238 G303 N304 I321	R238-S323 WeakPolarHBondContact CD-O 3.24Å; R238-S323 WeakPolarHBondContact CG-O 3.42Å; R238-S323 PolarHBondContact NE-O 2.7Å; G303-S323 PolarHBondContact O-OG 3.37Å; N304-S323 VanDerWaalsContact C-OG 3.29Å; N304-S323 PolarHBondContact O-N 3.39Å; N304-S323 PolarHBondContact O-OG 3.31Å; N304-S323 VanDerWaalsContact O-OG 3.06Å; I321-S323 PolarHBondContact O-N 2.99Å
324	R	98.4	Very high	98.2	Very high	103 Å²	103	33.3 Å²	33.3	39%	0.389	21%	0.21	S	C	.	.	S	Bend	trans	-138.9	176.4	171.9	59.1	160.3	174.3	94.9	-10.5	109.4	N304 E330	N304-R324 HydrophobicContact CB-CG 4.18Å; R324-E330 IonicContact CZ-OE1 3.68Å; R324-E330 IonicContact CZ-OE2 2.71Å; R324-E330 VanDerWaalsContact NH1-CD 3.32Å; R324-E330 IonicContact NH1-OE1 3.79Å; R324-E330 PolarHBondContact NH1-OE1 3.33Å; R324-E330 IonicContact NH1-OE2 3.32Å; R324-E330 PolarHBondContact NH1-OE2 2.92Å; R324-E330 IonicContact NH2-OE2 3.17Å; R324-E330 PolarHBondContact NH2-OE2 2.82Å
325	D	98.6	Very high	98.3	Very high	95 Å²	95	34 Å²	34	51%	0.508	20%	0.204	S	C	.	.			trans	-64.9	144.3	167.6	-53.4	-33.5	0	0	0	110.1	F236 R238	F236-D325 WeakPolarHBondContact O-CA 3.3Å; R238-D325 WeakPolarHBondContact CB-OD1 3.39Å; R238-D325 PolarHBondContact N-OD1 3.02Å
326	I	98.7	Very high	98.3	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-128.2	121.4	-176	-42.5	-175.3	0	0	0	108.9	A232 Q235 F236 N304 A322 E330 L332	A232-I326 HydrophobicContact CB-CG2 4.27Å; Q235-I326 CarbonylContact C-O 3.59Å; Q235-I326 VanDerWaalsContact CA-O 3.3Å; Q235-I326 WeakPolarHBondContact CA-O 3.45Å; Q235-I326 WeakPolarHBondContact CG-O 3.46Å; F236-I326 HydrophobicContact CB-CB 4.2Å; F236-I326 HydrophobicContact CB-CD1 4.41Å; F236-I326 HydrophobicContact CB-CG1 4.31Å; F236-I326 PolarHBondContact N-O 3.3Å; F236-I326 PolarHBondContact O-N 3.33Å; N304-I326 HydrophobicContact CB-CD1 3.93Å; N304-I326 HydrophobicContact CB-CG1 4.05Å; A322-I326 HydrophobicContact CB-CD1 3.89Å; A322-I326 HydrophobicContact CB-CG1 4.2Å; I326-E330 HydrophobicContact CG2-CB 3.84Å; I326-E330 HydrophobicContact CG2-CG 4.33Å; I326-L332 HydrophobicContact CD1-CD2 3.84Å; I326-L332 HydrophobicContact CG2-CD2 4.17Å
327	A	98.5	Very high	98.2	Very high	50 Å²	50	35.9 Å²	35.9	41%	0.413	22%	0.217	S	C	.	.			trans	-79.3	152.9	176.2	0	0	0	0	0	112.1	G329 E330	A327-G329 PolarHBondContact O-N 2.87Å; A327-E330 HydrophobicContact CB-CG 4.27Å; A327-E330 PolarHBondContact N-OE1 2.59Å; A327-E330 WeakPolarHBondContact O-CB 3.39Å; A327-E330 PolarHBondContact O-N 2.9Å
