A0A087XIC0_POEFO Loading...

Oxysterol-binding protein

AlphaFold DB , UniProt , Accession A0A087XIC0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 787 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.7	Very low	31.4	Very low	242 Å²	242	145.9 Å²	145.9	100%	1.192	84%	0.836	S	S	*	*				0	137.7	0	-77.2	174.7	171.1	0	0	107.7
2	E	30.5	Very low	31.4	Very low	165 Å²	165	152.5 Å²	152.5	77%	0.771	84%	0.837	S	S	*	*			trans	-71.4	160.7	-169.5	-53.6	118.7	110.1	0	0	113.5
3	K	29.5	Very low	31.3	Very low	215 Å²	215	149.5 Å²	149.5	94%	0.935	83%	0.826	S	S	*	*				-152.3	154.9	115.7	-109.2	166.3	-173.9	179	0	111.5
4	T	31.3	Very low	31.2	Very low	103 Å²	103	148.6 Å²	148.6	63%	0.632	82%	0.82	S	S	*	*			trans	-138.3	166.6	-150.6	-28.3	0	0	0	0	109.7
5	L	30.9	Very low	31.1	Very low	155 Å²	155	145.7 Å²	145.7	81%	0.812	81%	0.814	S	S	*	*			trans	71	138.9	162.2	-63.2	151.5	0	0	0	114.9
6	C	26.8	Very low	31.1	Very low	109 Å²	109	142.7 Å²	142.7	74%	0.736	81%	0.813	S	S	*	*			cis	-163.9	149.2	41.9	-135.4	0	0	0	0	113.8
7	S	32	Very low	31	Very low	109 Å²	109	141.5 Å²	141.5	76%	0.762	82%	0.816	S	S	*	*			trans	-130.2	154.8	147.8	-52.8	0	0	0	0	105.2
8	P	44.7	Very low	31	Very low	133 Å²	133	140.1 Å²	140.1	86%	0.864	82%	0.815	S	S	*	*				-155.9	-175	73.6	39.6	-17.8	0	0	0	115.5
9	G	26.5	Very low	32	Very low	79 Å²	79	138.8 Å²	138.8	81%	0.814	81%	0.813	S	S	*	*			trans	176.4	97	167.7	0	0	0	0	0	114.6
10	T	31.7	Very low	32	Very low	129 Å²	129	144.3 Å²	144.3	79%	0.791	82%	0.819	S	S	*	*			trans	-100	149.4	179.9	48.9	0	0	0	0	113.1
11	N	28.7	Very low	32.1	Very low	166 Å²	166	146.6 Å²	146.6	89%	0.888	82%	0.819	S	S	*	*			trans	-165.6	155.7	134.5	-105.4	-25.3	0	0	0	115.8
12	R	31	Very low	32.8	Very low	225 Å²	225	141.3 Å²	141.3	85%	0.849	80%	0.803	S	S	*	*			trans	-87.1	179.2	172.6	-55.9	168.8	164.3	169.5	-7.2	109.4
13	T	31	Very low	32.9	Very low	113 Å²	113	137.9 Å²	137.9	69%	0.693	80%	0.803	S	S	*	*			cis	-173.2	164.8	33.2	-11.4	0	0	0	0	111.6
14	N	29	Very low	33	Very low	138 Å²	138	132.5 Å²	132.5	74%	0.738	79%	0.793	S	S	*	*			trans	84.3	102	143.7	-72.7	1.9	0	0	0	125.4
15	S	30.6	Very low	32.9	Very low	105 Å²	105	139.5 Å²	139.5	73%	0.734	81%	0.807	S	S	*	*				80.2	116.3	110	73.2	0	0	0	0	125.5
16	A	31.2	Very low	32.9	Very low	97 Å²	97	137.9 Å²	137.9	80%	0.802	81%	0.809	S	S	*	*				78.5	123.3	124.1	0	0	0	0	0	123.6
17	S	28.5	Very low	33	Very low	122 Å²	122	136.7 Å²	136.7	85%	0.853	82%	0.815	S	S	*	*				174.8	155.6	105.3	47.1	0	0	0	0	114.2
18	S	32.2	Very low	32.9	Very low	116 Å²	116	136.3 Å²	136.3	81%	0.811	81%	0.813	S	S	*	*			trans	-117.2	165.1	172.9	-48.2	0	0	0	0	111.2
19	P	48.8	Very low	32.2	Very low	117 Å²	117	139.2 Å²	139.2	76%	0.76	81%	0.814	S	S	*	*				-149	136.5	115.4	31.2	-12.1	0	0	0	114.3
20	R	32.4	Very low	32.3	Very low	248 Å²	248	140.6 Å²	140.6	94%	0.936	81%	0.812	S	S	*	*				97	148.6	80.3	-80.1	-166.8	169.5	-156.5	-0.5	116.5
21	K	34.5	Very low	32.7	Very low	192 Å²	192	140.8 Å²	140.8	84%	0.835	82%	0.815	S	S	*	*			trans	-83.1	-175.5	-178.3	-58.1	177.1	174	179.1	0	113.3
22	P	46.4	Very low	32.6	Very low	132 Å²	132	136.5 Å²	136.5	86%	0.857	81%	0.81	S	S	*	*				-139.9	-171.2	101.9	39.2	-26.1	0	0	0	115.6
23	A	32.9	Very low	32.6	Very low	92 Å²	92	132 Å²	132	76%	0.76	81%	0.812	S	S	*	*			trans	-142.8	-174.8	179.8	0	0	0	0	0	108.4
24	S	31.4	Very low	32.5	Very low	103 Å²	103	130.5 Å²	130.5	72%	0.72	82%	0.82	S	S	*	*			cis	-166.4	174.5	14.1	61.3	0	0	0	0	109.2
25	R	29	Very low	32.5	Very low	249 Å²	249	129.3 Å²	129.3	94%	0.94	82%	0.822	S	S	*	*			trans	-174.9	157.1	135.8	-106.7	170.5	178.9	-177.7	-1.6	115.6
26	S	31.5	Very low	32.4	Very low	121 Å²	121	132.4 Å²	132.4	85%	0.846	83%	0.83	S	S	*	*			trans	-105.9	158.4	179.7	47	0	0	0	0	112.1
27	G	28.8	Very low	32.2	Very low	84 Å²	84	131.8 Å²	131.8	87%	0.866	83%	0.833	S	S	*	*			trans	-163.5	114.4	171.6	0	0	0	0	0	111.5
28	S	29.5	Very low	32.2	Very low	101 Å²	101	129.3 Å²	129.3	71%	0.706	83%	0.827	S	S	*	*			trans	-99.7	139.8	178.4	51.4	0	0	0	0	111.2
29	H	30.2	Very low	32	Very low	195 Å²	195	129.9 Å²	129.9	90%	0.903	83%	0.831	S	S	*	*			trans	-165.7	133.6	147.8	-91.8	-59.9	0	0	0	111.8
30	S	29.7	Very low	31.1	Very low	108 Å²	108	129.7 Å²	129.7	76%	0.755	84%	0.839	S	S	*	*			trans	-86.4	159.3	160.5	-49.5	0	0	0	0	109.6
31	P	38.8	Very low	31	Very low	133 Å²	133	121.8 Å²	121.8	86%	0.864	83%	0.834	S	S	*	*				-129.5	176.5	86.2	9.4	13.8	0	0	0	111.5
32	G	27.3	Very low	30.8	Very low	75 Å²	75	118 Å²	118	77%	0.773	84%	0.84	S	S	*	*			cis	125.3	118	14.8	0	0	0	0	0	109
33	S	31.3	Very low	30.1	Very low	130 Å²	130	115.6 Å²	115.6	91%	0.909	84%	0.838	S	S	*	*			trans	-76.5	143.4	-171.8	52	0	0	0	0	113.9
34	G	27.6	Very low	29.9	Very low	83 Å²	83	115.4 Å²	115.4	86%	0.856	85%	0.845	S	S	*	*			trans	-153.8	135.1	168.5	0	0	0	0	0	111.6
35	S	28.9	Very low	29.9	Very low	112 Å²	112	114.3 Å²	114.3	78%	0.783	85%	0.85	S	S	*	*			trans	-131.3	169.9	177.9	-173.7	0	0	0	0	109.3
36	L	29.3	Very low	29.9	Very low	171 Å²	171	115 Å²	115	90%	0.895	85%	0.853	S	S	*	*			trans	91.2	140.9	168.7	-54.5	165.7	0	0	0	118.8
37	G	27.7	Very low	29.9	Very low	83 Å²	83	113 Å²	113	86%	0.856	85%	0.851	S	S	*	*			trans	89.4	134.2	162.9	0	0	0	0	0	115.5
38	G	27.2	Very low	29.9	Very low	71 Å²	71	116 Å²	116	73%	0.732	85%	0.853	S	S	*	*			cis	150.7	124.3	-5.4	0	0	0	0	0	112.7
39	S	28.9	Very low	30	Very low	128 Å²	128	117.9 Å²	117.9	90%	0.895	86%	0.86	S	S	*	*			trans	76	126.7	156.6	-59	0	0	0	0	122.2
40	A	29.8	Very low	30.2	Very low	112 Å²	112	118.1 Å²	118.1	93%	0.926	86%	0.861	S	S	*	*			trans	76.2	125.5	134.7	0	0	0	0	0	121.7
41	G	31	Very low	30.3	Very low	82 Å²	82	118.2 Å²	118.2	85%	0.845	86%	0.862	S	S	*	*			trans	179.6	97.4	166.7	0	0	0	0	0	109.9
42	A	29.9	Very low	30.1	Very low	114 Å²	114	117.7 Å²	117.7	94%	0.942	86%	0.861	S	S	*	*			trans	-87	150.2	-172.9	0	0	0	0	0	113
43	G	31.1	Very low	30.3	Very low	80 Å²	80	117.8 Å²	117.8	83%	0.825	86%	0.863	S	S	*	*			trans	-161.5	105	171.2	0	0	0	0	0	110.3
44	G	29.4	Very low	30.8	Very low	89 Å²	89	116.5 Å²	116.5	92%	0.918	85%	0.849	S	S	*	*			trans	-89.4	149.8	-173	0	0	0	0	0	114
45	G	30.3	Very low	31.6	Very low	80 Å²	80	115.4 Å²	115.4	83%	0.825	83%	0.828	S	S	*	*			trans	-152.4	108	168.7	0	0	0	0	0	110.3
46	R	30.1	Very low	32.2	Very low	264 Å²	264	116.5 Å²	116.5	100%	0.996	83%	0.825	S	S	*	*			trans	-79.5	128.9	175.6	-91.2	178.2	162.8	178.6	-5.7	110
47	G	30.3	Very low	32.9	Very low	77 Å²	77	115.3 Å²	115.3	79%	0.794	81%	0.814	S	S	*	*			trans	-159.3	86.6	170.9	0	0	0	0	0	110.9	V49	G47-V49 PolarHBondContact O-N 3.21Å
48	T	29.4	Very low	33.6	Very low	148 Å²	148	116.3 Å²	116.3	91%	0.908	80%	0.797	S	S	*	*			trans	-83.2	110.7	178.3	38.4	0	0	0	0	111.4
49	V	32.1	Very low	34.3	Very low	141 Å²	141	118.1 Å²	118.1	86%	0.855	79%	0.786	S	S	*	*			trans	-131	129.8	156.6	-179.8	0	0	0	0	107.5	G47 S51	G47-V49 PolarHBondContact O-N 3.21Å; V49-S51 PolarHBondContact O-N 3.04Å
50	Q	35	Very low	34.9	Very low	199 Å²	199	118.5 Å²	118.5	93%	0.93	77%	0.774	S	S	*	*			trans	-68.3	123.7	-179.3	-70.5	167.4	-43.1	0	0	110.2
51	S	30.6	Very low	35.3	Very low	111 Å²	111	119.8 Å²	119.8	78%	0.776	76%	0.761	S	S	*	*			trans	-132	136.2	162.4	98.1	0	0	0	0	109.5	V49 G53	V49-S51 PolarHBondContact O-N 3.04Å; S51-G53 PolarHBondContact O-N 3.34Å; S51-G53 VanDerWaalsContact O-N 3.13Å
52	S	35.5	Very low	35.7	Very low	121 Å²	121	121 Å²	121	85%	0.846	75%	0.747	S	S	*	*			trans	-65.2	108.3	-174.1	-43.2	0	0	0	0	110.9	V54	S52-V54 PolarHBondContact O-N 3.13Å
53	G	31.4	Very low	36.2	Very low	78 Å²	78	121.9 Å²	121.9	80%	0.804	73%	0.731	S	S	*	*			trans	-67	105.3	-179.9	0	0	0	0	0	112.7	S51	S51-G53 PolarHBondContact O-N 3.34Å; S51-G53 VanDerWaalsContact O-N 3.13Å
54	V	40.7	Very low	36.5	Very low	102 Å²	102	121.3 Å²	121.3	62%	0.618	72%	0.719	S	S	*	*			trans	-71	126	157.8	176.8	0	0	0	0	107.4	S52 Q58	S52-V54 PolarHBondContact O-N 3.13Å; V54-Q58 HydrophobicContact CG1-CB 4.04Å; V54-Q58 HydrophobicContact CG1-CG 4.37Å
55	S	44.7	Very low	37.3	Very low	60 Å²	60	128 Å²	128	42%	0.42	72%	0.717	S	S	.	*			trans	-70	146.7	-173.7	71.3	0	0	0	0	112.1	Q57 Q58 Q59	S55-Q57 PolarHBondContact O-N 3.01Å; S55-Q57 VanDerWaalsContact O-N 3.12Å; S55-Q58 WeakPolarHBondContact O-CA 3.21Å; S55-Q58 WeakPolarHBondContact O-CB 3.47Å; S55-Q58 PolarHBondContact O-N 3.09Å; S55-Q58 PolarHBondContact OG-N 3.3Å; S55-Q59 PolarHBondContact O-N 3.12Å; S55-Q59 VanDerWaalsContact O-N 3.15Å
56	L	42.8	Very low	38.2	Very low	136 Å²	136	133.5 Å²	133.5	71%	0.712	71%	0.712	S	S	*	*	H	α-helix	trans	-55.9	-27.5	173.7	-90.7	134.3	0	0	0	112.8	Q59 Q60	L56-Q59 PolarHBondContact O-N 3.13Å; L56-Q60 PolarHBondContact O-N 3.17Å
57	Q	42	Very low	39.5	Very low	145 Å²	145	131.1 Å²	131.1	68%	0.678	70%	0.704	S	S	*	*	H	α-helix	trans	-66.6	-38.8	171.2	-81.1	-179.3	-20.7	0	0	112.7	S55 Q59 Q60 Q61	S55-Q57 PolarHBondContact O-N 3.01Å; S55-Q57 VanDerWaalsContact O-N 3.12Å; Q57-Q59 VanDerWaalsContact C-N 3.34Å; Q57-Q60 PolarHBondContact O-N 3.26Å; Q57-Q61 WeakPolarHBondContact O-CB 3.17Å; Q57-Q61 WeakPolarHBondContact O-CG 3.27Å; Q57-Q61 PolarHBondContact O-N 3.24Å
58	Q	44.2	Very low	41.4	Very low	105 Å²	105	131.8 Å²	131.8	49%	0.491	69%	0.686	S	S	.	*	H	α-helix	trans	-70.9	-33.3	177.2	-161	164.8	33.8	0	0	111.3	V54 S55 Q61 L62	V54-Q58 HydrophobicContact CG1-CB 4.04Å; V54-Q58 HydrophobicContact CG1-CG 4.37Å; S55-Q58 WeakPolarHBondContact O-CA 3.21Å; S55-Q58 WeakPolarHBondContact O-CB 3.47Å; S55-Q58 PolarHBondContact O-N 3.09Å; S55-Q58 PolarHBondContact OG-N 3.3Å; Q58-Q61 PolarHBondContact O-N 2.83Å; Q58-L62 WeakPolarHBondContact O-CB 3.49Å; Q58-L62 WeakPolarHBondContact O-CG 3.26Å; Q58-L62 PolarHBondContact O-N 3.36Å
59	Q	40.3	Very low	44.2	Very low	109 Å²	109	126.1 Å²	126.1	51%	0.509	65%	0.65	S	S	.	*	H	α-helix	trans	-67.8	-43.2	171.6	-153.2	168.6	16.4	0	0	111.6	S55 L56 Q57 Q61 L62 H63	S55-Q59 PolarHBondContact O-N 3.12Å; S55-Q59 VanDerWaalsContact O-N 3.15Å; L56-Q59 PolarHBondContact O-N 3.13Å; Q57-Q59 VanDerWaalsContact C-N 3.34Å; Q59-Q61 PolarHBondContact O-N 2.98Å; Q59-L62 PolarHBondContact O-N 3.04Å; Q59-H63 PolarHBondContact O-CD2 3.33Å; Q59-H63 PolarHBondContact O-N 3Å
60	Q	41.9	Very low	47.1	Very low	136 Å²	136	123.2 Å²	123.2	64%	0.636	63%	0.627	S	S	*	*	H	α-helix	trans	-63.9	-36.5	173	-78.1	-177.6	-11.3	0	0	113.2	L56 Q57 H63 A64	L56-Q60 PolarHBondContact O-N 3.17Å; Q57-Q60 PolarHBondContact O-N 3.26Å; Q60-H63 PolarHBondContact O-N 3.21Å; Q60-A64 WeakPolarHBondContact O-CB 3.44Å; Q60-A64 PolarHBondContact O-N 3.31Å
61	Q	38.5	Very low	49.8	Very low	139 Å²	139	114.4 Å²	114.4	65%	0.65	59%	0.589	S	S	*	*	H	α-helix	trans	-69.5	-34	174.2	-76.6	-177.5	-7.6	0	0	113	Q57 Q58 Q59 A64 R65	Q57-Q61 WeakPolarHBondContact O-CB 3.17Å; Q57-Q61 WeakPolarHBondContact O-CG 3.27Å; Q57-Q61 PolarHBondContact O-N 3.24Å; Q58-Q61 PolarHBondContact O-N 2.83Å; Q59-Q61 PolarHBondContact O-N 2.98Å; Q61-A64 PolarHBondContact O-N 2.85Å; Q61-R65 PolarHBondContact O-N 3.47Å; Q61-R65 VanDerWaalsContact O-N 3.16Å
62	L	39.1	Very low	52.9	Low	108 Å²	108	112.5 Å²	112.5	57%	0.565	57%	0.573	S	S	*	*	H	α-helix	trans	-67.5	-37.7	171.6	-76.5	166.5	0	0	0	112	Q58 Q59 R65	Q58-L62 WeakPolarHBondContact O-CB 3.49Å; Q58-L62 WeakPolarHBondContact O-CG 3.26Å; Q58-L62 PolarHBondContact O-N 3.36Å; Q59-L62 PolarHBondContact O-N 3.04Å; L62-R65 PolarHBondContact O-N 3.47Å
63	H	39.9	Very low	55.7	Low	131 Å²	131	106.7 Å²	106.7	61%	0.606	53%	0.533	S	S	*	.	H	α-helix	trans	-68.4	-31.9	171.8	-78.4	-70.2	0	0	0	113.2	Q59 Q60 R66	Q59-H63 PolarHBondContact O-CD2 3.33Å; Q59-H63 PolarHBondContact O-N 3Å; Q60-H63 PolarHBondContact O-N 3.21Å; H63-R66 PolarHBondContact O-N 3.01Å
64	A	39.2	Very low	58.7	Low	68 Å²	68	103.9 Å²	103.9	56%	0.562	50%	0.501	S	S	*	.	H	α-helix	trans	-69.5	-33.1	175.8	0	0	0	0	0	113	Q60 Q61 R66	Q60-A64 WeakPolarHBondContact O-CB 3.44Å; Q60-A64 PolarHBondContact O-N 3.31Å; Q61-A64 PolarHBondContact O-N 2.85Å; A64-R66 PolarHBondContact O-N 3.16Å
65	R	44.8	Very low	61.2	Low	231 Å²	231	99.9 Å²	99.9	87%	0.872	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-3.7	177.8	-100.1	-176.4	173.6	-176.4	-1	115.1	Q61 L62	Q61-R65 PolarHBondContact O-N 3.47Å; Q61-R65 VanDerWaalsContact O-N 3.16Å; L62-R65 PolarHBondContact O-N 3.47Å
66	R	49.4	Very low	63.1	Low	194 Å²	194	99.2 Å²	99.2	73%	0.732	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.6	8.2	-167.7	-129.7	178	-175.4	175.9	1.1	115.4	H63 A64 Q68	H63-R66 PolarHBondContact O-N 3.01Å; A64-R66 PolarHBondContact O-N 3.16Å; R66-Q68 PolarHBondContact O-N 2.68Å
67	R	56.8	Low	64.9	Low	215 Å²	215	93.8 Å²	93.8	81%	0.811	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-75.1	116.1	177.6	-67.5	-171.9	177.8	-165.9	-1.6	110.2
68	Q	71.1	Confident	66.2	Low	91 Å²	91	87.9 Å²	87.9	43%	0.425	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-54.2	136.7	159.8	-70.5	172.6	-23.1	0	0	107.9	R66 E70 V89 D91	R66-Q68 PolarHBondContact O-N 2.68Å; Q68-E70 PolarHBondContact O-N 3.18Å; Q68-V89 HydrophobicContact CB-CG1 4.09Å; Q68-D91 PolarHBondContact NE2-OD2 2.89Å
69	L	88.5	Confident	67	Low	29 Å²	29	84.1 Å²	84.1	15%	0.152	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	120.7	175.1	164.6	68.3	0	0	0	107.6	L90 F153 W154 Q157	L69-L90 HydrophobicContact CB-CB 4.06Å; L69-L90 HydrophobicContact CB-CD2 4.2Å; L69-L90 HydrophobicContact CD2-CD2 3.95Å; L69-L90 PolarHBondContact N-O 2.86Å; L69-L90 PolarHBondContact O-N 3.41Å; L69-F153 HydrophobicContact CD1-CD1 4.34Å; L69-F153 HydrophobicContact CD1-CE1 3.46Å; L69-F153 VanDerWaalsContact CD1-CE1 3.46Å; L69-F153 HydrophobicContact CD1-CZ 4.01Å; L69-W154 HydrophobicContact CD1-CH2 4.45Å; L69-W154 HydrophobicContact CD1-CZ2 4.35Å; L69-W154 HydrophobicContact CD2-CD2 3.99Å; L69-W154 HydrophobicContact CD2-CE3 3.57Å; L69-W154 HydrophobicContact CD2-CH2 4.22Å; L69-W154 HydrophobicContact CD2-CZ3 3.7Å; L69-W154 HydrophobicContact CG-CD2 4.48Å; L69-W154 HydrophobicContact CG-CE3 4.12Å; L69-W154 HydrophobicContact CG-CH2 3.84Å; L69-W154 HydrophobicContact CG-CZ2 4.2Å; L69-W154 HydrophobicContact CG-CZ3 3.79Å; L69-Q157 HydrophobicContact CD2-CB 3.46Å; L69-Q157 VanDerWaalsContact CD2-CB 3.46Å; L69-Q157 HydrophobicContact CD2-CG 3.81Å
70	E	93	Very high	68	Low	79 Å²	79	83.4 Å²	83.4	37%	0.369	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	153.5	-178.1	58.6	172.4	-156.1	0	0	112.6	Q68 Y87 F88 V89 K106	Q68-E70 PolarHBondContact O-N 3.18Å; E70-Y87 HydrophobicContact CB-CE1 3.72Å; E70-Y87 HydrophobicContact CG-CE1 4.32Å; E70-Y87 WeakPolarHBondContact CG-OH 3.39Å; E70-Y87 PolarHBondContact OE1-OH 2.94Å; E70-Y87 PolarHBondContact OE2-OH 2.99Å; E70-F88 WeakPolarHBondContact CA-O 3.41Å; E70-F88 WeakPolarHBondContact CB-O 3.13Å; E70-V89 HydrophobicContact CB-CG2 4.12Å; E70-K106 IonicContact OE1-NZ 3.09Å; E70-K106 PolarHBondContact OE1-NZ 2.98Å; E70-K106 WeakPolarHBondContact OE2-CE 3.42Å; E70-K106 IonicContact OE2-NZ 2.72Å; E70-K106 PolarHBondContact OE2-NZ 3.26Å
71	G	92.4	Very high	69.3	Low	14 Å²	14	81.9 Å²	81.9	14%	0.144	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	165	174.9	-177	0	0	0	0	0	113.2	F88	G71-F88 PolarHBondContact N-O 3.35Å; G71-F88 VanDerWaalsContact N-O 3.1Å; G71-F88 PolarHBondContact O-N 2.97Å
72	V	94.2	Very high	71.2	Confident	71 Å²	71	76 Å²	76	43%	0.43	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	123	-178.5	178.7	0	0	0	0	110.1	N85 R86 Y87	V72-N85 HydrophobicContact CG1-CB 3.77Å; V72-R86 WeakPolarHBondContact CA-O 3.4Å; V72-Y87 HydrophobicContact CG2-CD2 3.81Å; V72-Y87 HydrophobicContact CG2-CE2 4.42Å
73	L	95.4	Very high	73.4	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	145.6	167	-66	170.6	0	0	0	109.8	K75 R86 F88 F131 L143 A145 W154	L73-K75 PolarHBondContact O-N 3.49Å; L73-K75 VanDerWaalsContact O-N 3.14Å; L73-R86 PolarHBondContact N-O 3.19Å; L73-R86 PolarHBondContact O-N 2.94Å; L73-F88 HydrophobicContact CB-CD2 3.65Å; L73-F88 HydrophobicContact CB-CE2 3.76Å; L73-F88 HydrophobicContact CD1-CD2 4.05Å; L73-F88 HydrophobicContact CD1-CE2 4.48Å; L73-F88 HydrophobicContact CD1-CG 4.2Å; L73-F88 HydrophobicContact CG-CD2 4.16Å; L73-F131 HydrophobicContact CD1-CZ 3.86Å; L73-F131 HydrophobicContact CD2-CE1 4.39Å; L73-F131 HydrophobicContact CD2-CZ 4.41Å; L73-L143 HydrophobicContact CD1-CB 4.42Å; L73-L143 HydrophobicContact CD1-CD1 4.04Å; L73-A145 HydrophobicContact CD2-CB 4.14Å; L73-W154 HydrophobicContact CD1-CD2 3.79Å; L73-W154 HydrophobicContact CD1-CE3 4.07Å; L73-W154 HydrophobicContact CD1-CG 4.11Å; L73-W154 HydrophobicContact CD1-CZ2 4.33Å; L73-W154 HydrophobicContact CD1-CZ3 4.46Å; L73-W154 HydrophobicContact CD2-CD2 4.46Å; L73-W154 HydrophobicContact CD2-CG 4.19Å; L73-W154 HydrophobicContact CG-CD2 4.36Å; L73-W154 HydrophobicContact CG-CZ2 4.39Å
74	S	93.7	Very high	75.8	Confident	19 Å²	19	71.3 Å²	71.3	13%	0.133	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	106.4	164.3	-99.1	0	0	0	0	108.1	W83 N85 L143 K144	S74-W83 VanDerWaalsContact O-CE3 3.27Å; S74-W83 VanDerWaalsContact O-CZ3 3.23Å; S74-W83 WeakPolarHBondContact O-CZ3 3.32Å; S74-N85 PolarHBondContact OG-OD1 3.41Å; S74-L143 CarbonylContact O-C 3.54Å; S74-L143 WeakPolarHBondContact O-CA 3.44Å; S74-K144 WeakPolarHBondContact CB-O 3.29Å; S74-K144 PolarHBondContact N-O 3.13Å; S74-K144 PolarHBondContact O-N 2.9Å
75	K	92.7	Very high	78.3	Confident	17 Å²	17	72.8 Å²	72.8	7%	0.074	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	131.4	172.8	-169.3	-170.4	-178.5	-64.9	0	109.7	L73 T77 Q84 R86 F88 Y99 L143	L73-K75 PolarHBondContact O-N 3.49Å; L73-K75 VanDerWaalsContact O-N 3.14Å; K75-T77 PolarHBondContact O-N 2.61Å; K75-Q84 PolarHBondContact N-O 2.71Å; K75-Q84 PolarHBondContact O-N 3.17Å; K75-R86 HydrophobicContact CB-CB 4.23Å; K75-R86 HydrophobicContact CB-CG 3.94Å; K75-F88 HydrophobicContact CB-CE2 4Å; K75-F88 HydrophobicContact CB-CZ 3.87Å; K75-F88 HydrophobicContact CD-CZ 3.96Å; K75-F88 HydrophobicContact CG-CZ 3.93Å; K75-Y99 HydrophobicContact CD-CD1 4.11Å; K75-Y99 HydrophobicContact CD-CD2 4.17Å; K75-Y99 HydrophobicContact CD-CE1 3.84Å; K75-Y99 HydrophobicContact CD-CE2 3.9Å; K75-Y99 HydrophobicContact CD-CG 4.27Å; K75-L143 HydrophobicContact CB-CD2 4.14Å; K75-L143 HydrophobicContact CG-CD2 3.89Å
76	Y	84.8	Confident	80.7	Confident	46 Å²	46	63.5 Å²	63.5	18%	0.18	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	126.5	165.2	-162.9	-99	0	0	0	109.6	L79 W83 K142	Y76-L79 WeakPolarHBondContact OH-CD2 3.47Å; Y76-W83 AromaticContact CD2-CD2 3.97Å; Y76-W83 HydrophobicContact CD2-CD2 3.97Å; Y76-W83 AromaticContact CD2-CE2 3.79Å; Y76-W83 HydrophobicContact CD2-CE3 4.43Å; Y76-W83 HydrophobicContact CD2-CG 4.3Å; Y76-W83 HydrophobicContact CD2-CZ2 4.12Å; Y76-W83 AromaticContact CD2-NE1 3.99Å; Y76-K142 PolarHBondContact N-O 3.47Å
77	T	81.2	Confident	82.8	Confident	23 Å²	23	55 Å²	55	14%	0.141	26%	0.264	C	S	.	.			trans	-104.4	-68.3	-173.5	47.3	0	0	0	0	111.8	K75 Q81 G82 Q84	K75-T77 PolarHBondContact O-N 2.61Å; T77-Q81 VanDerWaalsContact OG1-CB 3.25Å; T77-Q81 WeakPolarHBondContact OG1-CB 3.32Å; T77-G82 PolarHBondContact N-O 2.9Å; T77-G82 PolarHBondContact OG1-O 2.99Å; T77-Q84 HydrophobicContact CG2-CB 3.84Å; T77-Q84 HydrophobicContact CG2-CG 3.9Å; T77-Q84 WeakPolarHBondContact OG1-CG 3.33Å
78	N	69.8	Low	84.7	Confident	21 Å²	21	44.8 Å²	44.8	11%	0.112	23%	0.226	C	C	.	.			trans	-151	-178.7	171.7	62.3	23.3	0	0	0	109.2	I80 Q81 G82 S422	N78-I80 VanDerWaalsContact C-N 3.3Å; N78-I80 PolarHBondContact O-N 3.5Å; N78-I80 PolarHBondContact OD1-N 3.33Å; N78-I80 VanDerWaalsContact OD1-N 3.16Å; N78-Q81 WeakPolarHBondContact OD1-CB 3.31Å; N78-Q81 PolarHBondContact OD1-N 3.3Å; N78-G82 VanDerWaalsContact O-CA 3.27Å; N78-G82 WeakPolarHBondContact O-CA 3.44Å; N78-G82 PolarHBondContact O-N 3.41Å; N78-S422 PolarHBondContact ND2-O 3.19Å
79	L	59.6	Low	85.8	Confident	26 Å²	26	40.9 Å²	40.9	14%	0.136	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-29.7	-178.9	-76.7	169.1	0	0	0	114.2	Y76 L421 F586 M589 L623	Y76-L79 WeakPolarHBondContact OH-CD2 3.47Å; L79-L421 HydrophobicContact CD1-CB 4.1Å; L79-L421 HydrophobicContact CD1-CD1 3.83Å; L79-L421 HydrophobicContact CD1-CD2 4.09Å; L79-L421 HydrophobicContact CD1-CG 4.23Å; L79-F586 HydrophobicContact CD1-CE2 4.34Å; L79-F586 HydrophobicContact CD1-CZ 3.71Å; L79-F586 HydrophobicContact CG-CZ 4.16Å; L79-M589 HydrophobicContact CD2-CG 4.46Å; L79-M589 HydrophobicContact CD2-SD 3.59Å; L79-M589 VanDerWaalsContact CD2-SD 3.59Å; L79-L623 HydrophobicContact CB-CD1 4.42Å; L79-L623 HydrophobicContact CD1-CD1 4.01Å; L79-L623 HydrophobicContact CD1-CD2 4.49Å; L79-L623 HydrophobicContact CD1-CG 4.09Å; L79-L623 HydrophobicContact CD2-CD1 3.96Å; L79-L623 HydrophobicContact CG-CD1 4.38Å
80	I	62.9	Low	86	Confident	94 Å²	94	39.8 Å²	39.8	48%	0.482	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-49.9	-176.9	-61.3	-163.3	0	0	0	111.6	N78 L418	N78-I80 VanDerWaalsContact C-N 3.3Å; N78-I80 PolarHBondContact O-N 3.5Å; N78-I80 PolarHBondContact OD1-N 3.33Å; N78-I80 VanDerWaalsContact OD1-N 3.16Å; I80-L418 HydrophobicContact CD1-CB 4.14Å; I80-L418 HydrophobicContact CD1-CD2 4.47Å; I80-L418 WeakPolarHBondContact CD1-O 3.23Å; I80-L418 HydrophobicContact CG1-CD2 4.45Å
81	Q	68.3	Low	85.9	Confident	104 Å²	104	37 Å²	37	49%	0.486	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-19.7	-178.2	-65.8	-178.4	-13	0	0	112	T77 N78 W83 Q84	T77-Q81 VanDerWaalsContact OG1-CB 3.25Å; T77-Q81 WeakPolarHBondContact OG1-CB 3.32Å; N78-Q81 WeakPolarHBondContact OD1-CB 3.31Å; N78-Q81 PolarHBondContact OD1-N 3.3Å; Q81-W83 PolarHBondContact O-N 3.36Å; Q81-Q84 HydrophobicContact CB-CG 4.05Å; Q81-Q84 PolarHBondContact O-NE2 3Å
82	G	78.9	Confident	85.6	Confident	16 Å²	16	38.2 Å²	38.2	17%	0.165	20%	0.196	C	C	.	.			trans	57.5	-131.6	176.7	0	0	0	0	0	113	T77 N78	T77-G82 PolarHBondContact N-O 2.9Å; T77-G82 PolarHBondContact OG1-O 2.99Å; N78-G82 VanDerWaalsContact O-CA 3.27Å; N78-G82 WeakPolarHBondContact O-CA 3.44Å; N78-G82 PolarHBondContact O-N 3.41Å
83	W	85.5	Confident	85.2	Confident	77 Å²	77	41.5 Å²	41.5	29%	0.292	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	124.8	173.8	-67.3	103.1	0	0	0	110.6	S74 Y76 Q81 M130 K142 K144	S74-W83 VanDerWaalsContact O-CE3 3.27Å; S74-W83 VanDerWaalsContact O-CZ3 3.23Å; S74-W83 WeakPolarHBondContact O-CZ3 3.32Å; Y76-W83 AromaticContact CD2-CD2 3.97Å; Y76-W83 HydrophobicContact CD2-CD2 3.97Å; Y76-W83 AromaticContact CD2-CE2 3.79Å; Y76-W83 HydrophobicContact CD2-CE3 4.43Å; Y76-W83 HydrophobicContact CD2-CG 4.3Å; Y76-W83 HydrophobicContact CD2-CZ2 4.12Å; Y76-W83 AromaticContact CD2-NE1 3.99Å; Q81-W83 PolarHBondContact O-N 3.36Å; W83-M130 HydrophobicContact CH2-CE 4Å; W83-M130 HydrophobicContact CH2-CG 3.8Å; W83-M130 HydrophobicContact CH2-SD 3.63Å; W83-M130 HydrophobicContact CZ2-CE 4.13Å; W83-M130 HydrophobicContact CZ2-CG 4.21Å; W83-M130 HydrophobicContact CZ2-SD 3.49Å; W83-M130 WeakPolarHBondContact CZ2-SD 3.48Å; W83-K142 HydrophobicContact CH2-CB 4.36Å; W83-K144 HydrophobicContact CE3-CB 3.9Å; W83-K144 HydrophobicContact CH2-CB 3.9Å; W83-K144 HydrophobicContact CZ3-CB 3.55Å
84	Q	88.7	Confident	84.8	Confident	62 Å²	62	46.9 Å²	46.9	29%	0.29	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	125.5	-177.5	-71.5	-70.2	-51.1	0	0	109.3	K75 T77 Q81 R86	K75-Q84 PolarHBondContact N-O 2.71Å; K75-Q84 PolarHBondContact O-N 3.17Å; T77-Q84 HydrophobicContact CG2-CB 3.84Å; T77-Q84 HydrophobicContact CG2-CG 3.9Å; T77-Q84 WeakPolarHBondContact OG1-CG 3.33Å; Q81-Q84 HydrophobicContact CB-CG 4.05Å; Q81-Q84 PolarHBondContact O-NE2 3Å; Q84-R86 PolarHBondContact O-N 3.14Å
85	N	92.3	Very high	84.6	Confident	99 Å²	99	46.1 Å²	46.1	53%	0.529	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	125.4	172.3	-73.1	-15.1	0	0	0	109.4	V72 S74	V72-N85 HydrophobicContact CG1-CB 3.77Å; S74-N85 PolarHBondContact OG-OD1 3.41Å
86	R	94.6	Very high	84.6	Confident	37 Å²	37	47.5 Å²	47.5	14%	0.14	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	145.2	177.8	-65.6	-63.4	173.8	-104.6	-0.6	108	V72 L73 K75 Q84 F88 Y99 F100	V72-R86 WeakPolarHBondContact CA-O 3.4Å; L73-R86 PolarHBondContact N-O 3.19Å; L73-R86 PolarHBondContact O-N 2.94Å; K75-R86 HydrophobicContact CB-CB 4.23Å; K75-R86 HydrophobicContact CB-CG 3.94Å; Q84-R86 PolarHBondContact O-N 3.14Å; R86-F88 HydrophobicContact CB-CD2 4.34Å; R86-F88 HydrophobicContact CB-CE2 3.78Å; R86-F88 HydrophobicContact CB-CZ 4.47Å; R86-F88 WeakPolarHBondContact O-CD2 3.22Å; R86-Y99 HydrophobicContact CB-CD2 3.86Å; R86-Y99 HydrophobicContact CG-CD2 3.85Å; R86-Y99 HydrophobicContact CG-CE2 4.16Å; R86-F100 WeakPolarHBondContact CB-O 3.22Å; R86-F100 WeakPolarHBondContact CD-O 3.42Å
87	Y	94.2	Very high	85.1	Confident	15 Å²	15	45.3 Å²	45.3	6%	0.059	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	117.7	178.3	-164.1	-80.2	0	0	0	108.6	E70 V72 V89 Y99 F100 E103 K106	E70-Y87 HydrophobicContact CB-CE1 3.72Å; E70-Y87 HydrophobicContact CG-CE1 4.32Å; E70-Y87 WeakPolarHBondContact CG-OH 3.39Å; E70-Y87 PolarHBondContact OE1-OH 2.94Å; E70-Y87 PolarHBondContact OE2-OH 2.99Å; V72-Y87 HydrophobicContact CG2-CD2 3.81Å; V72-Y87 HydrophobicContact CG2-CE2 4.42Å; Y87-V89 HydrophobicContact CD1-CG2 4.11Å; Y87-V89 HydrophobicContact CE1-CG2 3.97Å; Y87-Y99 CarbonylContact O-C 3.54Å; Y87-Y99 VanDerWaalsContact O-CA 3.25Å; Y87-Y99 WeakPolarHBondContact O-CA 3.46Å; Y87-F100 PolarHBondContact N-O 3.36Å; Y87-F100 VanDerWaalsContact N-O 3.1Å; Y87-F100 PolarHBondContact O-N 3.15Å; Y87-E103 HydrophobicContact CD2-CB 3.53Å; Y87-E103 HydrophobicContact CD2-CG 4.11Å; Y87-E103 HydrophobicContact CE2-CB 3.63Å; Y87-E103 VanDerWaalsContact CE2-CD 3.42Å; Y87-E103 HydrophobicContact CE2-CG 3.71Å; Y87-E103 WeakPolarHBondContact CE2-OE1 3.36Å; Y87-E103 HydrophobicContact CG-CB 4.11Å; Y87-E103 PolarHBondContact OH-OE1 3.33Å; Y87-K106 HydrophobicContact CE1-CD 4.37Å; Y87-K106 VanDerWaalsContact CZ-CE 3.42Å; Y87-K106 WeakPolarHBondContact OH-CE 3.41Å; Y87-K106 PolarHBondContact OH-NZ 3.43Å
88	F	96.2	Very high	85.7	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	144.8	-179.9	-77.2	-97.1	0	0	0	111	E70 G71 L73 K75 R86 L97 Q98 Y99 F141 L143 W154	E70-F88 WeakPolarHBondContact CA-O 3.41Å; E70-F88 WeakPolarHBondContact CB-O 3.13Å; G71-F88 PolarHBondContact N-O 3.35Å; G71-F88 VanDerWaalsContact N-O 3.1Å; G71-F88 PolarHBondContact O-N 2.97Å; L73-F88 HydrophobicContact CB-CD2 3.65Å; L73-F88 HydrophobicContact CB-CE2 3.76Å; L73-F88 HydrophobicContact CD1-CD2 4.05Å; L73-F88 HydrophobicContact CD1-CE2 4.48Å; L73-F88 HydrophobicContact CD1-CG 4.2Å; L73-F88 HydrophobicContact CG-CD2 4.16Å; K75-F88 HydrophobicContact CB-CE2 4Å; K75-F88 HydrophobicContact CB-CZ 3.87Å; K75-F88 HydrophobicContact CD-CZ 3.96Å; K75-F88 HydrophobicContact CG-CZ 3.93Å; R86-F88 HydrophobicContact CB-CD2 4.34Å; R86-F88 HydrophobicContact CB-CE2 3.78Å; R86-F88 HydrophobicContact CB-CZ 4.47Å; R86-F88 WeakPolarHBondContact O-CD2 3.22Å; F88-L97 HydrophobicContact CB-CD1 4.29Å; F88-L97 HydrophobicContact CD1-CD1 3.73Å; F88-L97 HydrophobicContact CD1-CD2 4.16Å; F88-L97 HydrophobicContact CD1-CG 3.89Å; F88-L97 HydrophobicContact CE1-CD2 4.33Å; F88-L97 HydrophobicContact CE1-CG 4.36Å; F88-L97 HydrophobicContact CG-CD1 4.47Å; F88-Q98 VanDerWaalsContact CA-O 3.31Å; F88-Q98 WeakPolarHBondContact CA-O 3.47Å; F88-Q98 WeakPolarHBondContact CD1-O 3.23Å; F88-Y99 HydrophobicContact CE1-CD1 4.18Å; F88-Y99 HydrophobicContact CE1-CG 4.09Å; F88-Y99 HydrophobicContact CZ-CD1 4.41Å; F88-Y99 HydrophobicContact CZ-CG 4.09Å; F88-F141 HydrophobicContact CE1-CD2 4.01Å; F88-F141 HydrophobicContact CE1-CE2 4.32Å; F88-L143 HydrophobicContact CE1-CD1 4.33Å; F88-L143 HydrophobicContact CE1-CD2 3.72Å; F88-L143 HydrophobicContact CE2-CD2 3.84Å; F88-L143 HydrophobicContact CZ-CD2 3.2Å; F88-W154 HydrophobicContact CB-CH2 3.73Å; F88-W154 HydrophobicContact CB-CZ2 4.44Å; F88-W154 HydrophobicContact CB-CZ3 4.17Å
89	V	94.2	Very high	86.9	Confident	10 Å²	10	46.6 Å²	46.6	6%	0.061	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	117.8	170.3	-176.8	0	0	0	0	107.2	Q68 E70 Y87 Q98 F100	Q68-V89 HydrophobicContact CB-CG1 4.09Å; E70-V89 HydrophobicContact CB-CG2 4.12Å; Y87-V89 HydrophobicContact CD1-CG2 4.11Å; Y87-V89 HydrophobicContact CE1-CG2 3.97Å; V89-Q98 PolarHBondContact N-O 2.93Å; V89-Q98 PolarHBondContact O-N 2.88Å; V89-F100 HydrophobicContact CB-CE2 4.23Å; V89-F100 HydrophobicContact CG2-CD2 4.19Å; V89-F100 HydrophobicContact CG2-CE2 3.76Å
90	L	94.2	Very high	88.5	Confident	5 Å²	5	46 Å²	46	3%	0.026	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	113.5	168.6	170.7	58.8	0	0	0	108	L69 P92 L97 L116 W154 Q157 L158 C161	L69-L90 HydrophobicContact CB-CB 4.06Å; L69-L90 HydrophobicContact CB-CD2 4.2Å; L69-L90 HydrophobicContact CD2-CD2 3.95Å; L69-L90 PolarHBondContact N-O 2.86Å; L69-L90 PolarHBondContact O-N 3.41Å; L90-P92 VanDerWaalsContact O-CD 3.28Å; L90-P92 WeakPolarHBondContact O-CD 3.35Å; L90-L97 HydrophobicContact CB-CD1 4.28Å; L90-L116 HydrophobicContact CD1-CD1 3.3Å; L90-W154 HydrophobicContact CB-CZ3 4.39Å; L90-Q157 HydrophobicContact CD2-CB 4.18Å; L90-L158 HydrophobicContact CD1-CD2 3.94Å; L90-L158 HydrophobicContact CD2-CD2 4.06Å; L90-L158 HydrophobicContact CG-CD2 4.45Å; L90-C161 HydrophobicContact CD1-CB 4.13Å; L90-C161 HydrophobicContact CD2-CB 4.36Å
91	D	90	Very high	89.6	Confident	22 Å²	22	46.4 Å²	46.4	12%	0.118	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	108.7	170.9	-167.1	-43.9	0	0	0	109.6	Q68 E93 L94 G95 Q96	Q68-D91 PolarHBondContact NE2-OD2 2.89Å; D91-E93 VanDerWaalsContact C-N 3.33Å; D91-E93 WeakPolarHBondContact OD1-CA 3.41Å; D91-E93 PolarHBondContact OD1-N 3.42Å; D91-L94 HydrophobicContact CB-CB 4.19Å; D91-L94 PolarHBondContact OD1-N 2.95Å; D91-G95 WeakPolarHBondContact O-CA 3.4Å; D91-G95 PolarHBondContact O-N 3.2Å; D91-Q96 PolarHBondContact N-O 2.92Å; D91-Q96 PolarHBondContact O-N 3.49Å
92	P	86.1	Confident	90.5	Very high	39 Å²	39	45 Å²	45	25%	0.253	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-14.9	-179.1	34.6	-36	0	0	0	113.4	L90 H165	L90-P92 VanDerWaalsContact O-CD 3.28Å; L90-P92 WeakPolarHBondContact O-CD 3.35Å; P92-H165 PolarHBondContact O-NE2 3.42Å
93	E	85.4	Confident	91	Very high	139 Å²	139	48.4 Å²	48.4	65%	0.65	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-40.6	178.6	-63.6	-172.6	-178.9	0	0	110.5	D91 H165	D91-E93 VanDerWaalsContact C-N 3.33Å; D91-E93 WeakPolarHBondContact OD1-CA 3.41Å; D91-E93 PolarHBondContact OD1-N 3.42Å; E93-H165 PolarHBondContact O-CE1 3.39Å; E93-H165 VanDerWaalsContact O-CE1 3.24Å
94	L	86.8	Confident	90.9	Very high	113 Å²	113	51.2 Å²	51.2	59%	0.592	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-14.9	175.9	-62	-179.2	0	0	0	114.3	D91 Q96	D91-L94 HydrophobicContact CB-CB 4.19Å; D91-L94 PolarHBondContact OD1-N 2.95Å; L94-Q96 HydrophobicContact CB-CB 4.43Å; L94-Q96 HydrophobicContact CB-CG 3.97Å
95	G	90.4	Very high	90.4	Very high	3 Å²	3	48.7 Å²	48.7	3%	0.031	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	68	36.6	-177.2	0	0	0	0	0	112.8	D91 L116 H165	D91-G95 WeakPolarHBondContact O-CA 3.4Å; D91-G95 PolarHBondContact O-N 3.2Å; G95-L116 WeakPolarHBondContact O-CB 3.37Å; G95-L116 PolarHBondContact O-N 2.88Å; G95-H165 VanDerWaalsContact CA-CD2 3.43Å; G95-H165 WeakPolarHBondContact CA-CD2 3.5Å; G95-H165 WeakPolarHBondContact CA-NE2 3.31Å; G95-H165 PolarHBondContact N-NE2 3.46Å
96	Q	92.8	Very high	89.8	Confident	47 Å²	47	47.2 Å²	47.2	22%	0.22	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	137.4	-174	-66	-69.1	-35.5	0	0	111	D91 L94 Q98 S113 L114	D91-Q96 PolarHBondContact N-O 2.92Å; D91-Q96 PolarHBondContact O-N 3.49Å; L94-Q96 HydrophobicContact CB-CB 4.43Å; L94-Q96 HydrophobicContact CB-CG 3.97Å; Q96-Q98 HydrophobicContact CB-CG 4.42Å; Q96-S113 PolarHBondContact OE1-OG 3.19Å; Q96-L114 PolarHBondContact OE1-O 3.34Å
97	L	95.3	Very high	88.8	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	109.5	164.4	-180	61.1	0	0	0	109.5	F88 L90 S113 L114 L116 V133 F141 L143 W154 L158	F88-L97 HydrophobicContact CB-CD1 4.29Å; F88-L97 HydrophobicContact CD1-CD1 3.73Å; F88-L97 HydrophobicContact CD1-CD2 4.16Å; F88-L97 HydrophobicContact CD1-CG 3.89Å; F88-L97 HydrophobicContact CE1-CD2 4.33Å; F88-L97 HydrophobicContact CE1-CG 4.36Å; F88-L97 HydrophobicContact CG-CD1 4.47Å; L90-L97 HydrophobicContact CB-CD1 4.28Å; L97-S113 CarbonylContact O-C 3.58Å; L97-S113 WeakPolarHBondContact O-CA 3.39Å; L97-L114 PolarHBondContact N-O 3.2Å; L97-L114 PolarHBondContact O-N 3.32Å; L97-L116 HydrophobicContact CB-CD1 4.28Å; L97-L116 HydrophobicContact CB-CD2 4.26Å; L97-L116 HydrophobicContact CB-CG 4.37Å; L97-V133 HydrophobicContact CD2-CG2 4.34Å; L97-F141 HydrophobicContact CD2-CD2 4.16Å; L97-L143 HydrophobicContact CD2-CD1 4.08Å; L97-W154 HydrophobicContact CD1-CZ3 4.25Å; L97-L158 HydrophobicContact CB-CD2 4.28Å; L97-L158 HydrophobicContact CD1-CD2 3.93Å; L97-L158 HydrophobicContact CD2-CD1 4.26Å; L97-L158 HydrophobicContact CD2-CD2 3.81Å; L97-L158 HydrophobicContact CG-CD2 4.21Å
98	Q	94.4	Very high	88.1	Confident	43 Å²	43	57.8 Å²	57.8	20%	0.201	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	154.8	179.5	-68.6	179.5	10.4	0	0	111.4	F88 V89 Q96 F100 P110 G112 S113	F88-Q98 VanDerWaalsContact CA-O 3.31Å; F88-Q98 WeakPolarHBondContact CA-O 3.47Å; F88-Q98 WeakPolarHBondContact CD1-O 3.23Å; V89-Q98 PolarHBondContact N-O 2.93Å; V89-Q98 PolarHBondContact O-N 2.88Å; Q96-Q98 HydrophobicContact CB-CG 4.42Å; Q98-F100 HydrophobicContact CB-CE2 4.27Å; Q98-P110 HydrophobicContact CB-CB 4.1Å; Q98-P110 HydrophobicContact CG-CB 4.31Å; Q98-P110 HydrophobicContact CG-CG 4.38Å; Q98-G112 WeakPolarHBondContact CA-O 2.93Å; Q98-S113 VanDerWaalsContact CG-OG 3.3Å; Q98-S113 WeakPolarHBondContact CG-OG 3.47Å
99	Y	94.1	Very high	87.5	Confident	28 Å²	28	67 Å²	67	11%	0.11	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	150.4	170.5	80.3	-88.6	0	0	0	114.2	K75 R86 Y87 F88 R111 G112 F141	K75-Y99 HydrophobicContact CD-CD1 4.11Å; K75-Y99 HydrophobicContact CD-CD2 4.17Å; K75-Y99 HydrophobicContact CD-CE1 3.84Å; K75-Y99 HydrophobicContact CD-CE2 3.9Å; K75-Y99 HydrophobicContact CD-CG 4.27Å; R86-Y99 HydrophobicContact CB-CD2 3.86Å; R86-Y99 HydrophobicContact CG-CD2 3.85Å; R86-Y99 HydrophobicContact CG-CE2 4.16Å; Y87-Y99 CarbonylContact O-C 3.54Å; Y87-Y99 VanDerWaalsContact O-CA 3.25Å; Y87-Y99 WeakPolarHBondContact O-CA 3.46Å; F88-Y99 HydrophobicContact CE1-CD1 4.18Å; F88-Y99 HydrophobicContact CE1-CG 4.09Å; F88-Y99 HydrophobicContact CZ-CD1 4.41Å; F88-Y99 HydrophobicContact CZ-CG 4.09Å; Y99-R111 HydrophobicContact CD2-CB 4.13Å; Y99-R111 HydrophobicContact CE2-CB 3.72Å; Y99-R111 HydrophobicContact CE2-CG 3.76Å; Y99-R111 PolarHBondContact O-N 2.68Å; Y99-G112 PolarHBondContact N-O 3.27Å; Y99-G112 PolarHBondContact O-N 2.78Å; Y99-F141 AromaticContact CD1-CE2 3.82Å; Y99-F141 HydrophobicContact CD1-CE2 3.82Å; Y99-F141 AromaticContact CD1-CZ 3.84Å; Y99-F141 HydrophobicContact CD1-CZ 3.84Å; Y99-F141 HydrophobicContact CE1-CE1 4.18Å; Y99-F141 HydrophobicContact CE1-CE2 4.16Å; Y99-F141 AromaticContact CE1-CZ 3.71Å; Y99-F141 HydrophobicContact CE1-CZ 3.71Å
100	F	92.3	Very high	87.3	Confident	13 Å²	13	68.4 Å²	68.4	6%	0.057	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	165.7	-177.9	-54.1	-92.7	0	0	0	109.6	R86 Y87 V89 Q98 N102 G105 Q108 P110	R86-F100 WeakPolarHBondContact CB-O 3.22Å; R86-F100 WeakPolarHBondContact CD-O 3.42Å; Y87-F100 PolarHBondContact N-O 3.36Å; Y87-F100 VanDerWaalsContact N-O 3.1Å; Y87-F100 PolarHBondContact O-N 3.15Å; V89-F100 HydrophobicContact CB-CE2 4.23Å; V89-F100 HydrophobicContact CG2-CD2 4.19Å; V89-F100 HydrophobicContact CG2-CE2 3.76Å; Q98-F100 HydrophobicContact CB-CE2 4.27Å; F100-N102 VanDerWaalsContact C-N 3.34Å; F100-N102 WeakPolarHBondContact CB-O 3.33Å; F100-G105 WeakPolarHBondContact CD1-O 3.45Å; F100-Q108 WeakPolarHBondContact CE1-O 3.41Å; F100-P110 HydrophobicContact CD1-CB 4.33Å; F100-P110 VanDerWaalsContact CE1-CA 3.49Å; F100-P110 HydrophobicContact CE1-CB 3.73Å; F100-P110 HydrophobicContact CE1-CG 4.48Å; F100-P110 HydrophobicContact CE2-CB 4.48Å; F100-P110 HydrophobicContact CZ-CB 3.81Å