328	A	98.3	Very high	98	Very high	61 Å²	61	37 Å²	37	50%	0.504	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	133.9	169.7	0	0	0	0	0	110.1	A232	A232-A328 CarbonylContact O-C 3.57Å; A232-A328 WeakPolarHBondContact O-CA 3.47Å
329	G	98	Very high	97.8	Very high	57 Å²	57	41.7 Å²	41.7	59%	0.588	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	98.3	-12.2	-172.3	0	0	0	0	0	114.6	A232 A327	A232-G329 PolarHBondContact O-N 2.83Å; A327-G329 PolarHBondContact O-N 2.87Å
330	E	98.4	Very high	97.7	Very high	52 Å²	52	44 Å²	44	24%	0.243	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-74.3	144.8	173.3	-69.2	-167.6	-125.2	0	0	112.7	I231 A232 N304 R324 I326 A327	I231-E330 WeakPolarHBondContact CA-O 3.48Å; A232-E330 PolarHBondContact N-O 3.46Å; N304-E330 PolarHBondContact ND2-OE2 2.59Å; R324-E330 IonicContact CZ-OE1 3.68Å; R324-E330 IonicContact CZ-OE2 2.71Å; R324-E330 VanDerWaalsContact NH1-CD 3.32Å; R324-E330 IonicContact NH1-OE1 3.79Å; R324-E330 PolarHBondContact NH1-OE1 3.33Å; R324-E330 IonicContact NH1-OE2 3.32Å; R324-E330 PolarHBondContact NH1-OE2 2.92Å; R324-E330 IonicContact NH2-OE2 3.17Å; R324-E330 PolarHBondContact NH2-OE2 2.82Å; I326-E330 HydrophobicContact CG2-CB 3.84Å; I326-E330 HydrophobicContact CG2-CG 4.33Å; A327-E330 HydrophobicContact CB-CG 4.27Å; A327-E330 PolarHBondContact N-OE1 2.59Å; A327-E330 WeakPolarHBondContact O-CB 3.39Å; A327-E330 PolarHBondContact O-N 2.9Å
331	E	98.5	Very high	97.6	Very high	34 Å²	34	51.3 Å²	51.3	16%	0.159	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-71.8	132.5	165.4	-169.3	-171.5	-175.8	0	0	110.1	I223 K226 I231 N298 N304 L333	I223-E331 HydrophobicContact CD1-CG 4.4Å; I223-E331 HydrophobicContact CG1-CG 4.41Å; K226-E331 WeakPolarHBondContact CD-OE1 3.37Å; K226-E331 IonicContact NZ-OE1 2.85Å; K226-E331 PolarHBondContact NZ-OE1 2.97Å; K226-E331 IonicContact NZ-OE2 2.72Å; K226-E331 PolarHBondContact NZ-OE2 3.06Å; I231-E331 HydrophobicContact CD1-CB 3.82Å; I231-E331 HydrophobicContact CD1-CG 4.23Å; N298-E331 WeakPolarHBondContact CB-OE1 3.19Å; N298-E331 PolarHBondContact ND2-OE1 3.07Å; N304-E331 PolarHBondContact ND2-O 3.09Å; E331-L333 HydrophobicContact CB-CG 4.48Å; E331-L333 HydrophobicContact CG-CD2 4.09Å; E331-L333 HydrophobicContact CG-CG 4.18Å
332	L	98.7	Very high	97.5	Very high	0 Å²	0	54 Å²	54	0%	0	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-77.2	129.7	171.5	-62.6	179.6	0	0	0	109.4	M218 V230 A232 V242 I297 N304 I326	M218-L332 HydrophobicContact CG-CD1 3.77Å; M218-L332 HydrophobicContact SD-CD1 3.74Å; V230-L332 HydrophobicContact CB-CD1 4.41Å; V230-L332 HydrophobicContact CG1-CD1 3.9Å; V230-L332 PolarHBondContact O-N 2.95Å; A232-L332 HydrophobicContact CB-CD2 4.25Å; V242-L332 HydrophobicContact CG1-CD1 3.6Å; V242-L332 HydrophobicContact CG1-CD2 4.28Å; I297-L332 HydrophobicContact CD1-CB 4.24Å; I297-L332 HydrophobicContact CD1-CD1 4.11Å; I297-L332 HydrophobicContact CG1-CB 4.4Å; I297-L332 HydrophobicContact CG2-CB 3.87Å; I297-L332 VanDerWaalsContact CG2-O 3.24Å; I297-L332 WeakPolarHBondContact CG2-O 3.11Å; N304-L332 WeakPolarHBondContact OD1-CA 3.45Å; I326-L332 HydrophobicContact CD1-CD2 3.84Å; I326-L332 HydrophobicContact CG2-CD2 4.17Å
333	L	98.6	Very high	97.3	Very high	28 Å²	28	55.3 Å²	55.3	15%	0.147	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	137.9	-173.2	-66.9	174	0	0	0	111.2	N298 G303 N304 C305 E331	N298-L333 HydrophobicContact CB-CD2 3.52Å; N298-L333 WeakPolarHBondContact O-CA 3.46Å; N298-L333 WeakPolarHBondContact O-CD2 3.41Å; G303-L333 CarbonylContact C-O 3.27Å; G303-L333 WeakPolarHBondContact CA-O 3.44Å; N304-L333 PolarHBondContact N-O 2.83Å; N304-L333 PolarHBondContact OD1-N 2.74Å; N304-L333 PolarHBondContact OD1-O 2.96Å; C305-L333 WeakPolarHBondContact CB-O 3.48Å; C305-L333 PolarHBondContact N-O 3.03Å; E331-L333 HydrophobicContact CB-CG 4.48Å; E331-L333 HydrophobicContact CG-CD2 4.09Å; E331-L333 HydrophobicContact CG-CG 4.18Å
334	Y	98.6	Very high	97.2	Very high	6 Å²	6	55.2 Å²	55.2	2%	0.024	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	162.7	172.1	74.2	-89.4	0	0	0	112.2	Y245 Y273 I297 N298 H299 S300 C305 T307 L320 Y336	Y245-Y334 WeakPolarHBondContact CE2-OH 3.39Å; Y273-Y334 HydrophobicContact CD2-CE2 4.32Å; Y273-Y334 HydrophobicContact CE2-CD2 4.45Å; Y273-Y334 AromaticContact CE2-CE2 3.64Å; Y273-Y334 HydrophobicContact CE2-CE2 3.64Å; I297-Y334 HydrophobicContact CB-CD1 4.16Å; I297-Y334 HydrophobicContact CB-CE1 4.09Å; I297-Y334 HydrophobicContact CG2-CD1 3.64Å; I297-Y334 HydrophobicContact CG2-CE1 4.08Å; I297-Y334 WeakPolarHBondContact O-CE1 3.44Å; N298-Y334 PolarHBondContact O-N 3.41Å; N298-Y334 VanDerWaalsContact O-N 3.1Å; H299-Y334 WeakPolarHBondContact CA-O 3.37Å; S300-Y334 PolarHBondContact N-O 2.85Å; S300-Y334 CarbonylContact O-C 3.6Å; S300-Y334 VanDerWaalsContact O-C 3.27Å; C305-Y334 WeakPolarHBondContact O-CB 3.41Å; T307-Y334 HydrophobicContact CG2-CD2 4.08Å; T307-Y334 HydrophobicContact CG2-CE2 4.4Å; L320-Y334 HydrophobicContact CD1-CD1 4.05Å; L320-Y334 HydrophobicContact CD1-CE1 4.25Å; L320-Y334 HydrophobicContact CD2-CD1 3.74Å; L320-Y334 HydrophobicContact CD2-CD2 4.34Å; L320-Y334 