101	I	86.7	Confident	86.9	Confident	103 Å²	103	76.7 Å²	76.7	53%	0.528	37%	0.373	S	S	.	.	S	Bend	trans	-64.3	-44.1	178.8	-64.3	175	0	0	0	110.2
102	N	88.3	Confident	86.8	Confident	74 Å²	74	76.6 Å²	76.6	40%	0.396	38%	0.377	S	S	.	.	S	Bend	trans	-149.8	177.3	178.1	58.2	8.7	0	0	0	109.3	F100 Q104 G105	F100-N102 VanDerWaalsContact C-N 3.34Å; F100-N102 WeakPolarHBondContact CB-O 3.33Å; N102-Q104 VanDerWaalsContact C-N 3.33Å; N102-Q104 VanDerWaalsContact CG-OE1 3.31Å; N102-Q104 PolarHBondContact ND2-OE1 3Å; N102-Q104 PolarHBondContact O-N 3.13Å; N102-G105 PolarHBondContact O-N 3.37Å; N102-G105 PolarHBondContact OD1-N 2.9Å
103	E	88	Confident	87	Confident	87 Å²	87	76.6 Å²	76.6	41%	0.407	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-63.1	-37.8	179.5	-178.1	154.5	-142.7	0	0	113	Y87 G105 K106	Y87-E103 HydrophobicContact CD2-CB 3.53Å; Y87-E103 HydrophobicContact CD2-CG 4.11Å; Y87-E103 HydrophobicContact CE2-CB 3.63Å; Y87-E103 VanDerWaalsContact CE2-CD 3.42Å; Y87-E103 HydrophobicContact CE2-CG 3.71Å; Y87-E103 WeakPolarHBondContact CE2-OE1 3.36Å; Y87-E103 HydrophobicContact CG-CB 4.11Å; Y87-E103 PolarHBondContact OH-OE1 3.33Å; E103-G105 PolarHBondContact O-N 3.37Å; E103-K106 HydrophobicContact CG-CD 4.21Å; E103-K106 WeakPolarHBondContact O-CB 3.46Å; E103-K106 WeakPolarHBondContact O-CD 3.43Å; E103-K106 WeakPolarHBondContact O-CG 3.47Å; E103-K106 PolarHBondContact O-N 3.39Å; E103-K106 VanDerWaalsContact O-N 3.16Å; E103-K106 IonicContact OE1-NZ 3.97Å; E103-K106 PolarHBondContact OE1-NZ 3.1Å
104	Q	83.8	Confident	87.3	Confident	137 Å²	137	70 Å²	70	64%	0.64	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-64.7	-22.4	179.4	-61.2	74.7	21.1	0	0	111.9	N102 K106	N102-Q104 VanDerWaalsContact C-N 3.33Å; N102-Q104 VanDerWaalsContact CG-OE1 3.31Å; N102-Q104 PolarHBondContact ND2-OE1 3Å; N102-Q104 PolarHBondContact O-N 3.13Å; Q104-K106 VanDerWaalsContact C-N 3.28Å; Q104-K106 PolarHBondContact O-N 3.46Å
105	G	78.3	Confident	87.6	Confident	9 Å²	9	65.9 Å²	65.9	9%	0.093	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-74.5	-4.6	176.1	0	0	0	0	0	115.6	F100 N102 E103 T107 Q108	F100-G105 WeakPolarHBondContact CD1-O 3.45Å; N102-G105 PolarHBondContact O-N 3.37Å; N102-G105 PolarHBondContact OD1-N 2.9Å; E103-G105 PolarHBondContact O-N 3.37Å; G105-T107 PolarHBondContact O-N 3.27Å; G105-T107 VanDerWaalsContact O-N 3.12Å; G105-Q108 WeakPolarHBondContact O-CB 3.44Å; G105-Q108 PolarHBondContact O-N 3.4Å
106	K	79.1	Confident	87.7	Confident	68 Å²	68	65.8 Å²	65.8	30%	0.296	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-52.4	-30.5	177.4	-79.6	170.1	177.7	176.5	0	114.1	E70 Y87 E103 Q104 Q108	E70-K106 IonicContact OE1-NZ 3.09Å; E70-K106 PolarHBondContact OE1-NZ 2.98Å; E70-K106 WeakPolarHBondContact OE2-CE 3.42Å; E70-K106 IonicContact OE2-NZ 2.72Å; E70-K106 PolarHBondContact OE2-NZ 3.26Å; Y87-K106 HydrophobicContact CE1-CD 4.37Å; Y87-K106 VanDerWaalsContact CZ-CE 3.42Å; Y87-K106 WeakPolarHBondContact OH-CE 3.41Å; Y87-K106 PolarHBondContact OH-NZ 3.43Å; E103-K106 HydrophobicContact CG-CD 4.21Å; E103-K106 WeakPolarHBondContact O-CB 3.46Å; E103-K106 WeakPolarHBondContact O-CD 3.43Å; E103-K106 WeakPolarHBondContact O-CG 3.47Å; E103-K106 PolarHBondContact O-N 3.39Å; E103-K106 VanDerWaalsContact O-N 3.16Å; E103-K106 IonicContact OE1-NZ 3.97Å; E103-K106 PolarHBondContact OE1-NZ 3.1Å; Q104-K106 VanDerWaalsContact C-N 3.28Å; Q104-K106 PolarHBondContact O-N 3.46Å; K106-Q108 VanDerWaalsContact C-N 3.28Å; K106-Q108 PolarHBondContact O-N 3.32Å
107	T	74.3	Confident	87.6	Confident	132 Å²	132	67 Å²	67	81%	0.81	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-80.5	-6.3	-179.8	55.1	0	0	0	0	113.6	G105	G105-T107 PolarHBondContact O-N 3.27Å; G105-T107 VanDerWaalsContact O-N 3.12Å
108	Q	79.9	Confident	87.1	Confident	141 Å²	141	69 Å²	69	66%	0.659	35%	0.354	S	S	*	.	S	Bend	trans	-103.3	171.7	177.2	-58.8	-174.2	-5	0	0	110.8	F100 G105 K106	F100-Q108 WeakPolarHBondContact CE1-O 3.41Å; G105-Q108 WeakPolarHBondContact O-CB 3.44Å; G105-Q108 PolarHBondContact O-N 3.4Å; K106-Q108 VanDerWaalsContact C-N 3.28Å; K106-Q108 PolarHBondContact O-N 3.32Å
109	K	83.8	Confident	86.9	Confident	193 Å²	193	67.4 Å²	67.4	84%	0.839	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-62.3	133.7	174.9	-172.6	175.7	-178.5	173.2	0	110.4
110	P	88.4	Confident	86.8	Confident	40 Å²	40	69.1 Å²	69.1	26%	0.26	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-57.5	142.5	178.6	22.1	-34	0	0	0	112	Q98 F100 G112	Q98-P110 HydrophobicContact CB-CB 4.1Å; Q98-P110 HydrophobicContact CG-CB 4.31Å; Q98-P110 HydrophobicContact CG-CG 4.38Å; F100-P110 HydrophobicContact CD1-CB 4.33Å; F100-P110 VanDerWaalsContact CE1-CA 3.49Å; F100-P110 HydrophobicContact CE1-CB 3.73Å; F100-P110 HydrophobicContact CE1-CG 4.48Å; F100-P110 HydrophobicContact CE2-CB 4.48Å; F100-P110 HydrophobicContact CZ-CB 3.81Å; P110-G112 PolarHBondContact O-N 3.39Å
111	R	87	Confident	86.8	Confident	180 Å²	180	69 Å²	69	68%	0.679	37%	0.365	S	S	*	.	S	Bend	trans	-73.8	-19.2	-179.7	-171.5	57	174.5	-179.9	0.5	112.2	Y99	Y99-R111 HydrophobicContact CD2-CB 4.13Å; Y99-R111 HydrophobicContact CE2-CB 3.72Å; Y99-R111 HydrophobicContact CE2-CG 3.76Å; Y99-R111 PolarHBondContact O-N 2.68Å
112	G	87.6	Confident	86.9	Confident	19 Å²	19	67.1 Å²	67.1	20%	0.196	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	156.6	161.5	0	0	0	0	0	110.9	Q98 Y99 P110	Q98-G112 WeakPolarHBondContact CA-O 2.93Å; Y99-G112 PolarHBondContact N-O 3.27Å; Y99-G112 PolarHBondContact O-N 2.78Å; P110-G112 PolarHBondContact O-N 3.39Å
113	S	91	Very high	86.8	Confident	39 Å²	39	67.8 Å²	67.8	27%	0.273	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	146.9	172.8	-163.3	0	0	0	0	107.7	Q96 L97 Q98	Q96-S113 PolarHBondContact OE1-OG 3.19Å; L97-S113 CarbonylContact O-C 3.58Å; L97-S113 WeakPolarHBondContact O-CA 3.39Å; Q98-S113 VanDerWaalsContact CG-OG 3.3Å; Q98-S113 WeakPolarHBondContact CG-OG 3.47Å
114	L	91.9	Very high	86.3	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	121.1	176.5	-177	153	0	0	0	108.8	Q96 L97 L116 V133 F141	Q96-L114 PolarHBondContact OE1-O 3.34Å; L97-L114 PolarHBondContact N-O 3.2Å; L97-L114 PolarHBondContact O-N 3.32Å; L114-L116 HydrophobicContact CD2-CD2 3.75Å; L114-V133 HydrophobicContact CD1-CB 4.5Å; L114-V133 HydrophobicContact CD1-CG1 4.26Å; L114-V133 HydrophobicContact CD2-CG1 3.59Å; L114-F141 HydrophobicContact CB-CD2 4.02Å; L114-F141 HydrophobicContact CB-CE1 4.39Å; L114-F141 HydrophobicContact CB-CE2 3.57Å; L114-F141 HydrophobicContact CB-CZ 3.77Å; L114-F141 HydrophobicContact CD1-CB 4.14Å; L114-F141 HydrophobicContact CD1-CD1 3.88Å; L114-F141 HydrophobicContact CD1-CD2 3.86Å; L114-F141 HydrophobicContact CD1-CE1 4.19Å; L114-F141 HydrophobicContact CD1-CE2 4.19Å; L114-F141 HydrophobicContact CD1-CG 3.69Å; L114-F141 HydrophobicContact CD1-CZ 4.34Å
115	P	91.8	Very high	85.8	Confident	28 Å²	28	65.9 Å²	65.9	18%	0.182	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	129.8	178.3	25.7	-27.3	0	0	0	110.5	S135	P115-S135 WeakPolarHBondContact CG-OG 3.35Å; P115-S135 PolarHBondContact O-OG 3.48Å
116	L	92.9	Very high	85.3	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	39%	0.386	C	S	.	.			trans	-92.2	-7.8	-175.9	-64	175	0	0	0	114.1	L90 G95 L97 L114 G118 A119 V133 L158 C161 A162	L90-L116 HydrophobicContact CD1-CD1 3.3Å; G95-L116 WeakPolarHBondContact O-CB 3.37Å; G95-L116 PolarHBondContact O-N 2.88Å; L97-L116 HydrophobicContact CB-CD1 4.28Å; L97-L116 HydrophobicContact CB-CD2 4.26Å; L97-L116 HydrophobicContact CB-CG 4.37Å; L114-L116 HydrophobicContact CD2-CD2 3.75Å; L116-G118 PolarHBondContact O-N 3.48Å; L116-A119 HydrophobicContact CB-CB 4.47Å; L116-A119 HydrophobicContact CD2-CB 4.21Å; L116-A119 VanDerWaalsContact O-CB 3.31Å; L116-A119 WeakPolarHBondContact O-CB 3.42Å; L116-A119 PolarHBondContact O-N 3.49Å; L116-V133 HydrophobicContact CD2-CG1 3.83Å; L116-L158 HydrophobicContact CD1-CD2 3.96Å; L116-L158 HydrophobicContact CD2-CD2 4.33Å; L116-C161 HydrophobicContact CD1-CB 4.03Å; L116-A162 HydrophobicContact CB-CB 4.27Å; L116-A162 VanDerWaalsContact O-CA 3.23Å; L116-A162 WeakPolarHBondContact O-CA 3.44Å; L116-A162 WeakPolarHBondContact O-CB 3.42Å
117	I	90.8	Very high	85.1	Confident	72 Å²	72	69.1 Å²	69.1	37%	0.369	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	122.6	174	-172.2	168.1	0	0	0	110.3	A119 V136 H165	I117-A119 PolarHBondContact O-N 3.04Å; I117-A119 VanDerWaalsContact O-N 3.15Å; I117-V136 WeakPolarHBondContact O-CG2 3.43Å; I117-H165 HydrophobicContact CB-CB 4.4Å
118	G	85.4	Confident	85.5	Confident	42 Å²	42	67.4 Å²	67.4	43%	0.433	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.8	5.9	-172.2	0	0	0	0	0	115.9	L116 V136 S166	L116-G118 PolarHBondContact O-N 3.48Å; G118-V136 VanDerWaalsContact C-CG1 3.48Å; G118-V136 VanDerWaalsContact O-CG1 3.25Å; G118-V136 WeakPolarHBondContact O-CG1 3.46Å; G118-S166 PolarHBondContact N-OG 2.85Å
119	A	90	Very high	86	Confident	11 Å²	11	65.6 Å²	65.6	9%	0.091	36%	0.36	C	S	.	.			trans	-72.5	141.1	-177.1	0	0	0	0	0	112	L116 I117 H134	L116-A119 HydrophobicContact CB-CB 4.47Å; L116-A119 HydrophobicContact CD2-CB 4.21Å; L116-A119 VanDerWaalsContact O-CB 3.31Å; L116-A119 WeakPolarHBondContact O-CB 3.42Å; L116-A119 PolarHBondContact O-N 3.49Å; I117-A119 PolarHBondContact O-N 3.04Å; I117-A119 VanDerWaalsContact O-N 3.15Å; A119-H134 CarbonylContact C-O 3.59Å; A119-H134 WeakPolarHBondContact CA-O 3.34Å; A119-H134 VanDerWaalsContact CB-O 3.27Å; A119-H134 WeakPolarHBondContact CB-O 3.3Å
120	S	91	Very high	86.3	Confident	64 Å²	64	56.5 Å²	56.5	45%	0.448	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	143.2	173.1	64.5	0	0	0	0	111.1	H134	S120-H134 PolarHBondContact N-O 3.05Å; S120-H134 PolarHBondContact O-N 2.85Å
121	V	93.1	Very high	86.5	Confident	11 Å²	11	54.6 Å²	54.6	7%	0.067	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	115.4	178.8	-172	0	0	0	0	108.5	F131 S132 V133 I155 L158 Q159	V121-F131 HydrophobicContact CG1-CD2 4.1Å; V121-S132 WeakPolarHBondContact CA-O 3.44Å; V121-V133 HydrophobicContact CG1-CG2 4.25Å; V121-V133 HydrophobicContact CG2-CG1 4.3Å; V121-V133 HydrophobicContact CG2-CG2 4.39Å; V121-I155 HydrophobicContact CG1-CB 4.39Å; V121-I155 HydrophobicContact CG1-CG1 4.1Å; V121-I155 HydrophobicContact CG1-CG2 4.12Å; V121-L158 HydrophobicContact CG2-CB 3.95Å; V121-Q159 HydrophobicContact CB-CG 3.71Å; V121-Q159 HydrophobicContact CG2-CG 3.96Å; V121-Q159 PolarHBondContact O-NE2 3.21Å; V121-Q159 VanDerWaalsContact O-NE2 3.14Å
122	T	88.4	Confident	86.7	Confident	62 Å²	62	46.3 Å²	46.3	38%	0.38	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	140.7	-174.5	49.3	0	0	0	0	111	F131 S132	T122-F131 CarbonylContact O-C 3.59Å; T122-F131 VanDerWaalsContact O-CA 3.27Å; T122-F131 WeakPolarHBondContact O-CA 3.43Å; T122-F131 WeakPolarHBondContact O-CB 3.24Å; T122-S132 PolarHBondContact N-O 3.07Å; T122-S132 PolarHBondContact O-N 3.21Å
123	T	86.9	Confident	87	Confident	89 Å²	89	45.4 Å²	45.4	55%	0.546	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	156.8	164.7	43.7	0	0	0	0	110.1	I155	T123-I155 HydrophobicContact CG2-CD1 3.67Å
124	S	77.3	Confident	86.9	Confident	19 Å²	19	46.8 Å²	46.8	13%	0.133	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	126.3	179.8	179.8	0	0	0	0	110.6	E126 M130	S124-E126 PolarHBondContact O-N 2.99Å; S124-E126 WeakPolarHBondContact OG-CG 3.44Å; S124-M130 PolarHBondContact N-O 3.13Å
125	D	73.1	Confident	86.7	Confident	165 Å²	165	47.2 Å²	47.2	88%	0.882	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	1.2	-179.5	-52.6	-32.1	0	0	0	112.6	A127	D125-A127 PolarHBondContact O-N 3.36Å
126	E	67.5	Low	86.2	Confident	122 Å²	122	50.9 Å²	50.9	57%	0.57	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-26.2	178.9	-69.3	-178.9	-155.3	0	0	113.2	S124 M130 K142	S124-E126 PolarHBondContact O-N 2.99Å; S124-E126 WeakPolarHBondContact OG-CG 3.44Å; E126-M130 HydrophobicContact CB-CE 4Å; E126-M130 HydrophobicContact CB-SD 3.74Å; E126-M130 HydrophobicContact CG-CE 4.47Å; E126-M130 WeakPolarHBondContact OE2-CE 3.33Å; E126-K142 IonicContact OE1-NZ 2.85Å; E126-K142 PolarHBondContact OE1-NZ 2.96Å; E126-K142 IonicContact OE2-NZ 3.96Å; E126-K142 PolarHBondContact OE2-NZ 3.35Å
127	A	74.3	Confident	85.4	Confident	22 Å²	22	55.2 Å²	55.2	18%	0.182	32%	0.318	C	S	.	.	S	Bend	trans	-155.7	155.1	174.2	0	0	0	0	0	111.3	D125 Y129 M130	D125-A127 PolarHBondContact O-N 3.36Å; A127-Y129 PolarHBondContact O-N 3.26Å; A127-M130 HydrophobicContact CB-CB 4.14Å; A127-M130 HydrophobicContact CB-SD 3.82Å; A127-M130 WeakPolarHBondContact O-CB 3.42Å; A127-M130 PolarHBondContact O-N 3.47Å
128	P	82.4	Confident	84.5	Confident	96 Å²	96	54 Å²	54	62%	0.623	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	133.8	174.3	-25.7	34.7	0	0	0	112.1	M130 K144	P128-M130 PolarHBondContact O-N 3.03Å; P128-K144 WeakPolarHBondContact O-CD 3.29Å; P128-K144 VanDerWaalsContact O-CG 3.24Å; P128-K144 WeakPolarHBondContact O-CG 3.18Å
129	Y	90.5	Very high	84.2	Confident	104 Å²	104	56.1 Å²	56.1	41%	0.408	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	25	176.1	-37.6	-47.7	0	0	0	115.1	A127 K144 A145 S146 A148 Q151	A127-Y129 PolarHBondContact O-N 3.26Å; Y129-K144 WeakPolarHBondContact O-CA 3.44Å; Y129-A145 PolarHBondContact O-N 3.49Å; Y129-S146 WeakPolarHBondContact CD2-O 3.25Å; Y129-A148 HydrophobicContact CD1-CB 3.77Å; Y129-A148 VanDerWaalsContact CD1-N 3.29Å; Y129-A148 HydrophobicContact CE1-CB 3.77Å; Y129-Q151 VanDerWaalsContact CA-CD 3.5Å
130	M	90.1	Very high	84.1	Confident	1 Å²	1	57 Å²	57	1%	0.005	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	145.1	-176.8	-174	175	158.1	0	0	113.3	W83 S124 E126 A127 P128 K142 L143 Q151	W83-M130 HydrophobicContact CH2-CE 4Å; W83-M130 HydrophobicContact CH2-CG 3.8Å; W83-M130 HydrophobicContact CH2-SD 3.63Å; W83-M130 HydrophobicContact CZ2-CE 4.13Å; W83-M130 HydrophobicContact CZ2-CG 4.21Å; W83-M130 HydrophobicContact CZ2-SD 3.49Å; W83-M130 WeakPolarHBondContact CZ2-SD 3.48Å; S124-M130 PolarHBondContact N-O 3.13Å; E126-M130 HydrophobicContact CB-CE 4Å; E126-M130 HydrophobicContact CB-SD 3.74Å; E126-M130 HydrophobicContact CG-CE 4.47Å; E126-M130 WeakPolarHBondContact OE2-CE 3.33Å; A127-M130 HydrophobicContact CB-CB 4.14Å; A127-M130 HydrophobicContact CB-SD 3.82Å; A127-M130 WeakPolarHBondContact O-CB 3.42Å; A127-M130 PolarHBondContact O-N 3.47Å; P128-M130 PolarHBondContact O-N 3.03Å; M130-K142 HydrophobicContact CE-CB 4.16Å; M130-K142 HydrophobicContact CE-CD 3.35Å; M130-K142 HydrophobicContact CE-CG 3.7Å; M130-L143 CarbonylContact C-O 3.58Å; M130-L143 WeakPolarHBondContact CA-O 3.43Å; M130-L143 WeakPolarHBondContact CG-O 3.47Å; M130-Q151 PolarHBondContact O-NE2 3.34Å
131	F	93.5	Very high	84.2	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	159.6	175.3	63.7	-78.9	0	0	0	111.2	L73 V121 T122 V133 L143 Q151 W154 I155 L158	L73-F131 HydrophobicContact CD1-CZ 3.86Å; L73-F131 HydrophobicContact CD2-CE1 4.39Å; L73-F131 HydrophobicContact CD2-CZ 4.41Å; V121-F131 HydrophobicContact CG1-CD2 4.1Å; T122-F131 CarbonylContact O-C 3.59Å; T122-F131 VanDerWaalsContact O-CA 3.27Å; T122-F131 WeakPolarHBondContact O-CA 3.43Å; T122-F131 WeakPolarHBondContact O-CB 3.24Å; F131-V133 HydrophobicContact CD2-CG2 4.32Å; F131-V133 HydrophobicContact CE2-CG2 4.29Å; F131-L143 HydrophobicContact CD1-CB 4.18Å; F131-L143 HydrophobicContact CD2-CB 4.19Å; F131-L143 HydrophobicContact CD2-CD1 4.42Å; F131-L143 HydrophobicContact CE1-CB 3.81Å; F131-L143 HydrophobicContact CE2-CB 3.82Å; F131-L143 HydrophobicContact CE2-CD1 3.62Å; F131-L143 HydrophobicContact CE2-CG 4.29Å; F131-L143 HydrophobicContact CG-CB 4.37Å; F131-L143 HydrophobicContact CZ-CB 3.62Å; F131-L143 HydrophobicContact CZ-CD1 3.91Å; F131-L143 HydrophobicContact CZ-CG 4.4Å; F131-L143 PolarHBondContact N-O 2.7Å; F131-L143 PolarHBondContact O-N 3.47Å; F131-Q151 HydrophobicContact CD1-CG 3.98Å; F131-W154 HydrophobicContact CE1-CB 4.42Å; F131-W154 HydrophobicContact CE2-CB 4.34Å; F131-W154 HydrophobicContact CZ-CB 3.75Å; F131-W154 HydrophobicContact CZ-CG 4.42Å; F131-I155 HydrophobicContact CB-CD1 3.79Å; F131-I155 HydrophobicContact CB-CG1 3.94Å; F131-I155 HydrophobicContact CD1-CG1 4.39Å; F131-I155 HydrophobicContact CD2-CG1 3.85Å; F131-I155 HydrophobicContact CE2-CG1 4.41Å; F131-I155 HydrophobicContact CG-CD1 4.13Å; F131-I155 HydrophobicContact CG-CG1 3.83Å; F131-L158 HydrophobicContact CE2-CD1 3.75Å
132	S	92.1	Very high	84.1	Confident	6 Å²	6	55.3 Å²	55.3	4%	0.042	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	134.1	-177.5	-68.8	0	0	0	0	110.2	V121 T122 H134 F141	V121-S132 WeakPolarHBondContact CA-O 3.44Å; T122-S132 PolarHBondContact N-O 3.07Å; T122-S132 PolarHBondContact O-N 3.21Å; S132-H134 WeakPolarHBondContact CB-NE2 3.43Å; S132-F141 WeakPolarHBondContact CA-O 3.48Å
133	V	93.7	Very high	84.4	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	112.8	172.4	-173.7	0	0	0	0	107.6	L97 L114 L116 V121 F131 L140 F141 L143 L158	L97-V133 HydrophobicContact CD2-CG2 4.34Å; L114-V133 HydrophobicContact CD1-CB 4.5Å; L114-V133 HydrophobicContact CD1-CG1 4.26Å; L114-V133 HydrophobicContact CD2-CG1 3.59Å; L116-V133 HydrophobicContact CD2-CG1 3.83Å; V121-V133 HydrophobicContact CG1-CG2 4.25Å; V121-V133 HydrophobicContact CG2-CG1 4.3Å; V121-V133 HydrophobicContact CG2-CG2 4.39Å; F131-V133 HydrophobicContact CD2-CG2 4.32Å; F131-V133 HydrophobicContact CE2-CG2 4.29Å; V133-L140 WeakPolarHBondContact O-CA 2.95Å; V133-L140 WeakPolarHBondContact O-CD1 3.49Å; V133-F141 HydrophobicContact CB-CB 4.47Å; V133-F141 PolarHBondContact N-O 2.82Å; V133-F141 PolarHBondContact O-N 3.31Å; V133-L143 HydrophobicContact CG2-CD1 3.92Å; V133-L158 HydrophobicContact CG2-CD1 3.92Å
134	H	88.3	Confident	84.7	Confident	69 Å²	69	50.9 Å²	50.9	32%	0.319	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	118.2	179.8	-65.3	-103.5	0	0	0	109.3	A119 S120 S132	A119-H134 CarbonylContact C-O 3.59Å; A119-H134 WeakPolarHBondContact CA-O 3.34Å; A119-H134 VanDerWaalsContact CB-O 3.27Å; A119-H134 WeakPolarHBondContact CB-O 3.3Å; S120-H134 PolarHBondContact N-O 3.05Å; S120-H134 PolarHBondContact O-N 2.85Å; S132-H134 WeakPolarHBondContact CB-NE2 3.43Å
135	S	88.4	Confident	85.5	Confident	9 Å²	9	50.3 Å²	50.3	6%	0.063	27%	0.273	C	S	.	.			trans	-88.8	154.4	174	-173.6	0	0	0	0	111.7	P115 N137 G138 E139	P115-S135 WeakPolarHBondContact CG-OG 3.35Å; P115-S135 PolarHBondContact O-OG 3.48Å; S135-N137 WeakPolarHBondContact CB-OD1 3.38Å; S135-N137 PolarHBondContact O-N 2.72Å; S135-N137 PolarHBondContact OG-OD1 2.86Å; S135-G138 PolarHBondContact O-N 3.38Å; S135-E139 PolarHBondContact N-O 2.96Å
136	V	79.8	Confident	86.4	Confident	104 Å²	104	46.7 Å²	46.7	63%	0.63	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-22.2	176.7	-63.7	0	0	0	0	113.6	I117 G118 G138	I117-V136 WeakPolarHBondContact O-CG2 3.43Å; G118-V136 VanDerWaalsContact C-CG1 3.48Å; G118-V136 VanDerWaalsContact O-CG1 3.25Å; G118-V136 WeakPolarHBondContact O-CG1 3.46Å; V136-G138 PolarHBondContact O-N 2.79Å
137	N	77.7	Confident	87.6	Confident	91 Å²	91	44.1 Å²	44.1	49%	0.487	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	1	174.1	71.8	-2.4	0	0	0	113.3	S135 E139	S135-N137 WeakPolarHBondContact CB-OD1 3.38Å; S135-N137 PolarHBondContact O-N 2.72Å; S135-N137 PolarHBondContact OG-OD1 2.86Å; N137-E139 PolarHBondContact ND2-OE2 3.48Å; N137-E139 VanDerWaalsContact OD1-CB 3.26Å; N137-E139 WeakPolarHBondContact OD1-CB 3.45Å; N137-E139 WeakPolarHBondContact OD1-CG 3.37Å; N137-E139 PolarHBondContact OD1-N 2.6Å
138	G	70.6	Confident	88.2	Confident	46 Å²	46	45.6 Å²	45.6	47%	0.474	26%	0.262	S	S	.	.	S	Bend	trans	89.6	-5.4	-179.3	0	0	0	0	0	115.2	S135 V136	S135-G138 PolarHBondContact O-N 3.38Å; V136-G138 PolarHBondContact O-N 2.79Å
139	E	80.5	Confident	88.7	Confident	88 Å²	88	49.5 Å²	49.5	41%	0.411	27%	0.27	S	S	.	.			trans	-70.6	146.2	176.3	-66.6	-174	117	0	0	112.4	S135 N137	S135-E139 PolarHBondContact N-O 2.96Å; N137-E139 PolarHBondContact ND2-OE2 3.48Å; N137-E139 VanDerWaalsContact OD1-CB 3.26Å; N137-E139 WeakPolarHBondContact OD1-CB 3.45Å; N137-E139 WeakPolarHBondContact OD1-CG 3.37Å; N137-E139 PolarHBondContact OD1-N 2.6Å
140	L	86.4	Confident	88.8	Confident	29 Å²	29	46.7 Å²	46.7	15%	0.152	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	121	-174.5	170.2	54.9	0	0	0	111.4	V133 L426	V133-L140 WeakPolarHBondContact O-CA 2.95Å; V133-L140 WeakPolarHBondContact O-CD1 3.49Å; L140-L426 HydrophobicContact CD2-CD2 3.58Å; L140-L426 HydrophobicContact CD2-CG 3.99Å; L140-L426 HydrophobicContact CG-CD2 4.32Å
141	F	93.1	Very high	89	Confident	15 Å²	15	47.9 Å²	47.9	7%	0.066	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	114.2	165	-70.4	-2.8	0	0	0	110.5	F88 L97 Y99 L114 S132 V133 L143	F88-F141 HydrophobicContact CE1-CD2 4.01Å; F88-F141 HydrophobicContact CE1-CE2 4.32Å; L97-F141 HydrophobicContact CD2-CD2 4.16Å; Y99-F141 AromaticContact CD1-CE2 3.82Å; Y99-F141 HydrophobicContact CD1-CE2 3.82Å; Y99-F141 AromaticContact CD1-CZ 3.84Å; Y99-F141 HydrophobicContact CD1-CZ 3.84Å; Y99-F141 HydrophobicContact CE1-CE1 4.18Å; Y99-F141 HydrophobicContact CE1-CE2 4.16Å; Y99-F141 AromaticContact CE1-CZ 3.71Å; Y99-F141 HydrophobicContact CE1-CZ 3.71Å; L114-F141 HydrophobicContact CB-CD2 4.02Å; L114-F141 HydrophobicContact CB-CE1 4.39Å; L114-F141 HydrophobicContact CB-CE2 3.57Å; L114-F141 HydrophobicContact CB-CZ 3.77Å; L114-F141 HydrophobicContact CD1-CB 4.14Å; L114-F141 HydrophobicContact CD1-CD1 3.88Å; L114-F141 HydrophobicContact CD1-CD2 3.86Å; L114-F141 HydrophobicContact CD1-CE1 4.19Å; L114-F141 HydrophobicContact CD1-CE2 4.19Å; L114-F141 HydrophobicContact CD1-CG 3.69Å; L114-F141 HydrophobicContact CD1-CZ 4.34Å; S132-F141 WeakPolarHBondContact CA-O 3.48Å; V133-F141 HydrophobicContact CB-CB 4.47Å; V133-F141 PolarHBondContact N-O 2.82Å; V133-F141 PolarHBondContact O-N 3.31Å; F141-L143 HydrophobicContact CB-CD1 4.37Å; F141-L143 HydrophobicContact CB-CD2 4.16Å; F141-L143 HydrophobicContact CB-CG 4.14Å
142	K	91.7	Very high	88.9	Confident	24 Å²	24	52.2 Å²	52.2	10%	0.104	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	122	163	-86.4	-174.7	172.9	-178.5	0	109.8	Y76 W83 E126 M130 L426	Y76-K142 PolarHBondContact N-O 3.47Å; W83-K142 HydrophobicContact CH2-CB 4.36Å; E126-K142 IonicContact OE1-NZ 2.85Å; E126-K142 PolarHBondContact OE1-NZ 2.96Å; E126-K142 IonicContact OE2-NZ 3.96Å; E126-K142 PolarHBondContact OE2-NZ 3.35Å; M130-K142 HydrophobicContact CE-CB 4.16Å; M130-K142 HydrophobicContact CE-CD 3.35Å; M130-K142 HydrophobicContact CE-CG 3.7Å; K142-L426 HydrophobicContact CD-CD2 3.3Å; K142-L426 HydrophobicContact CG-CD2 3.9Å
143	L	94.6	Very high	89	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	150.2	-171.6	-57.5	178.8	0	0	0	109.8	L73 S74 K75 F88 L97 M130 F131 V133 F141	L73-L143 HydrophobicContact CD1-CB 4.42Å; L73-L143 HydrophobicContact CD1-CD1 4.04Å; S74-L143 CarbonylContact O-C 3.54Å; S74-L143 WeakPolarHBondContact O-CA 3.44Å; K75-L143 HydrophobicContact CB-CD2 4.14Å; K75-L143 HydrophobicContact CG-CD2 3.89Å; F88-L143 HydrophobicContact CE1-CD1 4.33Å; F88-L143 HydrophobicContact CE1-CD2 3.72Å; F88-L143 HydrophobicContact CE2-CD2 3.84Å; F88-L143 HydrophobicContact CZ-CD2 3.2Å; L97-L143 HydrophobicContact CD2-CD1 4.08Å; M130-L143 CarbonylContact C-O 3.58Å; M130-L143 WeakPolarHBondContact CA-O 3.43Å; M130-L143 WeakPolarHBondContact CG-O 3.47Å; F131-L143 HydrophobicContact CD1-CB 4.18Å; F131-L143 HydrophobicContact CD2-CB 4.19Å; F131-L143 HydrophobicContact CD2-CD1 4.42Å; F131-L143 HydrophobicContact CE1-CB 3.81Å; F131-L143 HydrophobicContact CE2-CB 3.82Å; F131-L143 HydrophobicContact CE2-CD1 3.62Å; F131-L143 HydrophobicContact CE2-CG 4.29Å; F131-L143 HydrophobicContact CG-CB 4.37Å; F131-L143 HydrophobicContact CZ-CB 3.62Å; F131-L143 HydrophobicContact CZ-CD1 3.91Å; F131-L143 HydrophobicContact CZ-CG 4.4Å; F131-L143 PolarHBondContact N-O 2.7Å; F131-L143 PolarHBondContact O-N 3.47Å; V133-L143 HydrophobicContact CG2-CD1 3.92Å; F141-L143 HydrophobicContact CB-CD1 4.37Å; F141-L143 HydrophobicContact CB-CD2 4.16Å; F141-L143 HydrophobicContact CB-CG 4.14Å
144	K	93.9	Very high	89.1	Confident	59 Å²	59	57.1 Å²	57.1	26%	0.257	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	126.7	176.7	-171.2	-173.6	68.5	171.3	0	108.8	S74 W83 P128 Y129	S74-K144 WeakPolarHBondContact CB-O 3.29Å; S74-K144 PolarHBondContact N-O 3.13Å; S74-K144 PolarHBondContact O-N 2.9Å; W83-K144 HydrophobicContact CE3-CB 3.9Å; W83-K144 HydrophobicContact CH2-CB 3.9Å; W83-K144 HydrophobicContact CZ3-CB 3.55Å; P128-K144 WeakPolarHBondContact O-CD 3.29Å; P128-K144 VanDerWaalsContact O-CG 3.24Å; P128-K144 WeakPolarHBondContact O-CG 3.18Å; Y129-K144 WeakPolarHBondContact O-CA 3.44Å
145	A	93.8	Very high	89.4	Confident	6 Å²	6	54 Å²	54	5%	0.05	29%	0.292	C	S	.	.			trans	-82	170.8	174.4	0	0	0	0	0	111.6	L73 Y129 D147 E150 Q151	L73-A145 HydrophobicContact CD2-CB 4.14Å; Y129-A145 PolarHBondContact O-N 3.49Å; A145-D147 WeakPolarHBondContact CB-O 3.46Å; A145-E150 HydrophobicContact CB-CB 3.97Å; A145-E150 HydrophobicContact CB-CG 3.82Å; A145-Q151 HydrophobicContact CB-CB 3.84Å; A145-Q151 VanDerWaalsContact CB-N 3.29Å
146	S	91.8	Very high	89.6	Confident	89 Å²	89	57.1 Å²	57.1	62%	0.622	31%	0.309	S	S	*	.	S	Bend	trans	-72.4	-34.8	172.9	60.9	0	0	0	0	112.7	Y129 E150	Y129-S146 WeakPolarHBondContact CD2-O 3.25Å; S146-E150 VanDerWaalsContact CB-OE2 3.3Å; S146-E150 WeakPolarHBondContact CB-OE2 3.46Å; S146-E150 PolarHBondContact N-OE2 3.14Å; S146-E150 PolarHBondContact OG-OE2 3.23Å
147	D	91.8	Very high	90.3	Very high	69 Å²	69	56.1 Å²	56.1	37%	0.369	30%	0.297	S	S	.	.	S	Bend	trans	-146	174.8	176.9	70.6	42.6	0	0	0	112.9	A145 K149 E150 Q151	A145-D147 WeakPolarHBondContact CB-O 3.46Å; D147-K149 VanDerWaalsContact C-N 3.3Å; D147-K149 PolarHBondContact O-N 3.27Å; D147-K149 VanDerWaalsContact OD1-CA 3.32Å; D147-K149 WeakPolarHBondContact OD1-CA 3.42Å; D147-K149 VanDerWaalsContact OD1-CB 3.26Å; D147-K149 WeakPolarHBondContact OD1-CB 3.22Å; D147-K149 PolarHBondContact OD1-N 3.32Å; D147-E150 PolarHBondContact O-N 3.39Å; D147-E150 PolarHBondContact OD1-N 3.44Å; D147-Q151 WeakPolarHBondContact O-CB 3.32Å; D147-Q151 PolarHBondContact O-N 3.18Å
148	A	88.4	Confident	91.2	Very high	52 Å²	52	51.8 Å²	51.8	43%	0.43	27%	0.274	S	S	.	.	H	α-helix	trans	-66.2	-27.6	-179.7	0	0	0	0	0	114	Y129 Q152	Y129-A148 HydrophobicContact CD1-CB 3.77Å; Y129-A148 VanDerWaalsContact CD1-N 3.29Å; Y129-A148 HydrophobicContact CE1-CB 3.77Å; A148-Q152 WeakPolarHBondContact O-CB 3.44Å; A148-Q152 PolarHBondContact O-N 2.91Å
149	K	91.9	Very high	92.3	Very high	178 Å²	178	52.1 Å²	52.1	77%	0.774	26%	0.263	S	S	*	.	H	α-helix	trans	-74.6	-43.8	179.3	-179.7	-174.6	176.7	-175.4	0	110	D147 F153	D147-K149 VanDerWaalsContact C-N 3.3Å; D147-K149 PolarHBondContact O-N 3.27Å; D147-K149 VanDerWaalsContact OD1-CA 3.32Å; D147-K149 WeakPolarHBondContact OD1-CA 3.42Å; D147-K149 VanDerWaalsContact OD1-CB 3.26Å; D147-K149 WeakPolarHBondContact OD1-CB 3.22Å; D147-K149 PolarHBondContact OD1-N 3.32Å; K149-F153 VanDerWaalsContact O-CB 3.24Å; K149-F153 WeakPolarHBondContact O-CB 3.36Å; K149-F153 PolarHBondContact O-N 2.94Å
150	E	93.4	Very high	92.8	Very high	46 Å²	46	49.6 Å²	49.6	22%	0.215	26%	0.257	C	S	.	.	H	α-helix	trans	-64.9	-42	172	-179.9	176.7	-135.9	0	0	111.2	A145 S146 D147 Q152 F153 W154	A145-E150 HydrophobicContact CB-CB 3.97Å; A145-E150 HydrophobicContact CB-CG 3.82Å; S146-E150 VanDerWaalsContact CB-OE2 3.3Å; S146-E150 WeakPolarHBondContact CB-OE2 3.46Å; S146-E150 PolarHBondContact N-OE2 3.14Å; S146-E150 PolarHBondContact OG-OE2 3.23Å; D147-E150 PolarHBondContact O-N 3.39Å; D147-E150 PolarHBondContact OD1-N 3.44Å; E150-Q152 PolarHBondContact O-N 3.5Å; E150-F153 PolarHBondContact O-N 3.42Å; E150-W154 PolarHBondContact O-N 3.37Å
151	Q	94	Very high	93.1	Very high	26 Å²	26	48.4 Å²	48.4	12%	0.121	25%	0.251	C	S	.	.	H	α-helix	trans	-53.8	-55.5	173.7	-175.9	-167.9	16.2	0	0	111	Y129 M130 F131 A145 D147 F153 W154 I155	Y129-Q151 VanDerWaalsContact CA-CD 3.5Å; M130-Q151 PolarHBondContact O-NE2 3.34Å; F131-Q151 HydrophobicContact CD1-CG 3.98Å; A145-Q151 HydrophobicContact CB-CB 3.84Å; A145-Q151 VanDerWaalsContact CB-N 3.29Å; D147-Q151 WeakPolarHBondContact O-CB 3.32Å; D147-Q151 PolarHBondContact O-N 3.18Å; Q151-F153 VanDerWaalsContact C-N 3.3Å; Q151-F153 PolarHBondContact O-N 2.91Å; Q151-W154 PolarHBondContact O-N 3.48Å; Q151-I155 HydrophobicContact CG-CD1 3.84Å; Q151-I155 VanDerWaalsContact O-CG1 3.27Å; Q151-I155 WeakPolarHBondContact O-CG1 3.4Å; Q151-I155 PolarHBondContact O-N 3Å
152	Q	91.5	Very high	93	Very high	90 Å²	90	48 Å²	48	42%	0.421	25%	0.25	S	S	.	.	H	α-helix	trans	-64.4	-36.5	-178.6	-165.8	63.1	42.3	0	0	111.9	A148 E150 N156	A148-Q152 WeakPolarHBondContact O-CB 3.44Å; A148-Q152 PolarHBondContact O-N 2.91Å; E150-Q152 PolarHBondContact O-N 3.5Å; Q152-N156 PolarHBondContact NE2-OD1 3.33Å; Q152-N156 VanDerWaalsContact O-CB 3.28Å; Q152-N156 WeakPolarHBondContact O-CB 3.47Å; Q152-N156 PolarHBondContact O-N 3.12Å; Q152-N156 PolarHBondContact O-ND2 3.19Å; Q152-N156 PolarHBondContact O-OD1 3.16Å
153	F	94	Very high	92.9	Very high	105 Å²	105	53 Å²	53	46%	0.461	27%	0.269	S	S	.	.	H	α-helix	trans	-61.5	-50.3	176.2	-179.7	-115	0	0	0	112	L69 K149 E150 Q151 N156 Q157	L69-F153 HydrophobicContact CD1-CD1 4.34Å; L69-F153 HydrophobicContact CD1-CE1 3.46Å; L69-F153 VanDerWaalsContact CD1-CE1 3.46Å; L69-F153 HydrophobicContact CD1-CZ 4.01Å; K149-F153 VanDerWaalsContact O-CB 3.24Å; K149-F153 WeakPolarHBondContact O-CB 3.36Å; K149-F153 PolarHBondContact O-N 2.94Å; E150-F153 PolarHBondContact O-N 3.42Å; Q151-F153 VanDerWaalsContact C-N 3.3Å; Q151-F153 PolarHBondContact O-N 2.91Å; F153-N156 PolarHBondContact O-N 3.19Å; F153-Q157 HydrophobicContact CD2-CG 4.44Å; F153-Q157 HydrophobicContact CE2-CG 4.21Å; F153-Q157 HydrophobicContact CZ-CG 4.44Å; F153-Q157 VanDerWaalsContact O-CG 3.27Å; F153-Q157 WeakPolarHBondContact O-CG 3.47Å; F153-Q157 PolarHBondContact O-N 3.12Å; F153-Q157 VanDerWaalsContact O-N 3.13Å
154	W	95.3	Very high	92.7	Very high	4 Å²	4	59.5 Å²	59.5	2%	0.015	29%	0.293	C	S	.	.	H	α-helix	trans	-63.2	-44.6	176.4	-84	97.5	0	0	0	112.5	L69 L73 F88 L90 L97 F131 E150 Q151 N156 Q157 L158	L69-W154 HydrophobicContact CD1-CH2 4.45Å; L69-W154 HydrophobicContact CD1-CZ2 4.35Å; L69-W154 HydrophobicContact CD2-CD2 3.99Å; L69-W154 HydrophobicContact CD2-CE3 3.57Å; L69-W154 HydrophobicContact CD2-CH2 4.22Å; L69-W154 HydrophobicContact CD2-CZ3 3.7Å; L69-W154 HydrophobicContact CG-CD2 4.48Å; L69-W154 HydrophobicContact CG-CE3 4.12Å; L69-W154 HydrophobicContact CG-CH2 3.84Å; L69-W154 HydrophobicContact CG-CZ2 4.2Å; L69-W154 HydrophobicContact CG-CZ3 3.79Å; L73-W154 HydrophobicContact CD1-CD2 3.79Å; L73-W154 HydrophobicContact CD1-CE3 4.07Å; L73-W154 HydrophobicContact CD1-CG 4.11Å; L73-W154 HydrophobicContact CD1-CZ2 4.33Å; L73-W154 HydrophobicContact CD1-CZ3 4.46Å; L73-W154 HydrophobicContact CD2-CD2 4.46Å; L73-W154 HydrophobicContact CD2-CG 4.19Å; L73-W154 HydrophobicContact CG-CD2 4.36Å; L73-W154 HydrophobicContact CG-CZ2 4.39Å; F88-W154 HydrophobicContact CB-CH2 3.73Å; F88-W154 HydrophobicContact CB-CZ2 4.44Å; F88-W154 HydrophobicContact CB-CZ3 4.17Å; L90-W154 HydrophobicContact CB-CZ3 4.39Å; L97-W154 HydrophobicContact CD1-CZ3 4.25Å; F131-W154 HydrophobicContact CE1-CB 4.42Å; F131-W154 HydrophobicContact CE2-CB 4.34Å; F131-W154 HydrophobicContact CZ-CB 3.75Å; F131-W154 HydrophobicContact CZ-CG 4.42Å; E150-W154 PolarHBondContact O-N 3.37Å; Q151-W154 PolarHBondContact O-N 3.48Å; W154-N156 PolarHBondContact O-N 3.38Å; W154-Q157 PolarHBondContact O-N 3.13Å; W154-L158 HydrophobicContact CE3-CD1 4.35Å; W154-L158 HydrophobicContact CE3-CG 4.47Å; W154-L158 WeakPolarHBondContact O-CB 3.43Å; W154-L158 WeakPolarHBondContact O-CD1 3.45Å; W154-L158 WeakPolarHBondContact O-CG 3.18Å; W154-L158 PolarHBondContact O-N 3.39Å
155	I	94.2	Very high	92.3	Very high	4 Å²	4	58.5 Å²	58.5	2%	0.021	29%	0.289	C	S	.	.	H	α-helix	trans	-57.1	-51.2	176.9	-69.3	169.9	0	0	0	110.6	V121 T123 F131 Q151 Q157 L158 Q159	V121-I155 HydrophobicContact CG1-CB 4.39Å; V121-I155 HydrophobicContact CG1-CG1 4.1Å; V121-I155 HydrophobicContact CG1-CG2 4.12Å; T123-I155 HydrophobicContact CG2-CD1 3.67Å; F131-I155 HydrophobicContact CB-CD1 3.79Å; F131-I155 HydrophobicContact CB-CG1 3.94Å; F131-I155 HydrophobicContact CD1-CG1 4.39Å; F131-I155 HydrophobicContact CD2-CG1 3.85Å; F131-I155 HydrophobicContact CE2-CG1 4.41Å; F131-I155 HydrophobicContact CG-CD1 4.13Å; F131-I155 HydrophobicContact CG-CG1 3.83Å; Q151-I155 HydrophobicContact CG-CD1 3.84Å; Q151-I155 VanDerWaalsContact O-CG1 3.27Å; Q151-I155 WeakPolarHBondContact O-CG1 3.4Å; Q151-I155 PolarHBondContact O-N 3Å; I155-Q157 VanDerWaalsContact C-N 3.31Å; I155-Q157 PolarHBondContact O-N 3.17Å; I155-L158 PolarHBondContact O-N 2.79Å; I155-Q159 HydrophobicContact CG2-CG 4.22Å; I155-Q159 WeakPolarHBondContact O-CB 3.5Å; I155-Q159 VanDerWaalsContact O-CG 3.31Å; I155-Q159 WeakPolarHBondContact O-CG 3.31Å; I155-Q159 PolarHBondContact O-N 3.11Å
156	N	93.4	Very high	92	Very high	75 Å²	75	60 Å²	60	40%	0.401	30%	0.3	S	S	.	.	H	α-helix	trans	-58.1	-43.5	-178.4	-73.8	-5.7	0	0	0	111.8	Q152 F153 W154 A160	Q152-N156 PolarHBondContact NE2-OD1 3.33Å; Q152-N156 VanDerWaalsContact O-CB 3.28Å; Q152-N156 WeakPolarHBondContact O-CB 3.47Å; Q152-N156 PolarHBondContact O-N 3.12Å; Q152-N156 PolarHBondContact O-ND2 3.19Å; Q152-N156 PolarHBondContact O-OD1 3.16Å; F153-N156 PolarHBondContact O-N 3.19Å; W154-N156 PolarHBondContact O-N 3.38Å; N156-A160 VanDerWaalsContact O-CB 3.23Å; N156-A160 WeakPolarHBondContact O-CB 3.2Å; N156-A160 PolarHBondContact O-N 3.17Å
157	Q	94.8	Very high	91.4	Very high	83 Å²	83	60.5 Å²	60.5	39%	0.388	30%	0.295	S	S	.	.	H	α-helix	trans	-71.4	-41.2	-179	-66.4	-65.2	-30.7	0	0	112.5	L69 L90 F153 W154 I155 A160 C161	L69-Q157 HydrophobicContact CD2-CB 3.46Å; L69-Q157 VanDerWaalsContact CD2-CB 3.46Å; L69-Q157 HydrophobicContact CD2-CG 3.81Å; L90-Q157 HydrophobicContact CD2-CB 4.18Å; F153-Q157 HydrophobicContact CD2-CG 4.44Å; F153-Q157 HydrophobicContact CE2-CG 4.21Å; F153-Q157 HydrophobicContact CZ-CG 4.44Å; F153-Q157 VanDerWaalsContact O-CG 3.27Å; F153-Q157 WeakPolarHBondContact O-CG 3.47Å; F153-Q157 PolarHBondContact O-N 3.12Å; F153-Q157 VanDerWaalsContact O-N 3.13Å; W154-Q157 PolarHBondContact O-N 3.13Å; I155-Q157 VanDerWaalsContact C-N 3.31Å; I155-Q157 PolarHBondContact O-N 3.17Å; Q157-A160 PolarHBondContact O-N 3.4Å; Q157-C161 WeakPolarHBondContact O-CB 3.26Å; Q157-C161 PolarHBondContact O-N 3.21Å
158	L	95.4	Very high	90.6	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-65.2	-45.3	176.8	-70.4	168.5	0	0	0	111.8	L90 L97 L116 V121 F131 V133 W154 I155 C161 A162	L90-L158 HydrophobicContact CD1-CD2 3.94Å; L90-L158 HydrophobicContact CD2-CD2 4.06Å; L90-L158 HydrophobicContact CG-CD2 4.45Å; L97-L158 HydrophobicContact CB-CD2 4.28Å; L97-L158 HydrophobicContact CD1-CD2 3.93Å; L97-L158 HydrophobicContact CD2-CD1 4.26Å; L97-L158 HydrophobicContact CD2-CD2 3.81Å; L97-L158 HydrophobicContact CG-CD2 4.21Å; L116-L158 HydrophobicContact CD1-CD2 3.96Å; L116-L158 HydrophobicContact CD2-CD2 4.33Å; V121-L158 HydrophobicContact CG2-CB 3.95Å; F131-L158 HydrophobicContact CE2-CD1 3.75Å; V133-L158 HydrophobicContact CG2-CD1 3.92Å; W154-L158 HydrophobicContact CE3-CD1 4.35Å; W154-L158 HydrophobicContact CE3-CG 4.47Å; W154-L158 WeakPolarHBondContact O-CB 3.43Å; W154-L158 WeakPolarHBondContact O-CD1 3.45Å; W154-L158 WeakPolarHBondContact O-CG 3.18Å; W154-L158 PolarHBondContact O-N 3.39Å; I155-L158 PolarHBondContact O-N 2.79Å; L158-C161 PolarHBondContact O-N 2.71Å; L158-A162 WeakPolarHBondContact O-CB 3.49Å; L158-A162 PolarHBondContact O-N 3.2Å