HydrophobicContact CD2-CE1 4.45Å; L320-Y334 HydrophobicContact CD2-CG 3.68Å; Y334-Y336 HydrophobicContact CD1-CE1 4.34Å; Y334-Y336 AromaticContact CD2-CD1 3.93Å; Y334-Y336 HydrophobicContact CD2-CD1 3.93Å; Y334-Y336 HydrophobicContact CD2-CE1 4.46Å; Y334-Y336 HydrophobicContact CE1-CD1 4.13Å; Y334-Y336 AromaticContact CE1-CE1 3.73Å; Y334-Y336 HydrophobicContact CE1-CE1 3.73Å; Y334-Y336 AromaticContact CE2-CD1 3.35Å; Y334-Y336 HydrophobicContact CE2-CD1 3.35Å; Y334-Y336 AromaticContact CE2-CE1 3.84Å; Y334-Y336 HydrophobicContact CE2-CE1 3.84Å; Y334-Y336 HydrophobicContact CE2-CG 4.25Å; Y334-Y336 HydrophobicContact CG-CD1 4.49Å; Y334-Y336 AromaticContact CZ-CD1 3.48Å; Y334-Y336 VanDerWaalsContact CZ-CD1 3.48Å; Y334-Y336 AromaticContact CZ-CE1 3.43Å; Y334-Y336 VanDerWaalsContact CZ-CE1 3.43Å; Y334-Y336 PolarHBondContact O-N 2.68Å
335	D	98.1	Very high	97.1	Very high	57 Å²	57	56.3 Å²	56.3	31%	0.305	33%	0.328	S	S	.	.			trans	-80.1	114.1	175.3	-177.5	11.5	0	0	0	110.8	H299 S300 G337 R339	H299-D335 IonicContact CE1-OD1 2.65Å; H299-D335 PolarHBondContact CE1-OD1 3.32Å; S300-D335 PolarHBondContact O-N 3.27Å; D335-G337 PolarHBondContact O-N 2.99Å; D335-G337 VanDerWaalsContact O-N 3.12Å; D335-G337 PolarHBondContact OD1-N 2.99Å; D335-R339 IonicContact OD1-CZ 2.64Å; D335-R339 IonicContact OD1-NH1 2.65Å; D335-R339 PolarHBondContact OD1-NH1 2.92Å; D335-R339 VanDerWaalsContact OD1-NH1 3.16Å; D335-R339 IonicContact OD1-NH2 2.96Å; D335-R339 PolarHBondContact OD1-NH2 3.38Å; D335-R339 IonicContact OD2-CZ 3.24Å; D335-R339 IonicContact OD2-NH2 3.98Å; D335-R339 PolarHBondContact OD2-NH2 3.38Å
336	Y	97.4	Very high	96.9	Very high	70 Å²	70	55 Å²	55	28%	0.275	33%	0.33	S	S	.	.			trans	-66.1	-10.9	178.6	-72.3	16	0	0	0	113	I297 H299 Y334 D338 W349 L350	I297-Y336 PolarHBondContact O-OH 2.93Å; I297-Y336 VanDerWaalsContact O-OH 3.09Å; H299-Y336 HydrophobicContact CB-CD1 3.79Å; H299-Y336 HydrophobicContact CB-CD2 4.16Å; H299-Y336 HydrophobicContact CB-CE1 3.76Å; H299-Y336 HydrophobicContact CB-CE2 4.13Å; H299-Y336 HydrophobicContact CB-CG 4.01Å; H299-Y336 PolarHBondContact CE1-N 3.28Å; H299-Y336 VanDerWaalsContact ND1-CB 3.31Å; H299-Y336 WeakPolarHBondContact ND1-CB 3.25Å; H299-Y336 AromaticContact ND1-CD1 3.51Å; H299-Y336 AromaticContact ND1-CG 3.33Å; H299-Y336 VanDerWaalsContact ND1-CG 3.33Å; H299-Y336 PolarHBondContact ND1-N 2.81Å; H299-Y336 VanDerWaalsContact ND1-N 3.12Å; Y334-Y336 HydrophobicContact CD1-CE1 4.34Å; Y334-Y336 AromaticContact CD2-CD1 3.93Å; Y334-Y336 HydrophobicContact CD2-CD1 3.93Å; Y334-Y336 HydrophobicContact CD2-CE1 4.46Å; Y334-Y336 HydrophobicContact CE1-CD1 4.13Å; Y334-Y336 AromaticContact CE1-CE1 3.73Å; Y334-Y336 HydrophobicContact CE1-CE1 3.73Å; Y334-Y336 AromaticContact CE2-CD1 3.35Å; Y334-Y336 HydrophobicContact CE2-CD1 3.35Å; Y334-Y336 AromaticContact CE2-CE1 3.84Å; Y334-Y336 HydrophobicContact CE2-CE1 3.84Å; Y334-Y336 HydrophobicContact CE2-CG 4.25Å; Y334-Y336 HydrophobicContact CG-CD1 4.49Å; Y334-Y336 AromaticContact CZ-CD1 3.48Å; Y334-Y336 VanDerWaalsContact CZ-CD1 3.48Å; Y334-Y336 AromaticContact CZ-CE1 3.43Å; Y334-Y336 VanDerWaalsContact CZ-CE1 3.43Å; Y334-Y336 PolarHBondContact O-N 2.68Å; Y336-D338 PolarHBondContact O-N 2.69Å; Y336-W349 HydrophobicContact CD2-CH2 4.12Å; Y336-W349 AromaticContact CD2-CZ3 3.98Å; Y336-W349 HydrophobicContact CD2-CZ3 3.98Å; Y336-W349 AromaticContact CE2-CH2 3.9Å; Y336-W349 HydrophobicContact CE2-CH2 3.9Å; Y336-W349 AromaticContact CE2-CZ3 3.97Å; Y336-W349 HydrophobicContact CE2-CZ3 3.97Å; Y336-L350 HydrophobicContact CD2-CD2 4.32Å
337	G	94.6	Very high	96.7	Very high	45 Å²	45	58.6 Å²	58.6	46%	0.464	35%	0.347	S	S	.	.			trans	73.8	-16.8	173.7	0	0	0	0	0	115.7	D335 R339	D335-G337 PolarHBondContact O-N 2.99Å; D335-G337 VanDerWaalsContact O-N 3.12Å; D335-G337 PolarHBondContact OD1-N 2.99Å; G337-R339 PolarHBondContact O-N 3.07Å
338	D	93.8	Very high	96.6	Very high	64 Å²	64	59.6 Å²	59.6	34%	0.342	35%	0.349	S	S	.	.			trans	-65.2	130	175.9	-166	-4.6	0	0	0	111.1	Y336 S340 S343 L350	Y336-D338 PolarHBondContact O-N 2.69Å; D338-S340 WeakPolarHBondContact OD1-CB 3.5Å; D338-S340 PolarHBondContact OD1-N 3.01Å; D338-S343 WeakPolarHBondContact OD2-CB 3.31Å; D338-S343 PolarHBondContact OD2-OG 2.95Å; D338-L350 HydrophobicContact CB-CD1 4.47Å
339	R	95.4	Very high	96.5	Very high	105 Å²	105	62.8 Å²	62.8	40%	0.396	35%	0.348	S	S	.	.			trans	-130.3	9.2	178.9	-57.6	-60.4	176.3	-110.9	0.9	112.5	D335 G337	D335-R339 IonicContact OD1-CZ 2.64Å; D335-R339 IonicContact OD1-NH1 2.65Å; D335-R339 PolarHBondContact OD1-NH1 2.92Å; D335-R339 VanDerWaalsContact OD1-NH1 3.16Å; D335-R339 IonicContact OD1-NH2 2.96Å; D335-R339 PolarHBondContact OD1-NH2 3.38Å; D335-R339 IonicContact OD2-CZ 3.24Å; D335-R339 IonicContact OD2-NH2 3.98Å; D335-R339 PolarHBondContact OD2-NH2 3.38Å; G337-R339 PolarHBondContact O-N 3.07Å