159	Q	93.8	Very high	89.7	Confident	53 Å²	53	59.1 Å²	59.1	25%	0.248	29%	0.288	C	S	.	.	H	α-helix	trans	-64.1	-39.2	174.6	-69.4	-176.1	-1.8	0	0	112.3	V121 I155 C161 A162 R163	V121-Q159 HydrophobicContact CB-CG 3.71Å; V121-Q159 HydrophobicContact CG2-CG 3.96Å; V121-Q159 PolarHBondContact O-NE2 3.21Å; V121-Q159 VanDerWaalsContact O-NE2 3.14Å; I155-Q159 HydrophobicContact CG2-CG 4.22Å; I155-Q159 WeakPolarHBondContact O-CB 3.5Å; I155-Q159 VanDerWaalsContact O-CG 3.31Å; I155-Q159 WeakPolarHBondContact O-CG 3.31Å; I155-Q159 PolarHBondContact O-N 3.11Å; Q159-C161 VanDerWaalsContact C-N 3.34Å; Q159-A162 PolarHBondContact O-N 2.78Å; Q159-R163 VanDerWaalsContact CB-NH2 3.35Å; Q159-R163 WeakPolarHBondContact O-CB 3.26Å; Q159-R163 WeakPolarHBondContact O-CG 3.24Å; Q159-R163 PolarHBondContact O-N 3.15Å; Q159-R163 PolarHBondContact O-NE 3.02Å
160	A	90.6	Very high	88.2	Confident	35 Å²	35	53.2 Å²	53.2	29%	0.289	27%	0.272	S	S	.	.	H	α-helix	trans	-64.2	-38.6	176.1	0	0	0	0	0	112.2	N156 Q157 R164	N156-A160 VanDerWaalsContact O-CB 3.23Å; N156-A160 WeakPolarHBondContact O-CB 3.2Å; N156-A160 PolarHBondContact O-N 3.17Å; Q157-A160 PolarHBondContact O-N 3.4Å; A160-R164 WeakPolarHBondContact O-CB 3.39Å; A160-R164 PolarHBondContact O-N 3.32Å; A160-R164 VanDerWaalsContact O-N 3.12Å
161	C	92.9	Very high	86.6	Confident	4 Å²	4	58 Å²	58	3%	0.027	29%	0.292	C	S	.	.	H	α-helix	trans	-66.3	-48.1	173.8	-168.4	0	0	0	0	111.6	L90 L116 Q157 L158 Q159 R163 R164 H165	L90-C161 HydrophobicContact CD1-CB 4.13Å; L90-C161 HydrophobicContact CD2-CB 4.36Å; L116-C161 HydrophobicContact CD1-CB 4.03Å; Q157-C161 WeakPolarHBondContact O-CB 3.26Å; Q157-C161 PolarHBondContact O-N 3.21Å; L158-C161 PolarHBondContact O-N 2.71Å; Q159-C161 VanDerWaalsContact C-N 3.34Å; C161-R163 PolarHBondContact O-N 3.44Å; C161-R164 PolarHBondContact O-N 3.38Å; C161-H165 PolarHBondContact O-CD2 3.07Å; C161-H165 PolarHBondContact O-N 2.96Å; C161-H165 VanDerWaalsContact O-N 3.09Å
162	A	91.8	Very high	84.9	Confident	5 Å²	5	61 Å²	61	4%	0.041	31%	0.312	C	S	.	.	H	α-helix	trans	-57.7	-45.1	178.5	0	0	0	0	0	112.7	L116 L158 Q159 S166	L116-A162 HydrophobicContact CB-CB 4.27Å; L116-A162 VanDerWaalsContact O-CA 3.23Å; L116-A162 WeakPolarHBondContact O-CA 3.44Å; L116-A162 WeakPolarHBondContact O-CB 3.42Å; L158-A162 WeakPolarHBondContact O-CB 3.49Å; L158-A162 PolarHBondContact O-N 3.2Å; Q159-A162 PolarHBondContact O-N 2.78Å; A162-S166 WeakPolarHBondContact O-CB 3.25Å; A162-S166 PolarHBondContact O-N 3.2Å; A162-S166 VanDerWaalsContact O-N 3.13Å; A162-S166 PolarHBondContact O-OG 3.36Å
163	R	89.9	Confident	83	Confident	131 Å²	131	65.8 Å²	65.8	49%	0.494	33%	0.327	S	S	.	.	H	α-helix	trans	-59.2	-55.1	173.6	-74.9	-176.8	-77	-105.8	2.2	111.5	Q159 C161 H165 S166 D167	Q159-R163 VanDerWaalsContact CB-NH2 3.35Å; Q159-R163 WeakPolarHBondContact O-CB 3.26Å; Q159-R163 WeakPolarHBondContact O-CG 3.24Å; Q159-R163 PolarHBondContact O-N 3.15Å; Q159-R163 PolarHBondContact O-NE 3.02Å; C161-R163 PolarHBondContact O-N 3.44Å; R163-H165 VanDerWaalsContact C-N 3.29Å; R163-H165 PolarHBondContact O-N 2.99Å; R163-S166 WeakPolarHBondContact O-CB 3.25Å; R163-S166 PolarHBondContact O-N 3.07Å; R163-D167 PolarHBondContact O-N 3.33Å
164	R	89.6	Confident	80.8	Confident	135 Å²	135	68.6 Å²	68.6	51%	0.509	34%	0.338	S	S	.	.	H	α-helix	trans	-53.2	-42.8	-178.2	-175.1	-171.4	-61.1	159.4	2.1	113.3	A160 C161 S168	A160-R164 WeakPolarHBondContact O-CB 3.39Å; A160-R164 PolarHBondContact O-N 3.32Å; A160-R164 VanDerWaalsContact O-N 3.12Å; C161-R164 PolarHBondContact O-N 3.38Å; R164-S168 WeakPolarHBondContact O-CB 3.21Å; R164-S168 PolarHBondContact O-N 3.27Å; R164-S168 PolarHBondContact O-OG 3.13Å
165	H	87	Confident	78.4	Confident	38 Å²	38	73.9 Å²	73.9	18%	0.176	37%	0.366	C	S	.	.	H	α-helix	trans	-74.5	-34.5	-179.3	-84	-77.4	0	0	0	112.9	P92 E93 G95 I117 C161 R163 S169	P92-H165 PolarHBondContact O-NE2 3.42Å; E93-H165 PolarHBondContact O-CE1 3.39Å; E93-H165 VanDerWaalsContact O-CE1 3.24Å; G95-H165 VanDerWaalsContact CA-CD2 3.43Å; G95-H165 WeakPolarHBondContact CA-CD2 3.5Å; G95-H165 WeakPolarHBondContact CA-NE2 3.31Å; G95-H165 PolarHBondContact N-NE2 3.46Å; I117-H165 HydrophobicContact CB-CB 4.4Å; C161-H165 PolarHBondContact O-CD2 3.07Å; C161-H165 PolarHBondContact O-N 2.96Å; C161-H165 VanDerWaalsContact O-N 3.09Å; R163-H165 VanDerWaalsContact C-N 3.29Å; R163-H165 PolarHBondContact O-N 2.99Å; H165-S169 PolarHBondContact O-N 3.06Å
166	S	85.8	Confident	75.9	Confident	39 Å²	39	81.2 Å²	81.2	27%	0.273	40%	0.398	S	S	.	.	H	α-helix	trans	-65.6	-46.2	172.9	-51.9	0	0	0	0	111.3	G118 A162 R163 S168 S169 A170	G118-S166 PolarHBondContact N-OG 2.85Å; A162-S166 WeakPolarHBondContact O-CB 3.25Å; A162-S166 PolarHBondContact O-N 3.2Å; A162-S166 VanDerWaalsContact O-N 3.13Å; A162-S166 PolarHBondContact O-OG 3.36Å; R163-S166 WeakPolarHBondContact O-CB 3.25Å; R163-S166 PolarHBondContact O-N 3.07Å; S166-S168 PolarHBondContact O-N 2.88Å; S166-S169 PolarHBondContact O-N 2.71Å; S166-A170 PolarHBondContact O-N 3.41Å; S166-A170 VanDerWaalsContact O-N 3.13Å
167	D	79.9	Confident	73.3	Confident	98 Å²	98	82.3 Å²	82.3	52%	0.524	41%	0.412	S	S	.	.	H	α-helix	trans	-65.7	-38.4	179.1	-61.2	-25.8	0	0	0	112.5	R163 A170 K171	R163-D167 PolarHBondContact O-N 3.33Å; D167-A170 PolarHBondContact O-N 2.92Å; D167-K171 PolarHBondContact O-N 2.67Å
168	S	75.7	Confident	70.8	Confident	57 Å²	57	82 Å²	82	40%	0.399	42%	0.419	S	S	.	.	H	α-helix	trans	-65.1	-41	177.3	-59.5	0	0	0	0	111.4	R164 S166 A170 K171 V172	R164-S168 WeakPolarHBondContact O-CB 3.21Å; R164-S168 PolarHBondContact O-N 3.27Å; R164-S168 PolarHBondContact O-OG 3.13Å; S166-S168 PolarHBondContact O-N 2.88Å; S168-A170 PolarHBondContact O-N 3.17Å; S168-K171 PolarHBondContact O-N 3.48Å; S168-V172 WeakPolarHBondContact O-CG2 3.49Å; S168-V172 PolarHBondContact O-N 2.89Å
169	S	68.4	Low	68	Low	36 Å²	36	88.3 Å²	88.3	25%	0.252	45%	0.452	S	S	.	.	H	α-helix	trans	-62.3	-41.3	174.4	-171.2	0	0	0	0	112.2	H165 S166 K171 V172 R173	H165-S169 PolarHBondContact O-N 3.06Å; S166-S169 PolarHBondContact O-N 2.71Å; S169-K171 PolarHBondContact O-N 3.02Å; S169-V172 PolarHBondContact O-N 3.18Å; S169-R173 WeakPolarHBondContact O-CG 3.42Å; S169-R173 PolarHBondContact O-N 3.03Å
170	A	60.4	Low	65.3	Low	53 Å²	53	94.6 Å²	94.6	44%	0.438	48%	0.482	S	S	.	.	H	α-helix	trans	-63	-38.7	174.9	0	0	0	0	0	112.8	S166 D167 S168 R173 K174	S166-A170 PolarHBondContact O-N 3.41Å; S166-A170 VanDerWaalsContact O-N 3.13Å; D167-A170 PolarHBondContact O-N 2.92Å; S168-A170 PolarHBondContact O-N 3.17Å; A170-R173 PolarHBondContact O-N 3.47Å; A170-K174 PolarHBondContact O-N 3.02Å; A170-K174 VanDerWaalsContact O-N 3.14Å
171	K	60	Low	62.8	Low	146 Å²	146	101.1 Å²	101.1	64%	0.635	51%	0.506	S	S	*	.	H	α-helix	trans	-67.9	-40.5	174.8	-73.5	178.7	180	178.6	0	113	D167 S168 S169 R173 K174 L175	D167-K171 PolarHBondContact O-N 2.67Å; S168-K171 PolarHBondContact O-N 3.48Å; S169-K171 PolarHBondContact O-N 3.02Å; K171-R173 VanDerWaalsContact C-N 3.33Å; K171-R173 PolarHBondContact O-N 3.35Å; K171-K174 PolarHBondContact O-N 3.35Å; K171-L175 PolarHBondContact O-N 3.43Å
172	V	58.5	Low	60	Low	91 Å²	91	108.8 Å²	108.8	55%	0.552	55%	0.546	S	S	*	.	H	α-helix	trans	-64.4	-37.4	176.2	171.3	0	0	0	0	111.5	S168 S169 L175 K176	S168-V172 WeakPolarHBondContact O-CG2 3.49Å; S168-V172 PolarHBondContact O-N 2.89Å; S169-V172 PolarHBondContact O-N 3.18Å; V172-L175 PolarHBondContact O-N 2.96Å; V172-K176 PolarHBondContact O-N 3.41Å
173	R	51.1	Low	57.1	Low	190 Å²	190	113.7 Å²	113.7	72%	0.717	58%	0.58	S	S	*	*	H	α-helix	trans	-63.3	-40.3	172	-72.2	176.8	-178.3	164.1	0.1	112.4	S169 A170 K171 S177	S169-R173 WeakPolarHBondContact O-CG 3.42Å; S169-R173 PolarHBondContact O-N 3.03Å; A170-R173 PolarHBondContact O-N 3.47Å; K171-R173 VanDerWaalsContact C-N 3.33Å; K171-R173 PolarHBondContact O-N 3.35Å; R173-S177 PolarHBondContact O-N 3.19Å; R173-S177 VanDerWaalsContact O-N 3.17Å
174	K	47.9	Very low	54.3	Low	163 Å²	163	113.7 Å²	113.7	71%	0.709	59%	0.594	S	S	*	*	H	α-helix	trans	-64.8	-42.4	173.4	-85.4	-168.7	169.9	-172.2	0	113.2	A170 K171 S177 S178	A170-K174 PolarHBondContact O-N 3.02Å; A170-K174 VanDerWaalsContact O-N 3.14Å; K171-K174 PolarHBondContact O-N 3.35Å; K174-S177 PolarHBondContact O-N 2.97Å; K174-S178 PolarHBondContact O-N 3.26Å; K174-S178 PolarHBondContact O-OG 3.45Å
175	L	45.1	Very low	51.6	Low	115 Å²	115	114.9 Å²	114.9	60%	0.602	61%	0.611	S	S	*	*	H	α-helix	trans	-64.8	-43.5	176	-100.1	81.9	0	0	0	112.3	K171 V172 S177 S178 D179	K171-L175 PolarHBondContact O-N 3.43Å; V172-L175 PolarHBondContact O-N 2.96Å; L175-S177 VanDerWaalsContact C-N 3.26Å; L175-S177 PolarHBondContact O-N 3.38Å; L175-S178 WeakPolarHBondContact O-CA 3.36Å; L175-S178 VanDerWaalsContact O-CB 3.26Å; L175-S178 WeakPolarHBondContact O-CB 3.45Å; L175-S178 PolarHBondContact O-N 3.07Å; L175-D179 PolarHBondContact O-N 3.4Å
176	K	41.8	Very low	48.9	Very low	158 Å²	158	124.7 Å²	124.7	69%	0.687	65%	0.646	S	S	*	*	H	α-helix	trans	-61.4	-32.9	176.2	-82.3	-163.7	168.5	-164	0	113.5	V172 S178	V172-K176 PolarHBondContact O-N 3.41Å; K176-S178 PolarHBondContact O-N 2.93Å
177	S	39.1	Very low	46.3	Very low	98 Å²	98	127.7 Å²	127.7	69%	0.685	67%	0.673	S	S	*	*	H	α-helix	trans	-70	-9.5	170.4	-177.8	0	0	0	0	114.2	R173 K174 L175	R173-S177 PolarHBondContact O-N 3.19Å; R173-S177 VanDerWaalsContact O-N 3.17Å; K174-S177 PolarHBondContact O-N 2.97Å; L175-S177 VanDerWaalsContact C-N 3.26Å; L175-S177 PolarHBondContact O-N 3.38Å
178	S	42.1	Very low	43.9	Very low	77 Å²	77	127.2 Å²	127.2	54%	0.538	69%	0.691	S	S	.	*	H	α-helix	trans	-99.5	-31.1	-178.3	-50.5	0	0	0	0	112.4	K174 L175 K176	K174-S178 PolarHBondContact O-N 3.26Å; K174-S178 PolarHBondContact O-OG 3.45Å; L175-S178 WeakPolarHBondContact O-CA 3.36Å; L175-S178 VanDerWaalsContact O-CB 3.26Å; L175-S178 WeakPolarHBondContact O-CB 3.45Å; L175-S178 PolarHBondContact O-N 3.07Å; K176-S178 PolarHBondContact O-N 2.93Å
179	D	37.7	Very low	41.6	Very low	132 Å²	132	128.4 Å²	128.4	71%	0.706	71%	0.713	S	S	*	*	H	α-helix	trans	-82.8	-15.1	-174.4	-78.6	-29.6	0	0	0	114.7	L175 H181	L175-D179 PolarHBondContact O-N 3.4Å; D179-H181 PolarHBondContact O-N 2.94Å
180	E	36.9	Very low	39.7	Very low	185 Å²	185	130 Å²	130	86%	0.864	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	8.1	179.4	-78.6	-164	126.8	0	0	114.9
181	H	37.3	Very low	38.3	Very low	172 Å²	172	136 Å²	136	80%	0.796	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.1	20.5	-172.9	-122.3	-64.8	0	0	0	116.4	D179	D179-H181 PolarHBondContact O-N 2.94Å
182	L	33.3	Very low	36.8	Very low	166 Å²	166	136.1 Å²	136.1	87%	0.869	76%	0.762	S	S	*	*			trans	-134.3	79.2	174.7	-74.1	175.2	0	0	0	113.7
183	S	31.1	Very low	35.5	Very low	108 Å²	108	135.1 Å²	135.1	76%	0.755	77%	0.769	S	S	*	*			trans	-149.1	144.4	151	62.3	0	0	0	0	109.2
184	V	32.5	Very low	34.3	Very low	131 Å²	131	132.8 Å²	132.8	79%	0.794	78%	0.777	S	S	*	*			trans	70.7	122.4	-162.6	-167	0	0	0	0	110.6
185	D	31.4	Very low	33.4	Very low	159 Å²	159	129.9 Å²	129.9	85%	0.85	78%	0.777	S	S	*	*			cis	-142.3	171.1	22.8	-121.5	-37.1	0	0	0	113.5
186	R	30.8	Very low	32.7	Very low	244 Å²	244	129.8 Å²	129.8	92%	0.921	79%	0.786	S	S	*	*			trans	-143.3	93.5	178.3	-169.5	-173.4	-169.8	-174.1	4.1	113.9
187	A	31	Very low	32.2	Very low	102 Å²	102	127.5 Å²	127.5	84%	0.843	79%	0.789	S	S	*	*			trans	-159.9	123	166	0	0	0	0	0	114
188	G	29.3	Very low	31.5	Very low	88 Å²	88	126.5 Å²	126.5	91%	0.907	80%	0.795	S	S	*	*			trans	66.8	152.5	169.2	0	0	0	0	0	117
189	G	27.5	Very low	31	Very low	83 Å²	83	133.3 Å²	133.3	86%	0.856	81%	0.809	S	S	*	*			cis	155.5	126.6	-5.4	0	0	0	0	0	111.1
190	G	28.3	Very low	30.4	Very low	69 Å²	69	133.6 Å²	133.6	71%	0.711	82%	0.815	S	S	*	*			trans	98.3	125.2	-176.7	0	0	0	0	0	113.4
191	Q	31.3	Very low	30	Very low	178 Å²	178	134.6 Å²	134.6	83%	0.832	81%	0.811	S	S	*	*				57.7	128.6	76.7	-75	-175.6	-30.2	0	0	113.1
192	D	29.9	Very low	29.7	Very low	150 Å²	150	131.4 Å²	131.4	80%	0.802	81%	0.808	S	S	*	*			cis	-151.8	166.1	-9.8	-83	-45.7	0	0	0	105.6
193	G	29.3	Very low	29.3	Very low	69 Å²	69	133.6 Å²	133.6	71%	0.711	81%	0.811	S	S	*	*			cis	-173.8	-167.8	4.3	0	0	0	0	0	112.1
194	T	27.7	Very low	29.2	Very low	142 Å²	142	134 Å²	134	87%	0.871	81%	0.814	S	S	*	*			trans	-53.8	160.6	179	58.3	0	0	0	0	114.3
195	S	28.9	Very low	28.9	Very low	102 Å²	102	136.1 Å²	136.1	71%	0.713	82%	0.82	S	S	*	*			cis	-172.1	161	39.7	68.5	0	0	0	0	113.9
196	S	29.1	Very low	28.8	Very low	112 Å²	112	135.5 Å²	135.5	78%	0.783	82%	0.816	S	S	*	*			trans	52	149.9	130.7	-176.2	0	0	0	0	121.5
197	S	30.9	Very low	28.7	Very low	110 Å²	110	129.8 Å²	129.8	77%	0.769	81%	0.81	S	S	*	*			cis	177.5	143.3	-21.4	179.8	0	0	0	0	105.9
198	G	25.3	Very low	28.5	Very low	77 Å²	77	133.9 Å²	133.9	79%	0.794	81%	0.811	S	S	*	*			trans	-166.8	93.5	-177.2	0	0	0	0	0	115.2
199	R	31.3	Very low	28.4	Very low	221 Å²	221	137.3 Å²	137.3	83%	0.834	81%	0.808	S	S	*	*			trans	-79	161.4	170.3	-58.4	162.6	98.8	150.3	3.8	109.7
200	T	24.3	Very low	28.5	Very low	138 Å²	138	139.9 Å²	139.9	85%	0.847	81%	0.807	S	S	*	*				-176.2	153.6	109.5	-72.8	0	0	0	0	113.7
201	R	29.1	Very low	29.2	Very low	205 Å²	205	142.3 Å²	142.3	77%	0.774	81%	0.811	S	S	*	*			trans	-58.6	143.8	-176.2	-63.3	167.3	-177.3	-176.1	-0.7	113.7
202	S	32.2	Very low	28.9	Very low	105 Å²	105	139.4 Å²	139.4	73%	0.734	81%	0.81	S	S	*	*				65.2	120.8	75.4	-35.4	0	0	0	0	115.9
203	F	24.4	Very low	28.7	Very low	213 Å²	213	137.2 Å²	137.2	93%	0.934	81%	0.806	S	S	*	*			trans	-148.9	152.4	149.9	-92.2	-72.3	0	0	0	111.2
204	S	28.5	Very low	28.7	Very low	115 Å²	115	139.4 Å²	139.4	80%	0.804	81%	0.811	S	S	*	*			trans	-140.7	149.6	172.9	-52.3	0	0	0	0	107.4
205	L	27.1	Very low	29.4	Very low	177 Å²	177	137.9 Å²	137.9	93%	0.927	80%	0.804	S	S	*	*			trans	-161.1	135.9	154.7	-103.7	176.2	0	0	0	110.8
206	L	27.7	Very low	29.2	Very low	146 Å²	146	138.4 Å²	138.4	76%	0.764	81%	0.807	S	S	*	*			trans	-121.1	156.7	167	-92.1	165.4	0	0	0	107.4
207	P	29.9	Very low	29.1	Very low	123 Å²	123	137.7 Å²	137.7	80%	0.799	80%	0.802	S	S	*	*			trans	-112.9	154.5	151.1	2.6	18.8	0	0	0	112.6
208	H	26.3	Very low	29	Very low	188 Å²	188	139.5 Å²	139.5	87%	0.87	80%	0.798	S	S	*	*			trans	-94.4	163.6	-175.6	-84.6	-108.9	0	0	0	114.2
209	L	28.3	Very low	29.1	Very low	160 Å²	160	145 Å²	145	84%	0.838	80%	0.795	S	S	*	*			trans	-78.2	175.4	172.5	-69.3	157.3	0	0	0	113.3
210	T	27.8	Very low	29	Very low	137 Å²	137	142.8 Å²	142.8	84%	0.84	79%	0.794	S	S	*	*				169.1	-172.8	125.8	54.6	0	0	0	0	110.4
211	P	43.8	Very low	29	Very low	121 Å²	121	144.9 Å²	144.9	79%	0.786	79%	0.794	S	S	*	*				-140.5	167.6	-108	38.6	-15.2	0	0	0	118.1
212	S	24.8	Very low	28.9	Very low	116 Å²	116	138.4 Å²	138.4	81%	0.811	79%	0.791	S	S	*	*			trans	-169	163.1	153.1	89.6	0	0	0	0	108.6
213	S	25.7	Very low	28.7	Very low	104 Å²	104	142.1 Å²	142.1	73%	0.727	80%	0.796	S	S	*	*			cis	-180	131.3	-20.6	44.9	0	0	0	0	105.3
214	S	29.8	Very low	28.8	Very low	115 Å²	115	137.5 Å²	137.5	80%	0.804	79%	0.791	S	S	*	*			trans	-72.2	177.6	169.2	-31.7	0	0	0	0	110.5
215	P	42.4	Very low	28.7	Very low	111 Å²	111	136.7 Å²	136.7	72%	0.721	79%	0.791	S	S	*	*			cis	-154.7	-172.7	37.1	43.9	-21.6	0	0	0	119.1
216	S	24.3	Very low	28.9	Very low	112 Å²	112	132.7 Å²	132.7	78%	0.783	78%	0.784	S	S	*	*			trans	70.2	152.6	154.5	75.3	0	0	0	0	117.5
217	S	28.1	Very low	29.3	Very low	98 Å²	98	131.3 Å²	131.3	69%	0.685	78%	0.783	S	S	*	*			cis	-159.5	167	14.1	-116.5	0	0	0	0	108.3
218	Q	28.4	Very low	29.1	Very low	148 Å²	148	129.9 Å²	129.9	69%	0.692	78%	0.776	S	S	*	*			cis	-161.1	-160.6	-3.8	-134.7	-175.1	103.7	0	0	112.6
219	R	27.3	Very low	29.1	Very low	192 Å²	192	128.2 Å²	128.2	73%	0.725	77%	0.774	S	S	*	*			trans	-28.2	154.8	170.7	-69	175.5	168	161.8	-8.3	119.8
220	H	27.9	Very low	28.9	Very low	174 Å²	174	128.1 Å²	128.1	81%	0.806	77%	0.772	S	S	*	*			cis	-147.9	164.2	49.9	-95.4	-91.2	0	0	0	117.3
221	Q	26.1	Very low	28.8	Very low	183 Å²	183	128.1 Å²	128.1	86%	0.855	77%	0.772	S	S	*	*			trans	-88.7	167.1	174.9	-68.4	162.8	-34.9	0	0	111.9
222	G	25.5	Very low	27.8	Very low	69 Å²	69	127.3 Å²	127.3	71%	0.711	77%	0.765	S	S	*	*			cis	169.4	-153.9	-1	0	0	0	0	0	114.8
223	H	28.5	Very low	27.9	Very low	182 Å²	182	129.2 Å²	129.2	84%	0.843	76%	0.764	S	S	*	*			trans	70.5	100.7	166.9	-62	-60.5	0	0	0	122.7
224	S	27.3	Very low	27.9	Very low	116 Å²	116	130 Å²	130	81%	0.811	77%	0.765	S	S	*	*				58.2	112.3	120.7	-168.9	0	0	0	0	122
225	A	26.4	Very low	27.8	Very low	98 Å²	98	132.1 Å²	132.1	81%	0.81	76%	0.762	S	S	*	*				-176.5	149.4	111.6	0	0	0	0	0	111.7
226	A	30.6	Very low	27.5	Very low	94 Å²	94	135.1 Å²	135.1	78%	0.777	77%	0.766	S	S	*	*			trans	-108.2	152.5	158.5	0	0	0	0	0	107.8
227	P	35.7	Very low	27.7	Very low	117 Å²	117	140.1 Å²	140.1	76%	0.76	77%	0.773	S	S	*	*				-150.4	167.7	85.9	40.4	-22.6	0	0	0	117.2
228	S	25.1	Very low	27.6	Very low	92 Å²	92	140.6 Å²	140.6	64%	0.643	78%	0.777	S	S	*	*			trans	11.2	130.8	153.8	60.3	0	0	0	0	123.2
229	N	27.2	Very low	27.9	Very low	154 Å²	154	140 Å²	140	82%	0.824	79%	0.786	S	S	*	*			trans	65.1	134.7	133.8	-62.3	-16	0	0	0	121.9
230	I	25	Very low	28.1	Very low	157 Å²	157	135.3 Å²	135.3	81%	0.805	79%	0.788	S	S	*	*			trans	103.9	113.3	170.2	-61	165	0	0	0	113.2
231	V	24.6	Very low	28.3	Very low	137 Å²	137	131.8 Å²	131.8	83%	0.83	79%	0.789	S	S	*	*			trans	-128.3	97.9	163.2	-180	0	0	0	0	108.5
232	T	23.7	Very low	28.6	Very low	105 Å²	105	127.6 Å²	127.6	64%	0.644	79%	0.786	S	S	*	*			trans	-60.8	130	160.8	-52.8	0	0	0	0	108.8	T234	T232-T234 PolarHBondContact O-N 3.46Å
233	I	25.7	Very low	29	Very low	155 Å²	155	135.9 Å²	135.9	80%	0.795	80%	0.795	S	S	*	*			trans	-78.2	109.7	175.1	-61.3	175.3	0	0	0	108.5
234	T	26.5	Very low	29.3	Very low	121 Å²	121	139.1 Å²	139.1	74%	0.742	80%	0.8	S	S	*	*			trans	-108.9	149	167.2	46.1	0	0	0	0	110.9	T232	T232-T234 PolarHBondContact O-N 3.46Å
235	H	28.2	Very low	29.5	Very low	160 Å²	160	139 Å²	139	74%	0.741	80%	0.8	S	S	*	*			trans	-75.6	169.7	-170.6	-79	-121	0	0	0	114
236	H	34.9	Very low	30.1	Very low	174 Å²	174	145 Å²	145	81%	0.806	80%	0.801	S	S	*	*			trans	66.8	115.9	151.7	60.5	-104.4	0	0	0	121.4
237	K	28.3	Very low	30.5	Very low	216 Å²	216	146 Å²	146	94%	0.939	80%	0.803	S	S	*	*			trans	-159	152.1	140.9	-117.5	169.2	-174.4	174	0	113.5
238	S	27.1	Very low	30.8	Very low	109 Å²	109	148.6 Å²	148.6	76%	0.762	80%	0.804	S	S	*	*			trans	-88.2	164.4	-159.5	-55.9	0	0	0	0	116.5	A240	S238-A240 PolarHBondContact O-N 3.01Å
239	P	34.4	Very low	32.1	Very low	135 Å²	135	152.1 Å²	152.1	88%	0.877	81%	0.805	S	S	*	*	S	Bend	trans	-90.3	81.1	-167.7	36	-35.8	0	0	0	114.3
240	A	30.5	Very low	33.2	Very low	94 Å²	94	149.8 Å²	149.8	78%	0.777	80%	0.798	S	S	*	*			trans	-108.7	-11.2	174.7	0	0	0	0	0	115	S238	S238-A240 PolarHBondContact O-N 3.01Å
241	A	33.6	Very low	34.6	Very low	99 Å²	99	144.8 Å²	144.8	82%	0.818	79%	0.785	S	S	*	*	S	Bend	trans	-87.1	-10.7	-168.6	0	0	0	0	0	115.9	R243	A241-R243 VanDerWaalsContact C-N 3.34Å; A241-R243 PolarHBondContact O-N 3.21Å
242	A	32.8	Very low	36.4	Very low	95 Å²	95	144 Å²	144	79%	0.785	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	8.5	-165.7	0	0	0	0	0	116.5
243	R	33.2	Very low	38.6	Very low	243 Å²	243	140.7 Å²	140.7	92%	0.917	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	13.3	-170	-74.1	-167.6	180	-173	2	116.6	A241	A241-R243 VanDerWaalsContact C-N 3.34Å; A241-R243 PolarHBondContact O-N 3.21Å
244	R	35	Very low	40.8	Very low	250 Å²	250	139.3 Å²	139.3	94%	0.943	74%	0.744	S	S	*	*	S	Bend	trans	-119	21.9	-171.7	-75	-167.7	-179.4	174.2	1.9	117.6
245	S	32.2	Very low	43.2	Very low	114 Å²	114	139.8 Å²	139.8	80%	0.797	74%	0.738	S	S	*	*			trans	-133.6	79.8	171.6	55.1	0	0	0	0	113.1
246	R	39	Very low	45.5	Very low	225 Å²	225	135.5 Å²	135.5	85%	0.849	72%	0.723	S	S	*	*			trans	-136.7	104.8	166.8	-105.6	-172.4	173.4	-172.1	-3.2	109.6
247	S	39	Very low	47.5	Very low	115 Å²	115	133.3 Å²	133.3	80%	0.804	71%	0.711	S	S	*	*			trans	166	94.6	147.4	-175.8	0	0	0	0	110.3
248	Q	41.8	Very low	50	Low	170 Å²	170	128.9 Å²	128.9	79%	0.794	69%	0.694	S	S	*	*			trans	-178.9	86.4	158.7	-106.4	175.1	16.1	0	0	107.8
249	Y	51.7	Low	52.5	Low	166 Å²	166	127.9 Å²	127.9	65%	0.651	68%	0.683	S	S	*	*			trans	-134.2	-28.8	-177.5	-81.8	-80.8	0	0	0	116	G251	Y249-G251 PolarHBondContact O-N 3.39Å
250	P	50.9	Low	55	Low	105 Å²	105	122.3 Å²	122.3	68%	0.682	65%	0.645	S	S	*	*	H	α-helix	trans	-64.7	-32.9	-176.9	-26.5	35.7	0	0	0	115.6
251	G	54.7	Low	57.5	Low	52 Å²	52	121.5 Å²	121.5	54%	0.536	63%	0.634	S	S	.	*	H	α-helix	trans	-72.6	-35.2	-172.9	0	0	0	0	0	114.8	Y249 L253 L254 E255	Y249-G251 PolarHBondContact O-N 3.39Å; G251-L253 VanDerWaalsContact C-N 3.33Å; G251-L253 PolarHBondContact O-N 3Å; G251-L254 PolarHBondContact O-N 3.24Å; G251-E255 PolarHBondContact O-N 3.06Å
252	Q	60.9	Low	60	Low	120 Å²	120	121.9 Å²	121.9	56%	0.561	62%	0.619	S	S	*	*	H	α-helix	trans	-69.6	-29.4	-174.4	-71.2	173.6	-18.7	0	0	112.7	L254 E255 V256	Q252-L254 VanDerWaalsContact C-N 3.32Å; Q252-L254 PolarHBondContact O-N 3.3Å; Q252-E255 PolarHBondContact O-N 3.41Å; Q252-V256 WeakPolarHBondContact O-CG2 3.35Å; Q252-V256 PolarHBondContact O-N 3.2Å
253	L	70.6	Confident	62.4	Low	36 Å²	36	118.9 Å²	118.9	19%	0.188	59%	0.594	C	S	.	*	H	α-helix	trans	-69.3	-27.5	177	-84.5	162.3	0	0	0	113.4	G251 K257 L308 L311 Q312 T315	G251-L253 VanDerWaalsContact C-N 3.33Å; G251-L253 PolarHBondContact O-N 3Å; L253-K257 WeakPolarHBondContact O-CB 3.48Å; L253-K257 PolarHBondContact O-N 3.17Å; L253-K257 VanDerWaalsContact O-N 3.17Å; L253-L308 HydrophobicContact CD2-CD1 3.78Å; L253-L311 HydrophobicContact CD2-CB 4.08Å; L253-Q312 HydrophobicContact CD2-CG 4.25Å; L253-T315 HydrophobicContact CD1-CG2 4.07Å; L253-T315 WeakPolarHBondContact CD1-OG1 3.41Å
254	L	71.8	Confident	64.9	Low	126 Å²	126	111.4 Å²	111.4	66%	0.66	57%	0.57	S	S	*	*	H	α-helix	trans	-71.2	-44.7	173.3	-83.2	149.5	0	0	0	111.1	G251 Q252 K257 E258	G251-L254 PolarHBondContact O-N 3.24Å; Q252-L254 VanDerWaalsContact C-N 3.32Å; Q252-L254 PolarHBondContact O-N 3.3Å; L254-K257 WeakPolarHBondContact O-CB 3.45Å; L254-K257 PolarHBondContact O-N 3.15Å; L254-E258 PolarHBondContact O-N 2.94Å
255	E	75.8	Confident	67.4	Low	132 Å²	132	100.9 Å²	100.9	62%	0.617	54%	0.539	S	S	*	.	H	α-helix	trans	-61.4	-44.6	176.5	-171.6	175.1	-167.7	0	0	111.6	G251 Q252 K257 E258 V259	G251-E255 PolarHBondContact O-N 3.06Å; Q252-E255 PolarHBondContact O-N 3.41Å; E255-K257 VanDerWaalsContact C-N 3.32Å; E255-K257 PolarHBondContact O-N 3.29Å; E255-E258 PolarHBondContact O-N 3.04Å; E255-V259 WeakPolarHBondContact O-CG2 3.49Å; E255-V259 PolarHBondContact O-N 2.99Å
256	V	77.1	Confident	69.9	Low	70 Å²	70	102 Å²	102	42%	0.424	53%	0.531	S	S	.	.	H	α-helix	trans	-62	-38.1	174.8	174.5	0	0	0	0	111.9	Q252 V259 M260 L308	Q252-V256 WeakPolarHBondContact O-CG2 3.35Å; Q252-V256 PolarHBondContact O-N 3.2Å; V256-V259 PolarHBondContact O-N 3.49Å; V256-M260 WeakPolarHBondContact O-CB 3.23Å; V256-M260 WeakPolarHBondContact O-CG 3.38Å; V256-M260 PolarHBondContact O-N 2.76Å; V256-L308 HydrophobicContact CG1-CD1 3.88Å; V256-L308 HydrophobicContact CG1-CD2 4.48Å
257	K	77.3	Confident	72.5	Confident	128 Å²	128	92.3 Å²	92.3	56%	0.557	50%	0.496	S	S	*	.	H	α-helix	trans	-65.5	-37.5	176.4	-173.4	179	179.3	179.7	0	112.2	L253 L254 E255 S261 L308	L253-K257 WeakPolarHBondContact O-CB 3.48Å; L253-K257 PolarHBondContact O-N 3.17Å; L253-K257 VanDerWaalsContact O-N 3.17Å; L254-K257 WeakPolarHBondContact O-CB 3.45Å; L254-K257 PolarHBondContact O-N 3.15Å; E255-K257 VanDerWaalsContact C-N 3.32Å; E255-K257 PolarHBondContact O-N 3.29Å; K257-S261 PolarHBondContact O-N 3.46Å; K257-S261 VanDerWaalsContact O-N 3.12Å; K257-L308 HydrophobicContact CB-CD2 4.34Å
258	E	80.5	Confident	74.9	Confident	123 Å²	123	93.4 Å²	93.4	58%	0.575	49%	0.486	S	S	*	.	H	α-helix	trans	-67.1	-46.5	175.7	-169.1	178.8	165.8	0	0	111.5	L254 E255 M260 S261 Q262	L254-E258 PolarHBondContact O-N 2.94Å; E255-E258 PolarHBondContact O-N 3.04Å; E258-M260 VanDerWaalsContact C-N 3.32Å; E258-M260 PolarHBondContact O-N 2.68Å; E258-S261 PolarHBondContact O-N 3.33Å; E258-S261 VanDerWaalsContact O-N 3.17Å; E258-Q262 WeakPolarHBondContact O-CG 3.4Å; E258-Q262 PolarHBondContact O-N 3.03Å; E258-Q262 PolarHBondContact OE1-NE2 2.92Å
259	V	80.8	Confident	77.2	Confident	87 Å²	87	90.6 Å²	90.6	53%	0.527	48%	0.477	S	S	.	.	H	α-helix	trans	-60.7	-39.9	176.2	174.2	0	0	0	0	111.6	E255 V256 Q262 A263	E255-V259 WeakPolarHBondContact O-CG2 3.49Å; E255-V259 PolarHBondContact O-N 2.99Å; V256-V259 PolarHBondContact O-N 3.49Å; V259-Q262 PolarHBondContact O-N 2.9Å; V259-A263 WeakPolarHBondContact O-CB 3.46Å; V259-A263 PolarHBondContact O-N 3.26Å
260	M	86	Confident	78.9	Confident	18 Å²	18	85.4 Å²	85.4	9%	0.089	46%	0.46	C	S	.	.	H	α-helix	trans	-59.5	-46.7	173.3	-82.3	-60.6	-59.7	0	0	112.3	V256 E258 Q262 A263 E264 L301 L304 L308	V256-M260 WeakPolarHBondContact O-CB 3.23Å; V256-M260 WeakPolarHBondContact O-CG 3.38Å; V256-M260 PolarHBondContact O-N 2.76Å; E258-M260 VanDerWaalsContact C-N 3.32Å; E258-M260 PolarHBondContact O-N 2.68Å; M260-Q262 VanDerWaalsContact C-N 3.33Å; M260-Q262 PolarHBondContact O-N 3.09Å; M260-A263 PolarHBondContact O-N 2.79Å; M260-E264 PolarHBondContact O-N 3.05Å; M260-L301 HydrophobicContact CE-CD2 3.75Å; M260-L301 HydrophobicContact SD-CD2 4.38Å; M260-L304 HydrophobicContact CE-CB 3.86Å; M260-L304 HydrophobicContact SD-CB 3.55Å; M260-L304 VanDerWaalsContact SD-CB 3.55Å; M260-L304 HydrophobicContact SD-CD1 4.35Å; M260-L308 HydrophobicContact CB-CD2 4.43Å; M260-L308 HydrophobicContact CG-CD2 3.97Å
261	S	83.5	Confident	80.8	Confident	77 Å²	77	82.2 Å²	82.2	54%	0.538	44%	0.438	S	S	.	.	H	α-helix	trans	-62	-39.8	177.8	-174.1	0	0	0	0	112.4	K257 E258 E264 G265	K257-S261 PolarHBondContact O-N 3.46Å; K257-S261 VanDerWaalsContact O-N 3.12Å; E258-S261 PolarHBondContact O-N 3.33Å; E258-S261 VanDerWaalsContact O-N 3.17Å; S261-E264 PolarHBondContact O-N 3.09Å; S261-G265 PolarHBondContact O-N 3.41Å; S261-G265 VanDerWaalsContact O-N 3.1Å
262	Q	84.6	Confident	82.6	Confident	107 Å²	107	86.1 Å²	86.1	50%	0.5	44%	0.442	S	S	.	.	H	α-helix	trans	-64.7	-41.6	174.5	-67.1	178.5	21.3	0	0	111.9	E258 V259 M260 G265 Q266	E258-Q262 WeakPolarHBondContact O-CG 3.4Å; E258-Q262 PolarHBondContact O-N 3.03Å; E258-Q262 PolarHBondContact OE1-NE2 2.92Å; V259-Q262 PolarHBondContact O-N 2.9Å; M260-Q262 VanDerWaalsContact C-N 3.33Å; M260-Q262 PolarHBondContact O-N 3.09Å; Q262-G265 PolarHBondContact O-N 2.92Å; Q262-Q266 WeakPolarHBondContact O-CG 3.35Å; Q262-Q266 PolarHBondContact O-N 2.83Å
263	A	83.2	Confident	84	Confident	33 Å²	33	83.6 Å²	83.6	27%	0.273	44%	0.438	S	S	.	.	H	α-helix	trans	-66.2	-40.4	177.7	0	0	0	0	0	112.3	V259 M260 G265 Q266 Q267 L301	V259-A263 WeakPolarHBondContact O-CB 3.46Å; V259-A263 PolarHBondContact O-N 3.26Å; M260-A263 PolarHBondContact O-N 2.79Å; A263-G265 VanDerWaalsContact C-N 3.32Å; A263-G265 PolarHBondContact O-N 2.82Å; A263-Q266 PolarHBondContact O-N 3.45Å; A263-Q267 PolarHBondContact O-N 3.07Å; A263-L301 HydrophobicContact CB-CD2 3.82Å
264	E	87.4	Confident	85	Confident	86 Å²	86	82.2 Å²	82.2	40%	0.402	43%	0.431	S	S	.	.	H	α-helix	trans	-59.2	-40.6	170.9	-74.4	-179.3	-159.5	0	0	112.6	M260 S261 Q267 K268 L301	M260-E264 PolarHBondContact O-N 3.05Å; S261-E264 PolarHBondContact O-N 3.09Å; E264-Q267 PolarHBondContact O-N 3.17Å; E264-K268 WeakPolarHBondContact O-CG 3.31Å; E264-K268 PolarHBondContact O-N 2.9Å; E264-L301 HydrophobicContact CG-CD1 4.37Å; E264-L301 HydrophobicContact CG-CD2 4.07Å
265	G	87.1	Confident	85.9	Confident	28 Å²	28	80.1 Å²	80.1	29%	0.289	42%	0.42	S	S	.	.	H	α-helix	trans	-62.7	-45.1	174.5	0	0	0	0	0	112.4	S261 Q262 A263 Q267 K268 N269	S261-G265 PolarHBondContact O-N 3.41Å; S261-G265 VanDerWaalsContact O-N 3.1Å; Q262-G265 PolarHBondContact O-N 2.92Å; A263-G265 VanDerWaalsContact C-N 3.32Å; A263-G265 PolarHBondContact O-N 2.82Å; G265-Q267 VanDerWaalsContact C-N 3.33Å; G265-Q267 PolarHBondContact O-N 3.26Å; G265-K268 PolarHBondContact O-N 2.92Å; G265-N269 VanDerWaalsContact O-CG 3.3Å; G265-N269 PolarHBondContact O-N 2.83Å; G265-N269 VanDerWaalsContact O-N 3.13Å; G265-N269 PolarHBondContact O-ND2 3.27Å
266	Q	84.3	Confident	86.6	Confident	137 Å²	137	77.8 Å²	77.8	64%	0.64	42%	0.419	S	S	*	.	H	α-helix	trans	-63	-38.9	175.6	-70.7	-177.8	6.9	0	0	112.2	Q262 A263 N269 L270	Q262-Q266 WeakPolarHBondContact O-CG 3.35Å; Q262-Q266 PolarHBondContact O-N 2.83Å; A263-Q266 PolarHBondContact O-N 3.45Å; Q266-N269 PolarHBondContact O-N 2.85Å; Q266-L270 PolarHBondContact O-N 3.04Å
267	Q	92.6	Very high	87.2	Confident	23 Å²	23	77.1 Å²	77.1	11%	0.107	41%	0.412	C	S	.	.	H	α-helix	trans	-64.6	-44.3	175.7	175	62.8	2.9	0	0	112.7	A263 E264 G265 N269 L270 V271 K294 S297 A298 L301	A263-Q267 PolarHBondContact O-N 3.07Å; E264-Q267 PolarHBondContact O-N 3.17Å; G265-Q267 VanDerWaalsContact C-N 3.33Å; G265-Q267 PolarHBondContact O-N 3.26Å; Q267-N269 VanDerWaalsContact C-N 3.26Å; Q267-N269 PolarHBondContact O-N 3.42Å; Q267-L270 WeakPolarHBondContact O-CB 3.36Å; Q267-L270 PolarHBondContact O-N 3Å; Q267-L270 VanDerWaalsContact O-N 3.15Å; Q267-V271 HydrophobicContact CG-CG2 4.35Å; Q267-V271 VanDerWaalsContact O-CG2 3.31Å; Q267-V271 WeakPolarHBondContact O-CG2 3.42Å; Q267-V271 PolarHBondContact O-N 3.31Å; Q267-K294 PolarHBondContact NE2-O 2.97Å; Q267-S297 PolarHBondContact NE2-OG 3.33Å; Q267-S297 PolarHBondContact OE1-OG 2.87Å; Q267-A298 VanDerWaalsContact NE2-N 3.15Å; Q267-L301 HydrophobicContact CB-CD1 3.26Å; Q267-L301 HydrophobicContact CG-CD1 3.66Å
268	K	89.8	Confident	87.6	Confident	137 Å²	137	74.6 Å²	74.6	60%	0.596	41%	0.409	S	S	*	.	H	α-helix	trans	-59.3	-40.7	176.4	-73.8	166.7	-178	165.2	0	111.1	E264 G265 V271 H272	E264-K268 WeakPolarHBondContact O-CG 3.31Å; E264-K268 PolarHBondContact O-N 2.9Å; G265-K268 PolarHBondContact O-N 2.92Å; K268-V271 PolarHBondContact O-N 2.87Å; K268-H272 WeakPolarHBondContact O-CB 3.28Å; K268-H272 PolarHBondContact O-N 3.02Å
269	N	90.1	Very high	87.5	Confident	112 Å²	112	73.2 Å²	73.2	60%	0.599	41%	0.409	S	S	*	.	H	α-helix	trans	-66.2	-38.6	175.1	-66.7	-22.1	0	0	0	112.7	G265 Q266 Q267 S273	G265-N269 VanDerWaalsContact O-CG 3.3Å; G265-N269 PolarHBondContact O-N 2.83Å; G265-N269 VanDerWaalsContact O-N 3.13Å; G265-N269 PolarHBondContact O-ND2 3.27Å; Q266-N269 PolarHBondContact O-N 2.85Å; Q267-N269 VanDerWaalsContact C-N 3.26Å; Q267-N269 PolarHBondContact O-N 3.42Å; N269-S273 VanDerWaalsContact O-CB 3.31Å; N269-S273 WeakPolarHBondContact O-CB 3.35Å; N269-S273 PolarHBondContact O-N 3.38Å; N269-S273 PolarHBondContact O-OG 3.03Å
270	L	88.1	Confident	86.7	Confident	56 Å²	56	78 Å²	78	29%	0.293	42%	0.423	S	S	.	.	H	α-helix	trans	-64.5	-48.1	174.9	177.3	60.6	0	0	0	111.6	Q266 Q267 H272 S273 I274 L293	Q266-L270 PolarHBondContact O-N 3.04Å; Q267-L270 WeakPolarHBondContact O-CB 3.36Å; Q267-L270 PolarHBondContact O-N 3Å; Q267-L270 VanDerWaalsContact O-N 3.15Å; L270-H272 PolarHBondContact O-N 3.34Å; L270-S273 WeakPolarHBondContact O-CB 3.5Å; L270-S273 PolarHBondContact O-N 3.16Å; L270-I274 HydrophobicContact CD1-CD1 3.87Å; L270-I274 HydrophobicContact CD1-CG1 4.38Å; L270-I274 HydrophobicContact CG-CD1 4.02Å; L270-I274 WeakPolarHBondContact O-CG1 3.29Å; L270-I274 PolarHBondContact O-N 2.71Å; L270-L293 HydrophobicContact CD1-CD2 4.31Å; L270-L293 HydrophobicContact CD2-CD2 4.5Å; L270-L293 HydrophobicContact CD2-CG 4.27Å
271	V	91.4	Very high	85.9	Confident	39 Å²	39	79.5 Å²	79.5	24%	0.236	44%	0.443	C	S	.	.	H	α-helix	trans	-56	-52.2	175.9	169.8	0	0	0	0	110.6	Q267 K268 S273 I274 D275 K294	Q267-V271 HydrophobicContact CG-CG2 4.35Å; Q267-V271 VanDerWaalsContact O-CG2 3.31Å; Q267-V271 WeakPolarHBondContact O-CG2 3.42Å; Q267-V271 PolarHBondContact O-N 3.31Å; K268-V271 PolarHBondContact O-N 2.87Å; V271-S273 VanDerWaalsContact C-N 3.29Å; V271-S273 PolarHBondContact O-N 3.27Å; V271-I274 PolarHBondContact O-N 2.94Å; V271-I274 VanDerWaalsContact O-N 3.16Å; V271-D275 VanDerWaalsContact CG1-OD2 3.32Å; V271-D275 WeakPolarHBondContact CG1-OD2 3.29Å; V271-D275 WeakPolarHBondContact O-CB 3.45Å; V271-D275 VanDerWaalsContact O-CG 3.31Å; V271-D275 PolarHBondContact O-N 3.17Å; V271-K294 HydrophobicContact CG1-CD 4.37Å; V271-K294 HydrophobicContact CG2-CD 4.41Å; V271-K294 HydrophobicContact CG2-CG 4.19Å
272	H	92	Very high	85	Confident	134 Å²	134	82.6 Å²	82.6	62%	0.62	46%	0.461	S	S	*	.	H	α-helix	trans	-60.8	-37.8	177.8	-174.1	-70	0	0	0	112.2	K268 L270 I274 D275 S276	K268-H272 WeakPolarHBondContact O-CB 3.28Å; K268-H272 PolarHBondContact O-N 3.02Å; L270-H272 PolarHBondContact O-N 3.34Å; H272-I274 VanDerWaalsContact C-N 3.32Å; H272-I274 PolarHBondContact O-N 2.76Å; H272-D275 PolarHBondContact O-N 2.96Å; H272-S276 VanDerWaalsContact O-CB 3.27Å; H272-S276 WeakPolarHBondContact O-CB 3.32Å; H272-S276 PolarHBondContact O-N 2.69Å; H272-S276 PolarHBondContact O-OG 2.97Å
273	S	90.1	Very high	84.5	Confident	67 Å²	67	82.5 Å²	82.5	47%	0.469	46%	0.464	S	S	.	.	H	α-helix	trans	-65.4	-35.2	177.7	-60.8	0	0	0	0	112.4	N269 L270 V271 S276	N269-S273 VanDerWaalsContact O-CB 3.31Å; N269-S273 WeakPolarHBondContact O-CB 3.35Å; N269-S273 PolarHBondContact O-N 3.38Å; N269-S273 PolarHBondContact O-OG 3.03Å; L270-S273 WeakPolarHBondContact O-CB 3.5Å; L270-S273 PolarHBondContact O-N 3.16Å; V271-S273 VanDerWaalsContact C-N 3.29Å; V271-S273 PolarHBondContact O-N 3.27Å; S273-S276 PolarHBondContact O-OG 3.23Å; S273-S276 VanDerWaalsContact O-OG 3.13Å
274	I	91	Very high	84.7	Confident	6 Å²	6	81.6 Å²	81.6	3%	0.031	46%	0.455	C	S	.	.	H	α-helix	trans	-75.8	-44.8	176.6	-66.8	164.4	0	0	0	110.5	L270 V271 H272 S276 L277 C285 L290 K294	L270-I274 HydrophobicContact CD1-CD1 3.87Å; L270-I274 HydrophobicContact CD1-CG1 4.38Å; L270-I274 HydrophobicContact CG-CD1 4.02Å; L270-I274 WeakPolarHBondContact O-CG1 3.29Å; L270-I274 PolarHBondContact O-N 2.71Å; V271-I274 PolarHBondContact O-N 2.94Å; V271-I274 VanDerWaalsContact O-N 3.16Å; H272-I274 VanDerWaalsContact C-N 3.32Å; H272-I274 PolarHBondContact O-N 2.76Å; I274-S276 VanDerWaalsContact C-N 3.25Å; I274-S276 PolarHBondContact O-N 2.79Å; I274-L277 WeakPolarHBondContact O-CB 3.15Å; I274-L277 PolarHBondContact O-N 3.15Å; I274-L277 VanDerWaalsContact O-N 3.12Å; I274-C285 WeakPolarHBondContact O-CB 3.31Å; I274-L290 HydrophobicContact CD1-CB 4.45Å; I274-L290 HydrophobicContact CG1-CB 4.39Å; I274-L290 HydrophobicContact CG2-CB 4.14Å; I274-K294 HydrophobicContact CD1-CB 3.91Å; I274-K294 HydrophobicContact CG2-CD 4.48Å
275	D	90.6	Very high	84.5	Confident	83 Å²	83	78.3 Å²	78.3	44%	0.444	44%	0.442	S	S	.	.	H	α-helix	trans	-70.2	-21.6	-177.7	-65.8	-22.3	0	0	0	113.2	V271 H272 L277 K294	V271-D275 VanDerWaalsContact CG1-OD2 3.32Å; V271-D275 WeakPolarHBondContact CG1-OD2 3.29Å; V271-D275 WeakPolarHBondContact O-CB 3.45Å; V271-D275 VanDerWaalsContact O-CG 3.31Å; V271-D275 PolarHBondContact O-N 3.17Å; H272-D275 PolarHBondContact O-N 2.96Å; D275-L277 VanDerWaalsContact C-N 3.32Å; D275-K294 IonicContact OD1-NZ 2.68Å; D275-K294 PolarHBondContact OD1-NZ 2.96Å; D275-K294 IonicContact OD2-NZ 3.94Å; D275-K294 PolarHBondContact OD2-NZ 3.24Å
276	S	90.4	Very high	84.5	Confident	83 Å²	83	82.5 Å²	82.5	58%	0.58	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-2.5	172.9	66.8	0	0	0	0	114.9	H272 S273 I274	H272-S276 VanDerWaalsContact O-CB 3.27Å; H272-S276 WeakPolarHBondContact O-CB 3.32Å; H272-S276 PolarHBondContact O-N 2.69Å; H272-S276 PolarHBondContact O-OG 2.97Å; S273-S276 PolarHBondContact O-OG 3.23Å; S273-S276 VanDerWaalsContact O-OG 3.13Å; I274-S276 VanDerWaalsContact C-N 3.25Å; I274-S276 PolarHBondContact O-N 2.79Å
277	L	90.6	Very high	84.8	Confident	55 Å²	55	78.4 Å²	78.4	29%	0.288	44%	0.439	S	S	.	.	S	Bend	trans	-75.1	151.5	174.1	-67.2	173.3	0	0	0	111.5	I274 D275 C285 L290	I274-L277 WeakPolarHBondContact O-CB 3.15Å; I274-L277 PolarHBondContact O-N 3.15Å; I274-L277 VanDerWaalsContact O-N 3.12Å; D275-L277 VanDerWaalsContact C-N 3.32Å; L277-C285 HydrophobicContact CB-CB 3.99Å; L277-C285 WeakPolarHBondContact O-CB 3.48Å; L277-C285 PolarHBondContact O-SG 3.01Å; L277-L290 HydrophobicContact CD1-CD1 3.4Å; L277-L290 VanDerWaalsContact CD1-CD1 3.4Å
278	P	84.8	Confident	84.4	Confident	76 Å²	76	85 Å²	85	49%	0.494	47%	0.47	S	S	.	.			trans	-64.4	153	175.6	29	-36	0	0	0	111.4	K280 S284 C285	P278-K280 PolarHBondContact O-N 3.03Å; P278-S284 WeakPolarHBondContact O-CA 3.23Å; P278-S284 WeakPolarHBondContact O-CB 3.44Å; P278-S284 PolarHBondContact O-OG 2.82Å; P278-C285 PolarHBondContact O-N 2.92Å; P278-C285 VanDerWaalsContact O-N 3.13Å
279	T	78.9	Confident	84	Confident	94 Å²	94	84.3 Å²	84.3	58%	0.577	47%	0.473	S	S	*	.	S	Bend	trans	-74.2	-11.6	178.8	49.6	0	0	0	0	113.9	S284	T279-S284 PolarHBondContact O-OG 2.88Å
280	K	63.5	Low	83.8	Confident	186 Å²	186	80.6 Å²	80.6	81%	0.809	45%	0.453	S	S	*	.	S	Bend	trans	-142.2	137.9	175.6	-62.8	-174.8	-178.7	-179.1	0	110.1	P278	P278-K280 PolarHBondContact O-N 3.03Å
281	G	70.3	Confident	83.7	Confident	50 Å²	50	81.4 Å²	81.4	52%	0.515	46%	0.457	S	S	.	.	S	Bend	trans	150.2	174.8	-177.7	0	0	0	0	0	111.1	L283	G281-L283 PolarHBondContact O-N 2.91Å
282	P	64.4	Low	83.4	Confident	143 Å²	143	84.3 Å²	84.3	93%	0.929	47%	0.471	S	S	*	.	S	Bend	trans	-67.8	-14.6	178.8	26.3	-33.2	0	0	0	113.9
283	L	74.1	Confident	83	Confident	105 Å²	105	82 Å²	82	55%	0.55	46%	0.462	S	S	.	.	S	Bend	trans	-136	125.8	163.7	-84.8	157.4	0	0	0	106.8	G281 L290	G281-L283 PolarHBondContact O-N 2.91Å; L283-L290 HydrophobicContact CD2-CD1 4.09Å
284	S	87.8	Confident	83	Confident	13 Å²	13	81.3 Å²	81.3	9%	0.091	45%	0.451	C	S	.	.			trans	-130.3	155.1	-172.7	174.7	0	0	0	0	111.3	P278 T279 L286 D287	P278-S284 WeakPolarHBondContact O-CA 3.23Å; P278-S284 WeakPolarHBondContact O-CB 3.44Å; P278-S284 PolarHBondContact O-OG 2.82Å; T279-S284 PolarHBondContact O-OG 2.88Å; S284-L286 PolarHBondContact O-N 3.43Å; S284-L286 PolarHBondContact OG-N 2.92Å; S284-L286 VanDerWaalsContact OG-N 3.09Å; S284-D287 WeakPolarHBondContact O-CB 3.42Å; S284-D287 PolarHBondContact O-N 3.27Å
285	C	83.6	Confident	82.5	Confident	18 Å²	18	83.8 Å²	83.8	12%	0.122	47%	0.473	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-14.9	168.2	59	0	0	0	0	112.9	I274 L277 P278 L291	I274-C285 WeakPolarHBondContact O-CB 3.31Å; L277-C285 HydrophobicContact CB-CB 3.99Å; L277-C285 WeakPolarHBondContact O-CB 3.48Å; L277-C285 PolarHBondContact O-SG 3.01Å; P278-C285 PolarHBondContact O-N 2.92Å; P278-C285 VanDerWaalsContact O-N 3.13Å; C285-L291 WeakPolarHBondContact O-CD2 3.48Å
286	L	87.1	Confident	82.1	Confident	116 Å²	116	83.4 Å²	83.4	61%	0.607	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	6.4	173.2	-57.9	178.8	0	0	0	113.4	S284 Q288	S284-L286 PolarHBondContact O-N 3.43Å; S284-L286 PolarHBondContact OG-N 2.92Å; S284-L286 VanDerWaalsContact OG-N 3.09Å; L286-Q288 PolarHBondContact O-N 3.09Å
287	D	89.8	Confident	81.9	Confident	50 Å²	50	80.6 Å²	80.6	27%	0.267	45%	0.454	S	S	.	.			trans	-63.3	131.4	176.9	179.9	-83.3	0	0	0	111.1	S284 D289 L290 L291	S284-D287 WeakPolarHBondContact O-CB 3.42Å; S284-D287 PolarHBondContact O-N 3.27Å; D287-D289 PolarHBondContact O-N 2.96Å; D287-D289 PolarHBondContact OD1-N 2.91Å; D287-L290 HydrophobicContact CB-CB 4.12Å; D287-L290 HydrophobicContact CB-CD1 4.08Å; D287-L290 HydrophobicContact CB-CG 4.05Å; D287-L290 PolarHBondContact O-N 3.43Å; D287-L290 PolarHBondContact OD1-N 3.18Å; D287-L291 WeakPolarHBondContact O-CB 3.2Å; D287-L291 WeakPolarHBondContact O-CG 3.48Å; D287-L291 PolarHBondContact O-N 3.12Å
288	Q	84.2	Confident	81.7	Confident	163 Å²	163	80.3 Å²	80.3	76%	0.762	46%	0.46	S	S	*	.	H	α-helix	trans	-67.3	-34.4	-170.9	-172.8	171	-5.7	0	0	112.8	L286 L292	L286-Q288 PolarHBondContact O-N 3.09Å; Q288-L292 WeakPolarHBondContact O-CB 3.31Å; Q288-L292 PolarHBondContact O-N 3.41Å
289	D	81.5	Confident	81.6	Confident	121 Å²	121	79.3 Å²	79.3	65%	0.647	46%	0.458	S	S	*	.	H	α-helix	trans	-76.4	-35.7	178.4	-74.9	-19.6	0	0	0	111	D287 L293	D287-D289 PolarHBondContact O-N 2.96Å; D287-D289 PolarHBondContact OD1-N 2.91Å; D289-L293 VanDerWaalsContact O-CB 3.23Å; D289-L293 WeakPolarHBondContact O-CB 3.26Å; D289-L293 PolarHBondContact O-N 3.43Å
290	L	86.3	Confident	81.8	Confident	34 Å²	34	78.2 Å²	78.2	18%	0.178	45%	0.451	C	S	.	.	H	α-helix	trans	-69.3	-40.3	172.8	-63.4	-175.3	0	0	0	112.4	I274 L277 L283 D287 L293 K294	I274-L290 HydrophobicContact CD1-CB 4.45Å; I274-L290 HydrophobicContact CG1-CB 4.39Å; I274-L290 HydrophobicContact CG2-CB 4.14Å; L277-L290 HydrophobicContact CD1-CD1 3.4Å; L277-L290 VanDerWaalsContact CD1-CD1 3.4Å; L283-L290 HydrophobicContact CD2-CD1 4.09Å; D287-L290 HydrophobicContact CB-CB 4.12Å; D287-L290 HydrophobicContact CB-CD1 4.08Å; D287-L290 HydrophobicContact CB-CG 4.05Å; D287-L290 PolarHBondContact O-N 3.43Å; D287-L290 PolarHBondContact OD1-N 3.18Å; L290-L293 PolarHBondContact O-N 3.32Å; L290-K294 WeakPolarHBondContact O-CB 3.43Å; L290-K294 PolarHBondContact O-N 3.44Å
291	L	85.4	Confident	83.1	Confident	73 Å²	73	70.6 Å²	70.6	38%	0.382	42%	0.419	S	S	.	.	H	α-helix	trans	-65.7	-40.5	174	-73.6	176.9	0	0	0	111.8	C285 D287 K294 A295	C285-L291 WeakPolarHBondContact O-CD2 3.48Å; D287-L291 WeakPolarHBondContact O-CB 3.2Å; D287-L291 WeakPolarHBondContact O-CG 3.48Å; D287-L291 PolarHBondContact O-N 3.12Å; L291-K294 PolarHBondContact O-N 3.47Å; L291-A295 WeakPolarHBondContact O-CB 3.44Å; L291-A295 PolarHBondContact O-N 3.16Å
292	L	84.2	Confident	83.7	Confident	101 Å²	101	71.4 Å²	71.4	53%	0.529	42%	0.417	S	S	.	.	H	α-helix	trans	-62.5	-47	172.8	-179.9	60.4	0	0	0	110.8	Q288 K294 A295 T296	Q288-L292 WeakPolarHBondContact O-CB 3.31Å; Q288-L292 PolarHBondContact O-N 3.41Å; L292-K294 VanDerWaalsContact C-N 3.35Å; L292-K294 PolarHBondContact O-N 3.29Å; L292-A295 PolarHBondContact O-N 3.16Å; L292-T296 WeakPolarHBondContact O-CB 3.13Å; L292-T296 PolarHBondContact O-N 2.95Å; L292-T296 PolarHBondContact O-OG1 3.48Å; L292-T296 VanDerWaalsContact O-OG1 3.07Å
293	L	84.6	Confident	84.5	Confident	84 Å²	84	68 Å²	68	44%	0.44	40%	0.395	S	S	.	.	H	α-helix	trans	-56.5	-48.1	176	179.4	62.3	0	0	0	111.2	L270 D289 L290 A295 T296 S297	L270-L293 HydrophobicContact CD1-CD2 4.31Å; L270-L293 HydrophobicContact CD2-CD2 4.5Å; L270-L293 HydrophobicContact CD2-CG 4.27Å; D289-L293 VanDerWaalsContact O-CB 3.23Å; D289-L293 WeakPolarHBondContact O-CB 3.26Å; D289-L293 PolarHBondContact O-N 3.43Å; L290-L293 PolarHBondContact O-N 3.32Å; L293-A295 PolarHBondContact O-N 3.35Å; L293-T296 PolarHBondContact O-N 3.37Å; L293-S297 WeakPolarHBondContact O-CB 3.18Å; L293-S297 PolarHBondContact O-N 2.97Å; L293-S297 PolarHBondContact O-OG 3.33Å
294	K	89.4	Confident	84.8	Confident	53 Å²	53	67.1 Å²	67.1	23%	0.23	39%	0.39	C	S	.	.	H	α-helix	trans	-57.4	-44.7	175.8	170.5	165.5	169.4	176	0	112.4	Q267 V271 I274 D275 L290 L291 L292 S297 A298	Q267-K294 PolarHBondContact NE2-O 2.97Å; V271-K294 HydrophobicContact CG1-CD 4.37Å; V271-K294 HydrophobicContact CG2-CD 4.41Å; V271-K294 HydrophobicContact CG2-CG 4.19Å; I274-K294 HydrophobicContact CD1-CB 3.91Å; I274-K294 HydrophobicContact CG2-CD 4.48Å; D275-K294 IonicContact OD1-NZ 2.68Å; D275-K294 PolarHBondContact OD1-NZ 2.96Å; D275-K294 IonicContact OD2-NZ 3.94Å; D275-K294 PolarHBondContact OD2-NZ 3.24Å; L290-K294 WeakPolarHBondContact O-CB 3.43Å; L290-K294 PolarHBondContact O-N 3.44Å; L291-K294 PolarHBondContact O-N 3.47Å; L292-K294 VanDerWaalsContact C-N 3.35Å; L292-K294 PolarHBondContact O-N 3.29Å; K294-S297 PolarHBondContact O-OG 2.99Å; K294-A298 WeakPolarHBondContact O-CB 3.29Å; K294-A298 PolarHBondContact O-N 3.47Å
295	A	81.4	Confident	84.6	Confident	59 Å²	59	67.5 Å²	67.5	49%	0.488	40%	0.397	S	S	.	.	H	α-helix	trans	-69.6	-48	179.6	0	0	0	0	0	112.3	L291 L292 L293 S297 A298 A299	L291-A295 WeakPolarHBondContact O-CB 3.44Å; L291-A295 PolarHBondContact O-N 3.16Å; L292-A295 PolarHBondContact O-N 3.16Å; L293-A295 PolarHBondContact O-N 3.35Å; A295-S297 PolarHBondContact O-N 3.15Å; A295-A298 PolarHBondContact O-N 3.12Å; A295-A299 WeakPolarHBondContact O-CB 3.4Å; A295-A299 PolarHBondContact O-N 3.32Å
296	T	82	Confident	84.4	Confident	75 Å²	75	71.8 Å²	71.8	46%	0.46	42%	0.415	S	S	.	.	H	α-helix	trans	-63.1	-41.1	179.8	-60.2	0	0	0	0	111.7	L292 L293 A299 T300	L292-T296 WeakPolarHBondContact O-CB 3.13Å; L292-T296 PolarHBondContact O-N 2.95Å; L292-T296 PolarHBondContact O-OG1 3.48Å; L292-T296 VanDerWaalsContact O-OG1 3.07Å; L293-T296 PolarHBondContact O-N 3.37Å; T296-A299 PolarHBondContact O-N 3.08Å; T296-T300 WeakPolarHBondContact O-CB 3.41Å; T296-T300 PolarHBondContact O-N 2.94Å; T296-T300 PolarHBondContact O-OG1 3.4Å
297	S	85.5	Confident	84	Confident	23 Å²	23	69.6 Å²	69.6	16%	0.161	41%	0.409	C	S	.	.	H	α-helix	trans	-72.9	-31.3	179.7	64.4	0	0	0	0	112.8	Q267 L293 K294 A295 L301	Q267-S297 PolarHBondContact NE2-OG 3.33Å; Q267-S297 PolarHBondContact OE1-OG 2.87Å; L293-S297 WeakPolarHBondContact O-CB 3.18Å; L293-S297 PolarHBondContact O-N 2.97Å; L293-S297 PolarHBondContact O-OG 3.33Å; K294-S297 PolarHBondContact O-OG 2.99Å; A295-S297 PolarHBondContact O-N 3.15Å; S297-L301 PolarHBondContact O-N 3.38Å
298	A	87	Confident	83.6	Confident	50 Å²	50	68 Å²	68	41%	0.413	40%	0.4	S	S	.	.	H	α-helix	trans	-66.7	-47.2	170.4	0	0	0	0	0	111.8	Q267 K294 A295 T300 L301 S302	Q267-A298 VanDerWaalsContact NE2-N 3.15Å; K294-A298 WeakPolarHBondContact O-CB 3.29Å; K294-A298 PolarHBondContact O-N 3.47Å; A295-A298 PolarHBondContact O-N 3.12Å; A298-T300 VanDerWaalsContact C-N 3.33Å; A298-T300 PolarHBondContact O-N 3.47Å; A298-L301 PolarHBondContact O-N 2.75Å; A298-S302 PolarHBondContact O-N 2.88Å; A298-S302 VanDerWaalsContact O-N 3.14Å
299	A	82.9	Confident	83.4	Confident	55 Å²	55	64.3 Å²	64.3	46%	0.455	39%	0.386	S	S	.	.	H	α-helix	trans	-60.8	-41.7	176.4	0	0	0	0	0	112.1	A295 T296 L301 S302 C303	A295-A299 WeakPolarHBondContact O-CB 3.4Å; A295-A299 PolarHBondContact O-N 3.32Å; T296-A299 PolarHBondContact O-N 3.08Å; A299-L301 VanDerWaalsContact C-N 3.33Å; A299-L301 PolarHBondContact O-N 3.02Å; A299-S302 WeakPolarHBondContact O-CB 3.08Å; A299-S302 PolarHBondContact O-N 3.28Å; A299-C303 PolarHBondContact O-N 3.39Å; A299-C303 PolarHBondContact O-SG 3.45Å; A299-C303 VanDerWaalsContact O-SG 3.35Å
300	T	83.4	Confident	83.3	Confident	71 Å²	71	63.3 Å²	63.3	44%	0.436	38%	0.379	S	S	.	.	H	α-helix	trans	-58.4	-43.8	178	-59.7	0	0	0	0	111.6	T296 A298 C303 L304	T296-T300 WeakPolarHBondContact O-CB 3.41Å; T296-T300 PolarHBondContact O-N 2.94Å; T296-T300 PolarHBondContact O-OG1 3.4Å; A298-T300 VanDerWaalsContact C-N 3.33Å; A298-T300 PolarHBondContact O-N 3.47Å; T300-C303 PolarHBondContact O-N 3.43Å; T300-L304 HydrophobicContact CG2-CD1 4.04Å; T300-L304 VanDerWaalsContact O-CG 3.3Å; T300-L304 WeakPolarHBondContact O-CG 3.4Å; T300-L304 PolarHBondContact O-N 2.99Å
301	L	90	Very high	82.7	Confident	26 Å²	26	66.2 Å²	66.2	14%	0.136	40%	0.395	C	S	.	.	H	α-helix	trans	-67.9	-37.2	176.5	-88	167.2	0	0	0	113.3	M260 A263 E264 Q267 S297 A298 A299 L304 G305	M260-L301 HydrophobicContact CE-CD2 3.75Å; M260-L301 HydrophobicContact SD-CD2 4.38Å; A263-L301 HydrophobicContact CB-CD2 3.82Å; E264-L301 HydrophobicContact CG-CD1 4.37Å; E264-L301 HydrophobicContact CG-CD2 4.07Å; Q267-L301 HydrophobicContact CB-CD1 3.26Å; Q267-L301 HydrophobicContact CG-CD1 3.66Å; S297-L301 PolarHBondContact O-N 3.38Å; A298-L301 PolarHBondContact O-N 2.75Å; A299-L301 VanDerWaalsContact C-N 3.33Å; A299-L301 PolarHBondContact O-N 3.02Å; L301-L304 PolarHBondContact O-N 3.45Å; L301-G305 PolarHBondContact O-N 3.03Å
302	S	83.4	Confident	82.2	Confident	67 Å²	67	65.8 Å²	65.8	47%	0.469	39%	0.39	S	S	.	.	H	α-helix	trans	-58.2	-50.9	173.5	-162.9	0	0	0	0	110.7	A298 A299 L304 G305 E306	A298-S302 PolarHBondContact O-N 2.88Å; A298-S302 VanDerWaalsContact O-N 3.14Å; A299-S302 WeakPolarHBondContact O-CB 3.08Å; A299-S302 PolarHBondContact O-N 3.28Å; S302-L304 VanDerWaalsContact C-N 3.35Å; S302-L304 PolarHBondContact O-N 3.28Å; S302-G305 PolarHBondContact O-N 2.77Å; S302-E306 WeakPolarHBondContact O-CG 3.49Å; S302-E306 PolarHBondContact O-N 3.25Å; S302-E306 PolarHBondContact OG-OE1 3.03Å
303	C	81.4	Confident	81.7	Confident	70 Å²	70	64.7 Å²	64.7	47%	0.473	38%	0.383	S	S	.	.	H	α-helix	trans	-60.9	-41.2	178.9	-63.4	0	0	0	0	112.6	A299 T300 E306 C307	A299-C303 PolarHBondContact O-N 3.39Å; A299-C303 PolarHBondContact O-SG 3.45Å; A299-C303 VanDerWaalsContact O-SG 3.35Å; T300-C303 PolarHBondContact O-N 3.43Å; C303-E306 PolarHBondContact O-N 3.07Å; C303-C307 PolarHBondContact O-N 3.19Å; C303-C307 PolarHBondContact O-SG 3.49Å
304	L	80.2	Confident	80.7	Confident	87 Å²	87	64.2 Å²	64.2	46%	0.455	38%	0.383	S	S	.	.	H	α-helix	trans	-67.7	-36.4	177.3	-69.6	170.7	0	0	0	112.4	M260 T300 L301 S302 C307 L308	M260-L304 HydrophobicContact CE-CB 3.86Å; M260-L304 HydrophobicContact SD-CB 3.55Å; M260-L304 VanDerWaalsContact SD-CB 3.55Å; M260-L304 HydrophobicContact SD-CD1 4.35Å; T300-L304 HydrophobicContact CG2-CD1 4.04Å; T300-L304 VanDerWaalsContact O-CG 3.3Å; T300-L304 WeakPolarHBondContact O-CG 3.4Å; T300-L304 PolarHBondContact O-N 2.99Å; L301-L304 PolarHBondContact O-N 3.45Å; S302-L304 VanDerWaalsContact C-N 3.35Å; S302-L304 PolarHBondContact O-N 3.28Å; L304-C307 PolarHBondContact O-N 3.09Å; L304-L308 PolarHBondContact O-N 3.39Å
305	G	83.7	Confident	79.4	Confident	22 Å²	22	64.8 Å²	64.8	23%	0.227	39%	0.392	C	S	.	.	H	α-helix	trans	-64.7	-42.3	173	0	0	0	0	0	112.7	L301 S302 L308 N309	L301-G305 PolarHBondContact O-N 3.03Å; S302-G305 PolarHBondContact O-N 2.77Å; G305-L308 PolarHBondContact O-N 3.14Å; G305-N309 PolarHBondContact O-N 3.14Å
306	E	79.1	Confident	78.2	Confident	107 Å²	107	68.6 Å²	68.6	50%	0.5	40%	0.399	S	S	.	.	H	α-helix	trans	-60.7	-46.5	172.7	-72.9	165.1	-146.2	0	0	111.6	S302 C303 L308 N309 I310	S302-E306 WeakPolarHBondContact O-CG 3.49Å; S302-E306 PolarHBondContact O-N 3.25Å; S302-E306 PolarHBondContact OG-OE1 3.03Å; C303-E306 PolarHBondContact O-N 3.07Å; E306-L308 VanDerWaalsContact C-N 3.34Å; E306-L308 PolarHBondContact O-N 3.21Å; E306-N309 PolarHBondContact O-N 3.07Å; E306-I310 WeakPolarHBondContact O-CG1 3.46Å; E306-I310 PolarHBondContact O-N 3.36Å
307	C	78.4	Confident	76.9	Confident	70 Å²	70	69 Å²	69	47%	0.473	41%	0.405	S	S	.	.	H	α-helix	trans	-58.7	-42.4	174.4	-69.6	0	0	0	0	112.5	C303 L304 I310 L311	C303-C307 PolarHBondContact O-N 3.19Å; C303-C307 PolarHBondContact O-SG 3.49Å; L304-C307 PolarHBondContact O-N 3.09Å; C307-I310 PolarHBondContact O-N 3.27Å; C307-L311 VanDerWaalsContact O-CG 3.31Å; C307-L311 WeakPolarHBondContact O-CG 3.45Å; C307-L311 PolarHBondContact O-N 2.81Å; C307-L311 VanDerWaalsContact O-N 3.08Å
308	L	82.3	Confident	75.3	Confident	16 Å²	16	75 Å²	75	8%	0.084	43%	0.43	C	S	.	.	H	α-helix	trans	-64.7	-39.9	177.6	-179.3	56.6	0	0	0	112	L253 V256 K257 M260 L304 G305 E306 L311 Q312	L253-L308 HydrophobicContact CD2-CD1 3.78Å; V256-L308 HydrophobicContact CG1-CD1 3.88Å; V256-L308 HydrophobicContact CG1-CD2 4.48Å; K257-L308 HydrophobicContact CB-CD2 4.34Å; M260-L308 HydrophobicContact CB-CD2 4.43Å; M260-L308 HydrophobicContact CG-CD2 3.97Å; L304-L308 PolarHBondContact O-N 3.39Å; G305-L308 PolarHBondContact O-N 3.14Å; E306-L308 VanDerWaalsContact C-N 3.34Å; E306-L308 PolarHBondContact O-N 3.21Å; L308-L311 PolarHBondContact O-N 3.49Å; L308-Q312 HydrophobicContact CD1-CG 4.34Å; L308-Q312 WeakPolarHBondContact O-CG 3.27Å; L308-Q312 PolarHBondContact O-N 3.03Å
309	N	79.9	Confident	73.5	Confident	87 Å²	87	77.2 Å²	77.2	47%	0.465	44%	0.443	S	S	.	.	H	α-helix	trans	-61.8	-44.3	175.1	-79.1	-28.2	0	0	0	112.2	G305 E306 L311 Q312 Q313	G305-N309 PolarHBondContact O-N 3.14Å; E306-N309 PolarHBondContact O-N 3.07Å; N309-L311 VanDerWaalsContact C-N 3.32Å; N309-L311 PolarHBondContact O-N 2.71Å; N309-Q312 PolarHBondContact O-N 3.48Å; N309-Q313 VanDerWaalsContact O-CG 3.28Å; N309-Q313 WeakPolarHBondContact O-CG 3.26Å; N309-Q313 PolarHBondContact O-N 3.43Å
310	I	80	Confident	71.7	Confident	100 Å²	100	79.1 Å²	79.1	51%	0.513	45%	0.453	S	S	.	.	H	α-helix	trans	-60.7	-42.3	176.6	-66.2	164.1	0	0	0	110.9	E306 C307 Q313 T314	E306-I310 WeakPolarHBondContact O-CG1 3.46Å; E306-I310 PolarHBondContact O-N 3.36Å; C307-I310 PolarHBondContact O-N 3.27Å; I310-Q313 PolarHBondContact O-N 3.09Å; I310-T314 WeakPolarHBondContact O-CB 3.44Å; I310-T314 PolarHBondContact O-N 3.12Å; I310-T314 PolarHBondContact O-OG1 2.86Å
311	L	72.9	Confident	69.5	Low	95 Å²	95	85 Å²	85	50%	0.497	48%	0.475	S	S	.	.	H	α-helix	trans	-66.3	-38.4	178.3	-70.1	169	0	0	0	112.4	L253 C307 L308 N309 T315	L253-L311 HydrophobicContact CD2-CB 4.08Å; C307-L311 VanDerWaalsContact O-CG 3.31Å; C307-L311 WeakPolarHBondContact O-CG 3.45Å; C307-L311 PolarHBondContact O-N 2.81Å; C307-L311 VanDerWaalsContact O-N 3.08Å; L308-L311 PolarHBondContact O-N 3.49Å; N309-L311 VanDerWaalsContact C-N 3.32Å; N309-L311 PolarHBondContact O-N 2.71Å; L311-T315 PolarHBondContact O-N 2.72Å; L311-T315 VanDerWaalsContact O-N 3.14Å; L311-T315 PolarHBondContact O-OG1 2.86Å
312	Q	75.8	Confident	66.9	Low	63 Å²	63	88.4 Å²	88.4	29%	0.294	51%	0.507	S	S	.	.	H	α-helix	trans	-66	-44	175.9	-72.8	176.8	13.6	0	0	111.9	L253 L308 N309 T315 Q316	L253-Q312 HydrophobicContact CD2-CG 4.25Å; L308-Q312 HydrophobicContact CD1-CG 4.34Å; L308-Q312 WeakPolarHBondContact O-CG 3.27Å; L308-Q312 PolarHBondContact O-N 3.03Å; N309-Q312 PolarHBondContact O-N 3.48Å; Q312-T315 WeakPolarHBondContact O-CB 3.49Å; Q312-T315 PolarHBondContact O-N 3.08Å; Q312-Q316 PolarHBondContact O-N 2.86Å; Q312-Q316 VanDerWaalsContact O-N 3.09Å
313	Q	73.4	Confident	64.7	Low	78 Å²	78	91.2 Å²	91.2	36%	0.364	52%	0.523	S	S	.	.	H	α-helix	trans	-61.8	-44.9	176.6	-68.4	165	10.6	0	0	111.9	N309 I310 T315 Q316 S317 W344	N309-Q313 VanDerWaalsContact O-CG 3.28Å; N309-Q313 WeakPolarHBondContact O-CG 3.26Å; N309-Q313 PolarHBondContact O-N 3.43Å; I310-Q313 PolarHBondContact O-N 3.09Å; Q313-T315 PolarHBondContact O-N 2.89Å; Q313-Q316 PolarHBondContact O-N 2.93Å; Q313-S317 PolarHBondContact O-N 3.17Å; Q313-S317 VanDerWaalsContact O-N 3.07Å; Q313-S317 PolarHBondContact O-OG 3.09Å; Q313-W344 VanDerWaalsContact CD-CH2 3.4Å; Q313-W344 HydrophobicContact CG-CH2 4.5Å; Q313-W344 VanDerWaalsContact OE1-CH2 3.25Å
314	T	62.4	Low	62.6	Low	74 Å²	74	93.5 Å²	93.5	45%	0.454	54%	0.538	S	S	.	.	H	α-helix	trans	-62.5	-27.4	177.2	-53.4	0	0	0	0	112.4	I310 S317	I310-T314 WeakPolarHBondContact O-CB 3.44Å; I310-T314 PolarHBondContact O-N 3.12Å; I310-T314 PolarHBondContact O-OG1 2.86Å; T314-S317 PolarHBondContact O-OG 3.16Å; T314-S317 VanDerWaalsContact O-OG 3.04Å
315	T	62.3	Low	60.6	Low	66 Å²	66	95.7 Å²	95.7	41%	0.405	56%	0.557	S	S	.	*	H	α-helix	trans	-78.6	-40.1	177	-55.2	0	0	0	0	111.7	L253 L311 Q312 Q313 H318	L253-T315 HydrophobicContact CD1-CG2 4.07Å; L253-T315 WeakPolarHBondContact CD1-OG1 3.41Å; L311-T315 PolarHBondContact O-N 2.72Å; L311-T315 VanDerWaalsContact O-N 3.14Å; L311-T315 PolarHBondContact O-OG1 2.86Å; Q312-T315 WeakPolarHBondContact O-CB 3.49Å; Q312-T315 PolarHBondContact O-N 3.08Å; Q313-T315 PolarHBondContact O-N 2.89Å; T315-H318 PolarHBondContact O-N 3.25Å
316	Q	56.5	Low	58.5	Low	139 Å²	139	104 Å²	104	65%	0.65	59%	0.59	S	S	*	*	H	α-helix	trans	-70.7	-32	178.5	-70.7	179	-4.8	0	0	113.2	Q312 Q313 H318 S319	Q312-Q316 PolarHBondContact O-N 2.86Å; Q312-Q316 VanDerWaalsContact O-N 3.09Å; Q313-Q316 PolarHBondContact O-N 2.93Å; Q316-H318 PolarHBondContact O-N 3.07Å; Q316-S319 PolarHBondContact O-OG 3.29Å
317	S	55.1	Low	56.1	Low	82 Å²	82	104.7 Å²	104.7	57%	0.573	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-19.9	175.7	54.4	0	0	0	0	113.8	Q313 T314	Q313-S317 PolarHBondContact O-N 3.17Å; Q313-S317 VanDerWaalsContact O-N 3.07Å; Q313-S317 PolarHBondContact O-OG 3.09Å; T314-S317 PolarHBondContact O-OG 3.16Å; T314-S317 VanDerWaalsContact O-OG 3.04Å
318	H	51.6	Low	53.8	Low	149 Å²	149	110.2 Å²	110.2	69%	0.69	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	-10	-176.5	-96.4	-43.6	0	0	0	115.3	T315 Q316	T315-H318 PolarHBondContact O-N 3.25Å; Q316-H318 PolarHBondContact O-N 3.07Å
319	S	48.2	Very low	51.3	Low	98 Å²	98	113.7 Å²	113.7	69%	0.685	66%	0.656	S	S	*	*	S	Bend	trans	-87.1	-4.4	-179.8	44.2	0	0	0	0	115.3	Q316	Q316-S319 PolarHBondContact O-OG 3.29Å
320	S	45.2	Very low	48.9	Very low	95 Å²	95	114.5 Å²	114.5	66%	0.664	67%	0.669	S	S	*	*	S	Bend	trans	-111.1	24.7	-161.1	-51.3	0	0	0	0	115.6
321	Q	38.2	Very low	46.5	Very low	195 Å²	195	119.4 Å²	119.4	91%	0.911	69%	0.689	S	S	*	*			trans	-135	103.7	175	-72.1	-171.6	-8.8	0	0	112.6
322	A	34.8	Very low	44.2	Very low	97 Å²	97	118.7 Å²	118.7	80%	0.802	71%	0.705	S	S	*	*			trans	-115.6	138.9	161	0	0	0	0	0	108.7
323	P	38.3	Very low	41.9	Very low	125 Å²	125	121 Å²	121	81%	0.812	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-93.4	141	-170.4	34.6	-34	0	0	0	113.8
324	P	36.5	Very low	39.8	Very low	119 Å²	119	129 Å²	129	77%	0.773	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-85.3	163.7	158.6	34.7	-31.3	0	0	0	111.7
325	P	38.7	Very low	38.1	Very low	132 Å²	132	128.7 Å²	128.7	86%	0.857	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-83.4	167.1	-169.9	33.6	-36.4	0	0	0	115.1
326	Q	38.6	Very low	36.5	Very low	197 Å²	197	132.5 Å²	132.5	92%	0.921	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-79.6	148.9	-172.5	-61.7	173.3	-22	0	0	114.5
327	S	29.3	Very low	35.2	Very low	121 Å²	121	131.5 Å²	131.5	85%	0.846	80%	0.796	S	S	*	*			trans	-152.7	173	152.1	67.2	0	0	0	0	111.3
328	H	30.4	Very low	34.4	Very low	187 Å²	187	133.3 Å²	133.3	87%	0.866	81%	0.808	S	S	*	*			trans	-99.8	160	-151.8	-72.8	-101.4	0	0	0	117.2
329	A	29.3	Very low	33.2	Very low	88 Å²	88	134.1 Å²	134.1	73%	0.727	82%	0.818	S	S	*	*			trans	99.9	129.2	135.7	0	0	0	0	0	122.6
330	S	28.9	Very low	32.2	Very low	105 Å²	105	132.7 Å²	132.7	73%	0.734	82%	0.819	S	S	*	*			trans	70.9	127.3	137.5	59.5	0	0	0	0	123.8
331	Q	29.5	Very low	31.4	Very low	203 Å²	203	134.3 Å²	134.3	95%	0.949	82%	0.824	S	S	*	*			trans	61.4	137.6	147.3	-65	-176.5	3.7	0	0	120.1
332	G	25.8	Very low	30.8	Very low	80 Å²	80	129.8 Å²	129.8	83%	0.825	81%	0.812	S	S	*	*			trans	153.8	122.3	160	0	0	0	0	0	116.4
333	S	28	Very low	30.4	Very low	112 Å²	112	131.1 Å²	131.1	78%	0.783	81%	0.81	S	S	*	*			trans	-68.7	163.1	175	-176.5	0	0	0	0	115
334	R	28.3	Very low	29.7	Very low	244 Å²	244	134.1 Å²	134.1	92%	0.921	81%	0.805	S	S	*	*			trans	73.3	132.6	162.1	-80.3	176.8	169.6	-179.2	-3.2	120.2
335	G	26.3	Very low	29.2	Very low	69 Å²	69	133.8 Å²	133.8	71%	0.711	80%	0.801	S	S	*	*			trans	95.1	104.1	146.2	0	0	0	0	0	116	P337	G335-P337 WeakPolarHBondContact O-CD 3.39Å
336	T	29.6	Very low	28.7	Very low	145 Å²	145	133.8 Å²	133.8	89%	0.89	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-83.1	117.9	162.1	43.4	0	0	0	0	109.8
337	P	29.6	Very low	28.1	Very low	119 Å²	119	130 Å²	130	77%	0.773	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-76.1	162	173.4	-9	26.9	0	0	0	111.6	G335	G335-P337 WeakPolarHBondContact O-CD 3.39Å
338	S	37.6	Very low	27.9	Very low	119 Å²	119	133.8 Å²	133.8	83%	0.832	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-68	139.7	164.4	55.5	0	0	0	0	110.9
339	D	26.5	Very low	27.6	Very low	166 Å²	166	129.9 Å²	129.9	89%	0.888	79%	0.785	S	S	*	*			trans	-118.7	139.7	165.8	-131.6	-24.1	0	0	0	110.9
340	G	27.6	Very low	27.4	Very low	69 Å²	69	132 Å²	132	71%	0.711	79%	0.792	S	S	*	*			trans	-80.3	128.7	-154.7	0	0	0	0	0	115.5
341	V	27.8	Very low	27.4	Very low	129 Å²	129	132.8 Å²	132.8	78%	0.782	80%	0.797	S	S	*	*			trans	-77.3	127.8	162	180	0	0	0	0	109	V343	V341-V343 PolarHBondContact O-N 3.06Å; V341-V343 VanDerWaalsContact O-N 3.15Å
342	P	25.7	Very low	27.2	Very low	100 Å²	100	126.5 Å²	126.5	65%	0.649	79%	0.787	S	S	*	*			trans	-63.5	115.2	172.7	-21.2	33.1	0	0	0	111	W344	P342-W344 PolarHBondContact O-N 2.93Å
343	V	27.1	Very low	27.1	Very low	124 Å²	124	132.5 Å²	132.5	75%	0.752	79%	0.794	S	S	*	*			trans	-74.3	111.2	174.9	177.2	0	0	0	0	109.1	V341 T345	V341-V343 PolarHBondContact O-N 3.06Å; V341-V343 VanDerWaalsContact O-N 3.15Å; V343-T345 HydrophobicContact CG1-CG2 4.22Å; V343-T345 PolarHBondContact O-N 2.81Å
344	W	23.4	Very low	26.9	Very low	188 Å²	188	135.1 Å²	135.1	71%	0.712	79%	0.794	S	S	*	*			trans	-77	99.1	168.4	-79	106.6	0	0	0	110.5	Q313 P342	Q313-W344 VanDerWaalsContact CD-CH2 3.4Å; Q313-W344 HydrophobicContact CG-CH2 4.5Å; Q313-W344 VanDerWaalsContact OE1-CH2 3.25Å; P342-W344 PolarHBondContact O-N 2.93Å
345	T	24.8	Very low	26.7	Very low	112 Å²	112	132.2 Å²	132.2	69%	0.687	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-78.4	132.7	166.5	43.8	0	0	0	0	110.2	V343 P347	V343-T345 HydrophobicContact CG1-CG2 4.22Å; V343-T345 PolarHBondContact O-N 2.81Å; T345-P347 WeakPolarHBondContact O-CD 3.47Å
346	V	28.3	Very low	26.7	Very low	133 Å²	133	137 Å²	137	81%	0.806	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-76.9	123.2	174.4	177.4	0	0	0	0	109.3	K348	V346-K348 PolarHBondContact O-N 3.24Å
347	P	25.8	Very low	26.5	Very low	117 Å²	117	138 Å²	138	76%	0.76	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-67.2	126.4	169.5	-18.7	33	0	0	0	110.4	T345	T345-P347 WeakPolarHBondContact O-CD 3.47Å
348	K	24.9	Very low	26.2	Very low	201 Å²	201	136.4 Å²	136.4	87%	0.874	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-63.9	133.4	173.5	-66.6	174.2	177.8	176	0	110	V346	V346-K348 PolarHBondContact O-N 3.24Å
349	S	25.1	Very low	25.5	Very low	104 Å²	104	134.1 Å²	134.1	73%	0.727	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-61.6	133.9	165.7	-47.8	0	0	0	0	110.2	S351	S349-S351 PolarHBondContact O-N 2.86Å
350	P	25.4	Very low	25.4	Very low	133 Å²	133	133.8 Å²	133.8	86%	0.864	80%	0.795	S	S	*	*			trans	-72.1	115.9	166.1	-12.4	28.2	0	0	0	109.1
351	S	28.1	Very low	25.2	Very low	121 Å²	121	136.4 Å²	136.4	85%	0.846	80%	0.797	S	S	*	*			trans	-78.6	146.1	174.7	-58.1	0	0	0	0	111.9	S349	S349-S351 PolarHBondContact O-N 2.86Å
352	G	25	Very low	25.4	Very low	72 Å²	72	135.6 Å²	135.6	74%	0.742	79%	0.794	S	S	*	*			trans	104.6	109.5	138.8	0	0	0	0	0	117.6
353	E	24.1	Very low	25.3	Very low	206 Å²	206	139.4 Å²	139.4	96%	0.963	81%	0.808	S	S	*	*				-122.4	156.5	126.2	-84.3	-158.6	134	0	0	109.7
354	Q	23.8	Very low	25.1	Very low	167 Å²	167	142.4 Å²	142.4	78%	0.78	81%	0.814	S	S	*	*			trans	-133	117.3	-152.9	176.8	-170.7	60.9	0	0	109.5
355	L	24.6	Very low	25.2	Very low	183 Å²	183	139.3 Å²	139.3	96%	0.958	82%	0.821	S	S	*	*			trans	-127.8	145.8	165.8	-86.4	171.2	0	0	0	111.5
356	K	25.8	Very low	25.1	Very low	169 Å²	169	140 Å²	140	74%	0.735	83%	0.825	S	S	*	*			trans	-101.9	148.8	-151.7	-69.7	170.8	173.9	171.3	0	113.8
357	N	24.9	Very low	25	Very low	166 Å²	166	142.2 Å²	142.2	89%	0.888	83%	0.827	S	S	*	*			trans	25.1	119.1	143.5	-60	0.8	0	0	0	119.9
358	G	24.5	Very low	24.9	Very low	85 Å²	85	148.2 Å²	148.2	88%	0.876	83%	0.834	S	S	*	*			trans	-142.3	124.7	142	0	0	0	0	0	107.8
359	G	22.3	Very low	24.9	Very low	72 Å²	72	144.1 Å²	144.1	74%	0.742	83%	0.831	S	S	*	*			trans	-123.9	178.3	-170.3	0	0	0	0	0	114.8
360	L	24.4	Very low	25.1	Very low	159 Å²	159	145.7 Å²	145.7	83%	0.832	84%	0.838	S	S	*	*			trans	83	93.3	167.1	-56.1	176.8	0	0	0	118.6
361	T	24	Very low	25.2	Very low	123 Å²	123	143.4 Å²	143.4	76%	0.755	83%	0.831	S	S	*	*				49.8	163.2	116.9	57.8	0	0	0	0	122
362	P	31.9	Very low	25.2	Very low	113 Å²	113	145.4 Å²	145.4	73%	0.734	83%	0.831	S	S	*	*			cis	-135.3	161.3	-44.2	38	-23.2	0	0	0	112
363	L	23.4	Very low	25.3	Very low	179 Å²	179	153.6 Å²	153.6	94%	0.937	84%	0.84	S	S	*	*			trans	-141.5	130.6	159.9	-102.3	171.3	0	0	0	111.7
364	Q	22.9	Very low	25.5	Very low	188 Å²	188	153.7 Å²	153.7	88%	0.879	84%	0.837	S	S	*	*			trans	-86.5	142.4	179.4	-63.7	168.5	-35.3	0	0	110.5
365	S	24.5	Very low	25.5	Very low	123 Å²	123	157.2 Å²	157.2	86%	0.86	84%	0.843	S	S	*	*			trans	-153.8	111.5	145.8	58.9	0	0	0	0	109.9
366	T	23.9	Very low	25.5	Very low	126 Å²	126	154.2 Å²	154.2	77%	0.773	84%	0.837	S	S	*	*			trans	-74.2	143.6	173.9	44	0	0	0	0	112.2
367	E	25	Very low	25.6	Very low	179 Å²	179	154.5 Å²	154.5	84%	0.836	85%	0.846	S	S	*	*				165.4	108.5	129.7	-90.6	177	-172.9	0	0	108.6
368	R	24.6	Very low	25.6	Very low	244 Å²	244	151.6 Å²	151.6	92%	0.921	84%	0.839	S	S	*	*				65.2	112	80	-76.1	-168.3	174.2	179.8	0.3	114.4
369	S	25.4	Very low	26	Very low	114 Å²	114	154 Å²	154	80%	0.797	84%	0.839	S	S	*	*			trans	-57.1	146.1	176.7	-37.4	0	0	0	0	113.3	A371	S369-A371 PolarHBondContact O-N 2.81Å
370	P	29.4	Very low	26.1	Very low	137 Å²	137	154 Å²	154	89%	0.89	84%	0.84	S	S	*	*			trans	-75.1	107	173.8	30.1	-32.5	0	0	0	110.8
371	A	25.8	Very low	26.4	Very low	86 Å²	86	151.1 Å²	151.1	71%	0.711	84%	0.839	S	S	*	*			trans	-74.7	164.9	169.8	0	0	0	0	0	112.2	S369	S369-A371 PolarHBondContact O-N 2.81Å
372	L	30	Very low	26.6	Very low	162 Å²	162	153.5 Å²	153.5	85%	0.848	84%	0.841	S	S	*	*			trans	-38.4	134.7	177.8	-71.2	80.3	0	0	0	114.4
373	R	26.3	Very low	26.4	Very low	244 Å²	244	157.1 Å²	157.1	92%	0.921	85%	0.848	S	S	*	*			trans	-124.3	108.9	150.1	-77.1	-168.2	172.6	-169.8	-1	110.5	R375	R373-R375 PolarHBondContact O-N 3.1Å
374	K	28	Very low	26.7	Very low	208 Å²	208	155.6 Å²	155.6	90%	0.904	84%	0.835	S	S	*	*			trans	-54.7	130.4	162.5	-73.9	178.2	174.5	177.8	0	108.5
375	R	24.4	Very low	27.3	Very low	242 Å²	242	152.2 Å²	152.2	91%	0.913	83%	0.83	S	S	*	*			trans	-114.3	123.7	164.9	-153.9	172.8	-170.1	177.4	1.8	108.1	R373	R373-R375 PolarHBondContact O-N 3.1Å
376	S	24.4	Very low	28.1	Very low	119 Å²	119	157.8 Å²	157.8	83%	0.832	83%	0.832	S	S	*	*			trans	-65.6	137.7	-176.8	45.3	0	0	0	0	112
377	L	26.8	Very low	29.8	Very low	176 Å²	176	153.9 Å²	153.9	92%	0.921	81%	0.806	S	S	*	*			trans	-71.3	148.9	174.8	-76	155.2	0	0	0	111.9
378	S	26.1	Very low	31.4	Very low	105 Å²	105	150.5 Å²	150.5	73%	0.734	79%	0.79	S	S	*	*			trans	-129.8	143.7	152	54.8	0	0	0	0	108	G380	S378-G380 PolarHBondContact O-N 3.33Å
379	P	33.3	Very low	33.5	Very low	134 Å²	134	144.6 Å²	144.6	87%	0.87	78%	0.777	S	S	*	*			trans	-89.8	108.7	-158.3	32.7	-34.1	0	0	0	113.5
380	G	24.6	Very low	36.2	Very low	74 Å²	74	140 Å²	140	76%	0.763	74%	0.743	S	S	*	*			trans	-107.3	93.3	158.6	0	0	0	0	0	109.3	S378 E382	S378-G380 PolarHBondContact O-N 3.33Å; G380-E382 PolarHBondContact O-N 3.35Å; G380-E382 VanDerWaalsContact O-N 3.16Å
381	A	30	Very low	38.8	Very low	98 Å²	98	135.5 Å²	135.5	81%	0.81	72%	0.715	S	S	*	*			trans	-84.7	85.9	-173.5	0	0	0	0	0	112.2
382	E	28.3	Very low	41.6	Very low	173 Å²	173	134.3 Å²	134.3	81%	0.808	70%	0.7	S	S	*	*			trans	-79.2	123.2	156.4	-69.4	-162.1	157.3	0	0	109.4	G380 H384	G380-E382 PolarHBondContact O-N 3.35Å; G380-E382 VanDerWaalsContact O-N 3.16Å; E382-H384 PolarHBondContact O-N 3.49Å
383	H	27.1	Very low	44.2	Very low	189 Å²	189	131.5 Å²	131.5	88%	0.875	69%	0.694	S	S	*	*			trans	-67.9	94.4	176.9	-96.2	-7.7	0	0	0	110.8
384	H	31.1	Very low	47.2	Very low	146 Å²	146	122.8 Å²	122.8	68%	0.676	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-63.6	126.8	154.4	-77.3	-42.4	0	0	0	108.9	E382 R386	E382-H384 PolarHBondContact O-N 3.49Å; H384-R386 PolarHBondContact O-N 3.07Å; H384-R386 VanDerWaalsContact O-N 3.14Å
385	P	35.3	Very low	50.3	Low	117 Å²	117	113.7 Å²	113.7	76%	0.76	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-62	121.7	178.4	25	-32.6	0	0	0	108.9	L387	P385-L387 PolarHBondContact O-N 2.87Å; P385-L387 VanDerWaalsContact O-N 3.17Å
386	R	41.4	Very low	53.6	Low	240 Å²	240	105.8 Å²	105.8	91%	0.906	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-55.1	121	178.1	-161.5	177.6	-168.7	174.9	3	108.1	H384 E388	H384-R386 PolarHBondContact O-N 3.07Å; H384-R386 VanDerWaalsContact O-N 3.14Å; R386-E388 PolarHBondContact O-N 2.93Å
387	L	57.8	Low	56.9	Low	44 Å²	44	103.4 Å²	103.4	23%	0.23	58%	0.583	C	S	.	*	P	Polyproline II helix	trans	-55.1	129.5	176.6	-73.5	155.1	0	0	0	108.7	P385 D389 K768 Y769 N781	P385-L387 PolarHBondContact O-N 2.87Å; P385-L387 VanDerWaalsContact O-N 3.17Å; L387-D389 PolarHBondContact O-N 3.19Å; L387-K768 HydrophobicContact CD2-CG 4.01Å; L387-Y769 HydrophobicContact CD2-CD1 3.65Å; L387-Y769 HydrophobicContact CD2-CE1 3.49Å; L387-Y769 VanDerWaalsContact CD2-CE1 3.49Å; L387-Y769 HydrophobicContact CD2-CG 4.43Å; L387-N781 VanDerWaalsContact CD1-ND2 3.29Å; L387-N781 WeakPolarHBondContact CD1-ND2 3.26Å
388	E	59.3	Low	60	Low	109 Å²	109	95.5 Å²	95.5	51%	0.509	54%	0.542	S	S	.	.			trans	-63.4	102.7	-179.7	-69.3	160.7	116.5	0	0	109.2	R386 I390 K768	R386-E388 PolarHBondContact O-N 2.93Å; E388-I390 PolarHBondContact O-N 3.14Å; E388-K768 IonicContact OE2-NZ 2.94Å; E388-K768 PolarHBondContact OE2-NZ 3.43Å
389	D	69.6	Low	62.9	Low	120 Å²	120	96.5 Å²	96.5	64%	0.642	54%	0.544	S	S	*	.			trans	-77.6	104	173.4	-162	3.4	0	0	0	108	L387 S391 R550	L387-D389 PolarHBondContact O-N 3.19Å; D389-S391 PolarHBondContact O-N 3.09Å; D389-S391 VanDerWaalsContact O-N 3.16Å; D389-R550 IonicContact OD1-NH1 3.32Å; D389-R550 PolarHBondContact OD1-NH1 3.17Å
390	I	81.7	Confident	65	Low	17 Å²	17	93.6 Å²	93.6	9%	0.087	52%	0.519	C	S	.	.			trans	-69.6	112.7	-174.9	-65.4	171.3	0	0	0	109.2	E388 E395 H505 R548 R711	E388-I390 PolarHBondContact O-N 3.14Å; I390-E395 HydrophobicContact CG2-CG 3.86Å; I390-H505 HydrophobicContact CD1-CB 3.6Å; I390-R548 PolarHBondContact O-NH2 2.95Å; I390-R548 VanDerWaalsContact O-NH2 3.15Å; I390-R711 HydrophobicContact CG2-CG 3.88Å
391	S	83.4	Confident	66.9	Low	42 Å²	42	96 Å²	96	29%	0.294	51%	0.514	S	S	.	.			trans	-59.1	132.2	176.7	-178.6	0	0	0	0	110.2	D389 S393 E394	D389-S391 PolarHBondContact O-N 3.09Å; D389-S391 VanDerWaalsContact O-N 3.16Å; S391-S393 PolarHBondContact O-N 2.98Å; S391-S393 VanDerWaalsContact O-N 3.13Å; S391-S393 PolarHBondContact OG-N 3.39Å; S391-S393 PolarHBondContact OG-OG 3.22Å; S391-E394 WeakPolarHBondContact O-CB 3.4Å; S391-E394 PolarHBondContact O-N 3.47Å
392	P	84.1	Confident	68.6	Low	62 Å²	62	93 Å²	93	40%	0.403	48%	0.484	S	S	.	.	G	3₁₀ helix	trans	-59.2	-25.7	176.5	20.7	-28	0	0	0	112.8	E394 E395	P392-E394 PolarHBondContact O-N 2.91Å; P392-E395 PolarHBondContact O-N 3.29Å
393	S	85.8	Confident	70.3	Confident	103 Å²	103	87.6 Å²	87.6	72%	0.72	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-71.2	-9.3	175.5	60.1	0	0	0	0	114.7	S391	S391-S393 PolarHBondContact O-N 2.98Å; S391-S393 VanDerWaalsContact O-N 3.13Å; S391-S393 PolarHBondContact OG-N 3.39Å; S391-S393 PolarHBondContact OG-OG 3.22Å
394	E	88.8	Confident	72.1	Confident	60 Å²	60	80.3 Å²	80.3	28%	0.28	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-91.9	-13.2	172.7	-68.8	174.9	-144.7	0	0	113.2	S391 P392 R711 P712	S391-E394 WeakPolarHBondContact O-CB 3.4Å; S391-E394 PolarHBondContact O-N 3.47Å; P392-E394 PolarHBondContact O-N 2.91Å; E394-R711 HydrophobicContact CB-CG 4.14Å; E394-R711 VanDerWaalsContact OE2-CD 3.29Å; E394-R711 WeakPolarHBondContact OE2-CD 3.46Å; E394-R711 IonicContact OE2-NH1 2.9Å; E394-R711 PolarHBondContact OE2-NH1 2.73Å; E394-P712 VanDerWaalsContact O-CD 3.25Å; E394-P712 WeakPolarHBondContact O-CD 2.96Å
395	E	92.8	Very high	73.4	Confident	17 Å²	17	80.8 Å²	80.8	8%	0.079	44%	0.439	C	S	.	.			trans	-95.1	128.5	-174.7	-57.8	-173.6	111.3	0	0	111.2	I390 P392 S507 R548 K709 L710 R711	I390-E395 HydrophobicContact CG2-CG 3.86Å; P392-E395 PolarHBondContact O-N 3.29Å; E395-S507 PolarHBondContact OE1-N 3.41Å; E395-S507 WeakPolarHBondContact OE2-CB 3.37Å; E395-S507 PolarHBondContact OE2-OG 2.86Å; E395-R548 IonicContact OE2-CZ 2.71Å; E395-R548 IonicContact OE2-NE 3.34Å; E395-R548 IonicContact OE2-NH2 3.53Å; E395-R548 PolarHBondContact OE2-NH2 2.89Å; E395-K709 HydrophobicContact CB-CB 3.9Å; E395-L710 WeakPolarHBondContact CA-O 3.34Å; E395-R711 HydrophobicContact CG-CG 4.34Å
396	V	94.5	Very high	74.3	Confident	77 Å²	77	81.2 Å²	81.2	47%	0.467	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	148.9	174.2	-62.9	0	0	0	0	110	D398 K709 L710 P712	V396-D398 PolarHBondContact O-N 3.21Å; V396-K709 CarbonylContact O-C 3.52Å; V396-K709 WeakPolarHBondContact O-CA 3.38Å; V396-L710 WeakPolarHBondContact CG2-O 3.39Å; V396-L710 PolarHBondContact N-O 2.8Å; V396-L710 PolarHBondContact O-N 3.33Å; V396-P712 HydrophobicContact CG1-CG 4.25Å; V396-P712 HydrophobicContact CG2-CG 4.02Å