340	S	95.6	Very high	96.5	Very high	49 Å²	49	60.3 Å²	60.3	34%	0.343	32%	0.321	S	S	.	.			trans	-61.5	138.4	178.2	119.3	0	0	0	0	110.1	D338 A342 S343 I344	D338-S340 WeakPolarHBondContact OD1-CB 3.5Å; D338-S340 PolarHBondContact OD1-N 3.01Å; S340-A342 VanDerWaalsContact C-N 3.29Å; S340-A342 PolarHBondContact O-N 2.86Å; S340-A342 PolarHBondContact OG-N 3.18Å; S340-S343 WeakPolarHBondContact CB-OG 3.34Å; S340-S343 PolarHBondContact O-N 2.72Å; S340-S343 WeakPolarHBondContact OG-CB 3.13Å; S340-S343 PolarHBondContact OG-N 3.31Å; S340-S343 PolarHBondContact OG-OG 3.22Å; S340-I344 WeakPolarHBondContact O-CB 3.31Å; S340-I344 WeakPolarHBondContact O-CG1 3.33Å; S340-I344 PolarHBondContact O-N 3.36Å
341	K	96.5	Very high	96.3	Very high	154 Å²	154	62.5 Å²	62.5	67%	0.67	33%	0.33	S	S	*	.	H	α-helix	trans	-59.3	-42.8	179.5	-179.9	179.2	168.8	-176.8	0	111.3	I344 E345	K341-I344 PolarHBondContact O-N 3.42Å; K341-E345 VanDerWaalsContact CE-CD 3.44Å; K341-E345 WeakPolarHBondContact CE-OE1 3.4Å; K341-E345 HydrophobicContact CG-CG 4.46Å; K341-E345 IonicContact NZ-OE1 3.15Å; K341-E345 WeakPolarHBondContact O-CB 3.32Å; K341-E345 VanDerWaalsContact O-CG 3.32Å; K341-E345 WeakPolarHBondContact O-CG 3.38Å; K341-E345 PolarHBondContact O-N 2.85Å
342	A	95.1	Very high	96	Very high	67 Å²	67	67.6 Å²	67.6	55%	0.554	35%	0.354	S	S	*	.	H	α-helix	trans	-64.6	-44.2	179.8	0	0	0	0	0	111.9	S340 I344 E345 A346	S340-A342 VanDerWaalsContact C-N 3.29Å; S340-A342 PolarHBondContact O-N 2.86Å; S340-A342 PolarHBondContact OG-N 3.18Å; A342-I344 VanDerWaalsContact C-N 3.33Å; A342-I344 PolarHBondContact O-N 3.24Å; A342-E345 PolarHBondContact O-N 3.01Å; A342-A346 PolarHBondContact O-N 2.7Å
343	S	94.3	Very high	95.9	Very high	27 Å²	27	71 Å²	71	19%	0.189	37%	0.371	C	S	.	.	H	α-helix	trans	-61.4	-42.6	175.7	-47.8	0	0	0	0	111.5	D338 S340 E345 A346 H347	D338-S343 WeakPolarHBondContact OD2-CB 3.31Å; D338-S343 PolarHBondContact OD2-OG 2.95Å; S340-S343 WeakPolarHBondContact CB-OG 3.34Å; S340-S343 PolarHBondContact O-N 2.72Å; S340-S343 WeakPolarHBondContact OG-CB 3.13Å; S340-S343 PolarHBondContact OG-N 3.31Å; S340-S343 PolarHBondContact OG-OG 3.22Å; S343-E345 VanDerWaalsContact C-N 3.31Å; S343-E345 PolarHBondContact O-N 3.02Å; S343-A346 PolarHBondContact O-N 2.87Å; S343-H347 WeakPolarHBondContact O-CA 3.45Å; S343-H347 WeakPolarHBondContact O-CB 3.38Å; S343-H347 PolarHBondContact O-N 2.78Å
344	I	96.3	Very high	95.8	Very high	35 Å²	35	73.2 Å²	73.2	18%	0.179	38%	0.383	C	S	.	.	H	α-helix	trans	-69.9	-26	178.4	-74.5	177.2	0	0	0	112.8	S340 K341 A342 P348 L350 K351	S340-I344 WeakPolarHBondContact O-CB 3.31Å; S340-I344 WeakPolarHBondContact O-CG1 3.33Å; S340-I344 PolarHBondContact O-N 3.36Å; K341-I344 PolarHBondContact O-N 3.42Å; A342-I344 VanDerWaalsContact C-N 3.33Å; A342-I344 PolarHBondContact O-N 3.24Å; I344-P348 WeakPolarHBondContact O-CA 2.96Å; I344-L350 HydrophobicContact CG1-CB 4.14Å; I344-K351 HydrophobicContact CG2-CD 4.15Å; I344-K351 HydrophobicContact CG2-CG 3.81Å