397	T	94.2	Very high	75	Confident	68 Å²	68	71.4 Å²	71.4	42%	0.417	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	129.8	174.1	-54.8	0	0	0	0	110.2	T399 R707	T397-T399 PolarHBondContact O-N 2.98Å; T397-R707 HydrophobicContact CG2-CB 3.93Å
398	D	91.6	Very high	74.8	Confident	11 Å²	11	72.3 Å²	72.3	6%	0.059	42%	0.42	C	S	.	.			trans	-62.8	117	178.3	-170.9	20.6	0	0	0	110.5	V396 E400 R707 K708 L710 R722	V396-D398 PolarHBondContact O-N 3.21Å; D398-E400 PolarHBondContact OD1-N 2.77Å; D398-R707 WeakPolarHBondContact O-CD 3.16Å; D398-K708 HydrophobicContact CB-CG 3.89Å; D398-K708 WeakPolarHBondContact CB-O 3.43Å; D398-K708 PolarHBondContact N-O 2.83Å; D398-K708 WeakPolarHBondContact OD2-CE 3.39Å; D398-K708 IonicContact OD2-NZ 2.71Å; D398-K708 PolarHBondContact OD2-NZ 3.35Å; D398-L710 HydrophobicContact CB-CD2 3.86Å; D398-L710 HydrophobicContact CB-CG 4.43Å; D398-R722 IonicContact OD1-CZ 2.71Å; D398-R722 IonicContact OD1-NH1 2.79Å; D398-R722 PolarHBondContact OD1-NH1 3.22Å; D398-R722 IonicContact OD1-NH2 3.38Å; D398-R722 PolarHBondContact OD1-NH2 3.15Å; D398-R722 IonicContact OD2-CZ 2.74Å; D398-R722 IonicContact OD2-NH2 2.85Å; D398-R722 PolarHBondContact OD2-NH2 3.35Å
399	T	85.3	Confident	74.3	Confident	126 Å²	126	72.9 Å²	72.9	77%	0.773	43%	0.43	S	S	*	.			trans	-104.1	-3.3	176	52.7	0	0	0	0	112.6	T397 D401	T397-T399 PolarHBondContact O-N 2.98Å; T399-D401 PolarHBondContact O-N 2.85Å; T399-D401 VanDerWaalsContact O-N 3.07Å
400	E	77.7	Confident	73.6	Confident	72 Å²	72	68.5 Å²	68.5	34%	0.336	41%	0.407	S	S	.	.			trans	-73.6	101.9	175.7	-66.1	-144	165	0	0	110.4	D398 N402 K733	D398-E400 PolarHBondContact OD1-N 2.77Å; E400-N402 PolarHBondContact O-N 3.23Å; E400-N402 PolarHBondContact O-ND2 3.02Å; E400-N402 VanDerWaalsContact O-ND2 3.11Å; E400-K733 IonicContact OE1-NZ 3.54Å; E400-K733 PolarHBondContact OE1-NZ 2.95Å; E400-K733 IonicContact OE2-NZ 3.89Å; E400-K733 PolarHBondContact OE2-NZ 2.9Å
401	D	65.6	Low	72.6	Confident	124 Å²	124	72 Å²	72	66%	0.663	43%	0.426	S	S	*	.			trans	-67.3	121.7	164.8	-158.8	-12.2	0	0	0	108.7	T399 A403	T399-D401 PolarHBondContact O-N 2.85Å; T399-D401 VanDerWaalsContact O-N 3.07Å; D401-A403 HydrophobicContact CB-CB 4.43Å; D401-A403 PolarHBondContact O-N 3.33Å; D401-A403 PolarHBondContact OD1-N 3.34Å
402	N	65.1	Low	71.7	Confident	35 Å²	35	76.6 Å²	76.6	19%	0.187	45%	0.447	C	S	.	.			trans	-83.3	33.9	175.9	-73.2	-104.3	0	0	0	110.1	E400 E404 R443	E400-N402 PolarHBondContact O-N 3.23Å; E400-N402 PolarHBondContact O-ND2 3.02Å; E400-N402 VanDerWaalsContact O-ND2 3.11Å; N402-E404 PolarHBondContact O-N 2.86Å; N402-R443 WeakPolarHBondContact OD1-CD 3.43Å
403	A	63.8	Low	71.2	Confident	61 Å²	61	76.9 Å²	76.9	50%	0.504	44%	0.443	S	S	.	.			trans	-63.8	104.8	173.6	0	0	0	0	0	108.6	D401 E405	D401-A403 HydrophobicContact CB-CB 4.43Å; D401-A403 PolarHBondContact O-N 3.33Å; D401-A403 PolarHBondContact OD1-N 3.34Å; A403-E405 PolarHBondContact O-N 2.99Å
404	E	64.8	Low	70.5	Confident	36 Å²	36	78.1 Å²	78.1	17%	0.168	43%	0.432	C	S	.	.			trans	-78.7	110.3	168.8	-67.1	-65.9	175.1	0	0	107.5	N402 D406 E441 K442 K493	N402-E404 PolarHBondContact O-N 2.86Å; E404-D406 PolarHBondContact O-N 2.85Å; E404-E441 WeakPolarHBondContact OE1-CA 3.47Å; E404-K442 PolarHBondContact OE1-N 2.8Å; E404-K493 HydrophobicContact CB-CD 4.38Å; E404-K493 HydrophobicContact CG-CD 3.98Å; E404-K493 IonicContact OE2-NZ 3.6Å; E404-K493 PolarHBondContact OE2-NZ 3.15Å
405	E	58.2	Low	69.9	Low	156 Å²	156	79 Å²	79	73%	0.729	45%	0.445	S	S	*	.			trans	-52	139	165.5	-68.8	178.6	163.1	0	0	109	A403 L407	A403-E405 PolarHBondContact O-N 2.99Å; E405-L407 PolarHBondContact O-N 2.9Å
406	D	55.8	Low	69.3	Low	125 Å²	125	81 Å²	81	67%	0.668	46%	0.458	S	S	*	.			trans	-55	139.5	-178.3	-165.6	12.1	0	0	0	109.2	E404 G408 V491	E404-D406 PolarHBondContact O-N 2.85Å; D406-G408 VanDerWaalsContact C-N 3.3Å; D406-G408 PolarHBondContact O-N 2.92Å; D406-V491 VanDerWaalsContact OD1-CG2 3.31Å; D406-V491 WeakPolarHBondContact OD1-CG2 3.48Å
407	L	54.5	Low	68.6	Low	35 Å²	35	78.6 Å²	78.6	18%	0.183	44%	0.442	C	S	.	.			trans	-68.2	98.4	177.7	-71.9	-174.6	0	0	0	107.1	E405 L410 V491	E405-L407 PolarHBondContact O-N 2.9Å; L407-L410 HydrophobicContact CB-CD1 4.38Å; L407-L410 HydrophobicContact CB-CG 4.26Å; L407-L410 HydrophobicContact CD1-CD1 4.2Å; L407-L410 HydrophobicContact CD1-CD2 4.19Å; L407-V491 HydrophobicContact CD1-CG1 3.62Å; L407-V491 HydrophobicContact CG-CG1 3.95Å
408	G	54.5	Low	67.8	Low	63 Å²	63	78.3 Å²	78.3	65%	0.649	44%	0.438	S	S	*	.			trans	-48	153	170.5	0	0	0	0	0	110.6	D406 L410	D406-G408 VanDerWaalsContact C-N 3.3Å; D406-G408 PolarHBondContact O-N 2.92Å; G408-L410 PolarHBondContact O-N 2.85Å
409	V	48.1	Very low	67.3	Low	120 Å²	120	83.4 Å²	83.4	73%	0.727	46%	0.461	S	S	*	.			trans	-35.2	104.8	-164.9	-173.7	0	0	0	0	112.4	D411	V409-D411 HydrophobicContact CG1-CB 4.08Å; V409-D411 VanDerWaalsContact CG1-OD2 3.28Å; V409-D411 WeakPolarHBondContact CG1-OD2 3.23Å; V409-D411 PolarHBondContact O-N 2.9Å
410	L	56.4	Low	67.2	Low	29 Å²	29	78.7 Å²	78.7	15%	0.152	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	6.6	-172.5	-87.1	166.5	0	0	0	114.8	L407 G408 D412 Q413 R414 I417 F438	L407-L410 HydrophobicContact CB-CD1 4.38Å; L407-L410 HydrophobicContact CB-CG 4.26Å; L407-L410 HydrophobicContact CD1-CD1 4.2Å; L407-L410 HydrophobicContact CD1-CD2 4.19Å; G408-L410 PolarHBondContact O-N 2.85Å; L410-D412 VanDerWaalsContact C-N 3.33Å; L410-D412 PolarHBondContact O-N 2.85Å; L410-Q413 HydrophobicContact CD2-CB 4.16Å; L410-Q413 CarbonylContact O-C 3.48Å; L410-Q413 PolarHBondContact O-N 2.67Å; L410-Q413 VanDerWaalsContact O-N 3.07Å; L410-R414 WeakPolarHBondContact O-CB 3.31Å; L410-R414 PolarHBondContact O-N 3.26Å; L410-I417 HydrophobicContact CD2-CD1 4.44Å; L410-F438 HydrophobicContact CD2-CD2 4.22Å; L410-F438 HydrophobicContact CD2-CE2 4.05Å
411	D	60.5	Low	67.3	Low	89 Å²	89	75.6 Å²	75.6	48%	0.476	42%	0.417	S	S	.	.	H	α-helix	trans	-62.5	-36.4	-172.7	-78.9	-35.9	0	0	0	112.6	V409 Q413 R414	V409-D411 HydrophobicContact CG1-CB 4.08Å; V409-D411 VanDerWaalsContact CG1-OD2 3.28Å; V409-D411 WeakPolarHBondContact CG1-OD2 3.23Å; V409-D411 PolarHBondContact O-N 2.9Å; D411-Q413 VanDerWaalsContact C-N 3.3Å; D411-Q413 PolarHBondContact O-N 2.99Å; D411-R414 VanDerWaalsContact O-CB 3.26Å; D411-R414 WeakPolarHBondContact O-CB 3.27Å; D411-R414 PolarHBondContact O-N 3.33Å; D411-R414 IonicContact OD1-CZ 4Å; D411-R414 IonicContact OD1-NH1 2.98Å; D411-R414 PolarHBondContact OD1-NH1 2.87Å
412	D	64.7	Low	67.8	Low	140 Å²	140	71.6 Å²	71.6	75%	0.749	40%	0.398	S	S	*	.	H	α-helix	trans	-62.8	-37.1	174.4	-67.3	-14.1	0	0	0	112.1	L410 S415	L410-D412 VanDerWaalsContact C-N 3.33Å; L410-D412 PolarHBondContact O-N 2.85Å; D412-S415 PolarHBondContact O-OG 3.33Å
413	Q	72.6	Confident	68.6	Low	67 Å²	67	75.3 Å²	75.3	31%	0.313	42%	0.415	S	S	.	.	H	α-helix	trans	-90.3	-9.7	-179.3	-59.5	-55.2	-44.2	0	0	113.3	L410 D411 S415 V416 I417 F438	L410-Q413 HydrophobicContact CD2-CB 4.16Å; L410-Q413 CarbonylContact O-C 3.48Å; L410-Q413 PolarHBondContact O-N 2.67Å; L410-Q413 VanDerWaalsContact O-N 3.07Å; D411-Q413 VanDerWaalsContact C-N 3.3Å; D411-Q413 PolarHBondContact O-N 2.99Å; Q413-S415 PolarHBondContact O-N 2.95Å; Q413-V416 WeakPolarHBondContact O-CB 3.15Å; Q413-V416 PolarHBondContact O-N 2.93Å; Q413-I417 PolarHBondContact O-N 3.34Å; Q413-F438 HydrophobicContact CB-CD1 4.23Å; Q413-F438 HydrophobicContact CB-CD2 4.48Å; Q413-F438 HydrophobicContact CB-CE1 3.8Å; Q413-F438 HydrophobicContact CB-CE2 4.1Å; Q413-F438 HydrophobicContact CB-CZ 3.77Å; Q413-F438 HydrophobicContact CG-CD1 3.98Å; Q413-F438 HydrophobicContact CG-CD2 4.5Å; Q413-F438 HydrophobicContact CG-CE1 4.07Å; Q413-F438 HydrophobicContact CG-CG 4.23Å; Q413-F438 HydrophobicContact CG-CZ 4.41Å
414	R	70.7	Confident	69.5	Low	129 Å²	129	72.6 Å²	72.6	49%	0.487	39%	0.392	S	S	.	.	H	α-helix	trans	-60.4	-33.7	-177.3	-172.7	177.5	-174	152.9	1.3	112.5	L410 D411 I417 L418	L410-R414 WeakPolarHBondContact O-CB 3.31Å; L410-R414 PolarHBondContact O-N 3.26Å; D411-R414 VanDerWaalsContact O-CB 3.26Å; D411-R414 WeakPolarHBondContact O-CB 3.27Å; D411-R414 PolarHBondContact O-N 3.33Å; D411-R414 IonicContact OD1-CZ 4Å; D411-R414 IonicContact OD1-NH1 2.98Å; D411-R414 PolarHBondContact OD1-NH1 2.87Å; R414-I417 PolarHBondContact O-N 3.14Å; R414-L418 HydrophobicContact CG-CD1 4.07Å; R414-L418 HydrophobicContact CG-CG 4.44Å; R414-L418 WeakPolarHBondContact O-CB 3.41Å; R414-L418 VanDerWaalsContact O-CG 3.25Å; R414-L418 WeakPolarHBondContact O-CG 3.35Å; R414-L418 PolarHBondContact O-N 2.94Å
415	S	76.8	Confident	70.2	Confident	79 Å²	79	78 Å²	78	55%	0.552	42%	0.415	S	S	*	.	H	α-helix	trans	-60.1	-44.7	174	61.4	0	0	0	0	111.8	D412 Q413 L418 H419	D412-S415 PolarHBondContact O-OG 3.33Å; Q413-S415 PolarHBondContact O-N 2.95Å; S415-L418 PolarHBondContact O-N 2.92Å; S415-H419 WeakPolarHBondContact O-CB 3.32Å; S415-H419 PolarHBondContact O-N 3.37Å
416	V	80.2	Confident	71.1	Confident	60 Å²	60	72 Å²	72	36%	0.364	39%	0.387	S	S	.	.	H	α-helix	trans	-66.7	-44.9	177.5	-174.9	0	0	0	0	110.9	Q413 H419 L420 P436 F438	Q413-V416 WeakPolarHBondContact O-CB 3.15Å; Q413-V416 PolarHBondContact O-N 2.93Å; V416-H419 PolarHBondContact O-N 3.25Å; V416-L420 WeakPolarHBondContact O-CB 3.28Å; V416-L420 PolarHBondContact O-N 2.93Å; V416-P436 HydrophobicContact CG1-CB 4.34Å; V416-P436 HydrophobicContact CG1-CG 3.75Å; V416-F438 HydrophobicContact CB-CE1 4.45Å; V416-F438 HydrophobicContact CG1-CE1 4.35Å
417	I	79	Confident	72.1	Confident	26 Å²	26	66.9 Å²	66.9	13%	0.133	36%	0.364	C	S	.	.	H	α-helix	trans	-59.7	-50.4	175.7	-62.3	175	0	0	0	110.2	L410 Q413 R414 H419 L420 L421 F438	L410-I417 HydrophobicContact CD2-CD1 4.44Å; Q413-I417 PolarHBondContact O-N 3.34Å; R414-I417 PolarHBondContact O-N 3.14Å; I417-H419 PolarHBondContact O-N 3.49Å; I417-L420 PolarHBondContact O-N 2.87Å; I417-L421 HydrophobicContact CG2-CD1 3.56Å; I417-L421 HydrophobicContact CG2-CG 4.16Å; I417-L421 WeakPolarHBondContact O-CB 3.45Å; I417-L421 WeakPolarHBondContact O-CG 3.4Å; I417-L421 PolarHBondContact O-N 3.35Å; I417-F438 HydrophobicContact CD1-CE2 4Å; I417-F438 HydrophobicContact CD1-CZ 4.01Å; I417-F438 HydrophobicContact CG1-CE2 4.14Å; I417-F438 HydrophobicContact CG1-CZ 3.65Å
418	L	78.1	Confident	73.5	Confident	61 Å²	61	68.3 Å²	68.3	32%	0.319	37%	0.371	S	S	.	.	H	α-helix	trans	-61	-44.6	178.4	-73.7	171.1	0	0	0	111.4	I80 R414 S415 L420 L421 S422 L623	I80-L418 HydrophobicContact CD1-CB 4.14Å; I80-L418 HydrophobicContact CD1-CD2 4.47Å; I80-L418 WeakPolarHBondContact CD1-O 3.23Å; I80-L418 HydrophobicContact CG1-CD2 4.45Å; R414-L418 HydrophobicContact CG-CD1 4.07Å; R414-L418 HydrophobicContact CG-CG 4.44Å; R414-L418 WeakPolarHBondContact O-CB 3.41Å; R414-L418 VanDerWaalsContact O-CG 3.25Å; R414-L418 WeakPolarHBondContact O-CG 3.35Å; R414-L418 PolarHBondContact O-N 2.94Å; S415-L418 PolarHBondContact O-N 2.92Å; L418-L420 PolarHBondContact O-N 3.39Å; L418-L421 PolarHBondContact O-N 3.39Å; L418-S422 WeakPolarHBondContact O-CB 3.19Å; L418-S422 PolarHBondContact O-N 3.35Å; L418-L623 HydrophobicContact CD2-CD2 3.72Å
419	H	82	Confident	75	Confident	118 Å²	118	69.6 Å²	69.6	55%	0.546	36%	0.363	S	S	.	.	H	α-helix	trans	-57.6	-49.2	177	-176.3	81.6	0	0	0	111.7	S415 V416 I417 S422 Q423	S415-H419 WeakPolarHBondContact O-CB 3.32Å; S415-H419 PolarHBondContact O-N 3.37Å; V416-H419 PolarHBondContact O-N 3.25Å; I417-H419 PolarHBondContact O-N 3.49Å; H419-S422 WeakPolarHBondContact O-CB 3.3Å; H419-S422 PolarHBondContact O-N 3.13Å; H419-S422 PolarHBondContact O-OG 3.45Å; H419-Q423 PolarHBondContact CD2-NE2 2.88Å; H419-Q423 PolarHBondContact NE2-NE2 3.49Å
420	L	81.6	Confident	76.7	Confident	27 Å²	27	64.5 Å²	64.5	14%	0.141	33%	0.332	C	S	.	.	H	α-helix	trans	-56	-53.4	174.9	-179.4	73	0	0	0	111.4	V416 I417 L418 S422 Q423 V433 L435	V416-L420 WeakPolarHBondContact O-CB 3.28Å; V416-L420 PolarHBondContact O-N 2.93Å; I417-L420 PolarHBondContact O-N 2.87Å; L418-L420 PolarHBondContact O-N 3.39Å; L420-S422 PolarHBondContact O-N 3.04Å; L420-Q423 WeakPolarHBondContact O-CB 3.3Å; L420-Q423 PolarHBondContact O-N 3.19Å; L420-V433 HydrophobicContact CD1-CG1 3.67Å; L420-L435 HydrophobicContact CD2-CD2 3.9Å
421	L	79.8	Confident	77.7	Confident	7 Å²	7	66.6 Å²	66.6	4%	0.037	35%	0.346	C	S	.	.	H	α-helix	trans	-64.2	-23.4	-178.3	-67.8	177.7	0	0	0	113.5	L79 I417 L418 Q423 L424 F586 I622 L623	L79-L421 HydrophobicContact CD1-CB 4.1Å; L79-L421 HydrophobicContact CD1-CD1 3.83Å; L79-L421 HydrophobicContact CD1-CD2 4.09Å; L79-L421 HydrophobicContact CD1-CG 4.23Å; I417-L421 HydrophobicContact CG2-CD1 3.56Å; I417-L421 HydrophobicContact CG2-CG 4.16Å; I417-L421 WeakPolarHBondContact O-CB 3.45Å; I417-L421 WeakPolarHBondContact O-CG 3.4Å; I417-L421 PolarHBondContact O-N 3.35Å; L418-L421 PolarHBondContact O-N 3.39Å; L421-Q423 VanDerWaalsContact C-N 3.27Å; L421-Q423 PolarHBondContact O-N 3.25Å; L421-L424 HydrophobicContact CD2-CD1 3.79Å; L421-L424 PolarHBondContact O-N 2.91Å; L421-F586 HydrophobicContact CD2-CE2 3.68Å; L421-F586 HydrophobicContact CD2-CZ 4.16Å; L421-I622 HydrophobicContact CD2-CD1 3.86Å; L421-I622 HydrophobicContact CD2-CG1 4.43Å; L421-L623 HydrophobicContact CD1-CD2 3.33Å; L421-L623 HydrophobicContact CD1-CG 3.87Å
422	S	77.3	Confident	78.3	Confident	40 Å²	40	73.6 Å²	73.6	28%	0.28	37%	0.365	S	S	.	.	H	α-helix	trans	-66.2	-30.3	173.5	85.4	0	0	0	0	112.7	N78 L418 H419 L420	N78-S422 PolarHBondContact ND2-O 3.19Å; L418-S422 WeakPolarHBondContact O-CB 3.19Å; L418-S422 PolarHBondContact O-N 3.35Å; H419-S422 WeakPolarHBondContact O-CB 3.3Å; H419-S422 PolarHBondContact O-N 3.13Å; H419-S422 PolarHBondContact O-OG 3.45Å; L420-S422 PolarHBondContact O-N 3.04Å
423	Q	81	Confident	79.1	Confident	113 Å²	113	68 Å²	68	53%	0.528	34%	0.336	S	S	.	.	H	α-helix	trans	-80.8	-23.7	179.6	-55.8	177.7	5.1	0	0	111.8	H419 L420 L421	H419-Q423 PolarHBondContact CD2-NE2 2.88Å; H419-Q423 PolarHBondContact NE2-NE2 3.49Å; L420-Q423 WeakPolarHBondContact O-CB 3.3Å; L420-Q423 PolarHBondContact O-N 3.19Å; L421-Q423 VanDerWaalsContact C-N 3.27Å; L421-Q423 PolarHBondContact O-N 3.25Å
424	L	82.3	Confident	79.5	Confident	5 Å²	5	70 Å²	70	3%	0.026	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-79.2	132.7	-176	-53.8	-173.8	0	0	0	112.3	L421 M428 L430 V433 F586	L421-L424 HydrophobicContact CD2-CD1 3.79Å; L421-L424 PolarHBondContact O-N 2.91Å; L424-M428 HydrophobicContact CD2-CE 3.53Å; L424-M428 HydrophobicContact CD2-SD 4.05Å; L424-L430 HydrophobicContact CD1-CD2 3.95Å; L424-L430 HydrophobicContact CD2-CD2 3.75Å; L424-L430 HydrophobicContact CG-CD2 4.46Å; L424-V433 HydrophobicContact CD2-CG1 4.23Å; L424-V433 HydrophobicContact CD2-CG2 3.91Å; L424-F586 HydrophobicContact CB-CD1 3.81Å; L424-F586 HydrophobicContact CB-CD2 4.17Å; L424-F586 HydrophobicContact CB-CE1 3.8Å; L424-F586 HydrophobicContact CB-CE2 4.15Å; L424-F586 HydrophobicContact CB-CG 3.99Å; L424-F586 HydrophobicContact CB-CZ 3.97Å; L424-F586 HydrophobicContact CD1-CD2 3.46Å; L424-F586 VanDerWaalsContact CD1-CD2 3.46Å; L424-F586 HydrophobicContact CD1-CE2 3.57Å; L424-F586 HydrophobicContact CD1-CG 4.01Å; L424-F586 HydrophobicContact CD1-CZ 4.21Å; L424-F586 HydrophobicContact CG-CD2 4.46Å
425	K	81.1	Confident	80	Confident	150 Å²	150	65.7 Å²	65.7	65%	0.652	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-102.4	146.5	169.7	-64	175.2	-173.8	168.9	0	109.7	G427 M428 F586	K425-G427 PolarHBondContact O-N 3.17Å; K425-M428 WeakPolarHBondContact O-CB 3.27Å; K425-M428 PolarHBondContact O-N 2.98Å; K425-F586 WeakPolarHBondContact O-CD1 3.25Å
426	L	75.8	Confident	80.4	Confident	29 Å²	29	63.1 Å²	63.1	15%	0.152	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	131.6	176.5	-173.9	69.3	0	0	0	111.3	L140 K142 M428 M587 G588	L140-L426 HydrophobicContact CD2-CD2 3.58Å; L140-L426 HydrophobicContact CD2-CG 3.99Å; L140-L426 HydrophobicContact CG-CD2 4.32Å; K142-L426 HydrophobicContact CD-CD2 3.3Å; K142-L426 HydrophobicContact CG-CD2 3.9Å; L426-M428 VanDerWaalsContact C-N 3.3Å; L426-M587 VanDerWaalsContact CD1-CA 3.43Å; L426-G588 VanDerWaalsContact CD1-N 3.34Å
427	G	77.2	Confident	80.7	Confident	18 Å²	18	60.6 Å²	60.6	19%	0.186	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	84	-2.3	-179.7	0	0	0	0	0	115.2	K425 K585 F586	K425-G427 PolarHBondContact O-N 3.17Å; G427-K585 WeakPolarHBondContact O-CE 3.42Å; G427-F586 WeakPolarHBondContact CA-O 3.31Å; G427-F586 PolarHBondContact N-O 3.29Å
428	M	84.3	Confident	80.9	Confident	64 Å²	64	60.3 Å²	60.3	32%	0.315	30%	0.303	S	S	.	.			trans	-61.7	139	176.2	-179.6	173.2	146	0	0	112	L424 K425 L426 V433 F586	L424-M428 HydrophobicContact CD2-CE 3.53Å; L424-M428 HydrophobicContact CD2-SD 4.05Å; K425-M428 WeakPolarHBondContact O-CB 3.27Å; K425-M428 PolarHBondContact O-N 2.98Å; L426-M428 VanDerWaalsContact C-N 3.3Å; M428-V433 HydrophobicContact CE-CG2 3.43Å; M428-V433 VanDerWaalsContact CE-CG2 3.43Å; M428-F586 PolarHBondContact O-N 2.98Å
429	D	84.9	Confident	81.2	Confident	90 Å²	90	59.3 Å²	59.3	48%	0.481	30%	0.298	S	S	.	.	B	Isolated β-bridge	trans	-70.1	132.4	171.2	-171.7	-22.7	0	0	0	110.2	T431 S584	D429-T431 VanDerWaalsContact CG-OG1 3.22Å; D429-T431 VanDerWaalsContact OD1-CB 3.32Å; D429-T431 WeakPolarHBondContact OD1-CB 3.49Å; D429-T431 VanDerWaalsContact OD1-CG2 3.25Å; D429-T431 WeakPolarHBondContact OD1-CG2 3.4Å; D429-T431 PolarHBondContact OD1-N 3.49Å; D429-T431 PolarHBondContact OD1-OG1 2.91Å; D429-T431 PolarHBondContact OD2-OG1 3.44Å; D429-S584 WeakPolarHBondContact CA-O 3.28Å
430	L	83.8	Confident	81.5	Confident	14 Å²	14	54.1 Å²	54.1	7%	0.073	27%	0.274	C	S	.	.			trans	-100.9	-1.2	-177.2	-60.9	179.2	0	0	0	114.3	L424 R432 V433 S584 F586 V591	L424-L430 HydrophobicContact CD1-CD2 3.95Å; L424-L430 HydrophobicContact CD2-CD2 3.75Å; L424-L430 HydrophobicContact CG-CD2 4.46Å; L430-R432 PolarHBondContact O-N 2.81Å; L430-V433 HydrophobicContact CD2-CB 4.2Å; L430-V433 HydrophobicContact CD2-CG2 3.71Å; L430-V433 PolarHBondContact O-N 3.07Å; L430-V433 VanDerWaalsContact O-N 3.08Å; L430-S584 PolarHBondContact N-O 2.89Å; L430-F586 HydrophobicContact CD1-CB 4.16Å; L430-F586 HydrophobicContact CD2-CB 4.11Å; L430-F586 HydrophobicContact CG-CB 4.25Å; L430-V591 HydrophobicContact CD1-CB 4.14Å; L430-V591 HydrophobicContact CD1-CG1 3.53Å; L430-V591 HydrophobicContact CD1-CG2 3.51Å
431	T	77.8	Confident	81.8	Confident	73 Å²	73	53.5 Å²	53.5	45%	0.448	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-31	176.6	51.7	0	0	0	0	113.2	D429	D429-T431 VanDerWaalsContact CG-OG1 3.22Å; D429-T431 VanDerWaalsContact OD1-CB 3.32Å; D429-T431 WeakPolarHBondContact OD1-CB 3.49Å; D429-T431 VanDerWaalsContact OD1-CG2 3.25Å; D429-T431 WeakPolarHBondContact OD1-CG2 3.4Å; D429-T431 PolarHBondContact OD1-N 3.49Å; D429-T431 PolarHBondContact OD1-OG1 2.91Å; D429-T431 PolarHBondContact OD2-OG1 3.44Å
432	R	73.7	Confident	82.3	Confident	235 Å²	235	55 Å²	55	89%	0.887	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	5.6	179.3	-53.3	-173.2	74.9	179.4	4.9	113.8	L430	L430-R432 PolarHBondContact O-N 2.81Å
433	V	81.4	Confident	83	Confident	22 Å²	22	53.7 Å²	53.7	13%	0.133	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-93.2	119.4	179.1	176.3	0	0	0	0	109.2	L420 L424 M428 L430 L435	L420-V433 HydrophobicContact CD1-CG1 3.67Å; L424-V433 HydrophobicContact CD2-CG1 4.23Å; L424-V433 HydrophobicContact CD2-CG2 3.91Å; M428-V433 HydrophobicContact CE-CG2 3.43Å; M428-V433 VanDerWaalsContact CE-CG2 3.43Å; L430-V433 HydrophobicContact CD2-CB 4.2Å; L430-V433 HydrophobicContact CD2-CG2 3.71Å; L430-V433 PolarHBondContact O-N 3.07Å; L430-V433 VanDerWaalsContact O-N 3.08Å; V433-L435 HydrophobicContact CG1-CD2 4.03Å; V433-L435 PolarHBondContact O-N 2.78Å
434	V	80.3	Confident	83.7	Confident	109 Å²	109	48.5 Å²	48.5	66%	0.661	24%	0.241	S	C	*	.	P	Polyproline II helix	trans	-70.6	119.8	171	-176.9	0	0	0	0	108.1
435	L	82.6	Confident	84.2	Confident	39 Å²	39	49.5 Å²	49.5	20%	0.204	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-96.2	142.8	177.2	-61	172.5	0	0	0	109.7	L420 V433 I439 K494	L420-L435 HydrophobicContact CD2-CD2 3.9Å; V433-L435 HydrophobicContact CG1-CD2 4.03Å; V433-L435 PolarHBondContact O-N 2.78Å; L435-I439 HydrophobicContact CB-CD1 3.84Å; L435-I439 HydrophobicContact CB-CG1 4.27Å; L435-I439 HydrophobicContact CD1-CD1 4.02Å; L435-I439 HydrophobicContact CD2-CD1 4.46Å; L435-I439 HydrophobicContact CG-CD1 4.31Å; L435-K494 HydrophobicContact CD1-CD 3.66Å
436	P	83.8	Confident	85	Confident	25 Å²	25	42.4 Å²	42.4	16%	0.162	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-58.7	149	179	-26	34.7	0	0	0	113.4	V416 F438 I439	V416-P436 HydrophobicContact CG1-CB 4.34Å; V416-P436 HydrophobicContact CG1-CG 3.75Å; P436-F438 VanDerWaalsContact C-N 3.26Å; P436-F438 HydrophobicContact CB-CD1 3.59Å; P436-F438 HydrophobicContact CB-CE1 3.23Å; P436-F438 HydrophobicContact CB-CG 4.43Å; P436-F438 HydrophobicContact CB-CZ 3.83Å; P436-F438 HydrophobicContact CG-CE1 3.84Å; P436-F438 HydrophobicContact CG-CZ 4.1Å; P436-F438 PolarHBondContact O-N 2.85Å; P436-I439 VanDerWaalsContact O-CG1 3.27Å; P436-I439 WeakPolarHBondContact O-CG1 3.41Å; P436-I439 PolarHBondContact O-N 2.78Å
437	T	86.4	Confident	85.9	Confident	8 Å²	8	41.2 Å²	41.2	5%	0.049	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-65.9	-26.3	-175.2	-42	0	0	0	0	112.7	I439 L440 L732 M737 A740 T741	T437-I439 VanDerWaalsContact C-N 3.27Å; T437-I439 PolarHBondContact O-N 2.67Å; T437-L440 HydrophobicContact CG2-CD1 3.84Å; T437-L440 VanDerWaalsContact O-CB 3.29Å; T437-L440 WeakPolarHBondContact O-CB 3.17Å; T437-L440 WeakPolarHBondContact O-CG 3.46Å; T437-L440 PolarHBondContact O-N 3.22Å; T437-L440 VanDerWaalsContact O-N 3.09Å; T437-L732 HydrophobicContact CG2-CD2 4.23Å; T437-M737 HydrophobicContact CG2-CE 3.97Å; T437-A740 HydrophobicContact CG2-CB 3.81Å; T437-T741 WeakPolarHBondContact CB-OG1 3.27Å; T437-T741 WeakPolarHBondContact OG1-CB 3.18Å; T437-T741 PolarHBondContact OG1-OG1 3.19Å
438	F	82.9	Confident	86.7	Confident	20 Å²	20	40.5 Å²	40.5	9%	0.088	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-71.8	-16.3	-178.4	66.9	-100.3	0	0	0	114.2	L410 Q413 V416 I417 P436 L440 M737	L410-F438 HydrophobicContact CD2-CD2 4.22Å; L410-F438 HydrophobicContact CD2-CE2 4.05Å; Q413-F438 HydrophobicContact CB-CD1 4.23Å; Q413-F438 HydrophobicContact CB-CD2 4.48Å; Q413-F438 HydrophobicContact CB-CE1 3.8Å; Q413-F438 HydrophobicContact CB-CE2 4.1Å; Q413-F438 HydrophobicContact CB-CZ 3.77Å; Q413-F438 HydrophobicContact CG-CD1 3.98Å; Q413-F438 HydrophobicContact CG-CD2 4.5Å; Q413-F438 HydrophobicContact CG-CE1 4.07Å; Q413-F438 HydrophobicContact CG-CG 4.23Å; Q413-F438 HydrophobicContact CG-CZ 4.41Å; V416-F438 HydrophobicContact CB-CE1 4.45Å; V416-F438 HydrophobicContact CG1-CE1 4.35Å; I417-F438 HydrophobicContact CD1-CE2 4Å; I417-F438 HydrophobicContact CD1-CZ 4.01Å; I417-F438 HydrophobicContact CG1-CE2 4.14Å; I417-F438 HydrophobicContact CG1-CZ 3.65Å; P436-F438 VanDerWaalsContact C-N 3.26Å; P436-F438 HydrophobicContact CB-CD1 3.59Å; P436-F438 HydrophobicContact CB-CE1 3.23Å; P436-F438 HydrophobicContact CB-CG 4.43Å; P436-F438 HydrophobicContact CB-CZ 3.83Å; P436-F438 HydrophobicContact CG-CE1 3.84Å; P436-F438 HydrophobicContact CG-CZ 4.1Å; P436-F438 PolarHBondContact O-N 2.85Å; F438-L440 VanDerWaalsContact C-N 3.29Å; F438-M737 HydrophobicContact CB-CE 3.69Å; F438-M737 HydrophobicContact CB-SD 4.13Å
439	I	85.3	Confident	87.1	Confident	39 Å²	39	38.1 Å²	38.1	20%	0.2	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-89.4	5.2	172.1	73.9	155.1	0	0	0	112.7	L435 P436 T437 K493 K494	L435-I439 HydrophobicContact CB-CD1 3.84Å; L435-I439 HydrophobicContact CB-CG1 4.27Å; L435-I439 HydrophobicContact CD1-CD1 4.02Å; L435-I439 HydrophobicContact CD2-CD1 4.46Å; L435-I439 HydrophobicContact CG-CD1 4.31Å; P436-I439 VanDerWaalsContact O-CG1 3.27Å; P436-I439 WeakPolarHBondContact O-CG1 3.41Å; P436-I439 PolarHBondContact O-N 2.78Å; T437-I439 VanDerWaalsContact C-N 3.27Å; T437-I439 PolarHBondContact O-N 2.67Å; I439-K493 CarbonylContact O-C 3.53Å; I439-K493 VanDerWaalsContact O-CA 3.28Å; I439-K493 WeakPolarHBondContact O-CA 3.42Å; I439-K493 WeakPolarHBondContact O-CB 3.21Å; I439-K494 PolarHBondContact O-N 3.45Å
440	L	88.6	Confident	87.6	Confident	9 Å²	9	33.9 Å²	33.9	5%	0.047	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	138.7	179.3	-59.5	178	0	0	0	111.4	T437 F438 K493 K494 Y496 L732 K744	T437-L440 HydrophobicContact CG2-CD1 3.84Å; T437-L440 VanDerWaalsContact O-CB 3.29Å; T437-L440 WeakPolarHBondContact O-CB 3.17Å; T437-L440 WeakPolarHBondContact O-CG 3.46Å; T437-L440 PolarHBondContact O-N 3.22Å; T437-L440 VanDerWaalsContact O-N 3.09Å; F438-L440 VanDerWaalsContact C-N 3.29Å; L440-K493 WeakPolarHBondContact O-CD 3.33Å; L440-K494 CarbonylContact C-O 3.48Å; L440-K494 VanDerWaalsContact CA-O 3.24Å; L440-K494 WeakPolarHBondContact CA-O 3.35Å; L440-K494 HydrophobicContact CD2-CB 4.47Å; L440-Y496 HydrophobicContact CB-CD1 4.27Å; L440-Y496 HydrophobicContact CB-CE1 4.06Å; L440-Y496 HydrophobicContact CD1-CD1 4.13Å; L440-Y496 HydrophobicContact CD1-CE1 4.26Å; L440-L732 HydrophobicContact CB-CD1 4.38Å; L440-K744 HydrophobicContact CD1-CD 3.75Å
441	E	87.9	Confident	87.9	Confident	15 Å²	15	34.3 Å²	34.3	7%	0.07	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	147.8	168.5	-169.3	-179	-131.7	0	0	108.8	E404 R443 K493 K494 Y496	E404-E441 WeakPolarHBondContact OE1-CA 3.47Å; E441-R443 VanDerWaalsContact CD-NH2 3.31Å; E441-R443 HydrophobicContact CG-CG 4.1Å; E441-R443 PolarHBondContact O-N 2.95Å; E441-R443 IonicContact OE1-CZ 2.72Å; E441-R443 IonicContact OE1-NE 2.7Å; E441-R443 PolarHBondContact OE1-NE 3.12Å; E441-R443 IonicContact OE1-NH2 3.94Å; E441-R443 PolarHBondContact OE1-NH2 3.05Å; E441-R443 WeakPolarHBondContact OE2-CG 3.32Å; E441-R443 IonicContact OE2-CZ 2.78Å; E441-R443 IonicContact OE2-NE 3.3Å; E441-R443 PolarHBondContact OE2-NE 3.12Å; E441-R443 IonicContact OE2-NH2 3.43Å; E441-R443 PolarHBondContact OE2-NH2 3.11Å; E441-K493 HydrophobicContact CB-CB 3.85Å; E441-K494 PolarHBondContact N-O 2.95Å; E441-Y496 WeakPolarHBondContact O-CE1 3.24Å
442	K	90.6	Very high	88.6	Confident	38 Å²	38	32.3 Å²	32.3	17%	0.165	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	18.6	-172.3	-70	165.9	-178.5	171.6	0	115.8	E404 Y496 T729 L732 K733	E404-K442 PolarHBondContact OE1-N 2.8Å; K442-Y496 WeakPolarHBondContact CA-OH 3.43Å; K442-T729 HydrophobicContact CB-CG2 4.34Å; K442-T729 PolarHBondContact O-OG1 2.87Å; K442-T729 VanDerWaalsContact O-OG1 3.13Å; K442-L732 WeakPolarHBondContact CE-O 3.29Å; K442-L732 HydrophobicContact CG-CB 4.3Å; K442-K733 HydrophobicContact CD-CG 3.96Å
443	R	91.6	Very high	89.5	Confident	13 Å²	13	21.7 Å²	21.7	5%	0.049	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	160.3	-175	69.6	-171.4	174.9	-164.3	-2.2	113.6	N402 E441 E447 N451 G486 P495 Y496	N402-R443 WeakPolarHBondContact OD1-CD 3.43Å; E441-R443 VanDerWaalsContact CD-NH2 3.31Å; E441-R443 HydrophobicContact CG-CG 4.1Å; E441-R443 PolarHBondContact O-N 2.95Å; E441-R443 IonicContact OE1-CZ 2.72Å; E441-R443 IonicContact OE1-NE 2.7Å; E441-R443 PolarHBondContact OE1-NE 3.12Å; E441-R443 IonicContact OE1-NH2 3.94Å; E441-R443 PolarHBondContact OE1-NH2 3.05Å; E441-R443 WeakPolarHBondContact OE2-CG 3.32Å; E441-R443 IonicContact OE2-CZ 2.78Å; E441-R443 IonicContact OE2-NE 3.3Å; E441-R443 PolarHBondContact OE2-NE 3.12Å; E441-R443 IonicContact OE2-NH2 3.43Å; E441-R443 PolarHBondContact OE2-NH2 3.11Å; R443-E447 HydrophobicContact CB-CB 4.43Å; R443-E447 HydrophobicContact CB-CG 4.46Å; R443-N451 PolarHBondContact NH1-ND2 2.9Å; R443-G486 PolarHBondContact NH2-O 3.27Å; R443-P495 CarbonylContact O-C 3.44Å; R443-P495 WeakPolarHBondContact O-CA 3.27Å; R443-P495 WeakPolarHBondContact O-CB 3.37Å; R443-Y496 WeakPolarHBondContact O-CD2 3.27Å; R443-Y496 PolarHBondContact O-N 3.48Å
444	S	95.1	Very high	90	Very high	3 Å²	3	20.8 Å²	20.8	2%	0.021	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	155.8	173.6	176.7	0	0	0	0	112.8	L446 E447 M448 E502	S444-L446 PolarHBondContact O-N 2.8Å; S444-L446 PolarHBondContact OG-N 2.8Å; S444-E447 PolarHBondContact O-N 2.85Å; S444-M448 PolarHBondContact O-N 2.86Å; S444-E502 WeakPolarHBondContact CB-OE1 3.2Å; S444-E502 PolarHBondContact OG-OE1 3.48Å
445	L	94.1	Very high	90.6	Very high	27 Å²	27	15.7 Å²	15.7	14%	0.141	8%	0.078	C	C	.	.	H	α-helix	trans	-55.4	-36.3	170.9	-172.5	74.7	0	0	0	111.4	E447 M448 Y449 P495 Y496 P498	L445-E447 VanDerWaalsContact C-N 3.35Å; L445-E447 PolarHBondContact O-N 2.88Å; L445-M448 HydrophobicContact CD1-CE 3.66Å; L445-M448 HydrophobicContact CD1-SD 4.15Å; L445-M448 WeakPolarHBondContact O-CB 3.33Å; L445-M448 PolarHBondContact O-N 3.46Å; L445-Y449 HydrophobicContact CD1-CD2 4.35Å; L445-Y449 HydrophobicContact CD1-CE2 3.97Å; L445-Y449 HydrophobicContact CD2-CE2 4.46Å; L445-Y449 HydrophobicContact CG-CD2 4.12Å; L445-Y449 HydrophobicContact CG-CE2 4Å; L445-Y449 WeakPolarHBondContact O-CD2 3.36Å; L445-Y449 PolarHBondContact O-N 2.83Å; L445-P495 HydrophobicContact CB-CB 4.47Å; L445-P495 HydrophobicContact CB-CG 4.23Å; L445-P495 HydrophobicContact CD1-CG 3.66Å; L445-Y496 PolarHBondContact N-O 2.86Å; L445-Y496 VanDerWaalsContact N-O 3.08Å; L445-P498 HydrophobicContact CB-CG 3.65Å; L445-P498 HydrophobicContact CD2-CG 4.42Å
446	L	96.8	Very high	91.3	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-62.2	-42.8	179.6	-56.5	-172.6	0	0	0	111.6	S444 P498 E502 F504 A553 F565	S444-L446 PolarHBondContact O-N 2.8Å; S444-L446 PolarHBondContact OG-N 2.8Å; L446-P498 HydrophobicContact CD1-CB 4.34Å; L446-P498 HydrophobicContact CD2-CB 4.37Å; L446-P498 HydrophobicContact CD2-CG 3.98Å; L446-P498 HydrophobicContact CG-CB 4.05Å; L446-P498 HydrophobicContact CG-CG 3.83Å; L446-E502 HydrophobicContact CD1-CB 4.12Å; L446-E502 HydrophobicContact CD1-CG 3.94Å; L446-E502 VanDerWaalsContact CD1-O 3.31Å; L446-E502 WeakPolarHBondContact CD1-O 3.25Å; L446-F504 HydrophobicContact CB-CB 3.74Å; L446-F504 HydrophobicContact CD1-CB 4.48Å; L446-A553 HydrophobicContact CB-CB 4.05Å; L446-A553 HydrophobicContact CD2-CB 4.21Å; L446-A553 HydrophobicContact CG-CB 4.48Å; L446-F565 HydrophobicContact CD2-CE1 4.21Å; L446-F565 HydrophobicContact CD2-CZ 4.46Å
447	E	95.3	Very high	91.8	Very high	5 Å²	5	13.7 Å²	13.7	2%	0.023	7%	0.067	C	C	.	.	H	α-helix	trans	-71	-37.1	173.8	178.6	166.2	172.8	0	0	112	R443 S444 L445 Y449 A450 N451 F504 K708 R722	R443-E447 HydrophobicContact CB-CB 4.43Å; R443-E447 HydrophobicContact CB-CG 4.46Å; S444-E447 PolarHBondContact O-N 2.85Å; L445-E447 VanDerWaalsContact C-N 3.35Å; L445-E447 PolarHBondContact O-N 2.88Å; E447-Y449 VanDerWaalsContact C-N 3.26Å; E447-Y449 PolarHBondContact O-N 2.86Å; E447-A450 WeakPolarHBondContact O-CB 3.09Å; E447-A450 PolarHBondContact O-N 3.22Å; E447-N451 PolarHBondContact O-ND2 3.29Å; E447-F504 HydrophobicContact CB-CD1 4.48Å; E447-F504 HydrophobicContact CB-CD2 3.89Å; E447-F504 HydrophobicContact CB-CE1 4.25Å; E447-F504 HydrophobicContact CB-CE2 3.64Å; E447-F504 HydrophobicContact CB-CG 4.31Å; E447-F504 HydrophobicContact CB-CZ 3.84Å; E447-F504 HydrophobicContact CG-CD2 4.49Å; E447-F504 HydrophobicContact CG-CE1 4.2Å; E447-F504 HydrophobicContact CG-CE2 3.75Å; E447-F504 HydrophobicContact CG-CZ 3.58Å; E447-F504 WeakPolarHBondContact OE2-CE2 3.07Å; E447-K708 WeakPolarHBondContact OE1-CE 3.35Å; E447-K708 IonicContact OE1-NZ 2.84Å; E447-K708 PolarHBondContact OE1-NZ 2.75Å; E447-R722 IonicContact OE1-CZ 3.62Å; E447-R722 IonicContact OE1-NE 3.69Å; E447-R722 IonicContact OE1-NH2 3.57Å; E447-R722 PolarHBondContact OE1-NH2 3.29Å; E447-R722 WeakPolarHBondContact OE2-CG 3.16Å; E447-R722 IonicContact OE2-CZ 3.22Å; E447-R722 IonicContact OE2-NE 3.68Å; E447-R722 PolarHBondContact OE2-NE 2.85Å; E447-R722 IonicContact OE2-NH2 2.67Å
448	M	93.1	Very high	92.2	Very high	2 Å²	2	14.6 Å²	14.6	1%	0.01	7%	0.071	C	C	.	.	H	α-helix	trans	-54.6	-43.8	178.1	-173.9	-151.7	69.1	0	0	111.2	S444 L445 N451 P495	S444-M448 PolarHBondContact O-N 2.86Å; L445-M448 HydrophobicContact CD1-CE 3.66Å; L445-M448 HydrophobicContact CD1-SD 4.15Å; L445-M448 WeakPolarHBondContact O-CB 3.33Å; L445-M448 PolarHBondContact O-N 3.46Å; M448-N451 PolarHBondContact O-N 2.9Å; M448-N451 PolarHBondContact O-ND2 3.11Å; M448-P495 HydrophobicContact CB-CB 4.39Å; M448-P495 HydrophobicContact SD-CG 3.87Å
449	Y	93.9	Very high	92.9	Very high	15 Å²	15	13.7 Å²	13.7	6%	0.059	7%	0.067	C	C	.	.	H	α-helix	trans	-66.7	-31.4	177.1	-88.2	-84.2	0	0	0	113.9	L445 E447 N451 F452 F565 V580 M595 L614	L445-Y449 HydrophobicContact CD1-CD2 4.35Å; L445-Y449 HydrophobicContact CD1-CE2 3.97Å; L445-Y449 HydrophobicContact CD2-CE2 4.46Å; L445-Y449 HydrophobicContact CG-CD2 4.12Å; L445-Y449 HydrophobicContact CG-CE2 4Å; L445-Y449 WeakPolarHBondContact O-CD2 3.36Å; L445-Y449 PolarHBondContact O-N 2.83Å; E447-Y449 VanDerWaalsContact C-N 3.26Å; E447-Y449 PolarHBondContact O-N 2.86Å; Y449-N451 PolarHBondContact O-N 3.35Å; Y449-F452 AromaticContact CD1-CD2 3.71Å; Y449-F452 HydrophobicContact CD1-CD2 3.71Å; Y449-F452 AromaticContact CD1-CE2 3.49Å; Y449-F452 HydrophobicContact CD1-CE2 3.49Å; Y449-F452 VanDerWaalsContact CD1-CE2 3.49Å; Y449-F452 HydrophobicContact CD1-CZ 4.48Å; Y449-F452 HydrophobicContact CE1-CD2 4.15Å; Y449-F452 AromaticContact CE1-CE2 3.53Å; Y449-F452 HydrophobicContact CE1-CE2 3.53Å; Y449-F452 HydrophobicContact CE1-CZ 4.45Å; Y449-F452 HydrophobicContact CG-CE2 4.38Å; Y449-F452 WeakPolarHBondContact O-CB 3.26Å; Y449-F452 PolarHBondContact O-N 3.44Å; Y449-F452 VanDerWaalsContact O-N 3.11Å; Y449-F565 HydrophobicContact CD1-CE2 4.45Å; Y449-F565 HydrophobicContact CD1-CZ 4.26Å; Y449-F565 AromaticContact CD2-CE1 3.86Å; Y449-F565 HydrophobicContact CD2-CE1 3.86Å; Y449-F565 HydrophobicContact CD2-CE2 4.18Å; Y449-F565 AromaticContact CD2-CZ 3.4Å; Y449-F565 HydrophobicContact CD2-CZ 3.4Å; Y449-F565 HydrophobicContact CE2-CE2 4.39Å; Y449-F565 AromaticContact CE2-CZ 3.93Å; Y449-F565 HydrophobicContact CE2-CZ 3.93Å; Y449-F565 HydrophobicContact CG-CD1 4.46Å; Y449-F565 AromaticContact CG-CE1 3.74Å; Y449-F565 HydrophobicContact CG-CE1 3.74Å; Y449-F565 HydrophobicContact CG-CE2 4.23Å; Y449-F565 AromaticContact CG-CZ 3.6Å; Y449-F565 HydrophobicContact CG-CZ 3.6Å; Y449-V580 HydrophobicContact CE1-CG2 4.25Å; Y449-V580 WeakPolarHBondContact OH-CG1 3.32Å; Y449-M595 WeakPolarHBondContact OH-CE 3.3Å; Y449-L614 HydrophobicContact CE1-CD1 3.75Å
450	A	94.7	Very high	93.4	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-61.3	-28.7	175.5	0	0	0	0	0	112.3	E447 F452 M453 F504 W508 F551 K708	E447-A450 WeakPolarHBondContact O-CB 3.09Å; E447-A450 PolarHBondContact O-N 3.22Å; A450-F452 PolarHBondContact O-N 3.11Å; A450-M453 WeakPolarHBondContact O-CB 3.46Å; A450-M453 PolarHBondContact O-N 3.1Å; A450-F504 HydrophobicContact CB-CD1 4.15Å; A450-F504 HydrophobicContact CB-CE1 3.64Å; A450-W508 HydrophobicContact CB-CH2 4.34Å; A450-W508 WeakPolarHBondContact O-CZ2 3.39Å; A450-F551 HydrophobicContact CB-CD1 4.01Å; A450-F551 HydrophobicContact CB-CE1 3.7Å; A450-F551 HydrophobicContact CB-CZ 3.97Å; A450-K708 HydrophobicContact CB-CD 4.48Å
451	N	91	Very high	93.7	Very high	23 Å²	23	12 Å²	12	12%	0.123	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-7.6	178.9	-50.3	-59.3	0	0	0	113.6	R443 E447 M448 Y449 M453 A454 K708	R443-N451 PolarHBondContact NH1-ND2 2.9Å; E447-N451 PolarHBondContact O-ND2 3.29Å; M448-N451 PolarHBondContact O-N 2.9Å; M448-N451 PolarHBondContact O-ND2 3.11Å; Y449-N451 PolarHBondContact O-N 3.35Å; N451-M453 PolarHBondContact O-N 3.31Å; N451-A454 PolarHBondContact O-N 2.85Å; N451-K708 PolarHBondContact OD1-NZ 3.05Å
452	F	91.5	Very high	94.2	Very high	31 Å²	31	11.3 Å²	11.3	14%	0.136	6%	0.056	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-14.1	165.6	-64	-14.5	0	0	0	112.2	Y449 A450 A454 Y478 A482 F483	Y449-F452 AromaticContact CD1-CD2 3.71Å; Y449-F452 HydrophobicContact CD1-CD2 3.71Å; Y449-F452 AromaticContact CD1-CE2 3.49Å; Y449-F452 HydrophobicContact CD1-CE2 3.49Å; Y449-F452 VanDerWaalsContact CD1-CE2 3.49Å; Y449-F452 HydrophobicContact CD1-CZ 4.48Å; Y449-F452 HydrophobicContact CE1-CD2 4.15Å; Y449-F452 AromaticContact CE1-CE2 3.53Å; Y449-F452 HydrophobicContact CE1-CE2 3.53Å; Y449-F452 HydrophobicContact CE1-CZ 4.45Å; Y449-F452 HydrophobicContact CG-CE2 4.38Å; Y449-F452 WeakPolarHBondContact O-CB 3.26Å; Y449-F452 PolarHBondContact O-N 3.44Å; Y449-F452 VanDerWaalsContact O-N 3.11Å; A450-F452 PolarHBondContact O-N 3.11Å; F452-A454 PolarHBondContact O-N 3.23Å; F452-Y478 PolarHBondContact O-OH 2.93Å; F452-A482 WeakPolarHBondContact CA-O 3.2Å; F452-A482 HydrophobicContact CB-CB 4.19Å; F452-A482 WeakPolarHBondContact CD1-O 3.27Å; F452-A482 WeakPolarHBondContact O-CB 3.36Å; F452-F483 HydrophobicContact CE1-CD1 4.14Å; F452-F483 HydrophobicContact CE2-CE1 4.3Å; F452-F483 HydrophobicContact CZ-CD1 4.15Å; F452-F483 HydrophobicContact CZ-CE1 4.17Å
453	M	93.4	Very high	94.4	Very high	12 Å²	12	9.6 Å²	9.6	6%	0.059	5%	0.048	C	C	.	.			trans	-91.4	43.7	169.3	-163.7	56.3	65.1	0	0	111.2	A450 N451 H455 P456 F459 Y478 W508	A450-M453 WeakPolarHBondContact O-CB 3.46Å; A450-M453 PolarHBondContact O-N 3.1Å; N451-M453 PolarHBondContact O-N 3.31Å; M453-H455 VanDerWaalsContact C-N 3.34Å; M453-P456 HydrophobicContact CG-CB 3.96Å; M453-P456 HydrophobicContact SD-CB 3.79Å; M453-F459 HydrophobicContact CE-CB 4.3Å; M453-F459 HydrophobicContact CE-CD1 3.88Å; M453-F459 HydrophobicContact CE-CD2 3.94Å; M453-F459 HydrophobicContact CE-CE1 4.12Å; M453-F459 HydrophobicContact CE-CE2 4.18Å; M453-F459 HydrophobicContact CE-CG 3.77Å; M453-F459 HydrophobicContact CE-CZ 4.26Å; M453-F459 HydrophobicContact SD-CB 3.8Å; M453-F459 HydrophobicContact SD-CD1 3.9Å; M453-F459 HydrophobicContact SD-CG 3.84Å; M453-Y478 VanDerWaalsContact CE-OH 3.26Å; M453-Y478 WeakPolarHBondContact CE-OH 3.01Å; M453-Y478 HydrophobicContact SD-CE2 4.34Å; M453-W508 HydrophobicContact CB-CH2 3.66Å; M453-W508 HydrophobicContact CB-CZ2 3.54Å; M453-W508 HydrophobicContact CB-CZ3 4.25Å; M453-W508 HydrophobicContact CG-CD2 4.03Å; M453-W508 HydrophobicContact CG-CE3 4.02Å; M453-W508 HydrophobicContact CG-CH2 3.86Å; M453-W508 HydrophobicContact CG-CZ2 3.86Å; M453-W508 HydrophobicContact CG-CZ3 3.94Å; M453-W508 PolarHBondContact O-NE1 2.82Å
454	A	90.5	Very high	94.4	Very high	4 Å²	4	9 Å²	9	3%	0.033	5%	0.047	C	C	.	.	S	Bend	trans	-64.7	-36.8	175.6	0	0	0	0	0	113.6	N451 F452 P456 E485 V705 I706	N451-A454 PolarHBondContact O-N 2.85Å; F452-A454 PolarHBondContact O-N 3.23Å; A454-P456 VanDerWaalsContact O-CD 3.31Å; A454-P456 WeakPolarHBondContact O-CD 3.26Å; A454-E485 HydrophobicContact CB-CB 3.78Å; A454-E485 HydrophobicContact CB-CG 3.44Å; A454-E485 VanDerWaalsContact CB-CG 3.44Å; A454-V705 HydrophobicContact CB-CG1 4.49Å; A454-I706 PolarHBondContact O-N 3.37Å; A454-I706 VanDerWaalsContact O-N 3.1Å
455	H	94.4	Very high	94.3	Very high	1 Å²	1	9 Å²	9	1%	0.005	5%	0.046	C	C	.	.			trans	-121.8	67.1	-176.7	-52.9	-57.5	0	0	0	109.7	M453 D457 M458 F459 H484 L703 P704	M453-H455 VanDerWaalsContact C-N 3.34Å; H455-D457 WeakPolarHBondContact CA-OD1 3.4Å; H455-D457 PolarHBondContact O-N 2.87Å; H455-M458 HydrophobicContact CB-CB 4.1Å; H455-M458 HydrophobicContact CB-CG 3.96Å; H455-M458 HydrophobicContact CB-SD 3.99Å; H455-M458 WeakPolarHBondContact O-CB 3.32Å; H455-M458 PolarHBondContact O-N 3.26Å; H455-M458 VanDerWaalsContact O-N 3.07Å; H455-F459 PolarHBondContact O-N 3.18Å; H455-H484 AromaticContact CD2-NE2 3.95Å; H455-H484 AromaticContact CE1-NE2 3.85Å; H455-H484 AromaticContact NE2-CD2 3.97Å; H455-H484 AromaticContact NE2-CE1 3.78Å; H455-H484 AromaticContact NE2-NE2 2.93Å; H455-H484 PolarHBondContact NE2-NE2 2.86Å; H455-L703 WeakPolarHBondContact CE1-CB 3.36Å; H455-P704 PolarHBondContact CE1-O 2.72Å; H455-P704 PolarHBondContact ND1-O 2.9Å
456	P	95.9	Very high	94.2	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-65.4	-20.8	180	30.1	-35.7	0	0	0	112	M453 A454 F459 L460 W508 V510 V549 I706	M453-P456 HydrophobicContact CG-CB 3.96Å; M453-P456 HydrophobicContact SD-CB 3.79Å; A454-P456 VanDerWaalsContact O-CD 3.31Å; A454-P456 WeakPolarHBondContact O-CD 3.26Å; P456-F459 PolarHBondContact O-N 3.17Å; P456-L460 WeakPolarHBondContact O-CB 3.23Å; P456-L460 VanDerWaalsContact O-CG 3.23Å; P456-L460 WeakPolarHBondContact O-CG 3.42Å; P456-L460 PolarHBondContact O-N 2.72Å; P456-W508 HydrophobicContact CB-CB 4.45Å; P456-W508 HydrophobicContact CB-CG 4.43Å; P456-W508 HydrophobicContact CG-CB 4.13Å; P456-W508 HydrophobicContact CG-CG 4.06Å; P456-V510 HydrophobicContact CB-CG2 3.71Å; P456-V510 HydrophobicContact CG-CG2 3.67Å; P456-V549 HydrophobicContact CB-CG2 4.2Å; P456-I706 HydrophobicContact CG-CB 3.82Å; P456-I706 HydrophobicContact CG-CD1 3.94Å; P456-I706 HydrophobicContact CG-CG1 4.37Å; P456-I706 HydrophobicContact CG-CG2 4.15Å
457	D	94.8	Very high	94.2	Very high	23 Å²	23	14.2 Å²	14.2	12%	0.123	9%	0.086	C	C	.	.	H	α-helix	trans	-62.1	-42	168.4	58.6	-56	0	0	0	113	H455 S461 V510 K514 I706	H455-D457 WeakPolarHBondContact CA-OD1 3.4Å; H455-D457 PolarHBondContact O-N 2.87Å; D457-S461 WeakPolarHBondContact O-CB 3.49Å; D457-S461 PolarHBondContact O-N 3.09Å; D457-S461 VanDerWaalsContact O-N 3.09Å; D457-S461 PolarHBondContact O-OG 3.47Å; D457-V510 HydrophobicContact CB-CG1 3.87Å; D457-K514 HydrophobicContact CB-CB 4.35Å; D457-I706 HydrophobicContact CB-CD1 4.07Å
458	M	95.4	Very high	94.3	Very high	27 Å²	27	14.9 Å²	14.9	13%	0.133	9%	0.092	C	C	.	.	H	α-helix	trans	-68.6	-42.1	173	-67.1	-174.4	68.2	0	0	111.1	H455 S461 I462 E477 Y478 T481 I698 L703	H455-M458 HydrophobicContact CB-CB 4.1Å; H455-M458 HydrophobicContact CB-CG 3.96Å; H455-M458 HydrophobicContact CB-SD 3.99Å; H455-M458 WeakPolarHBondContact O-CB 3.32Å; H455-M458 PolarHBondContact O-N 3.26Å; H455-M458 VanDerWaalsContact O-N 3.07Å; M458-S461 WeakPolarHBondContact O-CB 3.44Å; M458-S461 PolarHBondContact O-N 2.9Å; M458-I462 PolarHBondContact O-N 3.41Å; M458-E477 HydrophobicContact CE-CB 3.86Å; M458-Y478 HydrophobicContact CB-CD2 4.11Å; M458-T481 HydrophobicContact CE-CG2 3.98Å; M458-T481 HydrophobicContact SD-CG2 4.1Å; M458-T481 PolarHBondContact SD-OG1 3.48Å; M458-I698 HydrophobicContact CE-CD1 4.32Å; M458-L703 HydrophobicContact SD-CD1 4.24Å
459	F	96.7	Very high	94.4	Very high	1 Å²	1	17.3 Å²	17.3	0%	0.004	10%	0.103	C	C	.	.	H	α-helix	trans	-57.8	-52.4	175.2	173.6	-108.8	0	0	0	112.1	M453 H455 P456 S461 I462 Y478 M574 V576 L601	M453-F459 HydrophobicContact CE-CB 4.3Å; M453-F459 HydrophobicContact CE-CD1 3.88Å; M453-F459 HydrophobicContact CE-CD2 3.94Å; M453-F459 HydrophobicContact CE-CE1 4.12Å; M453-F459 HydrophobicContact CE-CE2 4.18Å; M453-F459 HydrophobicContact CE-CG 3.77Å; M453-F459 HydrophobicContact CE-CZ 4.26Å; M453-F459 HydrophobicContact SD-CB 3.8Å; M453-F459 HydrophobicContact SD-CD1 3.9Å; M453-F459 HydrophobicContact SD-CG 3.84Å; H455-F459 PolarHBondContact O-N 3.18Å; P456-F459 PolarHBondContact O-N 3.17Å; F459-S461 PolarHBondContact O-N 3.21Å; F459-I462 HydrophobicContact CD2-CD1 4.06Å; F459-I462 VanDerWaalsContact O-CB 3.29Å; F459-I462 WeakPolarHBondContact O-CB 3.29Å; F459-I462 WeakPolarHBondContact O-CD1 3.37Å; F459-I462 WeakPolarHBondContact O-CG1 3.19Å; F459-I462 PolarHBondContact O-N 2.99Å; F459-I462 VanDerWaalsContact O-N 3.07Å; F459-Y478 HydrophobicContact CB-CD1 4.31Å; F459-Y478 HydrophobicContact CB-CD2 3.94Å; F459-Y478 HydrophobicContact CB-CE1 4.23Å; F459-Y478 HydrophobicContact CB-CE2 3.87Å; F459-Y478 HydrophobicContact CB-CG 4.19Å; F459-Y478 HydrophobicContact CD2-CD1 4.03Å; F459-Y478 AromaticContact CD2-CE1 3.69Å; F459-Y478 HydrophobicContact CD2-CE1 3.69Å; F459-Y478 HydrophobicContact CG-CE1 4.38Å; F459-M574 HydrophobicContact CD1-CE 4.17Å; F459-M574 HydrophobicContact CD2-CE 4.11Å; F459-M574 HydrophobicContact CE1-CE 3.8Å; F459-M574 HydrophobicContact CE1-SD 4.38Å; F459-M574 HydrophobicContact CE2-CE 3.74Å; F459-M574 HydrophobicContact CG-CE 4.32Å; F459-M574 HydrophobicContact CZ-CE 3.58Å; F459-M574 WeakPolarHBondContact O-CE 3.41Å; F459-V576 HydrophobicContact CE2-CG2 3.61Å; F459-V576 HydrophobicContact CZ-CG2 3.82Å; F459-L601 HydrophobicContact CE2-CD1 3.96Å; F459-L601 HydrophobicContact CZ-CD1 4.33Å
460	L	96.4	Very high	94.5	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-65.2	-24.6	177.9	-66.6	179	0	0	0	113.1	P456 I462 V510 V515 Y547 V549 C569 R572 M574	P456-L460 WeakPolarHBondContact O-CB 3.23Å; P456-L460 VanDerWaalsContact O-CG 3.23Å; P456-L460 WeakPolarHBondContact O-CG 3.42Å; P456-L460 PolarHBondContact O-N 2.72Å; L460-I462 PolarHBondContact O-N 3.37Å; L460-V510 HydrophobicContact CD1-CB 3.9Å; L460-V510 HydrophobicContact CD1-CG1 4.14Å; L460-V510 HydrophobicContact CD1-CG2 3.85Å; L460-V515 HydrophobicContact CB-CG1 3.61Å; L460-V515 HydrophobicContact CB-CG2 4.2Å; L460-V515 HydrophobicContact CD1-CG2 4.11Å; L460-Y547 HydrophobicContact CD1-CD2 4.11Å; L460-Y547 HydrophobicContact CD1-CG 4Å; L460-V549 HydrophobicContact CD1-CG2 3.9Å; L460-V549 HydrophobicContact CD2-CG2 4Å; L460-V549 HydrophobicContact CG-CG2 4.06Å; L460-C569 HydrophobicContact CD2-CB 3.43Å; L460-C569 VanDerWaalsContact CD2-CB 3.43Å; L460-R572 HydrophobicContact CD2-CB 4.15Å; L460-R572 HydrophobicContact CD2-CG 4.1Å; L460-M574 HydrophobicContact CD2-CG 4.5Å; L460-M574 HydrophobicContact CD2-SD 3.91Å
461	S	95.4	Very high	94.7	Very high	13 Å²	13	19.7 Å²	19.7	9%	0.091	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-11.7	175.2	-64.6	0	0	0	0	113.4	D457 M458 F459 A464 R474 K516	D457-S461 WeakPolarHBondContact O-CB 3.49Å; D457-S461 PolarHBondContact O-N 3.09Å; D457-S461 VanDerWaalsContact O-N 3.09Å; D457-S461 PolarHBondContact O-OG 3.47Å; M458-S461 WeakPolarHBondContact O-CB 3.44Å; M458-S461 PolarHBondContact O-N 2.9Å; F459-S461 PolarHBondContact O-N 3.21Å; S461-A464 WeakPolarHBondContact O-CB 3.33Å; S461-A464 PolarHBondContact O-N 3.24Å; S461-R474 WeakPolarHBondContact O-CD 3.38Å; S461-R474 PolarHBondContact O-NH1 3.48Å; S461-K516 PolarHBondContact OG-N 2.83Å
462	I	97.1	Very high	95	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-53.8	177.3	-60.7	167.9	0	0	0	110.7	M458 F459 L460 A464 G465 R471 R474 F475 Y478 M574 L601 L603	M458-I462 PolarHBondContact O-N 3.41Å; F459-I462 HydrophobicContact CD2-CD1 4.06Å; F459-I462 VanDerWaalsContact O-CB 3.29Å; F459-I462 WeakPolarHBondContact O-CB 3.29Å; F459-I462 WeakPolarHBondContact O-CD1 3.37Å; F459-I462 WeakPolarHBondContact O-CG1 3.19Å; F459-I462 PolarHBondContact O-N 2.99Å; F459-I462 VanDerWaalsContact O-N 3.07Å; L460-I462 PolarHBondContact O-N 3.37Å; I462-A464 PolarHBondContact O-N 2.88Å; I462-A464 VanDerWaalsContact O-N 3.1Å; I462-G465 PolarHBondContact O-N 3.21Å; I462-R471 WeakPolarHBondContact O-CG 3.46Å; I462-R474 HydrophobicContact CG1-CB 4.34Å; I462-F475 HydrophobicContact CD1-CB 4.04Å; I462-F475 HydrophobicContact CD1-CD2 3.67Å; I462-F475 HydrophobicContact CD1-CG 4.14Å; I462-F475 HydrophobicContact CG1-CB 4.34Å; I462-F475 HydrophobicContact CG2-CB 4.1Å; I462-Y478 HydrophobicContact CD1-CD1 3.97Å; I462-Y478 HydrophobicContact CD1-CG 4.33Å; I462-M574 HydrophobicContact CB-CE 4.49Å; I462-L601 HydrophobicContact CD1-CD2 4Å; I462-L601 HydrophobicContact CG2-CD2 4.29Å; I462-L603 HydrophobicContact CG2-CD1 3.88Å; I462-L603 HydrophobicContact CG2-CD2 4.2Å
463	T	95.2	Very high	95.3	Very high	1 Å²	1	17.7 Å²	17.7	1%	0.006	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-18.6	179.9	-161.6	0	0	0	0	113.1	G465 L518 R572 M574 E605 H606	T463-G465 PolarHBondContact O-N 2.71Å; T463-L518 HydrophobicContact CG2-CD2 4.18Å; T463-R572 HydrophobicContact CG2-CB 4.12Å; T463-M574 HydrophobicContact CG2-SD 4.06Å; T463-E605 PolarHBondContact OG1-OE2 3.13Å; T463-H606 PolarHBondContact O-NE2 3.45Å; T463-H606 PolarHBondContact OG1-CD2 2.78Å; T463-H606 PolarHBondContact OG1-NE2 2.95Å
464	A	91.7	Very high	95.5	Very high	2 Å²	2	18.2 Å²	18.2	2%	0.017	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	7	174.1	0	0	0	0	0	114.7	S461 I462 R474 K516 L518	S461-A464 WeakPolarHBondContact O-CB 3.33Å; S461-A464 PolarHBondContact O-N 3.24Å; I462-A464 PolarHBondContact O-N 2.88Å; I462-A464 VanDerWaalsContact O-N 3.1Å; A464-R474 PolarHBondContact O-NH1 3.02Å; A464-R474 PolarHBondContact O-NH2 3.39Å; A464-K516 HydrophobicContact CB-CB 4.43Å; A464-K516 WeakPolarHBondContact CB-O 3.26Å; A464-L518 HydrophobicContact CB-CD2 4.13Å
465	G	93.6	Very high	95.9	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.01	11%	0.107	C	C	.	.			trans	-74.5	125.6	174.1	0	0	0	0	0	112	I462 T463 T467 D470 R471	I462-G465 PolarHBondContact O-N 3.21Å; T463-G465 PolarHBondContact O-N 2.71Å; G465-T467 VanDerWaalsContact C-N 3.32Å; G465-T467 PolarHBondContact O-N 2.74Å; G465-D470 WeakPolarHBondContact CA-OD2 3.21Å; G465-R471 WeakPolarHBondContact O-CD 3.4Å; G465-R471 VanDerWaalsContact O-CG 3.31Å; G465-R471 WeakPolarHBondContact O-CG 3.37Å; G465-R471 PolarHBondContact O-NH1 2.77Å
466	A	91.7	Very high	96	Very high	58 Å²	58	18.1 Å²	18.1	48%	0.479	11%	0.107	S	C	.	.	S	Bend	trans	-69.8	-30.5	-172.9	0	0	0	0	0	112.8	D470 V519	A466-D470 PolarHBondContact N-OD2 2.88Å; A466-V519 HydrophobicContact CB-CB 4.04Å; A466-V519 HydrophobicContact CB-CG1 4.13Å; A466-V519 HydrophobicContact CB-CG2 4.4Å
467	T	95.9	Very high	96.1	Very high	79 Å²	79	18.9 Å²	18.9	49%	0.485	11%	0.111	S	C	.	.	S	Bend	trans	-122.6	160.8	177.4	65.7	0	0	0	0	110.1	G465 E469 D470 R471	G465-T467 VanDerWaalsContact C-N 3.32Å; G465-T467 PolarHBondContact O-N 2.74Å; T467-E469 PolarHBondContact O-N 2.76Å; T467-D470 PolarHBondContact O-N 2.78Å; T467-D470 VanDerWaalsContact O-N 3.16Å; T467-D470 PolarHBondContact OG1-N 2.85Å; T467-R471 WeakPolarHBondContact O-CG 3.46Å; T467-R471 PolarHBondContact O-N 2.9Å
468	A	97.3	Very high	96.2	Very high	20 Å²	20	18.8 Å²	18.8	17%	0.165	11%	0.109	C	C	.	.	H	α-helix	trans	-61.7	-29.1	175.3	0	0	0	0	0	112.9	I472 E608 Y643	A468-I472 WeakPolarHBondContact O-CG2 3.48Å; A468-I472 PolarHBondContact O-N 3.5Å; A468-E608 WeakPolarHBondContact CB-OE1 3.4Å; A468-Y643 HydrophobicContact CB-CD2 4.14Å; A468-Y643 HydrophobicContact CB-CE2 4.1Å
469	E	97	Very high	96.3	Very high	52 Å²	52	17.9 Å²	17.9	24%	0.243	10%	0.104	C	C	.	.	H	α-helix	trans	-60.7	-53.8	170.5	-175.5	169.2	144.6	0	0	111.1	T467 R471 I472 V473 Y643 V675 S691	T467-E469 PolarHBondContact O-N 2.76Å; E469-R471 VanDerWaalsContact C-N 3.32Å; E469-R471 PolarHBondContact O-N 2.98Å; E469-I472 VanDerWaalsContact O-CG2 3.26Å; E469-I472 WeakPolarHBondContact O-CG2 3.1Å; E469-I472 PolarHBondContact O-N 3.22Å; E469-V473 WeakPolarHBondContact O-CB 3.33Å; E469-V473 VanDerWaalsContact O-CG2 3.25Å; E469-V473 WeakPolarHBondContact O-CG2 3.46Å; E469-V473 PolarHBondContact O-N 2.86Å; E469-Y643 HydrophobicContact CB-CE1 3.96Å; E469-Y643 HydrophobicContact CG-CE1 4.12Å; E469-Y643 PolarHBondContact OE2-OH 2.87Å; E469-V675 HydrophobicContact CG-CB 3.9Å; E469-V675 HydrophobicContact CG-CG1 4.21Å; E469-V675 HydrophobicContact CG-CG2 3.98Å; E469-V675 WeakPolarHBondContact OE2-CG1 3.49Å; E469-S691 PolarHBondContact OE1-OG 3.5Å
470	D	95.9	Very high	96.2	Very high	46 Å²	46	17.9 Å²	17.9	25%	0.246	10%	0.104	C	C	.	.	H	α-helix	trans	-59.7	-41.7	178.2	-175.4	17.1	0	0	0	111.1	G465 A466 T467 V473 R474	G465-D470 WeakPolarHBondContact CA-OD2 3.21Å; A466-D470 PolarHBondContact N-OD2 2.88Å; T467-D470 PolarHBondContact O-N 2.78Å; T467-D470 VanDerWaalsContact O-N 3.16Å; T467-D470 PolarHBondContact OG1-N 2.85Å; D470-V473 PolarHBondContact O-N 2.91Å; D470-R474 WeakPolarHBondContact O-CB 3.42Å; D470-R474 VanDerWaalsContact O-CG 3.26Å; D470-R474 WeakPolarHBondContact O-CG 3.39Å; D470-R474 PolarHBondContact O-N 2.81Å; D470-R474 IonicContact OD1-CZ 2.67Å; D470-R474 IonicContact OD1-NE 3.38Å; D470-R474 PolarHBondContact OD1-NE 2.89Å; D470-R474 IonicContact OD1-NH2 3.71Å; D470-R474 PolarHBondContact OD1-NH2 3.49Å; D470-R474 IonicContact OD2-CZ 3.73Å; D470-R474 IonicContact OD2-NE 3.98Å; D470-R474 IonicContact OD2-NH2 2.73Å; D470-R474 PolarHBondContact OD2-NH2 2.96Å
471	R	97.9	Very high	96.1	Very high	20 Å²	20	17.9 Å²	17.9	8%	0.075	10%	0.104	C	C	.	.	H	α-helix	trans	-63.7	-46.8	177.1	-66.6	-169.2	-65.2	-91.5	9	113.2	I462 G465 T467 E469 R474 F475 L603 H606 E608 Y610	I462-R471 WeakPolarHBondContact O-CG 3.46Å; G465-R471 WeakPolarHBondContact O-CD 3.4Å; G465-R471 VanDerWaalsContact O-CG 3.31Å; G465-R471 WeakPolarHBondContact O-CG 3.37Å; G465-R471 PolarHBondContact O-NH1 2.77Å; T467-R471 WeakPolarHBondContact O-CG 3.46Å; T467-R471 PolarHBondContact O-N 2.9Å; E469-R471 VanDerWaalsContact C-N 3.32Å; E469-R471 PolarHBondContact O-N 2.98Å; R471-R474 PolarHBondContact O-N 2.81Å; R471-F475 PolarHBondContact O-N 3.43Å; R471-L603 HydrophobicContact CB-CD1 4.45Å; R471-H606 VanDerWaalsContact CZ-ND1 3.26Å; R471-H606 PolarHBondContact NH1-CE1 2.97Å; R471-H606 PolarHBondContact NH1-ND1 3.16Å; R471-H606 VanDerWaalsContact NH1-ND1 3.15Å; R471-E608 IonicContact CZ-OE1 2.62Å; R471-E608 IonicContact CZ-OE2 3.17Å; R471-E608 IonicContact NE-OE1 2.77Å; R471-E608 IonicContact NE-OE2 2.68Å; R471-E608 PolarHBondContact NE-OE2 3.15Å; R471-E608 IonicContact NH2-OE1 2.68Å; R471-E608 PolarHBondContact NH2-OE1 2.68Å; R471-E608 IonicContact NH2-OE2 2.71Å; R471-E608 PolarHBondContact NH2-OE2 2.81Å; R471-Y610 WeakPolarHBondContact CB-OH 3.43Å
472	I	98.3	Very high	96	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-67.5	-37.3	177.2	-166.4	168.6	0	0	0	111.8	A468 E469 F475 V476 Y610 Y643 A645 V666	A468-I472 WeakPolarHBondContact O-CG2 3.48Å; A468-I472 PolarHBondContact O-N 3.5Å; E469-I472 VanDerWaalsContact O-CG2 3.26Å; E469-I472 WeakPolarHBondContact O-CG2 3.1Å; E469-I472 PolarHBondContact O-N 3.22Å; I472-F475 PolarHBondContact O-N 2.79Å; I472-V476 WeakPolarHBondContact O-CG2 3.48Å; I472-V476 PolarHBondContact O-N 2.94Å; I472-Y610 HydrophobicContact CB-CE1 3.79Å; I472-Y610 HydrophobicContact CD1-CE1 4.21Å; I472-Y610 HydrophobicContact CG1-CD1 4.36Å; I472-Y610 HydrophobicContact CG1-CE1 3.89Å; I472-Y643 HydrophobicContact CG2-CD1 3.87Å; I472-Y643 HydrophobicContact CG2-CG 3.98Å; I472-A645 HydrophobicContact CD1-CB 4.49Å; I472-V666 HydrophobicContact CD1-CG1 4.21Å; I472-V666 HydrophobicContact CG1-CG1 4.19Å; I472-V666 HydrophobicContact CG2-CG1 3.61Å
473	V	97.3	Very high	95.7	Very high	11 Å²	11	17.8 Å²	17.8	7%	0.067	10%	0.103	C	C	.	.	H	α-helix	trans	-62.5	-47.4	177.3	168.1	0	0	0	0	110.2	E469 D470 F475 V476 E477 V666 C676 Y690	E469-V473 WeakPolarHBondContact O-CB 3.33Å; E469-V473 VanDerWaalsContact O-CG2 3.25Å; E469-V473 WeakPolarHBondContact O-CG2 3.46Å; E469-V473 PolarHBondContact O-N 2.86Å; D470-V473 PolarHBondContact O-N 2.91Å; V473-F475 VanDerWaalsContact C-N 3.31Å; V473-F475 PolarHBondContact O-N 2.89Å; V473-V476 PolarHBondContact O-N 2.92Å; V473-V476 VanDerWaalsContact O-N 3.14Å; V473-E477 WeakPolarHBondContact O-CG 3.3Å; V473-E477 PolarHBondContact O-N 2.79Å; V473-V666 HydrophobicContact CG2-CG1 4.37Å; V473-C676 HydrophobicContact CG1-CB 4.46Å; V473-C676 HydrophobicContact CG2-CB 3.71Å; V473-Y690 HydrophobicContact CG1-CD1 4.07Å; V473-Y690 HydrophobicContact CG1-CE1 3.58Å
474	R	97.1	Very high	95.3	Very high	24 Å²	24	18.6 Å²	18.6	9%	0.091	11%	0.106	C	C	.	.	H	α-helix	trans	-61.6	-35.7	174.1	-69.9	-179.7	-162.9	-167.2	11	113	S461 I462 A464 D470 R471 E477 Y478	S461-R474 WeakPolarHBondContact O-CD 3.38Å; S461-R474 PolarHBondContact O-NH1 3.48Å; I462-R474 HydrophobicContact CG1-CB 4.34Å; A464-R474 PolarHBondContact O-NH1 3.02Å; A464-R474 PolarHBondContact O-NH2 3.39Å; D470-R474 WeakPolarHBondContact O-CB 3.42Å; D470-R474 VanDerWaalsContact O-CG 3.26Å; D470-R474 WeakPolarHBondContact O-CG 3.39Å; D470-R474 PolarHBondContact O-N 2.81Å; D470-R474 IonicContact OD1-CZ 2.67Å; D470-R474 IonicContact OD1-NE 3.38Å; D470-R474 PolarHBondContact OD1-NE 2.89Å; D470-R474 IonicContact OD1-NH2 3.71Å; D470-R474 PolarHBondContact OD1-NH2 3.49Å; D470-R474 IonicContact OD2-CZ 3.73Å; D470-R474 IonicContact OD2-NE 3.98Å; D470-R474 IonicContact OD2-NH2 2.73Å; D470-R474 PolarHBondContact OD2-NH2 2.96Å; R471-R474 PolarHBondContact O-N 2.81Å; R474-E477 PolarHBondContact O-N 2.94Å; R474-Y478 PolarHBondContact O-N 3.37Å
475	F	98.3	Very high	94.8	Very high	3 Å²	3	20 Å²	20	1%	0.013	11%	0.113	C	C	.	.	H	α-helix	trans	-65.5	-40.9	174.5	-174	-158.3	0	0	0	111.3	I462 R471 I472 V473 Y478 Y479 L601 Y610 F612 I636	I462-F475 HydrophobicContact CD1-CB 4.04Å; I462-F475 HydrophobicContact CD1-CD2 3.67Å; I462-F475 HydrophobicContact CD1-CG 4.14Å; I462-F475 HydrophobicContact CG1-CB 4.34Å; I462-F475 HydrophobicContact CG2-CB 4.1Å; R471-F475 PolarHBondContact O-N 3.43Å; I472-F475 PolarHBondContact O-N 2.79Å; V473-F475 VanDerWaalsContact C-N 3.31Å; V473-F475 PolarHBondContact O-N 2.89Å; F475-Y478 HydrophobicContact CD2-CD1 4.14Å; F475-Y478 HydrophobicContact CE2-CD1 4.25Å; F475-Y478 PolarHBondContact O-N 3.35Å; F475-Y479 WeakPolarHBondContact O-CB 3.24Å; F475-Y479 PolarHBondContact O-N 3.37Å; F475-L601 HydrophobicContact CD1-CD2 3.76Å; F475-L601 HydrophobicContact CD2-CD2 3.82Å; F475-L601 HydrophobicContact CE1-CB 4.23Å; F475-L601 HydrophobicContact CE1-CD2 3.79Å; F475-L601 HydrophobicContact CE2-CD2 3.86Å; F475-L601 HydrophobicContact CG-CD2 3.8Å; F475-L601 HydrophobicContact CZ-CB 4.19Å; F475-L601 HydrophobicContact CZ-CD2 3.85Å; F475-Y610 AromaticContact CD1-CD1 3.99Å; F475-Y610 HydrophobicContact CD1-CD1 3.99Å; F475-Y610 AromaticContact CD1-CG 3.98Å; F475-Y610 HydrophobicContact CD1-CG 3.98Å; F475-Y610 HydrophobicContact CE1-CG 4.25Å; F475-F612 HydrophobicContact CE1-CB 4.44Å; F475-F612 HydrophobicContact CE1-CD1 4.05Å; F475-F612 HydrophobicContact CE1-CG 4.43Å; F475-F612 HydrophobicContact CZ-CB 4.33Å; F475-F612 AromaticContact CZ-CD1 3.58Å; F475-F612 HydrophobicContact CZ-CD1 3.58Å; F475-F612 AromaticContact CZ-CE1 3.92Å; F475-F612 HydrophobicContact CZ-CE1 3.92Å; F475-F612 AromaticContact CZ-CG 3.92Å; F475-F612 HydrophobicContact CZ-CG 3.92Å; F475-I636 HydrophobicContact CD1-CG2 3.54Å; F475-I636 HydrophobicContact CE1-CG2 3.49Å; F475-I636 VanDerWaalsContact CE1-CG2 3.49Å
476	V	98.3	Very high	93.6	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-65.6	-37.8	174.5	174.6	0	0	0	0	111.9	I472 V473 Y479 L480 I636 A645 A664 V666 F688	I472-V476 WeakPolarHBondContact O-CG2 3.48Å; I472-V476 PolarHBondContact O-N 2.94Å; V473-V476 PolarHBondContact O-N 2.92Å; V473-V476 VanDerWaalsContact O-N 3.14Å; V476-Y479 PolarHBondContact O-N 3.28Å; V476-L480 HydrophobicContact CG1-CD1 3.95Å; V476-L480 HydrophobicContact CG1-CG 4.42Å; V476-L480 WeakPolarHBondContact O-CB 3.2Å; V476-L480 WeakPolarHBondContact O-CG 3.39Å; V476-L480 PolarHBondContact O-N 3.39Å; V476-I636 HydrophobicContact CG2-CD1 4.09Å; V476-A645 HydrophobicContact CG2-CB 3.51Å; V476-A664 HydrophobicContact CG1-CB 4.05Å; V476-V666 HydrophobicContact CB-CG2 4.32Å; V476-V666 HydrophobicContact CG1-CG2 4.29Å; V476-V666 HydrophobicContact CG2-CG2 3.9Å; V476-F688 HydrophobicContact CG1-CE1 4.44Å
477	E	96.4	Very high	92.6	Very high	16 Å²	16	19.9 Å²	19.9	8%	0.075	10%	0.099	C	C	.	.	H	α-helix	trans	-58.6	-54	172	-69.7	-171.8	164.4	0	0	111.8	M458 V473 R474 Y479 L480 T481 F688 Y690 K696	M458-E477 HydrophobicContact CE-CB 3.86Å; V473-E477 WeakPolarHBondContact O-CG 3.3Å; V473-E477 PolarHBondContact O-N 2.79Å; R474-E477 PolarHBondContact O-N 2.94Å; E477-Y479 PolarHBondContact O-N 2.96Å; E477-L480 PolarHBondContact O-N 3.45Å; E477-T481 WeakPolarHBondContact O-CG2 3.4Å; E477-T481 PolarHBondContact O-N 2.86Å; E477-T481 PolarHBondContact O-OG1 3.21Å; E477-F688 HydrophobicContact CB-CE1 4.4Å; E477-F688 HydrophobicContact CB-CZ 4.36Å; E477-F688 HydrophobicContact CG-CD1 4.14Å; E477-F688 HydrophobicContact CG-CE1 3.72Å; E477-F688 HydrophobicContact CG-CZ 3.99Å; E477-Y690 PolarHBondContact OE1-OH 2.85Å; E477-K696 WeakPolarHBondContact OE1-CD 3.21Å; E477-K696 IonicContact OE1-NZ 3.69Å; E477-K696 PolarHBondContact OE1-NZ 2.86Å; E477-K696 IonicContact OE2-NZ 3.74Å; E477-K696 PolarHBondContact OE2-NZ 3.12Å
478	Y	96.7	Very high	91.2	Very high	20 Å²	20	22.6 Å²	22.6	8%	0.078	10%	0.104	C	C	.	.	H	α-helix	trans	-60.1	-44.1	177.5	165.5	-110.3	0	0	0	111.8	F452 M453 M458 F459 I462 R474 F475 L480 T481 A482	F452-Y478 PolarHBondContact O-OH 2.93Å; M453-Y478 VanDerWaalsContact CE-OH 3.26Å; M453-Y478 WeakPolarHBondContact CE-OH 3.01Å; M453-Y478 HydrophobicContact SD-CE2 4.34Å; M458-Y478 HydrophobicContact CB-CD2 4.11Å; F459-Y478 HydrophobicContact CB-CD1 4.31Å; F459-Y478 HydrophobicContact CB-CD2 3.94Å; F459-Y478 HydrophobicContact CB-CE1 4.23Å; F459-Y478 HydrophobicContact CB-CE2 3.87Å; F459-Y478 HydrophobicContact CB-CG 4.19Å; F459-Y478 HydrophobicContact CD2-CD1 4.03Å; F459-Y478 AromaticContact CD2-CE1 3.69Å; F459-Y478 HydrophobicContact CD2-CE1 3.69Å; F459-Y478 HydrophobicContact CG-CE1 4.38Å; I462-Y478 HydrophobicContact CD1-CD1 3.97Å; I462-Y478 HydrophobicContact CD1-CG 4.33Å; R474-Y478 PolarHBondContact O-N 3.37Å; F475-Y478 HydrophobicContact CD2-CD1 4.14Å; F475-Y478 HydrophobicContact CE2-CD1 4.25Å; F475-Y478 PolarHBondContact O-N 3.35Å; Y478-L480 VanDerWaalsContact C-N 3.33Å; Y478-L480 PolarHBondContact O-N 3.47Å; Y478-T481 PolarHBondContact O-N 2.81Å; Y478-T481 PolarHBondContact O-OG1 2.98Å; Y478-T481 VanDerWaalsContact O-OG1 3.13Å; Y478-A482 PolarHBondContact O-N 3.38Å; Y478-A482 VanDerWaalsContact O-N 3.08Å
479	Y	97.4	Very high	89.7	Confident	8 Å²	8	23.4 Å²	23.4	3%	0.031	12%	0.115	C	C	.	.	H	α-helix	trans	-61.3	-41.5	-178.7	-174.6	-92.5	0	0	0	111.8	F475 V476 E477 A482 F483 F612 T613 P615 V634 I636 V647 F649	F475-Y479 WeakPolarHBondContact O-CB 3.24Å; F475-Y479 PolarHBondContact O-N 3.37Å; V476-Y479 PolarHBondContact O-N 3.28Å; E477-Y479 PolarHBondContact O-N 2.96Å; Y479-A482 WeakPolarHBondContact O-CB 3.33Å; Y479-A482 PolarHBondContact O-N 2.67Å; Y479-F483 HydrophobicContact CD1-CE2 4.03Å; Y479-F483 AromaticContact CE1-CE2 3.63Å; Y479-F483 HydrophobicContact CE1-CE2 3.63Å; Y479-F483 AromaticContact CE1-CZ 3.94Å; Y479-F483 HydrophobicContact CE1-CZ 3.94Å; Y479-F483 HydrophobicContact CE2-CE2 4.32Å; Y479-F483 HydrophobicContact CE2-CZ 4.08Å; Y479-F483 AromaticContact CZ-CE2 3.76Å; Y479-F483 AromaticContact CZ-CZ 3.58Å; Y479-F483 WeakPolarHBondContact O-CD2 3.46Å; Y479-F483 WeakPolarHBondContact O-CE2 3.41Å; Y479-F483 WeakPolarHBondContact OH-CZ 3.34Å; Y479-F612 HydrophobicContact CD2-CD2 4.45Å; Y479-F612 AromaticContact CE2-CD2 3.97Å; Y479-F612 HydrophobicContact CE2-CD2 3.97Å; Y479-F612 HydrophobicContact CE2-CE2 4.43Å; Y479-T613 PolarHBondContact OH-O 2.94Å; Y479-P615 WeakPolarHBondContact OH-CD 3.1Å; Y479-V634 HydrophobicContact CE1-CG1 3.95Å; Y479-I636 HydrophobicContact CD1-CD1 4.17Å; Y479-I636 HydrophobicContact CD2-CD1 4.32Å; Y479-I636 HydrophobicContact CG-CD1 3.94Å; Y479-V647 HydrophobicContact CD1-CG2 4.48Å; Y479-F649 HydrophobicContact CE1-CE2 4.26Å; Y479-F649 HydrophobicContact CE1-CZ 4.39Å
480	L	96.3	Very high	88.3	Confident	1 Å²	1	25.1 Å²	25.1	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-71.1	-28.6	178.3	-71.4	173.2	0	0	0	113.2	V476 E477 Y478 V647 F649 V662 A664 A678 L686 F688	V476-L480 HydrophobicContact CG1-CD1 3.95Å; V476-L480 HydrophobicContact CG1-CG 4.42Å; V476-L480 WeakPolarHBondContact O-CB 3.2Å; V476-L480 WeakPolarHBondContact O-CG 3.39Å; V476-L480 PolarHBondContact O-N 3.39Å; E477-L480 PolarHBondContact O-N 3.45Å; Y478-L480 VanDerWaalsContact C-N 3.33Å; Y478-L480 PolarHBondContact O-N 3.47Å; L480-V647 HydrophobicContact CD2-CG1 3.69Å; L480-F649 HydrophobicContact CD2-CZ 4.5Å; L480-V662 HydrophobicContact CD2-CG1 4.22Å; L480-V662 HydrophobicContact CD2-CG2 3.59Å; L480-A664 HydrophobicContact CD1-CB 4.22Å; L480-A678 HydrophobicContact CD1-CB 3.86Å; L480-L686 HydrophobicContact CB-CD1 3.81Å; L480-F688 HydrophobicContact CB-CZ 4.49Å; L480-F688 HydrophobicContact CD1-CE1 3.92Å; L480-F688 HydrophobicContact CD1-CZ 3.73Å
481	T	93.7	Very high	87.5	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-86.1	-6	175.9	63.3	0	0	0	0	113.9	M458 E477 Y478 F483 H484 L686 I698 T700 L703	M458-T481 HydrophobicContact CE-CG2 3.98Å; M458-T481 HydrophobicContact SD-CG2 4.1Å; M458-T481 PolarHBondContact SD-OG1 3.48Å; E477-T481 WeakPolarHBondContact O-CG2 3.4Å; E477-T481 PolarHBondContact O-N 2.86Å; E477-T481 PolarHBondContact O-OG1 3.21Å; Y478-T481 PolarHBondContact O-N 2.81Å; Y478-T481 PolarHBondContact O-OG1 2.98Å; Y478-T481 VanDerWaalsContact O-OG1 3.13Å; T481-F483 VanDerWaalsContact C-N 3.35Å; T481-F483 PolarHBondContact O-N 3.16Å; T481-H484 PolarHBondContact O-CD2 3.02Å; T481-L686 HydrophobicContact CG2-CD1 4.31Å; T481-I698 HydrophobicContact CG2-CG2 3.91Å; T481-T700 HydrophobicContact CG2-CG2 4.37Å; T481-L703 HydrophobicContact CG2-CD1 3.65Å
482	A	92.6	Very high	86.8	Confident	5 Å²	5	23.4 Å²	23.4	4%	0.041	13%	0.133	C	C	.	.	S	Bend	trans	-71.3	-22.4	-178	0	0	0	0	0	114.7	F452 Y478 Y479	F452-A482 WeakPolarHBondContact CA-O 3.2Å; F452-A482 HydrophobicContact CB-CB 4.19Å; F452-A482 WeakPolarHBondContact CD1-O 3.27Å; F452-A482 WeakPolarHBondContact O-CB 3.36Å; Y478-A482 PolarHBondContact O-N 3.38Å; Y478-A482 VanDerWaalsContact O-N 3.08Å; Y479-A482 WeakPolarHBondContact O-CB 3.33Å; Y479-A482 PolarHBondContact O-N 2.67Å
483	F	90.7	Very high	86.2	Confident	7 Å²	7	24.6 Å²	24.6	3%	0.031	14%	0.138	C	C	.	.	S	Bend	trans	-89.5	-23.1	-164.3	-67.4	-74.7	0	0	0	116.2	F452 Y479 T481 L614 P615 L630 F649 W682	F452-F483 HydrophobicContact CE1-CD1 4.14Å; F452-F483 HydrophobicContact CE2-CE1 4.3Å; F452-F483 HydrophobicContact CZ-CD1 4.15Å; F452-F483 HydrophobicContact CZ-CE1 4.17Å; Y479-F483 HydrophobicContact CD1-CE2 4.03Å; Y479-F483 AromaticContact CE1-CE2 3.63Å; Y479-F483 HydrophobicContact CE1-CE2 3.63Å; Y479-F483 AromaticContact CE1-CZ 3.94Å; Y479-F483 HydrophobicContact CE1-CZ 3.94Å; Y479-F483 HydrophobicContact CE2-CE2 4.32Å; Y479-F483 HydrophobicContact CE2-CZ 4.08Å; Y479-F483 AromaticContact CZ-CE2 3.76Å; Y479-F483 AromaticContact CZ-CZ 3.58Å; Y479-F483 WeakPolarHBondContact O-CD2 3.46Å; Y479-F483 WeakPolarHBondContact O-CE2 3.41Å; Y479-F483 WeakPolarHBondContact OH-CZ 3.34Å; T481-F483 VanDerWaalsContact C-N 3.35Å; T481-F483 PolarHBondContact O-N 3.16Å; F483-L614 HydrophobicContact CE1-CD2 4.48Å; F483-L614 HydrophobicContact CZ-CD2 4.46Å; F483-P615 HydrophobicContact CE1-CG 3.84Å; F483-P615 HydrophobicContact CZ-CG 4.01Å; F483-L630 HydrophobicContact CB-CD1 3.95Å; F483-L630 HydrophobicContact CD1-CD1 3.83Å; F483-L630 HydrophobicContact CG-CD1 3.87Å; F483-F649 HydrophobicContact CD2-CE1 4.16Å; F483-F649 AromaticContact CD2-CZ 3.85Å; F483-F649 HydrophobicContact CD2-CZ 3.85Å; F483-F649 HydrophobicContact CE2-CE1 4.43Å; F483-F649 AromaticContact CE2-CZ 3.69Å; F483-F649 HydrophobicContact CE2-CZ 3.69Å; F483-F649 HydrophobicContact CZ-CZ 4.35Å; F483-W682 HydrophobicContact CB-CD2 4.45Å; F483-W682 HydrophobicContact CB-CE3 3.74Å; F483-W682 HydrophobicContact CB-CZ3 4.21Å
484	H	86.8	Confident	85.8	Confident	17 Å²	17	28 Å²	28	8%	0.079	15%	0.152	C	C	.	.	S	Bend	trans	-72.1	-46.4	-170.2	76.8	93.3	0	0	0	113.1	H455 T481 G486 R487 K488 N683 T700	H455-H484 AromaticContact CD2-NE2 3.95Å; H455-H484 AromaticContact CE1-NE2 3.85Å; H455-H484 AromaticContact NE2-CD2 3.97Å; H455-H484 AromaticContact NE2-CE1 3.78Å; H455-H484 AromaticContact NE2-NE2 2.93Å; H455-H484 PolarHBondContact NE2-NE2 2.86Å; T481-H484 PolarHBondContact O-CD2 3.02Å; H484-G486 VanDerWaalsContact C-N 3.25Å; H484-G486 PolarHBondContact O-N 3Å; H484-R487 CarbonylContact O-C 3.52Å; H484-R487 PolarHBondContact O-N 3.37Å; H484-K488 PolarHBondContact O-N 3.38Å; H484-N683 HydrophobicContact CB-CB 4.18Å; H484-T700 PolarHBondContact CE1-O 3.28Å; H484-T700 VanDerWaalsContact CE1-O 3.24Å
485	E	81.6	Confident	85.5	Confident	32 Å²	32	27.3 Å²	27.3	15%	0.15	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-59.8	-34.7	176.6	-80.7	-58	124.1	0	0	113	A454 R487 K488 V705	A454-E485 HydrophobicContact CB-CB 3.78Å; A454-E485 HydrophobicContact CB-CG 3.44Å; A454-E485 VanDerWaalsContact CB-CG 3.44Å; E485-R487 PolarHBondContact O-N 3.38Å; E485-R487 VanDerWaalsContact O-N 3.12Å; E485-K488 VanDerWaalsContact CD-CE 3.46Å; E485-K488 WeakPolarHBondContact OE1-CE 3.16Å; E485-K488 IonicContact OE1-NZ 2.71Å; E485-K488 PolarHBondContact OE1-NZ 2.85Å; E485-K488 VanDerWaalsContact OE2-CE 3.3Å; E485-K488 WeakPolarHBondContact OE2-CE 3.45Å; E485-K488 IonicContact OE2-NZ 3.64Å; E485-K488 PolarHBondContact OE2-NZ 2.89Å; E485-V705 VanDerWaalsContact CD-CG2 3.47Å; E485-V705 HydrophobicContact CG-CG1 4.19Å; E485-V705 HydrophobicContact CG-CG2 3.79Å; E485-V705 WeakPolarHBondContact OE1-CG2 3.13Å
486	G	68.7	Low	85.3	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-62.9	-16.2	176	0	0	0	0	0	113.8	R443 H484	R443-G486 PolarHBondContact NH2-O 3.27Å; H484-G486 VanDerWaalsContact C-N 3.25Å; H484-G486 PolarHBondContact O-N 3Å
487	R	70.7	Confident	85	Confident	56 Å²	56	30 Å²	30	21%	0.211	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-140.5	42	-169.3	-64.3	-63	-178.3	-177.5	-2.9	113.7	H484 E485 G489 K493 W682	H484-R487 CarbonylContact O-C 3.52Å; H484-R487 PolarHBondContact O-N 3.37Å; E485-R487 PolarHBondContact O-N 3.38Å; E485-R487 VanDerWaalsContact O-N 3.12Å; R487-G489 VanDerWaalsContact C-N 3.3Å; R487-G489 PolarHBondContact O-N 3.18Å; R487-K493 PolarHBondContact NH1-O 3.24Å; R487-W682 HydrophobicContact CB-CH2 4.1Å; R487-W682 HydrophobicContact CB-CZ3 4.27Å; R487-W682 HydrophobicContact CG-CH2 4.41Å
488	K	65.8	Low	84.9	Confident	136 Å²	136	29.3 Å²	29.3	59%	0.591	16%	0.161	S	C	*	.			trans	-58.6	-30.6	177.9	-84.4	178.4	152.6	158.6	0	115.8	H484 E485	H484-K488 PolarHBondContact O-N 3.38Å; E485-K488 VanDerWaalsContact CD-CE 3.46Å; E485-K488 WeakPolarHBondContact OE1-CE 3.16Å; E485-K488 IonicContact OE1-NZ 2.71Å; E485-K488 PolarHBondContact OE1-NZ 2.85Å; E485-K488 VanDerWaalsContact OE2-CE 3.3Å; E485-K488 WeakPolarHBondContact OE2-CE 3.45Å; E485-K488 IonicContact OE2-NZ 3.64Å; E485-K488 PolarHBondContact OE2-NZ 2.89Å
489	G	65.8	Low	84.9	Confident	37 Å²	37	28.8 Å²	28.8	38%	0.381	16%	0.16	S	C	.	.			trans	-75.3	132.1	179.2	0	0	0	0	0	112.6	R487 V491	R487-G489 VanDerWaalsContact C-N 3.3Å; R487-G489 PolarHBondContact O-N 3.18Å; G489-V491 PolarHBondContact O-N 3.48Å
490	A	68.5	Low	84.8	Confident	89 Å²	89	29.2 Å²	29.2	74%	0.736	16%	0.163	S	C	*	.	S	Bend	trans	-62.2	-29.2	171.4	0	0	0	0	0	112.3	W627	A490-W627 WeakPolarHBondContact O-CB 3.45Å
491	V	79.3	Confident	84.8	Confident	16 Å²	16	29.3 Å²	29.3	10%	0.097	16%	0.164	C	C	.	.	S	Bend	trans	-90.2	130	179.8	-171.4	0	0	0	0	111.2	D406 L407 G489 K493 V625 P626	D406-V491 VanDerWaalsContact OD1-CG2 3.31Å; D406-V491 WeakPolarHBondContact OD1-CG2 3.48Å; L407-V491 HydrophobicContact CD1-CG1 3.62Å; L407-V491 HydrophobicContact CG-CG1 3.95Å; G489-V491 PolarHBondContact O-N 3.48Å; V491-K493 PolarHBondContact O-N 3.48Å; V491-K493 VanDerWaalsContact O-N 3.1Å; V491-V625 HydrophobicContact CG1-CG1 4.38Å; V491-V625 HydrophobicContact CG2-CG1 3.87Å; V491-P626 CarbonylContact C-O 3.57Å; V491-P626 WeakPolarHBondContact CA-O 3.17Å; V491-P626 HydrophobicContact CG1-CG 4.08Å
492	A	82.8	Confident	85	Confident	13 Å²	13	29.3 Å²	29.3	11%	0.107	16%	0.164	C	C	.	.			trans	-72.7	101.8	176	0	0	0	0	0	111.8	A619 P626 V628	A492-A619 HydrophobicContact CB-CB 4.44Å; A492-P626 HydrophobicContact CB-CB 4.1Å; A492-P626 HydrophobicContact CB-CG 4.48Å; A492-P626 PolarHBondContact N-O 3.38Å; A492-V628 HydrophobicContact CB-CG2 3.46Å; A492-V628 VanDerWaalsContact CB-CG2 3.46Å