345	E	97.1	Very high	95.6	Very high	126 Å²	126	76.9 Å²	76.9	59%	0.589	40%	0.403	S	S	*	.	H	α-helix	trans	-79.6	-39	174.1	-76.2	173.1	161.5	0	0	111.8	K341 A342 S343	K341-E345 VanDerWaalsContact CE-CD 3.44Å; K341-E345 WeakPolarHBondContact CE-OE1 3.4Å; K341-E345 HydrophobicContact CG-CG 4.46Å; K341-E345 IonicContact NZ-OE1 3.15Å; K341-E345 WeakPolarHBondContact O-CB 3.32Å; K341-E345 VanDerWaalsContact O-CG 3.32Å; K341-E345 WeakPolarHBondContact O-CG 3.38Å; K341-E345 PolarHBondContact O-N 2.85Å; A342-E345 PolarHBondContact O-N 3.01Å; S343-E345 VanDerWaalsContact C-N 3.31Å; S343-E345 PolarHBondContact O-N 3.02Å
346	A	94.3	Very high	95.5	Very high	66 Å²	66	78.1 Å²	78.1	55%	0.545	41%	0.409	S	S	.	.	H	α-helix	trans	-75	-33.5	174.3	0	0	0	0	0	113.5	A342 S343	A342-A346 PolarHBondContact O-N 2.7Å; S343-A346 PolarHBondContact O-N 2.87Å
347	H	95	Very high	95.3	Very high	78 Å²	78	78.6 Å²	78.6	36%	0.361	42%	0.417	S	S	.	.			trans	-131.4	77	-174	-57	-33.1	0	0	0	110.9	S343 W349 L350	S343-H347 WeakPolarHBondContact O-CA 3.45Å; S343-H347 WeakPolarHBondContact O-CB 3.38Å; S343-H347 PolarHBondContact O-N 2.78Å; H347-W349 HydrophobicContact CB-CD2 4.37Å; H347-W349 HydrophobicContact CB-CZ2 3.87Å; H347-W349 PolarHBondContact O-N 3.15Å; H347-L350 HydrophobicContact CB-CD1 3.99Å; H347-L350 HydrophobicContact CB-CG 4.28Å; H347-L350 WeakPolarHBondContact O-CB 3.42Å; H347-L350 PolarHBondContact O-N 3.09Å
348	P	96.8	Very high	95.4	Very high	70 Å²	70	80.9 Å²	80.9	46%	0.455	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-59.4	-18.9	-174	-27.4	36.7	0	0	0	115.5	I344 L350 K351	I344-P348 WeakPolarHBondContact O-CA 2.96Å; P348-L350 VanDerWaalsContact C-N 3.26Å; P348-L350 PolarHBondContact O-N 3.15Å; P348-K351 WeakPolarHBondContact O-CB 3.4Å; P348-K351 VanDerWaalsContact O-CG 3.3Å; P348-K351 WeakPolarHBondContact O-CG 3.06Å; P348-K351 PolarHBondContact O-N 3.45Å
349	W	96.1	Very high	95.5	Very high	129 Å²	129	82.1 Å²	82.1	49%	0.489	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-66.3	-21.9	175.9	50.4	-103.2	0	0	0	113.6	H299 Y336 H347 K351 H352	H299-W349 HydrophobicContact CB-CE3 3.67Å; H299-W349 HydrophobicContact CB-CZ3 3.47Å; H299-W349 VanDerWaalsContact CB-CZ3 3.47Å; H299-W349 AromaticContact CD2-CE3 3.95Å; H299-W349 AromaticContact CG-CE3 3.87Å; H299-W349 AromaticContact CG-CZ3 3.78Å; Y336-W349 HydrophobicContact CD2-CH2 4.12Å; Y336-W349 AromaticContact CD2-CZ3 3.98Å; Y336-W349 HydrophobicContact CD2-CZ3 3.98Å; Y336-W349 AromaticContact CE2-CH2 3.9Å; Y336-W349 HydrophobicContact CE2-CH2 3.9Å; Y336-W349 AromaticContact CE2-CZ3 3.97Å; Y336-W349 HydrophobicContact CE2-CZ3 3.97Å; H347-W349 HydrophobicContact CB-CD2 4.37Å; H347-W349 HydrophobicContact CB-CZ2 3.87Å; H347-W349 PolarHBondContact O-N 3.15Å; W349-K351 PolarHBondContact O-N 2.97Å; W349-H352 PolarHBondContact O-N 3.01Å
350	L	96.5	Very high	95.5	Very high	4 Å²	4	80.3 Å²	80.3	2%	0.021	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-61	-6.3	171.2	-72.6	171.4	0	0	0	113.9	K301 Y336 D338 I344 H347 P348	K301-L350 WeakPolarHBondContact CE-O 3.29Å; Y336-L350 HydrophobicContact CD2-CD2 4.32Å; D338-L350 HydrophobicContact CB-CD1 4.47Å; I344-L350 HydrophobicContact CG1-CB 4.14Å; H347-L350 HydrophobicContact CB-CD1 3.99Å; H347-L350 HydrophobicContact CB-CG 4.28Å; H347-L350 WeakPolarHBondContact O-CB 3.42Å; H347-L350 PolarHBondContact O-N 3.09Å; P348-L350 VanDerWaalsContact C-N 3.26Å; P348-L350 PolarHBondContact O-N 3.15Å
351	K	95.8	Very high	95.5	Very high	99 Å²	99	82.9 Å²	82.9	43%	0.43	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-79.9	-15.1	176.7	-65.6	175.7	-174	174.4	0	113.6	K301 I344 P348 W349	K301-K351 WeakPolarHBondContact CD-O 3.42Å; K301-K351 VanDerWaalsContact CE-C 3.48Å; K301-K351 VanDerWaalsContact CE-O 3.3Å; K301-K351 WeakPolarHBondContact CE-O 3.49Å; K301-K351 VanDerWaalsContact NZ-C 3.28Å; K301-K351 PolarHBondContact NZ-O 2.98Å; I344-K351 HydrophobicContact CG2-CD 4.15Å; I344-K351 HydrophobicContact CG2-CG 3.81Å; P348-K351 WeakPolarHBondContact O-CB 3.4Å; P348-K351 VanDerWaalsContact O-CG 3.3Å; P348-K351 WeakPolarHBondContact O-CG 3.06Å; P348-K351 PolarHBondContact O-N 3.45Å; W349-K351 PolarHBondContact O-N 2.97Å
352	H	92.3	Very high	95.4	Very high	140 Å²	140	76.5 Å²	76.5	65%	0.648	41%	0.405	S	S	*	.			trans	-132.4	0	-164	-59.5	-67.6	0	0	0	113.9	H299 S300 K301 W349	H299-H352 PolarHBondContact CD2-O 2.65Å; H299-H352 VanDerWaalsContact CD2-O 3.27Å; H299-H352 PolarHBondContact NE2-O 2.87Å; H299-H352 VanDerWaalsContact NE2-O 3.13Å; S300-H352 WeakPolarHBondContact CA-O 3.01Å; S300-H352 PolarHBondContact OG-OXT 2.79Å; K301-H352 WeakPolarHBondContact CG-O 3.34Å; K301-H352 PolarHBondContact N-O 2.65Å; K301-H352 PolarHBondContact N-OXT 2.93Å; W349-H352 PolarHBondContact O-N 3.01Å

Retrieved 352 of 352 residues in 1230.8 ms (Link to these results)

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