493	K	86.3	Confident	85.3	Confident	25 Å²	25	29.5 Å²	29.5	11%	0.109	17%	0.165	C	C	.	.			trans	-100	155.9	164.6	-58.9	-166.9	-171.2	-176.6	0	111.5	E404 I439 L440 E441 R487 V491	E404-K493 HydrophobicContact CB-CD 4.38Å; E404-K493 HydrophobicContact CG-CD 3.98Å; E404-K493 IonicContact OE2-NZ 3.6Å; E404-K493 PolarHBondContact OE2-NZ 3.15Å; I439-K493 CarbonylContact O-C 3.53Å; I439-K493 VanDerWaalsContact O-CA 3.28Å; I439-K493 WeakPolarHBondContact O-CA 3.42Å; I439-K493 WeakPolarHBondContact O-CB 3.21Å; L440-K493 WeakPolarHBondContact O-CD 3.33Å; E441-K493 HydrophobicContact CB-CB 3.85Å; R487-K493 PolarHBondContact NH1-O 3.24Å; V491-K493 PolarHBondContact O-N 3.48Å; V491-K493 VanDerWaalsContact O-N 3.1Å
494	K	88	Confident	85.6	Confident	84 Å²	84	29.4 Å²	29.4	37%	0.365	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	126.4	178.4	-175.8	-166.8	167.7	-173.2	0	109	L435 I439 L440 E441	L435-K494 HydrophobicContact CD1-CD 3.66Å; I439-K494 PolarHBondContact O-N 3.45Å; L440-K494 CarbonylContact C-O 3.48Å; L440-K494 VanDerWaalsContact CA-O 3.24Å; L440-K494 WeakPolarHBondContact CA-O 3.35Å; L440-K494 HydrophobicContact CD2-CB 4.47Å; E441-K494 PolarHBondContact N-O 2.95Å
495	P	91.4	Very high	86.1	Confident	9 Å²	9	29.3 Å²	29.3	6%	0.058	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	161.8	173.3	30.7	-37.9	0	0	0	111.3	R443 L445 M448 N497	R443-P495 CarbonylContact O-C 3.44Å; R443-P495 WeakPolarHBondContact O-CA 3.27Å; R443-P495 WeakPolarHBondContact O-CB 3.37Å; L445-P495 HydrophobicContact CB-CB 4.47Å; L445-P495 HydrophobicContact CB-CG 4.23Å; L445-P495 HydrophobicContact CD1-CG 3.66Å; M448-P495 HydrophobicContact CB-CB 4.39Å; M448-P495 HydrophobicContact SD-CG 3.87Å; P495-N497 PolarHBondContact O-N 2.99Å
496	Y	93.1	Very high	86.8	Confident	3 Å²	3	28 Å²	28	1%	0.012	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	136	174	-45.9	-43.1	0	0	0	110.1	L440 E441 K442 R443 L445 P498 W725 V728 T729 L732	L440-Y496 HydrophobicContact CB-CD1 4.27Å; L440-Y496 HydrophobicContact CB-CE1 4.06Å; L440-Y496 HydrophobicContact CD1-CD1 4.13Å; L440-Y496 HydrophobicContact CD1-CE1 4.26Å; E441-Y496 WeakPolarHBondContact O-CE1 3.24Å; K442-Y496 WeakPolarHBondContact CA-OH 3.43Å; R443-Y496 WeakPolarHBondContact O-CD2 3.27Å; R443-Y496 PolarHBondContact O-N 3.48Å; L445-Y496 PolarHBondContact N-O 2.86Å; L445-Y496 VanDerWaalsContact N-O 3.08Å; Y496-P498 WeakPolarHBondContact O-CD 3.45Å; Y496-W725 HydrophobicContact CD1-CE3 4.26Å; Y496-W725 HydrophobicContact CD1-CZ3 4.49Å; Y496-W725 HydrophobicContact CD2-CB 3.69Å; Y496-W725 AromaticContact CD2-CD1 3.95Å; Y496-W725 AromaticContact CD2-CD2 3.46Å; Y496-W725 HydrophobicContact CD2-CD2 3.46Å; Y496-W725 VanDerWaalsContact CD2-CD2 3.46Å; Y496-W725 AromaticContact CD2-CE3 3.77Å; Y496-W725 HydrophobicContact CD2-CE3 3.77Å; Y496-W725 AromaticContact CD2-CG 3.41Å; Y496-W725 HydrophobicContact CD2-CG 3.41Å; Y496-W725 VanDerWaalsContact CD2-CG 3.41Å; Y496-W725 HydrophobicContact CE2-CB 3.61Å; Y496-W725 HydrophobicContact CE2-CD2 4.15Å; Y496-W725 HydrophobicContact CE2-CE3 4.25Å; Y496-W725 AromaticContact CE2-CG 3.89Å; Y496-W725 HydrophobicContact CE2-CG 3.89Å; Y496-W725 AromaticContact CG-CD2 3.78Å; Y496-W725 HydrophobicContact CG-CD2 3.78Å; Y496-W725 AromaticContact CG-CE3 3.78Å; Y496-W725 HydrophobicContact CG-CE3 3.78Å; Y496-W725 HydrophobicContact CG-CG 4.21Å; Y496-W725 HydrophobicContact CG-CZ3 4.2Å; Y496-V728 HydrophobicContact CE1-CG1 3.96Å; Y496-T729 WeakPolarHBondContact CE2-OG1 3.44Å; Y496-T729 WeakPolarHBondContact OH-CA 3.4Å; Y496-T729 PolarHBondContact OH-N 3.37Å; Y496-T729 PolarHBondContact OH-OG1 3.47Å; Y496-L732 HydrophobicContact CE1-CD1 3.93Å; Y496-L732 WeakPolarHBondContact OH-CD1 3.25Å
497	N	92.2	Very high	88.2	Confident	57 Å²	57	28 Å²	28	31%	0.305	16%	0.158	S	C	.	.			trans	-74.5	115.1	173.4	-176.9	50.4	0	0	0	107.5	P495	P495-N497 PolarHBondContact O-N 2.99Å
498	P	95.2	Very high	89.4	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.149	C	C	.	.	P	Polyproline II helix	trans	-65.4	144.8	-170.6	-19.1	31.4	0	0	0	111.6	L445 L446 Y496 E502 Q555 H558	L445-P498 HydrophobicContact CB-CG 3.65Å; L445-P498 HydrophobicContact CD2-CG 4.42Å; L446-P498 HydrophobicContact CD1-CB 4.34Å; L446-P498 HydrophobicContact CD2-CB 4.37Å; L446-P498 HydrophobicContact CD2-CG 3.98Å; L446-P498 HydrophobicContact CG-CB 4.05Å; L446-P498 HydrophobicContact CG-CG 3.83Å; Y496-P498 WeakPolarHBondContact O-CD 3.45Å; P498-E502 WeakPolarHBondContact CA-OE2 3.38Å; P498-E502 HydrophobicContact CB-CB 4.23Å; P498-E502 WeakPolarHBondContact CB-OE2 3.36Å; P498-Q555 HydrophobicContact CB-CB 3.87Å; P498-Q555 HydrophobicContact CB-CG 3.9Å; P498-H558 PolarHBondContact O-ND1 2.86Å
499	V	95.1	Very high	90.8	Very high	9 Å²	9	22.5 Å²	22.5	6%	0.055	14%	0.137	C	C	.	.	P	Polyproline II helix	trans	-79	155.8	172.7	-56.6	0	0	0	0	110.6	G501 E502 Q555 M719 L724 W725 L747 Q751	V499-G501 PolarHBondContact O-N 2.87Å; V499-E502 HydrophobicContact CG2-CB 3.95Å; V499-E502 PolarHBondContact N-OE2 3.28Å; V499-E502 VanDerWaalsContact N-OE2 3.15Å; V499-E502 WeakPolarHBondContact O-CB 3.28Å; V499-E502 PolarHBondContact O-N 2.71Å; V499-Q555 WeakPolarHBondContact O-CB 3.49Å; V499-Q555 WeakPolarHBondContact O-CG 3.4Å; V499-M719 HydrophobicContact CG2-CE 4.1Å; V499-L724 HydrophobicContact CG2-CD2 3.56Å; V499-W725 HydrophobicContact CG1-CZ2 4.28Å; V499-L747 HydrophobicContact CG1-CD2 3.34Å; V499-Q751 HydrophobicContact CB-CG 4.15Å; V499-Q751 HydrophobicContact CG1-CB 4.48Å; V499-Q751 HydrophobicContact CG1-CG 4.42Å; V499-Q751 VanDerWaalsContact CG1-OE1 3.28Å
500	L	96.2	Very high	92.2	Very high	17 Å²	17	20.8 Å²	20.8	9%	0.089	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	128.1	176.7	-170.7	64.5	0	0	0	111.1	E502 H558 Q751 W765	L500-E502 VanDerWaalsContact C-N 3.28Å; L500-E502 PolarHBondContact O-N 2.91Å; L500-H558 HydrophobicContact CB-CB 4.21Å; L500-H558 HydrophobicContact CD1-CB 4.41Å; L500-Q751 VanDerWaalsContact N-NE2 3.17Å; L500-W765 HydrophobicContact CD1-CG 4.08Å; L500-W765 HydrophobicContact CD2-CB 3.59Å; L500-W765 HydrophobicContact CD2-CD2 4.1Å; L500-W765 HydrophobicContact CD2-CG 3.66Å; L500-W765 HydrophobicContact CG-CB 4.19Å; L500-W765 HydrophobicContact CG-CD2 3.97Å; L500-W765 HydrophobicContact CG-CG 3.71Å
501	G	96.5	Very high	93.3	Very high	3 Å²	3	18.5 Å²	18.5	3%	0.031	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	4.5	-177.8	0	0	0	0	0	115.7	V499 Q555 M719	V499-G501 PolarHBondContact O-N 2.87Å; G501-Q555 PolarHBondContact N-O 3.2Å; G501-M719 WeakPolarHBondContact O-CE 3.3Å
502	E	98.1	Very high	93.8	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.103	C	C	.	.			trans	-61.9	140.8	167.2	-171.4	-178.3	137.9	0	0	110.3	S444 L446 P498 V499 L500 E554 Q555 M719 S721 L724 W725	S444-E502 WeakPolarHBondContact CB-OE1 3.2Å; S444-E502 PolarHBondContact OG-OE1 3.48Å; L446-E502 HydrophobicContact CD1-CB 4.12Å; L446-E502 HydrophobicContact CD1-CG 3.94Å; L446-E502 VanDerWaalsContact CD1-O 3.31Å; L446-E502 WeakPolarHBondContact CD1-O 3.25Å; P498-E502 WeakPolarHBondContact CA-OE2 3.38Å; P498-E502 HydrophobicContact CB-CB 4.23Å; P498-E502 WeakPolarHBondContact CB-OE2 3.36Å; V499-E502 HydrophobicContact CG2-CB 3.95Å; V499-E502 PolarHBondContact N-OE2 3.28Å; V499-E502 VanDerWaalsContact N-OE2 3.15Å; V499-E502 WeakPolarHBondContact O-CB 3.28Å; V499-E502 PolarHBondContact O-N 2.71Å; L500-E502 VanDerWaalsContact C-N 3.28Å; L500-E502 PolarHBondContact O-N 2.91Å; E502-E554 CarbonylContact O-C 3.58Å; E502-E554 VanDerWaalsContact O-CA 3.28Å; E502-E554 WeakPolarHBondContact O-CA 3.49Å; E502-Q555 HydrophobicContact CB-CB 4.33Å; E502-Q555 PolarHBondContact O-N 3.49Å; E502-M719 WeakPolarHBondContact CA-O 3.31Å; E502-M719 WeakPolarHBondContact CG-O 3.35Å; E502-S721 VanDerWaalsContact OE1-CB 3.26Å; E502-S721 WeakPolarHBondContact OE1-CB 3.46Å; E502-S721 PolarHBondContact OE1-OG 2.9Å; E502-L724 HydrophobicContact CB-CD2 4.21Å; E502-L724 HydrophobicContact CG-CD2 3.74Å; E502-W725 PolarHBondContact OE1-NE1 2.81Å; E502-W725 PolarHBondContact OE2-NE1 2.64Å
503	T	98.1	Very high	94	Very high	10 Å²	10	25.7 Å²	25.7	6%	0.061	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	153.3	-178.8	60	0	0	0	0	111.9	A553 E554 M719 E720 S721 Y769	T503-A553 CarbonylContact C-O 3.54Å; T503-A553 VanDerWaalsContact CA-O 3.25Å; T503-A553 WeakPolarHBondContact CA-O 3.35Å; T503-E554 HydrophobicContact CG2-CB 4.36Å; T503-E554 HydrophobicContact CG2-CG 4.1Å; T503-M719 PolarHBondContact N-O 3.41Å; T503-E720 CarbonylContact O-C 3.52Å; T503-E720 VanDerWaalsContact O-CA 3.24Å; T503-E720 WeakPolarHBondContact O-CA 3.48Å; T503-S721 PolarHBondContact O-N 2.79Å; T503-S721 PolarHBondContact O-OG 2.86Å; T503-Y769 HydrophobicContact CG2-CD2 4.02Å; T503-Y769 HydrophobicContact CG2-CE2 3.82Å
504	F	97.9	Very high	93.9	Very high	5 Å²	5	29.6 Å²	29.6	2%	0.022	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	134.1	168.8	-173.4	-98.7	0	0	0	110.3	L446 E447 A450 C506 F551 V552 A553 K708	L446-F504 HydrophobicContact CB-CB 3.74Å; L446-F504 HydrophobicContact CD1-CB 4.48Å; E447-F504 HydrophobicContact CB-CD1 4.48Å; E447-F504 HydrophobicContact CB-CD2 3.89Å; E447-F504 HydrophobicContact CB-CE1 4.25Å; E447-F504 HydrophobicContact CB-CE2 3.64Å; E447-F504 HydrophobicContact CB-CG 4.31Å; E447-F504 HydrophobicContact CB-CZ 3.84Å; E447-F504 HydrophobicContact CG-CD2 4.49Å; E447-F504 HydrophobicContact CG-CE1 4.2Å; E447-F504 HydrophobicContact CG-CE2 3.75Å; E447-F504 HydrophobicContact CG-CZ 3.58Å; E447-F504 WeakPolarHBondContact OE2-CE2 3.07Å; A450-F504 HydrophobicContact CB-CD1 4.15Å; A450-F504 HydrophobicContact CB-CE1 3.64Å; F504-C506 HydrophobicContact CE1-CB 3.95Å; F504-C506 HydrophobicContact CZ-CB 4.35Å; F504-F551 HydrophobicContact CD1-CD1 4.09Å; F504-F551 AromaticContact CD1-CE1 3.91Å; F504-F551 HydrophobicContact CD1-CE1 3.91Å; F504-V552 WeakPolarHBondContact O-CA 3.44Å; F504-A553 HydrophobicContact CB-CB 4.3Å; F504-A553 PolarHBondContact N-O 3.12Å; F504-A553 PolarHBondContact O-N 2.84Å; F504-K708 HydrophobicContact CZ-CD 4.35Å
505	H	96.9	Very high	93.8	Very high	15 Å²	15	25.8 Å²	25.8	7%	0.069	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	133.9	-179.6	-61.2	-76.8	0	0	0	110	I390 E720 Y769	I390-H505 HydrophobicContact CD1-CB 3.6Å; H505-E720 IonicContact CD2-OE2 3.42Å; H505-Y769 AromaticContact CE1-CE1 3.75Å; H505-Y769 AromaticContact CE1-CE2 3.65Å; H505-Y769 AromaticContact CE1-CZ 3.35Å; H505-Y769 PolarHBondContact CE1-OH 3.05Å; H505-Y769 AromaticContact NE2-CE2 3.62Å; H505-Y769 AromaticContact NE2-CZ 3.56Å; H505-Y769 PolarHBondContact NE2-OH 3.25Å
506	C	96.8	Very high	93	Very high	3 Å²	3	30.7 Å²	30.7	2%	0.02	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	166.6	169.6	63.9	0	0	0	0	111	F504 W508 F551 K708 K709	F504-C506 HydrophobicContact CE1-CB 3.95Å; F504-C506 HydrophobicContact CZ-CB 4.35Å; C506-W508 WeakPolarHBondContact SG-CH2 3.36Å; C506-F551 PolarHBondContact N-O 2.93Å; C506-F551 PolarHBondContact O-N 3.08Å; C506-K708 HydrophobicContact CB-CB 4.21Å; C506-K708 HydrophobicContact CB-CD 4.42Å; C506-K709 CarbonylContact C-O 3.52Å; C506-K709 WeakPolarHBondContact CA-O 3.48Å; C506-K709 WeakPolarHBondContact CB-O 3.46Å
507	S	97.2	Very high	91.7	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	169.6	170.3	75	0	0	0	0	112.4	E395 V549 K708 K709	E395-S507 PolarHBondContact OE1-N 3.41Å; E395-S507 WeakPolarHBondContact OE2-CB 3.37Å; E395-S507 PolarHBondContact OE2-OG 2.86Å; S507-V549 CarbonylContact C-O 3.47Å; S507-V549 WeakPolarHBondContact CA-O 3.41Å; S507-V549 WeakPolarHBondContact CB-O 3.19Å; S507-K708 CarbonylContact O-C 3.56Å; S507-K708 WeakPolarHBondContact O-CA 3.15Å; S507-K709 PolarHBondContact N-O 3.31Å; S507-K709 PolarHBondContact O-N 2.79Å
508	W	96.6	Very high	90.2	Very high	5 Å²	5	35.8 Å²	35.8	2%	0.019	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	139.3	167.4	-62.2	-107.2	0	0	0	108.5	A450 M453 P456 C506 V510 R548 V549 F551 I706 K708	A450-W508 HydrophobicContact CB-CH2 4.34Å; A450-W508 WeakPolarHBondContact O-CZ2 3.39Å; M453-W508 HydrophobicContact CB-CH2 3.66Å; M453-W508 HydrophobicContact CB-CZ2 3.54Å; M453-W508 HydrophobicContact CB-CZ3 4.25Å; M453-W508 HydrophobicContact CG-CD2 4.03Å; M453-W508 HydrophobicContact CG-CE3 4.02Å; M453-W508 HydrophobicContact CG-CH2 3.86Å; M453-W508 HydrophobicContact CG-CZ2 3.86Å; M453-W508 HydrophobicContact CG-CZ3 3.94Å; M453-W508 PolarHBondContact O-NE1 2.82Å; P456-W508 HydrophobicContact CB-CB 4.45Å; P456-W508 HydrophobicContact CB-CG 4.43Å; P456-W508 HydrophobicContact CG-CB 4.13Å; P456-W508 HydrophobicContact CG-CG 4.06Å; C506-W508 WeakPolarHBondContact SG-CH2 3.36Å; W508-V510 HydrophobicContact CB-CG2 4.28Å; W508-R548 WeakPolarHBondContact O-CA 3.32Å; W508-V549 HydrophobicContact CB-CB 4.32Å; W508-V549 HydrophobicContact CE3-CB 4.07Å; W508-V549 HydrophobicContact CE3-CG1 3.99Å; W508-V549 HydrophobicContact CZ3-CG1 4.4Å; W508-V549 PolarHBondContact N-O 3.4Å; W508-V549 PolarHBondContact O-N 2.88Å; W508-F551 HydrophobicContact CH2-CB 3.9Å; W508-F551 HydrophobicContact CH2-CG 4.34Å; W508-F551 HydrophobicContact CZ3-CB 3.56Å; W508-F551 HydrophobicContact CZ3-CG 4.45Å; W508-I706 PolarHBondContact NE1-O 2.89Å; W508-K708 HydrophobicContact CD2-CB 4.36Å; W508-K708 HydrophobicContact CZ2-CB 3.73Å
509	E	94.9	Very high	88.3	Confident	73 Å²	73	40.4 Å²	40.4	34%	0.341	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	113.3	163.1	-80.2	164.5	-148.7	0	0	107.8	K709	E509-K709 WeakPolarHBondContact OE1-CE 3.24Å; E509-K709 IonicContact OE1-NZ 2.67Å; E509-K709 PolarHBondContact OE1-NZ 2.86Å; E509-K709 WeakPolarHBondContact OE2-CE 3.3Å; E509-K709 IonicContact OE2-NZ 3.29Å; E509-K709 PolarHBondContact OE2-NZ 2.84Å
510	V	94.6	Very high	86.1	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	112.6	-178.3	-169.4	0	0	0	0	108.2	P456 D457 L460 W508 R512 V515 S546 Y547 V549 I706	P456-V510 HydrophobicContact CB-CG2 3.71Å; P456-V510 HydrophobicContact CG-CG2 3.67Å; D457-V510 HydrophobicContact CB-CG1 3.87Å; L460-V510 HydrophobicContact CD1-CB 3.9Å; L460-V510 HydrophobicContact CD1-CG1 4.14Å; L460-V510 HydrophobicContact CD1-CG2 3.85Å; W508-V510 HydrophobicContact CB-CG2 4.28Å; V510-R512 PolarHBondContact O-N 2.95Å; V510-V515 HydrophobicContact CB-CG2 4.44Å; V510-V515 HydrophobicContact CG1-CG2 3.53Å; V510-S546 CarbonylContact O-C 3.52Å; V510-S546 WeakPolarHBondContact O-CA 2.95Å; V510-S546 WeakPolarHBondContact O-CB 3.25Å; V510-Y547 PolarHBondContact N-O 2.99Å; V510-Y547 PolarHBondContact O-N 2.79Å; V510-V549 HydrophobicContact CG2-CG2 3.99Å; V510-I706 HydrophobicContact CG1-CD1 3.92Å
511	P	92.4	Very high	83.3	Confident	41 Å²	41	54 Å²	54	27%	0.266	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	134.3	177.1	-26.3	35.7	0	0	0	111.7	D513 K514	P511-D513 VanDerWaalsContact C-N 3.28Å; P511-D513 WeakPolarHBondContact CB-OD1 3.39Å; P511-D513 PolarHBondContact O-N 3.42Å; P511-K514 HydrophobicContact CB-CD 4.22Å; P511-K514 HydrophobicContact CB-CG 4.2Å; P511-K514 HydrophobicContact CG-CD 4.12Å; P511-K514 PolarHBondContact O-N 3.08Å; P511-K514 VanDerWaalsContact O-N 3.07Å
512	R	90.3	Very high	80.6	Confident	61 Å²	61	61.4 Å²	61.4	23%	0.23	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-62.4	-34.8	-172.5	-78.4	176.2	177.2	-104.7	-10.1	112.9	V510 K514 V515 D541 G545 S546 Y547	V510-R512 PolarHBondContact O-N 2.95Å; R512-K514 PolarHBondContact O-N 3.24Å; R512-V515 PolarHBondContact O-N 3.11Å; R512-D541 IonicContact NH1-OD1 2.78Å; R512-D541 PolarHBondContact NH1-OD1 3.37Å; R512-G545 WeakPolarHBondContact CB-O 3.35Å; R512-G545 VanDerWaalsContact CG-O 3.27Å; R512-G545 WeakPolarHBondContact CG-O 3.38Å; R512-G545 PolarHBondContact N-O 3.26Å; R512-S546 PolarHBondContact NE-O 2.87Å; R512-S546 PolarHBondContact NH2-O 3.42Å; R512-Y547 HydrophobicContact CB-CE2 4.1Å; R512-Y547 HydrophobicContact CG-CD2 3.84Å; R512-Y547 HydrophobicContact CG-CE2 3.54Å; R512-Y547 HydrophobicContact CG-CG 4.48Å
513	D	86.5	Confident	77.8	Confident	120 Å²	120	70.8 Å²	70.8	64%	0.642	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-59.9	-26.9	174.6	62.2	-62.2	0	0	0	113.7	P511	P511-D513 VanDerWaalsContact C-N 3.28Å; P511-D513 WeakPolarHBondContact CB-OD1 3.39Å; P511-D513 PolarHBondContact O-N 3.42Å
514	K	84.6	Confident	74.8	Confident	107 Å²	107	73.4 Å²	73.4	47%	0.465	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-85.3	-15.1	179.7	-62.9	-174.5	-178.5	-178.9	0	113.7	D457 P511 R512	D457-K514 HydrophobicContact CB-CB 4.35Å; P511-K514 HydrophobicContact CB-CD 4.22Å; P511-K514 HydrophobicContact CB-CG 4.2Å; P511-K514 HydrophobicContact CG-CD 4.12Å; P511-K514 PolarHBondContact O-N 3.08Å; P511-K514 VanDerWaalsContact O-N 3.07Å; R512-K514 PolarHBondContact O-N 3.24Å
515	V	84.6	Confident	72.3	Confident	4 Å²	4	79.4 Å²	79.4	2%	0.024	43%	0.428	C	S	.	.	S	Bend	trans	-98.3	132.9	178.7	-167.9	0	0	0	0	109.1	L460 V510 R512 Y547 R572	L460-V515 HydrophobicContact CB-CG1 3.61Å; L460-V515 HydrophobicContact CB-CG2 4.2Å; L460-V515 HydrophobicContact CD1-CG2 4.11Å; V510-V515 HydrophobicContact CB-CG2 4.44Å; V510-V515 HydrophobicContact CG1-CG2 3.53Å; R512-V515 PolarHBondContact O-N 3.11Å; V515-Y547 HydrophobicContact CB-CD2 4.27Å; V515-Y547 HydrophobicContact CB-CE2 3.98Å; V515-Y547 HydrophobicContact CG1-CE2 4.46Å; V515-Y547 HydrophobicContact CG2-CD2 3.72Å; V515-Y547 HydrophobicContact CG2-CE2 3.94Å; V515-R572 VanDerWaalsContact CG1-NH2 3.28Å
516	K	75.3	Confident	69.4	Low	111 Å²	111	83.7 Å²	83.7	48%	0.483	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-56.2	134	176.6	-71.5	-173.2	174.4	-174.6	0	110.6	S461 A464 R572	S461-K516 PolarHBondContact OG-N 2.83Å; A464-K516 HydrophobicContact CB-CB 4.43Å; A464-K516 WeakPolarHBondContact CB-O 3.26Å; K516-R572 PolarHBondContact O-NH2 2.84Å
517	P	65.5	Low	66.6	Low	106 Å²	106	95.2 Å²	95.2	69%	0.688	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-58	149.4	175.2	-26	34.9	0	0	0	112.1	V519	P517-V519 PolarHBondContact O-N 3.07Å
518	L	61	Low	63.8	Low	62 Å²	62	104.2 Å²	104.2	33%	0.325	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-64.9	121.3	169.1	-68.2	174.2	0	0	0	109	T463 A464 R520 R572	T463-L518 HydrophobicContact CG2-CD2 4.18Å; A464-L518 HydrophobicContact CB-CD2 4.13Å; L518-R520 PolarHBondContact O-N 3.33Å; L518-R572 VanDerWaalsContact CD2-NH1 3.34Å
519	V	56.3	Low	61.3	Low	97 Å²	97	110.1 Å²	110.1	59%	0.588	59%	0.591	S	S	*	*			trans	-75.5	91.6	171	-176.8	0	0	0	0	108.3	A466 P517 S521	A466-V519 HydrophobicContact CB-CB 4.04Å; A466-V519 HydrophobicContact CB-CG1 4.13Å; A466-V519 HydrophobicContact CB-CG2 4.4Å; P517-V519 PolarHBondContact O-N 3.07Å; V519-S521 PolarHBondContact O-N 3.34Å
520	R	48.3	Very low	58.4	Low	196 Å²	196	110.2 Å²	110.2	74%	0.74	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-67.4	119.1	168.7	-66	-174.7	-177.6	172.4	5.4	108.3	L518 N522	L518-R520 PolarHBondContact O-N 3.33Å; R520-N522 PolarHBondContact O-N 2.7Å
521	S	37.4	Very low	56	Low	115 Å²	115	122.8 Å²	122.8	80%	0.804	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-64.5	126.1	173.2	45.3	0	0	0	0	110.1	V519	V519-S521 PolarHBondContact O-N 3.34Å
522	N	39.3	Very low	53.1	Low	158 Å²	158	124.5 Å²	124.5	85%	0.845	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-55.2	138.2	-170.4	-76.8	-20.5	0	0	0	114.3	R520	R520-N522 PolarHBondContact O-N 2.7Å
523	Q	38.8	Very low	50.7	Low	197 Å²	197	126.8 Å²	126.8	92%	0.921	71%	0.709	S	S	*	*			trans	-109.7	111.2	147.5	-72	-169	19.6	0	0	109.8
524	G	36.4	Very low	48.2	Very low	65 Å²	65	128 Å²	128	67%	0.67	72%	0.716	S	S	*	*			trans	73.6	149	158	0	0	0	0	0	118.3
525	P	45.2	Very low	45.9	Very low	132 Å²	132	129.7 Å²	129.7	86%	0.857	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-74.4	142.7	168.3	31.5	-32.4	0	0	0	110.8
526	A	36.3	Very low	43.6	Very low	105 Å²	105	135.2 Å²	135.2	87%	0.868	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-63.8	134.4	-175	0	0	0	0	0	113.1
527	R	37.4	Very low	41.9	Very low	245 Å²	245	139.3 Å²	139.3	93%	0.925	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-96.5	142.6	154.5	-95.5	-177.2	164.5	-178.3	-5.2	108.6
528	E	37.3	Very low	40.5	Very low	188 Å²	188	142.9 Å²	142.9	88%	0.879	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-59.9	143.8	-177.4	-60.9	-176.2	147.4	0	0	112.8	G530	E528-G530 PolarHBondContact O-N 2.83Å
529	P	45	Very low	39.4	Very low	130 Å²	130	143.7 Å²	143.7	84%	0.844	82%	0.815	S	S	*	*			trans	-78.9	112.4	179.9	30.5	-32.9	0	0	0	112
530	G	35.1	Very low	38.7	Very low	75 Å²	75	147.3 Å²	147.3	77%	0.773	83%	0.826	S	S	*	*			trans	-64.1	141.6	162.5	0	0	0	0	0	111.8	E528	E528-G530 PolarHBondContact O-N 2.83Å
531	R	42.8	Very low	38.6	Very low	264 Å²	264	143.3 Å²	143.3	100%	0.996	82%	0.819	S	S	*	*			trans	-70	122.9	-173.2	-162	-178.1	-166.2	-171.9	4.9	112.2
532	G	32.8	Very low	38.9	Very low	76 Å²	76	141.1 Å²	141.1	78%	0.784	80%	0.804	S	S	*	*			trans	-174.8	119.5	172.2	0	0	0	0	0	114.2
533	S	38.9	Very low	39.6	Very low	109 Å²	109	138.7 Å²	138.7	76%	0.762	80%	0.797	S	S	*	*			trans	-84.8	136.4	-178.2	-51.4	0	0	0	0	113
534	N	34.2	Very low	40.5	Very low	147 Å²	147	137.8 Å²	137.8	79%	0.786	79%	0.793	S	S	*	*				170.1	128.5	109.1	-85.8	-20.8	0	0	0	114.3
535	N	35.9	Very low	42.7	Very low	141 Å²	141	136.3 Å²	136.3	75%	0.754	78%	0.777	S	S	*	*			trans	63.7	98.1	146	-73.8	6.8	0	0	0	123.1
536	T	36.3	Very low	44.9	Very low	121 Å²	121	132.4 Å²	132.4	74%	0.742	75%	0.753	S	S	*	*				59.3	86.9	121.7	39	0	0	0	0	120.7
537	Q	39.3	Very low	47.7	Very low	197 Å²	197	128.2 Å²	128.2	92%	0.921	72%	0.715	S	S	*	*				-168.6	81.3	102.7	-99.6	-178.9	22.5	0	0	109.6
538	Q	37.2	Very low	50.4	Low	180 Å²	180	118.5 Å²	118.5	84%	0.841	68%	0.678	S	S	*	*			trans	-110.1	120.2	162.8	-74.3	-177.5	-5.5	0	0	107.4	E540	Q538-E540 PolarHBondContact O-N 2.92Å; Q538-E540 VanDerWaalsContact O-N 3.08Å
539	G	37.5	Very low	53.3	Low	80 Å²	80	109.6 Å²	109.6	83%	0.825	64%	0.636	S	S	*	*			trans	-74	93.2	169.7	0	0	0	0	0	108.9
540	E	41.4	Very low	55.7	Low	173 Å²	173	105.8 Å²	105.8	81%	0.808	61%	0.605	S	S	*	*			trans	-63.5	130.8	166.5	-67.3	-178.2	126.9	0	0	108.9	Q538 S542	Q538-E540 PolarHBondContact O-N 2.92Å; Q538-E540 VanDerWaalsContact O-N 3.08Å; E540-S542 PolarHBondContact O-N 2.89Å
541	D	45.3	Very low	58.7	Low	111 Å²	111	103.1 Å²	103.1	59%	0.594	57%	0.572	S	S	*	*			trans	-70.8	80.6	167.2	-101.9	-47.5	0	0	0	108.1	R512 P543	R512-D541 IonicContact NH1-OD1 2.78Å; R512-D541 PolarHBondContact NH1-OD1 3.37Å; D541-P543 WeakPolarHBondContact O-CD 3.39Å
542	S	44.5	Very low	61.3	Low	70 Å²	70	91.2 Å²	91.2	49%	0.49	53%	0.529	S	S	.	.			trans	-64.5	122.9	165.5	56.6	0	0	0	0	108.2	E540 E544	E540-S542 PolarHBondContact O-N 2.89Å; S542-E544 PolarHBondContact O-N 3.32Å; S542-E544 VanDerWaalsContact O-N 3.11Å
543	P	53.4	Low	64.4	Low	106 Å²	106	87.6 Å²	87.6	69%	0.688	49%	0.492	S	S	*	.	S	Bend	trans	-64.4	-17.1	179.6	25.6	-33.8	0	0	0	112.6	D541 G545	D541-P543 WeakPolarHBondContact O-CD 3.39Å; P543-G545 PolarHBondContact O-N 3.07Å; P543-G545 VanDerWaalsContact O-N 3.08Å
544	E	57.9	Low	67.3	Low	179 Å²	179	82.5 Å²	82.5	84%	0.836	46%	0.456	S	S	*	.	S	Bend	trans	-74.5	86.7	168.6	-61.9	-171.7	161.5	0	0	110.9	S542	S542-E544 PolarHBondContact O-N 3.32Å; S542-E544 VanDerWaalsContact O-N 3.11Å
545	G	83.6	Confident	70.3	Confident	34 Å²	34	75.5 Å²	75.5	35%	0.351	42%	0.419	S	S	.	.			trans	-179.4	172.8	171.4	0	0	0	0	0	113.7	R512 P543	R512-G545 WeakPolarHBondContact CB-O 3.35Å; R512-G545 VanDerWaalsContact CG-O 3.27Å; R512-G545 WeakPolarHBondContact CG-O 3.38Å; R512-G545 PolarHBondContact N-O 3.26Å; P543-G545 PolarHBondContact O-N 3.07Å; P543-G545 VanDerWaalsContact O-N 3.08Å
546	S	90.7	Very high	73.2	Confident	49 Å²	49	69 Å²	69	34%	0.343	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	164.2	171.9	57.3	0	0	0	0	111.4	V510 R512	V510-S546 CarbonylContact O-C 3.52Å; V510-S546 WeakPolarHBondContact O-CA 2.95Å; V510-S546 WeakPolarHBondContact O-CB 3.25Å; R512-S546 PolarHBondContact NE-O 2.87Å; R512-S546 PolarHBondContact NH2-O 3.42Å
547	Y	94.9	Very high	75.9	Confident	17 Å²	17	64.6 Å²	64.6	7%	0.067	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	138.6	160.6	-62.9	-76	0	0	0	108.2	L460 V510 R512 V515 E571 R572	L460-Y547 HydrophobicContact CD1-CD2 4.11Å; L460-Y547 HydrophobicContact CD1-CG 4Å; V510-Y547 PolarHBondContact N-O 2.99Å; V510-Y547 PolarHBondContact O-N 2.79Å; R512-Y547 HydrophobicContact CB-CE2 4.1Å; R512-Y547 HydrophobicContact CG-CD2 3.84Å; R512-Y547 HydrophobicContact CG-CE2 3.54Å; R512-Y547 HydrophobicContact CG-CG 4.48Å; V515-Y547 HydrophobicContact CB-CD2 4.27Å; V515-Y547 HydrophobicContact CB-CE2 3.98Å; V515-Y547 HydrophobicContact CG1-CE2 4.46Å; V515-Y547 HydrophobicContact CG2-CD2 3.72Å; V515-Y547 HydrophobicContact CG2-CE2 3.94Å; Y547-E571 HydrophobicContact CD1-CB 3.85Å; Y547-E571 HydrophobicContact CE1-CB 4.33Å; Y547-R572 HydrophobicContact CD1-CG 3.89Å; Y547-R572 HydrophobicContact CE1-CG 3.86Å; Y547-R572 HydrophobicContact CG-CG 4.49Å; Y547-R572 PolarHBondContact OH-NE 3.1Å; Y547-R572 PolarHBondContact OH-NH2 3.05Å; Y547-R572 VanDerWaalsContact OH-NH2 3.11Å
548	R	95.1	Very high	78.2	Confident	42 Å²	42	56.4 Å²	56.4	16%	0.158	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	122.6	171.9	-165.7	175.6	179.3	-151.4	2.3	110	I390 E395 W508 R550 C569 E571	I390-R548 PolarHBondContact O-NH2 2.95Å; I390-R548 VanDerWaalsContact O-NH2 3.15Å; E395-R548 IonicContact OE2-CZ 2.71Å; E395-R548 IonicContact OE2-NE 3.34Å; E395-R548 IonicContact OE2-NH2 3.53Å; E395-R548 PolarHBondContact OE2-NH2 2.89Å; W508-R548 WeakPolarHBondContact O-CA 3.32Å; R548-R550 HydrophobicContact CG-CG 4.34Å; R548-C569 PolarHBondContact O-SG 2.88Å; R548-C569 VanDerWaalsContact O-SG 3.35Å; R548-E571 PolarHBondContact N-OE1 3.48Å
549	V	97	Very high	80.5	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	127.6	167	-176.5	0	0	0	0	107.5	P456 L460 S507 W508 V510 C567 E568 C569	P456-V549 HydrophobicContact CB-CG2 4.2Å; L460-V549 HydrophobicContact CD1-CG2 3.9Å; L460-V549 HydrophobicContact CD2-CG2 4Å; L460-V549 HydrophobicContact CG-CG2 4.06Å; S507-V549 CarbonylContact C-O 3.47Å; S507-V549 WeakPolarHBondContact CA-O 3.41Å; S507-V549 WeakPolarHBondContact CB-O 3.19Å; W508-V549 HydrophobicContact CB-CB 4.32Å; W508-V549 HydrophobicContact CE3-CB 4.07Å; W508-V549 HydrophobicContact CE3-CG1 3.99Å; W508-V549 HydrophobicContact CZ3-CG1 4.4Å; W508-V549 PolarHBondContact N-O 3.4Å; W508-V549 PolarHBondContact O-N 2.88Å; V510-V549 HydrophobicContact CG2-CG2 3.99Å; V549-C567 WeakPolarHBondContact CG1-SG 3.4Å; V549-E568 CarbonylContact C-O 3.55Å; V549-E568 WeakPolarHBondContact CA-O 3.49Å; V549-C569 HydrophobicContact CG2-CB 4.39Å
550	R	96.6	Very high	82.8	Confident	51 Å²	51	54 Å²	54	19%	0.192	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	138.5	175.5	-74	-168	-78.1	-162.4	-8.6	110.6	D389 R548 C567 E568	D389-R550 IonicContact OD1-NH1 3.32Å; D389-R550 PolarHBondContact OD1-NH1 3.17Å; R548-R550 HydrophobicContact CG-CG 4.34Å; R550-C567 CarbonylContact O-C 3.52Å; R550-C567 WeakPolarHBondContact O-CA 3.11Å; R550-C567 PolarHBondContact O-SG 3.4Å; R550-E568 HydrophobicContact CB-CG 4.3Å; R550-E568 IonicContact CZ-OE1 3.84Å; R550-E568 PolarHBondContact N-O 3.03Å; R550-E568 IonicContact NE-OE1 2.69Å; R550-E568 IonicContact NH2-OE1 3.63Å; R550-E568 PolarHBondContact NH2-OE1 2.8Å; R550-E568 PolarHBondContact O-N 2.85Å
551	F	97.6	Very high	85.1	Confident	18 Å²	18	47 Å²	47	8%	0.079	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	137.9	175.8	175.2	-84.5	0	0	0	111.2	A450 F504 C506 W508 A553 F565 Y566 C567	A450-F551 HydrophobicContact CB-CD1 4.01Å; A450-F551 HydrophobicContact CB-CE1 3.7Å; A450-F551 HydrophobicContact CB-CZ 3.97Å; F504-F551 HydrophobicContact CD1-CD1 4.09Å; F504-F551 AromaticContact CD1-CE1 3.91Å; F504-F551 HydrophobicContact CD1-CE1 3.91Å; C506-F551 PolarHBondContact N-O 2.93Å; C506-F551 PolarHBondContact O-N 3.08Å; W508-F551 HydrophobicContact CH2-CB 3.9Å; W508-F551 HydrophobicContact CH2-CG 4.34Å; W508-F551 HydrophobicContact CZ3-CB 3.56Å; W508-F551 HydrophobicContact CZ3-CG 4.45Å; F551-A553 HydrophobicContact CE1-CB 3.71Å; F551-A553 HydrophobicContact CZ-CB 4.08Å; F551-F565 HydrophobicContact CE2-CD1 4.31Å; F551-F565 AromaticContact CZ-CD1 3.72Å; F551-F565 HydrophobicContact CZ-CD1 3.72Å; F551-F565 HydrophobicContact CZ-CE1 4.42Å; F551-Y566 CarbonylContact C-O 3.57Å; F551-Y566 WeakPolarHBondContact CA-O 3.38Å; F551-C567 HydrophobicContact CD2-CB 4.17Å
552	V	97.6	Very high	87.5	Confident	15 Å²	15	41.9 Å²	41.9	9%	0.091	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	129.1	178.4	179.4	0	0	0	0	108.2	F504 F565 Y566 Y769 Y779	F504-V552 WeakPolarHBondContact O-CA 3.44Å; V552-F565 CarbonylContact O-C 3.59Å; V552-Y566 PolarHBondContact N-O 2.82Å; V552-Y566 PolarHBondContact O-N 2.81Å; V552-Y769 HydrophobicContact CG1-CD1 3.84Å; V552-Y769 HydrophobicContact CG1-CD2 4.27Å; V552-Y769 HydrophobicContact CG1-CE1 4.37Å; V552-Y769 HydrophobicContact CG1-CG 3.8Å; V552-Y779 HydrophobicContact CB-CE2 4.21Å; V552-Y779 HydrophobicContact CG1-CE2 4Å; V552-Y779 HydrophobicContact CG2-CE2 4.4Å
553	A	98.2	Very high	90	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	148.4	171.2	0	0	0	0	0	110.9	L446 T503 F504 F551 G564 F565	L446-A553 HydrophobicContact CB-CB 4.05Å; L446-A553 HydrophobicContact CD2-CB 4.21Å; L446-A553 HydrophobicContact CG-CB 4.48Å; T503-A553 CarbonylContact C-O 3.54Å; T503-A553 VanDerWaalsContact CA-O 3.25Å; T503-A553 WeakPolarHBondContact CA-O 3.35Å; F504-A553 HydrophobicContact CB-CB 4.3Å; F504-A553 PolarHBondContact N-O 3.12Å; F504-A553 PolarHBondContact O-N 2.84Å; F551-A553 HydrophobicContact CE1-CB 3.71Å; F551-A553 HydrophobicContact CZ-CB 4.08Å; A553-G564 CarbonylContact C-O 3.58Å; A553-G564 VanDerWaalsContact CA-O 3.26Å; A553-G564 WeakPolarHBondContact CA-O 3.4Å; A553-F565 HydrophobicContact CB-CD1 3.57Å; A553-F565 HydrophobicContact CB-CE1 3.89Å
554	E	98.4	Very high	92.1	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	140.6	174.9	-175.9	176.3	-173.1	0	0	111	E502 T503 V556 S563 G564 P767 K768 Y769 F770	E502-E554 CarbonylContact O-C 3.58Å; E502-E554 VanDerWaalsContact O-CA 3.28Å; E502-E554 WeakPolarHBondContact O-CA 3.49Å; T503-E554 HydrophobicContact CG2-CB 4.36Å; T503-E554 HydrophobicContact CG2-CG 4.1Å; E554-V556 HydrophobicContact CB-CG1 4.3Å; E554-V556 HydrophobicContact CG-CG1 4.35Å; E554-V556 PolarHBondContact O-N 3.38Å; E554-V556 VanDerWaalsContact O-N 3.11Å; E554-S563 CarbonylContact O-C 3.48Å; E554-S563 WeakPolarHBondContact O-CA 3.46Å; E554-G564 PolarHBondContact N-O 2.85Å; E554-G564 PolarHBondContact O-N 3.45Å; E554-P767 WeakPolarHBondContact OE1-CA 3.5Å; E554-P767 WeakPolarHBondContact OE1-CB 3.44Å; E554-P767 WeakPolarHBondContact OE2-CB 3.31Å; E554-K768 VanDerWaalsContact CD-N 3.33Å; E554-K768 PolarHBondContact OE1-N 3.46Å; E554-K768 PolarHBondContact OE2-N 3.5Å; E554-Y769 WeakPolarHBondContact OE2-CB 3.41Å; E554-Y769 PolarHBondContact OE2-N 3.05Å; E554-F770 HydrophobicContact CB-CD2 3.8Å; E554-F770 HydrophobicContact CB-CE2 3.85Å
555	Q	97.9	Very high	94	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.005	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	89.7	167.6	-168.1	67.8	19.9	0	0	110.5	P498 V499 G501 E502 S557 V562 S563	P498-Q555 HydrophobicContact CB-CB 3.87Å; P498-Q555 HydrophobicContact CB-CG 3.9Å; V499-Q555 WeakPolarHBondContact O-CB 3.49Å; V499-Q555 WeakPolarHBondContact O-CG 3.4Å; G501-Q555 PolarHBondContact N-O 3.2Å; E502-Q555 HydrophobicContact CB-CB 4.33Å; E502-Q555 PolarHBondContact O-N 3.49Å; Q555-S557 PolarHBondContact NE2-O 3.04Å; Q555-S557 PolarHBondContact O-N 3.39Å; Q555-V562 PolarHBondContact NE2-O 2.96Å; Q555-V562 VanDerWaalsContact NE2-O 3.12Å; Q555-S563 PolarHBondContact OE1-OG 3.13Å
556	V	96.9	Very high	94.7	Very high	5 Å²	5	24.1 Å²	24.1	3%	0.03	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	-22.8	-174.2	-60.4	0	0	0	0	114.1	E554 V562 P767 F770 W777	E554-V556 HydrophobicContact CB-CG1 4.3Å; E554-V556 HydrophobicContact CG-CG1 4.35Å; E554-V556 PolarHBondContact O-N 3.38Å; E554-V556 VanDerWaalsContact O-N 3.11Å; V556-V562 HydrophobicContact CG2-CB 3.87Å; V556-V562 HydrophobicContact CG2-CG1 3.77Å; V556-V562 WeakPolarHBondContact CG2-O 3.41Å; V556-V562 PolarHBondContact N-O 2.82Å; V556-P767 HydrophobicContact CB-CB 4.33Å; V556-P767 HydrophobicContact CB-CG 3.9Å; V556-P767 HydrophobicContact CG1-CB 4.03Å; V556-P767 HydrophobicContact CG1-CG 4.14Å; V556-F770 HydrophobicContact CG1-CB 3.77Å; V556-F770 HydrophobicContact CG1-CD2 3.97Å; V556-F770 HydrophobicContact CG1-CG 4.04Å; V556-W777 HydrophobicContact CB-CD2 3.9Å; V556-W777 HydrophobicContact CB-CE3 3.86Å; V556-W777 HydrophobicContact CB-CH2 4.03Å; V556-W777 HydrophobicContact CB-CZ2 4.07Å; V556-W777 HydrophobicContact CB-CZ3 3.95Å; V556-W777 HydrophobicContact CG1-CD2 4.32Å; V556-W777 HydrophobicContact CG1-CE3 4.09Å; V556-W777 HydrophobicContact CG1-CZ3 4.46Å; V556-W777 HydrophobicContact CG2-CD2 3.57Å; V556-W777 VanDerWaalsContact CG2-CE2 3.47Å; V556-W777 HydrophobicContact CG2-CE3 4.08Å; V556-W777 HydrophobicContact CG2-CG 3.86Å; V556-W777 HydrophobicContact CG2-CH2 4.36Å; V556-W777 HydrophobicContact CG2-CZ2 3.89Å; V556-W777 HydrophobicContact CG2-CZ3 4.46Å
557	S	93.7	Very high	95.1	Very high	27 Å²	27	22 Å²	22	19%	0.189	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	151	175.5	174.6	0	0	0	0	111.5	Q555 P560 P561 V562	Q555-S557 PolarHBondContact NE2-O 3.04Å; Q555-S557 PolarHBondContact O-N 3.39Å; S557-P560 CarbonylContact C-O 3.39Å; S557-P560 VanDerWaalsContact CB-O 3.32Å; S557-P560 WeakPolarHBondContact CB-O 3.48Å; S557-P560 PolarHBondContact OG-O 2.84Å; S557-P561 CarbonylContact O-C 3.4Å; S557-P561 WeakPolarHBondContact O-CA 3.44Å; S557-V562 PolarHBondContact N-O 3.42Å; S557-V562 VanDerWaalsContact N-O 3.12Å; S557-V562 PolarHBondContact O-N 3.27Å
558	H	87.7	Confident	95.2	Very high	26 Å²	26	21.6 Å²	21.6	12%	0.12	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	-27.8	176.3	-166.6	76.1	0	0	0	113.4	P498 L500 P560 P561 Q751	P498-H558 PolarHBondContact O-ND1 2.86Å; L500-H558 HydrophobicContact CB-CB 4.21Å; L500-H558 HydrophobicContact CD1-CB 4.41Å; H558-P560 CarbonylContact C-O 3.53Å; H558-P560 VanDerWaalsContact C-O 3.26Å; H558-P560 PolarHBondContact N-O 2.74Å; H558-P560 CarbonylContact O-C 3.58Å; H558-P560 VanDerWaalsContact O-C 3.28Å; H558-P561 WeakPolarHBondContact O-CA 3.31Å; H558-P561 WeakPolarHBondContact O-CD 3.49Å; H558-P561 VanDerWaalsContact O-N 3.1Å; H558-Q751 PolarHBondContact CD2-NE2 3.16Å; H558-Q751 PolarHBondContact CE1-NE2 2.9Å; H558-Q751 PolarHBondContact ND1-NE2 3.43Å; H558-Q751 VanDerWaalsContact ND1-NE2 3.16Å
559	H	84	Confident	95.2	Very high	135 Å²	135	19.6 Å²	19.6	63%	0.625	10%	0.102	S	C	*	.	T	Hydrogen-bonded Turn	trans	-133.7	89.5	179.6	-70.1	-24.5	0	0	0	110.8	E755	H559-E755 IonicContact CD2-OE1 2.82Å
560	P	85.3	Confident	95.1	Very high	74 Å²	74	24.8 Å²	24.8	48%	0.481	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	cis	-71.8	159.4	-0.5	31.3	-36	0	0	0	113.1	S557 H558 V562	S557-P560 CarbonylContact C-O 3.39Å; S557-P560 VanDerWaalsContact CB-O 3.32Å; S557-P560 WeakPolarHBondContact CB-O 3.48Å; S557-P560 PolarHBondContact OG-O 2.84Å; H558-P560 CarbonylContact C-O 3.53Å; H558-P560 VanDerWaalsContact C-O 3.26Å; H558-P560 PolarHBondContact N-O 2.74Å; H558-P560 CarbonylContact O-C 3.58Å; H558-P560 VanDerWaalsContact O-C 3.28Å; P560-V562 HydrophobicContact CG-CG2 4.22Å; P560-V562 PolarHBondContact O-N 3.49Å; P560-V562 VanDerWaalsContact O-N 3.1Å
561	P	90.4	Very high	94.9	Very high	25 Å²	25	26.4 Å²	26.4	16%	0.162	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	95.6	-177.1	30.4	-34.3	0	0	0	111.1	S557 H558 W581	S557-P561 CarbonylContact O-C 3.4Å; S557-P561 WeakPolarHBondContact O-CA 3.44Å; H558-P561 WeakPolarHBondContact O-CA 3.31Å; H558-P561 WeakPolarHBondContact O-CD 3.49Å; H558-P561 VanDerWaalsContact O-N 3.1Å; P561-W581 WeakPolarHBondContact O-CA 3.19Å; P561-W581 WeakPolarHBondContact O-CB 3.41Å
562	V	95.4	Very high	94.7	Very high	5 Å²	5	25.7 Å²	25.7	3%	0.03	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	129.7	179.2	-169.6	0	0	0	0	110.3	Q555 V556 S557 P560 H579 W581	Q555-V562 PolarHBondContact NE2-O 2.96Å; Q555-V562 VanDerWaalsContact NE2-O 3.12Å; V556-V562 HydrophobicContact CG2-CB 3.87Å; V556-V562 HydrophobicContact CG2-CG1 3.77Å; V556-V562 WeakPolarHBondContact CG2-O 3.41Å; V556-V562 PolarHBondContact N-O 2.82Å; S557-V562 PolarHBondContact N-O 3.42Å; S557-V562 VanDerWaalsContact N-O 3.12Å; S557-V562 PolarHBondContact O-N 3.27Å; P560-V562 HydrophobicContact CG-CG2 4.22Å; P560-V562 PolarHBondContact O-N 3.49Å; P560-V562 VanDerWaalsContact O-N 3.1Å; V562-H579 HydrophobicContact CG1-CB 4.44Å; V562-W581 HydrophobicContact CB-CB 4.48Å; V562-W581 HydrophobicContact CB-CE3 4.35Å; V562-W581 HydrophobicContact CG1-CE3 3.89Å; V562-W581 HydrophobicContact CG2-CB 4.06Å; V562-W581 HydrophobicContact CG2-CD2 4.15Å; V562-W581 HydrophobicContact CG2-CE3 3.63Å; V562-W581 HydrophobicContact CG2-CG 4.39Å; V562-W581 HydrophobicContact CG2-CZ3 4.37Å
563	S	97.7	Very high	94.6	Very high	1 Å²	1	28 Å²	28	1%	0.007	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	132.5	170.3	-45.9	0	0	0	0	109.4	E554 Q555 H579 V580	E554-S563 CarbonylContact O-C 3.48Å; E554-S563 WeakPolarHBondContact O-CA 3.46Å; Q555-S563 PolarHBondContact OE1-OG 3.13Å; S563-H579 CarbonylContact O-C 3.56Å; S563-H579 VanDerWaalsContact O-CA 3.32Å; S563-H579 WeakPolarHBondContact O-CA 3.45Å; S563-V580 PolarHBondContact N-O 3.44Å; S563-V580 PolarHBondContact O-N 3.4Å
564	G	98	Very high	94.5	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	144	168.3	0	0	0	0	0	110.6	A553 E554 F770	A553-G564 CarbonylContact C-O 3.58Å; A553-G564 VanDerWaalsContact CA-O 3.26Å; A553-G564 WeakPolarHBondContact CA-O 3.4Å; E554-G564 PolarHBondContact N-O 2.85Å; E554-G564 PolarHBondContact O-N 3.45Å; G564-F770 VanDerWaalsContact C-CZ 3.42Å
565	F	98	Very high	94.5	Very high	10 Å²	10	28 Å²	28	4%	0.044	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	137.7	-178.1	-54.4	-81.3	0	0	0	110.2	L446 Y449 F551 V552 A553 A578 V580	L446-F565 HydrophobicContact CD2-CE1 4.21Å; L446-F565 HydrophobicContact CD2-CZ 4.46Å; Y449-F565 HydrophobicContact CD1-CE2 4.45Å; Y449-F565 HydrophobicContact CD1-CZ 4.26Å; Y449-F565 AromaticContact CD2-CE1 3.86Å; Y449-F565 HydrophobicContact CD2-CE1 3.86Å; Y449-F565 HydrophobicContact CD2-CE2 4.18Å; Y449-F565 AromaticContact CD2-CZ 3.4Å; Y449-F565 HydrophobicContact CD2-CZ 3.4Å; Y449-F565 HydrophobicContact CE2-CE2 4.39Å; Y449-F565 AromaticContact CE2-CZ 3.93Å; Y449-F565 HydrophobicContact CE2-CZ 3.93Å; Y449-F565 HydrophobicContact CG-CD1 4.46Å; Y449-F565 AromaticContact CG-CE1 3.74Å; Y449-F565 HydrophobicContact CG-CE1 3.74Å; Y449-F565 HydrophobicContact CG-CE2 4.23Å; Y449-F565 AromaticContact CG-CZ 3.6Å; Y449-F565 HydrophobicContact CG-CZ 3.6Å; F551-F565 HydrophobicContact CE2-CD1 4.31Å; F551-F565 AromaticContact CZ-CD1 3.72Å; F551-F565 HydrophobicContact CZ-CD1 3.72Å; F551-F565 HydrophobicContact CZ-CE1 4.42Å; V552-F565 CarbonylContact O-C 3.59Å; A553-F565 HydrophobicContact CB-CD1 3.57Å; A553-F565 HydrophobicContact CB-CE1 3.89Å; F565-A578 HydrophobicContact CB-CB 4.36Å; F565-A578 PolarHBondContact N-O 3.47Å; F565-A578 PolarHBondContact O-N 2.79Å; F565-A578 VanDerWaalsContact O-O 3.12Å; F565-V580 HydrophobicContact CD2-CG2 4.2Å; F565-V580 HydrophobicContact CE2-CB 4.07Å; F565-V580 HydrophobicContact CE2-CG2 3.86Å
566	Y	98.2	Very high	94.5	Very high	4 Å²	4	29 Å²	29	2%	0.016	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	136.4	175.3	-179.5	-99.2	0	0	0	109.9	F551 V552 E568 C575 V576 N577 Y779 P782 L783 W784	F551-Y566 CarbonylContact C-O 3.57Å; F551-Y566 WeakPolarHBondContact CA-O 3.38Å; V552-Y566 PolarHBondContact N-O 2.82Å; V552-Y566 PolarHBondContact O-N 2.81Å; Y566-E568 HydrophobicContact CE1-CB 3.8Å; Y566-E568 HydrophobicContact CE1-CG 3.81Å; Y566-E568 VanDerWaalsContact CE1-OE2 3.31Å; Y566-E568 WeakPolarHBondContact CE1-OE2 3.38Å; Y566-E568 PolarHBondContact OH-OE2 2.79Å; Y566-C575 HydrophobicContact CE2-CB 4.05Å; Y566-V576 CarbonylContact C-O 3.55Å; Y566-V576 VanDerWaalsContact CA-O 3.3Å; Y566-V576 WeakPolarHBondContact CA-O 3.11Å; Y566-V576 WeakPolarHBondContact CD2-O 3.49Å; Y566-N577 HydrophobicContact CD2-CB 4.18Å; Y566-Y779 AromaticContact CD1-CD1 3.51Å; Y566-Y779 HydrophobicContact CD1-CD1 3.51Å; Y566-Y779 HydrophobicContact CD1-CD2 4.13Å; Y566-Y779 AromaticContact CD1-CE1 3.64Å; Y566-Y779 HydrophobicContact CD1-CE1 3.64Å; Y566-Y779 HydrophobicContact CD1-CE2 4.23Å; Y566-Y779 AromaticContact CD1-CG 3.78Å; Y566-Y779 HydrophobicContact CD1-CG 3.78Å; Y566-Y779 AromaticContact CD2-CD1 3.84Å; Y566-Y779 HydrophobicContact CD2-CD1 3.84Å; Y566-Y779 AromaticContact CD2-CG 3.77Å; Y566-Y779 HydrophobicContact CD2-CG 3.77Å; Y566-Y779 AromaticContact CE1-CD1 3.59Å; Y566-Y779 HydrophobicContact CE1-CD1 3.59Å; Y566-Y779 AromaticContact CE1-CE1 3.63Å; Y566-Y779 HydrophobicContact CE1-CE1 3.63Å; Y566-Y779 HydrophobicContact CE1-CG 4.31Å; Y566-Y779 AromaticContact CE2-CD1 3.92Å; Y566-Y779 HydrophobicContact CE2-CD1 3.92Å; Y566-Y779 HydrophobicContact CE2-CG 4.3Å; Y566-Y779 AromaticContact CG-CD1 3.63Å; Y566-Y779 HydrophobicContact CG-CD1 3.63Å; Y566-Y779 AromaticContact CG-CD2 3.93Å; Y566-Y779 HydrophobicContact CG-CD2 3.93Å; Y566-Y779 HydrophobicContact CG-CE1 4.22Å; Y566-Y779 HydrophobicContact CG-CE2 4.47Å; Y566-Y779 AromaticContact CG-CG 3.48Å; Y566-Y779 HydrophobicContact CG-CG 3.48Å; Y566-Y779 VanDerWaalsContact CG-CG 3.48Å; Y566-Y779 AromaticContact CZ-CD1 3.8Å; Y566-P782 HydrophobicContact CE2-CB 3.94Å; Y566-L783 PolarHBondContact OH-N 3.35Å; Y566-W784 HydrophobicContact CE2-CZ3 4.12Å
567	C	97.7	Very high	94.5	Very high	5 Å²	5	29 Å²	29	3%	0.034	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	135.2	178.7	-167.2	0	0	0	0	109.9	V549 R550 F551 C575 V576	V549-C567 WeakPolarHBondContact CG1-SG 3.4Å; R550-C567 CarbonylContact O-C 3.52Å; R550-C567 WeakPolarHBondContact O-CA 3.11Å; R550-C567 PolarHBondContact O-SG 3.4Å; F551-C567 HydrophobicContact CD2-CB 4.17Å; C567-C575 CarbonylContact O-C 3.47Å; C567-C575 WeakPolarHBondContact O-CA 3.32Å; C567-C575 WeakPolarHBondContact O-CB 3.43Å; C567-V576 HydrophobicContact CB-CB 4.31Å; C567-V576 PolarHBondContact N-O 2.91Å; C567-V576 PolarHBondContact O-N 2.81Å
568	E	97	Very high	94.7	Very high	8 Å²	8	28.3 Å²	28.3	4%	0.037	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	151.8	179.4	67.1	172.5	-149.3	0	0	113.7	V549 R550 Y566 R570 C575	V549-E568 CarbonylContact C-O 3.55Å; V549-E568 WeakPolarHBondContact CA-O 3.49Å; R550-E568 HydrophobicContact CB-CG 4.3Å; R550-E568 IonicContact CZ-OE1 3.84Å; R550-E568 PolarHBondContact N-O 3.03Å; R550-E568 IonicContact NE-OE1 2.69Å; R550-E568 IonicContact NH2-OE1 3.63Å; R550-E568 PolarHBondContact NH2-OE1 2.8Å; R550-E568 PolarHBondContact O-N 2.85Å; Y566-E568 HydrophobicContact CE1-CB 3.8Å; Y566-E568 HydrophobicContact CE1-CG 3.81Å; Y566-E568 VanDerWaalsContact CE1-OE2 3.31Å; Y566-E568 WeakPolarHBondContact CE1-OE2 3.38Å; Y566-E568 PolarHBondContact OH-OE2 2.79Å; E568-R570 IonicContact OE1-CZ 2.61Å; E568-R570 IonicContact OE1-NE 2.71Å; E568-R570 PolarHBondContact OE1-NE 2.8Å; E568-R570 IonicContact OE1-NH2 2.68Å; E568-R570 PolarHBondContact OE1-NH2 3.19Å; E568-R570 VanDerWaalsContact OE1-NH2 3.09Å; E568-R570 IonicContact OE2-NE 3.63Å; E568-C575 HydrophobicContact CB-CB 3.84Å
569	C	96.8	Very high	95.1	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	115.3	157.3	-177.5	0	0	0	0	108.2	L460 R548 V549 R572 Q573 M574	L460-C569 HydrophobicContact CD2-CB 3.43Å; L460-C569 VanDerWaalsContact CD2-CB 3.43Å; R548-C569 PolarHBondContact O-SG 2.88Å; R548-C569 VanDerWaalsContact O-SG 3.35Å; V549-C569 HydrophobicContact CG2-CB 4.39Å; C569-R572 HydrophobicContact CB-CB 4.31Å; C569-Q573 PolarHBondContact O-N 2.88Å; C569-Q573 VanDerWaalsContact O-N 3.16Å; C569-M574 HydrophobicContact CB-CG 4.41Å; C569-M574 PolarHBondContact N-O 2.78Å; C569-M574 PolarHBondContact O-N 3.3Å
570	R	93.9	Very high	95.6	Very high	110 Å²	110	21.6 Å²	21.6	42%	0.415	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-36.2	-174.8	-59.8	-163	176.6	177.8	-0.5	111.1	E568 R572 Q573 L783	E568-R570 IonicContact OE1-CZ 2.61Å; E568-R570 IonicContact OE1-NE 2.71Å; E568-R570 PolarHBondContact OE1-NE 2.8Å; E568-R570 IonicContact OE1-NH2 2.68Å; E568-R570 PolarHBondContact OE1-NH2 3.19Å; E568-R570 VanDerWaalsContact OE1-NH2 3.09Å; E568-R570 IonicContact OE2-NE 3.63Å; R570-R572 PolarHBondContact O-N 2.86Å; R570-Q573 PolarHBondContact O-N 2.86Å; R570-Q573 PolarHBondContact O-NE2 3.06Å; R570-L783 HydrophobicContact CB-CD1 4.37Å; R570-L783 HydrophobicContact CG-CD1 3.83Å
571	E	93.4	Very high	96	Very high	85 Å²	85	20.9 Å²	20.9	40%	0.397	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-20.2	179.4	-52	95.4	102.5	0	0	113	Y547 R548	Y547-E571 HydrophobicContact CD1-CB 3.85Å; Y547-E571 HydrophobicContact CE1-CB 4.33Å; R548-E571 PolarHBondContact N-OE1 3.48Å
572	R	92.5	Very high	96	Very high	3 Å²	3	21.3 Å²	21.3	1%	0.011	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	9.7	173	-73.5	-67.9	-169.3	134.6	2.3	113	L460 T463 V515 K516 L518 Y547 C569 R570 M574	L460-R572 HydrophobicContact CD2-CB 4.15Å; L460-R572 HydrophobicContact CD2-CG 4.1Å; T463-R572 HydrophobicContact CG2-CB 4.12Å; V515-R572 VanDerWaalsContact CG1-NH2 3.28Å; K516-R572 PolarHBondContact O-NH2 2.84Å; L518-R572 VanDerWaalsContact CD2-NH1 3.34Å; Y547-R572 HydrophobicContact CD1-CG 3.89Å; Y547-R572 HydrophobicContact CE1-CG 3.86Å; Y547-R572 HydrophobicContact CG-CG 4.49Å; Y547-R572 PolarHBondContact OH-NE 3.1Å; Y547-R572 PolarHBondContact OH-NH2 3.05Å; Y547-R572 VanDerWaalsContact OH-NH2 3.11Å; C569-R572 HydrophobicContact CB-CB 4.31Å; R570-R572 PolarHBondContact O-N 2.86Å; R572-M574 HydrophobicContact CB-CG 4Å; R572-M574 HydrophobicContact CB-SD 4.15Å; R572-M574 PolarHBondContact O-N 3.3Å; R572-M574 VanDerWaalsContact O-N 3.09Å
573	Q	95.1	Very high	95.7	Very high	64 Å²	64	27.1 Å²	27.1	30%	0.299	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.5	46	176.6	-68.8	-68.5	-66.8	0	0	113	C569 R570 L604 E605	C569-Q573 PolarHBondContact O-N 2.88Å; C569-Q573 VanDerWaalsContact O-N 3.16Å; R570-Q573 PolarHBondContact O-N 2.86Å; R570-Q573 PolarHBondContact O-NE2 3.06Å; Q573-L604 HydrophobicContact CB-CB 4.28Å; Q573-L604 VanDerWaalsContact O-CB 3.22Å; Q573-L604 WeakPolarHBondContact O-CB 3.48Å; Q573-L604 VanDerWaalsContact O-CG 3.25Å; Q573-L604 WeakPolarHBondContact O-CG 3.41Å; Q573-L604 PolarHBondContact O-N 2.94Å; Q573-E605 HydrophobicContact CB-CG 3.96Å; Q573-E605 HydrophobicContact CG-CG 4.47Å
574	M	96.6	Very high	95.3	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	148.3	-176.7	67	178.6	-61.7	0	0	112.1	F459 L460 I462 T463 C569 R572 L601 C602 L603	F459-M574 HydrophobicContact CD1-CE 4.17Å; F459-M574 HydrophobicContact CD2-CE 4.11Å; F459-M574 HydrophobicContact CE1-CE 3.8Å; F459-M574 HydrophobicContact CE1-SD 4.38Å; F459-M574 HydrophobicContact CE2-CE 3.74Å; F459-M574 HydrophobicContact CG-CE 4.32Å; F459-M574 HydrophobicContact CZ-CE 3.58Å; F459-M574 WeakPolarHBondContact O-CE 3.41Å; L460-M574 HydrophobicContact CD2-CG 4.5Å; L460-M574 HydrophobicContact CD2-SD 3.91Å; I462-M574 HydrophobicContact CB-CE 4.49Å; T463-M574 HydrophobicContact CG2-SD 4.06Å; C569-M574 HydrophobicContact CB-CG 4.41Å; C569-M574 PolarHBondContact N-O 2.78Å; C569-M574 PolarHBondContact O-N 3.3Å; R572-M574 HydrophobicContact CB-CG 4Å; R572-M574 HydrophobicContact CB-SD 4.15Å; R572-M574 PolarHBondContact O-N 3.3Å; R572-M574 VanDerWaalsContact O-N 3.09Å; M574-L601 HydrophobicContact CE-CD1 3.87Å; M574-C602 WeakPolarHBondContact CA-O 3.48Å; M574-L603 HydrophobicContact CB-CD2 4.03Å; M574-L603 HydrophobicContact CE-CD2 3.81Å
575	C	97.6	Very high	94.9	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	159.8	179.5	56.9	0	0	0	0	112.7	Y566 C567 E568 L601 C602 L783	Y566-C575 HydrophobicContact CE2-CB 4.05Å; C567-C575 CarbonylContact O-C 3.47Å; C567-C575 WeakPolarHBondContact O-CA 3.32Å; C567-C575 WeakPolarHBondContact O-CB 3.43Å; E568-C575 HydrophobicContact CB-CB 3.84Å; C575-L601 WeakPolarHBondContact O-CA 3.41Å; C575-C602 PolarHBondContact N-O 3.03Å; C575-C602 VanDerWaalsContact N-O 3.07Å; C575-C602 PolarHBondContact O-N 3.14Å; C575-L783 HydrophobicContact CB-CB 4.32Å
576	V	98.1	Very high	94.4	Very high	21 Å²	21	32.5 Å²	32.5	13%	0.127	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	131.3	172.8	176.1	0	0	0	0	108.4	F459 Y566 C567 A578 V600 L601 F612	F459-V576 HydrophobicContact CE2-CG2 3.61Å; F459-V576 HydrophobicContact CZ-CG2 3.82Å; Y566-V576 CarbonylContact C-O 3.55Å; Y566-V576 VanDerWaalsContact CA-O 3.3Å; Y566-V576 WeakPolarHBondContact CA-O 3.11Å; Y566-V576 WeakPolarHBondContact CD2-O 3.49Å; C567-V576 HydrophobicContact CB-CB 4.31Å; C567-V576 PolarHBondContact N-O 2.91Å; C567-V576 PolarHBondContact O-N 2.81Å; V576-A578 HydrophobicContact CG1-CB 4.49Å; V576-V600 CarbonylContact C-O 3.43Å; V576-V600 VanDerWaalsContact CA-O 3.26Å; V576-V600 WeakPolarHBondContact CA-O 3.47Å; V576-L601 HydrophobicContact CG2-CB 4.1Å; V576-L601 HydrophobicContact CG2-CD1 3.75Å; V576-F612 HydrophobicContact CG1-CE1 4.07Å; V576-F612 HydrophobicContact CG1-CZ 3.88Å
577	N	97.6	Very high	93.6	Very high	5 Å²	5	36.3 Å²	36.3	3%	0.027	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	125.1	165.3	179.8	99.1	0	0	0	108.8	Y566 G599 V600 W777 I778 Y779 W784	Y566-N577 HydrophobicContact CD2-CB 4.18Å; N577-G599 CarbonylContact O-C 3.59Å; N577-G599 WeakPolarHBondContact O-CA 3.42Å; N577-V600 PolarHBondContact N-O 2.9Å; N577-V600 PolarHBondContact O-N 3.48Å; N577-W777 PolarHBondContact ND2-O 3.33Å; N577-I778 WeakPolarHBondContact OD1-CA 3.34Å; N577-Y779 PolarHBondContact OD1-N 3.07Å; N577-W784 HydrophobicContact CB-CH2 3.71Å; N577-W784 HydrophobicContact CB-CZ3 4.19Å
578	A	97.4	Very high	92.8	Very high	13 Å²	13	36.3 Å²	36.3	11%	0.107	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	156.4	179.9	0	0	0	0	0	111.9	F565 V576 E598	F565-A578 HydrophobicContact CB-CB 4.36Å; F565-A578 PolarHBondContact N-O 3.47Å; F565-A578 PolarHBondContact O-N 2.79Å; F565-A578 VanDerWaalsContact O-O 3.12Å; V576-A578 HydrophobicContact CG1-CB 4.49Å; A578-E598 VanDerWaalsContact CA-O 3.31Å; A578-E598 WeakPolarHBondContact CA-O 3.39Å
579	H	96.6	Very high	92	Very high	14 Å²	14	40.7 Å²	40.7	7%	0.065	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	140.9	169.1	67.4	-81.6	0	0	0	109.3	V562 S563 W581 G597 E598 W777	V562-H579 HydrophobicContact CG1-CB 4.44Å; S563-H579 CarbonylContact O-C 3.56Å; S563-H579 VanDerWaalsContact O-CA 3.32Å; S563-H579 WeakPolarHBondContact O-CA 3.45Å; H579-W581 AromaticContact CD2-CZ3 3.83Å; H579-G597 WeakPolarHBondContact O-CA 3.46Å; H579-E598 PolarHBondContact N-O 2.79Å; H579-E598 PolarHBondContact O-N 3.41Å; H579-W777 HydrophobicContact CB-CB 4.07Å; H579-W777 HydrophobicContact CB-CG 4.49Å
580	V	94.8	Very high	91.6	Very high	6 Å²	6	41.2 Å²	41.2	4%	0.036	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	138.7	-177.7	-165.5	0	0	0	0	110.8	Y449 S563 F565 M595 V596 L614	Y449-V580 HydrophobicContact CE1-CG2 4.25Å; Y449-V580 WeakPolarHBondContact OH-CG1 3.32Å; S563-V580 PolarHBondContact N-O 3.44Å; S563-V580 PolarHBondContact O-N 3.4Å; F565-V580 HydrophobicContact CD2-CG2 4.2Å; F565-V580 HydrophobicContact CE2-CB 4.07Å; F565-V580 HydrophobicContact CE2-CG2 3.86Å; V580-M595 HydrophobicContact CG1-CB 4.28Å; V580-V596 CarbonylContact C-O 3.51Å; V580-V596 WeakPolarHBondContact CA-O 3.35Å; V580-L614 HydrophobicContact CB-CD1 4.49Å; V580-L614 HydrophobicContact CG1-CD1 4.08Å; V580-L614 HydrophobicContact CG2-CD1 3.52Å
581	W	92.3	Very high	91.4	Very high	60 Å²	60	37.2 Å²	37.2	23%	0.227	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	168.1	159	64.8	85.5	0	0	0	110.6	P561 V562 H579 V596	P561-W581 WeakPolarHBondContact O-CA 3.19Å; P561-W581 WeakPolarHBondContact O-CB 3.41Å; V562-W581 HydrophobicContact CB-CB 4.48Å; V562-W581 HydrophobicContact CB-CE3 4.35Å; V562-W581 HydrophobicContact CG1-CE3 3.89Å; V562-W581 HydrophobicContact CG2-CB 4.06Å; V562-W581 HydrophobicContact CG2-CD2 4.15Å; V562-W581 HydrophobicContact CG2-CE3 3.63Å; V562-W581 HydrophobicContact CG2-CG 4.39Å; V562-W581 HydrophobicContact CG2-CZ3 4.37Å; H579-W581 AromaticContact CD2-CZ3 3.83Å; W581-V596 HydrophobicContact CD2-CB 4.36Å; W581-V596 HydrophobicContact CD2-CG1 4.36Å; W581-V596 HydrophobicContact CG-CB 4.34Å; W581-V596 HydrophobicContact CH2-CG1 4.48Å; W581-V596 HydrophobicContact CZ2-CB 4.45Å; W581-V596 HydrophobicContact CZ2-CG1 3.61Å; W581-V596 PolarHBondContact N-O 2.68Å; W581-V596 PolarHBondContact O-N 3.13Å
582	T	91.3	Very high	91.3	Very high	33 Å²	33	33.4 Å²	33.4	20%	0.202	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	144.4	-178.5	67.6	0	0	0	0	112.1	V593 S594 M595	T582-V593 HydrophobicContact CG2-CG1 4.04Å; T582-S594 WeakPolarHBondContact CA-O 3.38Å; T582-M595 HydrophobicContact CG2-SD 3.59Å; T582-M595 VanDerWaalsContact CG2-SD 3.59Å
583	K	88.7	Confident	91.3	Very high	127 Å²	127	34.7 Å²	34.7	55%	0.552	18%	0.175	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-115.9	114.6	167.4	-66.9	-178.7	180	175.3	0	108.1	V593 S594 V596	K583-V593 WeakPolarHBondContact O-CA 3.01Å; K583-S594 PolarHBondContact N-O 2.79Å; K583-S594 PolarHBondContact O-N 2.97Å; K583-V596 HydrophobicContact CD-CG2 4.15Å; K583-V596 HydrophobicContact CG-CG2 4.25Å
584	S	90.1	Very high	91.2	Very high	24 Å²	24	34.1 Å²	34.1	17%	0.168	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	127.2	-173.5	-63.4	0	0	0	0	111.3	D429 L430 G592	D429-S584 WeakPolarHBondContact CA-O 3.28Å; L430-S584 PolarHBondContact N-O 2.89Å; S584-G592 CarbonylContact C-O 3.51Å; S584-G592 WeakPolarHBondContact CA-O 3.44Å
585	K	88.8	Confident	90.9	Very high	99 Å²	99	35.9 Å²	35.9	43%	0.43	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	130.3	-175.2	-171	168.5	-172.1	167.4	0	111.3	G427 M587 G592	G427-K585 WeakPolarHBondContact O-CE 3.42Å; K585-M587 PolarHBondContact O-N 3Å; K585-G592 PolarHBondContact N-O 3.44Å; K585-G592 PolarHBondContact O-N 3.34Å
586	F	87.4	Confident	90.7	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.009	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	126.8	172.5	-174.4	-114.6	0	0	0	111.2	L79 L421 L424 K425 G427 M428 L430 G588 V591 I622	L79-F586 HydrophobicContact CD1-CE2 4.34Å; L79-F586 HydrophobicContact CD1-CZ 3.71Å; L79-F586 HydrophobicContact CG-CZ 4.16Å; L421-F586 HydrophobicContact CD2-CE2 3.68Å; L421-F586 HydrophobicContact CD2-CZ 4.16Å; L424-F586 HydrophobicContact CB-CD1 3.81Å; L424-F586 HydrophobicContact CB-CD2 4.17Å; L424-F586 HydrophobicContact CB-CE1 3.8Å; L424-F586 HydrophobicContact CB-CE2 4.15Å; L424-F586 HydrophobicContact CB-CG 3.99Å; L424-F586 HydrophobicContact CB-CZ 3.97Å; L424-F586 HydrophobicContact CD1-CD2 3.46Å; L424-F586 VanDerWaalsContact CD1-CD2 3.46Å; L424-F586 HydrophobicContact CD1-CE2 3.57Å; L424-F586 HydrophobicContact CD1-CG 4.01Å; L424-F586 HydrophobicContact CD1-CZ 4.21Å; L424-F586 HydrophobicContact CG-CD2 4.46Å; K425-F586 WeakPolarHBondContact O-CD1 3.25Å; G427-F586 WeakPolarHBondContact CA-O 3.31Å; G427-F586 PolarHBondContact N-O 3.29Å; M428-F586 PolarHBondContact O-N 2.98Å; L430-F586 HydrophobicContact CD1-CB 4.16Å; L430-F586 HydrophobicContact CD2-CB 4.11Å; L430-F586 HydrophobicContact CG-CB 4.25Å; F586-G588 VanDerWaalsContact CE2-O 3.3Å; F586-G588 WeakPolarHBondContact CE2-O 3.49Å; F586-G588 VanDerWaalsContact CZ-O 3.3Å; F586-G588 WeakPolarHBondContact CZ-O 3.31Å; F586-V591 HydrophobicContact CD2-CG2 4.4Å; F586-I622 HydrophobicContact CD2-CD1 4.29Å; F586-I622 HydrophobicContact CE2-CD1 3.68Å
587	M	82.8	Confident	90.4	Very high	84 Å²	84	37.9 Å²	37.9	41%	0.414	20%	0.203	S	C	.	.			trans	-116.6	19.4	-176.4	-59.7	-178	70.6	0	0	112.9	L426 K585 M589 S590 Y618	L426-M587 VanDerWaalsContact CD1-CA 3.43Å; K585-M587 PolarHBondContact O-N 3Å; M587-M589 PolarHBondContact O-N 3.31Å; M587-S590 CarbonylContact C-O 3.51Å; M587-S590 VanDerWaalsContact CA-O 3.31Å; M587-S590 WeakPolarHBondContact CA-O 3.43Å; M587-S590 WeakPolarHBondContact CB-O 3.24Å; M587-S590 PolarHBondContact N-O 3.15Å; M587-Y618 HydrophobicContact CE-CE1 4.35Å; M587-Y618 HydrophobicContact SD-CD1 3.94Å; M587-Y618 HydrophobicContact SD-CE1 3.84Å
588	G	80.9	Confident	90.2	Very high	5 Å²	5	41.9 Å²	41.9	5%	0.052	22%	0.222	C	C	.	.	S	Bend	trans	83.7	-102.8	-176.4	0	0	0	0	0	109.8	L426 F586 S590 I622	L426-G588 VanDerWaalsContact CD1-N 3.34Å; F586-G588 VanDerWaalsContact CE2-O 3.3Å; F586-G588 WeakPolarHBondContact CE2-O 3.49Å; F586-G588 VanDerWaalsContact CZ-O 3.3Å; F586-G588 WeakPolarHBondContact CZ-O 3.31Å; G588-S590 PolarHBondContact O-N 3.08Å; G588-I622 WeakPolarHBondContact O-CD1 3.43Å
589	M	79.6	Confident	90.2	Very high	99 Å²	99	41.3 Å²	41.3	49%	0.488	22%	0.218	S	C	.	.	S	Bend	trans	-72.7	7.9	177.6	-63.5	-59	-61.2	0	0	114.2	L79 M587 S621 L623	L79-M589 HydrophobicContact CD2-CG 4.46Å; L79-M589 HydrophobicContact CD2-SD 3.59Å; L79-M589 VanDerWaalsContact CD2-SD 3.59Å; M587-M589 PolarHBondContact O-N 3.31Å; M589-S621 PolarHBondContact O-N 3.29Å; M589-L623 HydrophobicContact CE-CB 4.14Å; M589-L623 HydrophobicContact CE-CD1 4Å; M589-L623 HydrophobicContact CE-CG 4.49Å; M589-L623 HydrophobicContact SD-CD1 3.79Å
590	S	87.5	Confident	90.2	Very high	11 Å²	11	42 Å²	42	8%	0.077	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	163.4	-175.9	-56.2	0	0	0	0	111.1	M587 G588 A619 R620	M587-S590 CarbonylContact C-O 3.51Å; M587-S590 VanDerWaalsContact CA-O 3.31Å; M587-S590 WeakPolarHBondContact CA-O 3.43Å; M587-S590 WeakPolarHBondContact CB-O 3.24Å; M587-S590 PolarHBondContact N-O 3.15Å; G588-S590 PolarHBondContact O-N 3.08Å; S590-A619 CarbonylContact C-O 3.52Å; S590-A619 WeakPolarHBondContact CA-O 3.5Å; S590-A619 WeakPolarHBondContact CB-O 3.5Å; S590-R620 VanDerWaalsContact OG-CD 3.24Å; S590-R620 WeakPolarHBondContact OG-CD 3.26Å; S590-R620 PolarHBondContact OG-NH1 3.06Å
591	V	90.3	Very high	90.4	Very high	26 Å²	26	41.7 Å²	41.7	16%	0.158	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	126.7	164.6	171.7	0	0	0	0	108.1	L430 F586 V593 Y618 A619 I622	L430-V591 HydrophobicContact CD1-CB 4.14Å; L430-V591 HydrophobicContact CD1-CG1 3.53Å; L430-V591 HydrophobicContact CD1-CG2 3.51Å; F586-V591 HydrophobicContact CD2-CG2 4.4Å; V591-V593 HydrophobicContact CG1-CG2 4.13Å; V591-Y618 CarbonylContact O-C 3.59Å; V591-Y618 VanDerWaalsContact O-CA 3.25Å; V591-Y618 WeakPolarHBondContact O-CA 3.43Å; V591-A619 HydrophobicContact CB-CB 4.31Å; V591-A619 PolarHBondContact N-O 2.73Å; V591-A619 PolarHBondContact O-N 2.7Å; V591-I622 HydrophobicContact CG2-CD1 4.13Å
592	G	92	Very high	90.7	Very high	6 Å²	6	39 Å²	39	6%	0.062	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	137.9	170.8	0	0	0	0	0	110.7	S584 K585	S584-G592 CarbonylContact C-O 3.51Å; S584-G592 WeakPolarHBondContact CA-O 3.44Å; K585-G592 PolarHBondContact N-O 3.44Å; K585-G592 PolarHBondContact O-N 3.34Å
593	V	92.1	Very high	91	Very high	30 Å²	30	37.4 Å²	37.4	18%	0.182	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	108	179	-174.2	0	0	0	0	108	T582 K583 V591 M595 C616 A617	T582-V593 HydrophobicContact CG2-CG1 4.04Å; K583-V593 WeakPolarHBondContact O-CA 3.01Å; V591-V593 HydrophobicContact CG1-CG2 4.13Å; V593-M595 HydrophobicContact CG1-SD 4.49Å; V593-C616 WeakPolarHBondContact O-CA 3.19Å; V593-A617 WeakPolarHBondContact CA-O 3.38Å; V593-A617 HydrophobicContact CB-CB 4.49Å; V593-A617 WeakPolarHBondContact CB-O 3.4Å; V593-A617 PolarHBondContact N-O 3.24Å; V593-A617 PolarHBondContact O-N 3.3Å
594	S	92.3	Very high	91.3	Very high	52 Å²	52	33.5 Å²	33.5	36%	0.364	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	120.2	171.1	-61.8	0	0	0	0	109.3	T582 K583	T582-S594 WeakPolarHBondContact CA-O 3.38Å; K583-S594 PolarHBondContact N-O 2.79Å; K583-S594 PolarHBondContact O-N 2.97Å
595	M	91.8	Very high	91.5	Very high	36 Å²	36	36.8 Å²	36.8	18%	0.177	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	129.2	165.8	-56.3	-57.2	-154.6	0	0	108	Y449 V580 T582 V593 L614 P615	Y449-M595 WeakPolarHBondContact OH-CE 3.3Å; V580-M595 HydrophobicContact CG1-CB 4.28Å; T582-M595 HydrophobicContact CG2-SD 3.59Å; T582-M595 VanDerWaalsContact CG2-SD 3.59Å; V593-M595 HydrophobicContact CG1-SD 4.49Å; M595-L614 HydrophobicContact CB-CB 3.85Å; M595-L614 HydrophobicContact CG-CB 4.25Å; M595-P615 WeakPolarHBondContact CG-O 3.41Å
596	V	91.8	Very high	91.8	Very high	41 Å²	41	34.3 Å²	34.3	25%	0.248	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	136.2	-178.5	-176.5	0	0	0	0	108.6	V580 W581 K583	V580-V596 CarbonylContact C-O 3.51Å; V580-V596 WeakPolarHBondContact CA-O 3.35Å; W581-V596 HydrophobicContact CD2-CB 4.36Å; W581-V596 HydrophobicContact CD2-CG1 4.36Å; W581-V596 HydrophobicContact CG-CB 4.34Å; W581-V596 HydrophobicContact CH2-CG1 4.48Å; W581-V596 HydrophobicContact CZ2-CB 4.45Å; W581-V596 HydrophobicContact CZ2-CG1 3.61Å; W581-V596 PolarHBondContact N-O 2.68Å; W581-V596 PolarHBondContact O-N 3.13Å; K583-V596 HydrophobicContact CD-CG2 4.15Å; K583-V596 HydrophobicContact CG-CG2 4.25Å
597	G	92.1	Very high	92.2	Very high	22 Å²	22	40 Å²	40	23%	0.227	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	120.3	179.8	-168.4	0	0	0	0	0	110.4	H579	H579-G597 WeakPolarHBondContact O-CA 3.46Å
598	E	93.9	Very high	92.9	Very high	89 Å²	89	36.5 Å²	36.5	42%	0.416	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	159.4	-173.9	59.8	-176.8	-164	0	0	110.9	A578 H579 V611 F612	A578-E598 VanDerWaalsContact CA-O 3.31Å; A578-E598 WeakPolarHBondContact CA-O 3.39Å; H579-E598 PolarHBondContact N-O 2.79Å; H579-E598 PolarHBondContact O-N 3.41Å; E598-V611 HydrophobicContact CB-CG1 4.46Å; E598-F612 WeakPolarHBondContact CA-O 3.17Å
599	G	97	Very high	93.7	Very high	2 Å²	2	41.5 Å²	41.5	2%	0.021	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	149.2	166.7	0	0	0	0	0	110.9	N577 V611 F612	N577-G599 CarbonylContact O-C 3.59Å; N577-G599 WeakPolarHBondContact O-CA 3.42Å; G599-V611 CarbonylContact O-C 3.57Å; G599-V611 WeakPolarHBondContact O-CA 3.49Å; G599-F612 VanDerWaalsContact C-CD1 3.49Å; G599-F612 PolarHBondContact N-O 3.08Å; G599-F612 WeakPolarHBondContact O-CD1 3.41Å; G599-F612 PolarHBondContact O-N 2.72Å
600	V	97.8	Very high	94.6	Very high	28 Å²	28	36.8 Å²	36.8	17%	0.17	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	119	172.4	-173	0	0	0	0	107.4	V576 N577 E609 Y610 V611	V576-V600 CarbonylContact C-O 3.43Å; V576-V600 VanDerWaalsContact CA-O 3.26Å; V576-V600 WeakPolarHBondContact CA-O 3.47Å; N577-V600 PolarHBondContact N-O 2.9Å; N577-V600 PolarHBondContact O-N 3.48Å; V600-E609 HydrophobicContact CG1-CB 4.22Å; V600-Y610 WeakPolarHBondContact CA-O 3.35Å; V600-V611 HydrophobicContact CG2-CG2 4.37Å
601	L	98.3	Very high	95.1	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	116.1	169.2	164.9	63.4	0	0	0	108.5	F459 I462 F475 M574 C575 V576 L603 E609 Y610 F612	F459-L601 HydrophobicContact CE2-CD1 3.96Å; F459-L601 HydrophobicContact CZ-CD1 4.33Å; I462-L601 HydrophobicContact CD1-CD2 4Å; I462-L601 HydrophobicContact CG2-CD2 4.29Å; F475-L601 HydrophobicContact CD1-CD2 3.76Å; F475-L601 HydrophobicContact CD2-CD2 3.82Å; F475-L601 HydrophobicContact CE1-CB 4.23Å; F475-L601 HydrophobicContact CE1-CD2 3.79Å; F475-L601 HydrophobicContact CE2-CD2 3.86Å; F475-L601 HydrophobicContact CG-CD2 3.8Å; F475-L601 HydrophobicContact CZ-CB 4.19Å; F475-L601 HydrophobicContact CZ-CD2 3.85Å; M574-L601 HydrophobicContact CE-CD1 3.87Å; C575-L601 WeakPolarHBondContact O-CA 3.41Å; V576-L601 HydrophobicContact CG2-CB 4.1Å; V576-L601 HydrophobicContact CG2-CD1 3.75Å; L601-L603 HydrophobicContact CD1-CD2 3.77Å; L601-L603 HydrophobicContact CD2-CD2 4.23Å; L601-L603 HydrophobicContact CG-CD2 3.96Å; L601-L603 HydrophobicContact CG-CG 4.46Å; L601-E609 CarbonylContact O-C 3.54Å; L601-E609 WeakPolarHBondContact O-CA 3.49Å; L601-Y610 PolarHBondContact N-O 3.3Å; L601-Y610 PolarHBondContact O-N 2.55Å; L601-F612 HydrophobicContact CB-CE1 4.32Å
602	C	98.1	Very high	95.5	Very high	3 Å²	3	38.3 Å²	38.3	2%	0.02	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	124.2	175.3	-54.7	0	0	0	0	109.7	M574 C575 L604 E608 W784	M574-C602 WeakPolarHBondContact CA-O 3.48Å; C575-C602 PolarHBondContact N-O 3.03Å; C575-C602 VanDerWaalsContact N-O 3.07Å; C575-C602 PolarHBondContact O-N 3.14Å; C602-L604 HydrophobicContact CB-CD2 3.89Å; C602-E608 WeakPolarHBondContact CA-O 3.29Å; C602-W784 HydrophobicContact CB-CE3 4.47Å
603	L	97.6	Very high	95.7	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	94.2	171	-51.5	-175.7	0	0	0	108.2	I462 R471 M574 L601 E605 H606 D607 E608 Y610	I462-L603 HydrophobicContact CG2-CD1 3.88Å; I462-L603 HydrophobicContact CG2-CD2 4.2Å; R471-L603 HydrophobicContact CB-CD1 4.45Å; M574-L603 HydrophobicContact CB-CD2 4.03Å; M574-L603 HydrophobicContact CE-CD2 3.81Å; L601-L603 HydrophobicContact CD1-CD2 3.77Å; L601-L603 HydrophobicContact CD2-CD2 4.23Å; L601-L603 HydrophobicContact CG-CD2 3.96Å; L601-L603 HydrophobicContact CG-CG 4.46Å; L603-E605 PolarHBondContact O-N 3.36Å; L603-H606 HydrophobicContact CB-CB 4.47Å; L603-H606 PolarHBondContact O-N 3.37Å; L603-D607 PolarHBondContact O-N 2.9Å; L603-E608 HydrophobicContact CB-CB 4.43Å; L603-E608 PolarHBondContact N-O 2.69Å; L603-E608 PolarHBondContact O-N 3.48Å; L603-E608 VanDerWaalsContact O-N 3.12Å; L603-Y610 HydrophobicContact CD1-CD2 4.34Å; L603-Y610 HydrophobicContact CD1-CE2 3.63Å; L603-Y610 HydrophobicContact CG-CD2 4.4Å; L603-Y610 HydrophobicContact CG-CE2 4.11Å
604	L	95.3	Very high	95.9	Very high	45 Å²	45	40.1 Å²	40.1	24%	0.236	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-72	-32.6	-165.8	-49.3	176.2	0	0	0	112.5	Q573 C602 H606 D607 L783 W784	Q573-L604 HydrophobicContact CB-CB 4.28Å; Q573-L604 VanDerWaalsContact O-CB 3.22Å; Q573-L604 WeakPolarHBondContact O-CB 3.48Å; Q573-L604 VanDerWaalsContact O-CG 3.25Å; Q573-L604 WeakPolarHBondContact O-CG 3.41Å; Q573-L604 PolarHBondContact O-N 2.94Å; C602-L604 HydrophobicContact CB-CD2 3.89Å; L604-H606 PolarHBondContact O-N 3.32Å; L604-D607 PolarHBondContact O-N 2.9Å; L604-D607 VanDerWaalsContact O-N 3.11Å; L604-L783 HydrophobicContact CD1-CB 4.06Å; L604-L783 HydrophobicContact CD1-CD2 3.84Å; L604-L783 HydrophobicContact CD1-CG 3.65Å; L604-W784 HydrophobicContact CD1-CB 4.48Å; L604-W784 HydrophobicContact CD2-CB 3.74Å
605	E	94.1	Very high	96	Very high	92 Å²	92	37.9 Å²	37.9	43%	0.43	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-57.4	-29.7	172.4	-77.8	173.9	155.4	0	0	113.4	T463 Q573 L603	T463-E605 PolarHBondContact OG1-OE2 3.13Å; Q573-E605 HydrophobicContact CB-CG 3.96Å; Q573-E605 HydrophobicContact CG-CG 4.47Å; L603-E605 PolarHBondContact O-N 3.36Å
606	H	94.8	Very high	96.1	Very high	48 Å²	48	37.5 Å²	37.5	22%	0.222	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-102.9	-6.4	-179.7	-56	-78.2	0	0	0	112.2	T463 R471 L603 L604 E608 K640	T463-H606 PolarHBondContact O-NE2 3.45Å; T463-H606 PolarHBondContact OG1-CD2 2.78Å; T463-H606 PolarHBondContact OG1-NE2 2.95Å; R471-H606 VanDerWaalsContact CZ-ND1 3.26Å; R471-H606 PolarHBondContact NH1-CE1 2.97Å; R471-H606 PolarHBondContact NH1-ND1 3.16Å; R471-H606 VanDerWaalsContact NH1-ND1 3.15Å; L603-H606 HydrophobicContact CB-CB 4.47Å; L603-H606 PolarHBondContact O-N 3.37Å; L604-H606 PolarHBondContact O-N 3.32Å; H606-E608 HydrophobicContact CB-CB 4.23Å; H606-E608 HydrophobicContact CB-CG 4Å; H606-E608 PolarHBondContact O-N 2.61Å; H606-K640 PolarHBondContact O-NZ 2.8Å
607	D	95.8	Very high	96.2	Very high	122 Å²	122	35.9 Å²	35.9	65%	0.652	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.3	49.1	-168.8	166.7	61.3	0	0	0	110.1	L603 L604 K640	L603-D607 PolarHBondContact O-N 2.9Å; L604-D607 PolarHBondContact O-N 2.9Å; L604-D607 VanDerWaalsContact O-N 3.11Å; D607-K640 VanDerWaalsContact CG-NZ 3.29Å; D607-K640 WeakPolarHBondContact O-CD 3.32Å; D607-K640 WeakPolarHBondContact O-CE 3.26Å; D607-K640 PolarHBondContact O-NZ 3.24Å; D607-K640 IonicContact OD2-NZ 2.69Å; D607-K640 PolarHBondContact OD2-NZ 3.21Å
608	E	97.7	Very high	96.2	Very high	9 Å²	9	37.1 Å²	37.1	4%	0.042	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	137.4	-177.9	-79.5	177.8	163.3	0	0	111.9	A468 R471 C602 L603 H606 Y610 K640	A468-E608 WeakPolarHBondContact CB-OE1 3.4Å; R471-E608 IonicContact CZ-OE1 2.62Å; R471-E608 IonicContact CZ-OE2 3.17Å; R471-E608 IonicContact NE-OE1 2.77Å; R471-E608 IonicContact NE-OE2 2.68Å; R471-E608 PolarHBondContact NE-OE2 3.15Å; R471-E608 IonicContact NH2-OE1 2.68Å; R471-E608 PolarHBondContact NH2-OE1 2.68Å; R471-E608 IonicContact NH2-OE2 2.71Å; R471-E608 PolarHBondContact NH2-OE2 2.81Å; C602-E608 WeakPolarHBondContact CA-O 3.29Å; L603-E608 HydrophobicContact CB-CB 4.43Å; L603-E608 PolarHBondContact N-O 2.69Å; L603-E608 PolarHBondContact O-N 3.48Å; L603-E608 VanDerWaalsContact O-N 3.12Å; H606-E608 HydrophobicContact CB-CB 4.23Å; H606-E608 HydrophobicContact CB-CG 4Å; H606-E608 PolarHBondContact O-N 2.61Å; E608-Y610 HydrophobicContact CB-CE2 3.97Å; E608-Y610 PolarHBondContact OE2-OH 3.45Å; E608-K640 HydrophobicContact CG-CD 4.25Å
609	E	97.9	Very high	96	Very high	111 Å²	111	34.3 Å²	34.3	52%	0.519	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	127.9	175.6	-62.5	-172.6	153.9	0	0	110.3	V600 L601 C638	V600-E609 HydrophobicContact CG1-CB 4.22Å; L601-E609 CarbonylContact O-C 3.54Å; L601-E609 WeakPolarHBondContact O-CA 3.49Å; E609-C638 WeakPolarHBondContact O-CA 3.27Å; E609-C638 WeakPolarHBondContact O-CB 3.46Å; E609-C638 PolarHBondContact O-SG 2.61Å; E609-C638 VanDerWaalsContact O-SG 3.4Å
610	Y	98.6	Very high	95.6	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	108.7	176.6	-64.1	-99.8	0	0	0	109.8	R471 I472 F475 V600 L601 L603 E608 I636 N637 C638	R471-Y610 WeakPolarHBondContact CB-OH 3.43Å; I472-Y610 HydrophobicContact CB-CE1 3.79Å; I472-Y610 HydrophobicContact CD1-CE1 4.21Å; I472-Y610 HydrophobicContact CG1-CD1 4.36Å; I472-Y610 HydrophobicContact CG1-CE1 3.89Å; F475-Y610 AromaticContact CD1-CD1 3.99Å; F475-Y610 HydrophobicContact CD1-CD1 3.99Å; F475-Y610 AromaticContact CD1-CG 3.98Å; F475-Y610 HydrophobicContact CD1-CG 3.98Å; F475-Y610 HydrophobicContact CE1-CG 4.25Å; V600-Y610 WeakPolarHBondContact CA-O 3.35Å; L601-Y610 PolarHBondContact N-O 3.3Å; L601-Y610 PolarHBondContact O-N 2.55Å; L603-Y610 HydrophobicContact CD1-CD2 4.34Å; L603-Y610 HydrophobicContact CD1-CE2 3.63Å; L603-Y610 HydrophobicContact CG-CD2 4.4Å; L603-Y610 HydrophobicContact CG-CE2 4.11Å; E608-Y610 HydrophobicContact CB-CE2 3.97Å; E608-Y610 PolarHBondContact OE2-OH 3.45Å; Y610-I636 HydrophobicContact CD1-CG2 4.24Å; Y610-N637 CarbonylContact C-O 3.52Å; Y610-N637 WeakPolarHBondContact CA-O 3.38Å; Y610-C638 HydrophobicContact CD1-CB 3.57Å; Y610-C638 HydrophobicContact CD2-CB 4.48Å; Y610-C638 HydrophobicContact CE1-CB 3.55Å; Y610-C638 HydrophobicContact CE2-CB 4.47Å; Y610-C638 HydrophobicContact CG-CB 4.06Å
611	V	98.3	Very high	94.9	Very high	44 Å²	44	37.1 Å²	37.1	27%	0.267	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	126.5	173.9	-174.5	0	0	0	0	109	E598 G599 V600 I636 N637	E598-V611 HydrophobicContact CB-CG1 4.46Å; G599-V611 CarbonylContact O-C 3.57Å; G599-V611 WeakPolarHBondContact O-CA 3.49Å; V600-V611 HydrophobicContact CG2-CG2 4.37Å; V611-I636 CarbonylContact O-C 3.28Å; V611-I636 WeakPolarHBondContact O-CA 3.36Å; V611-N637 PolarHBondContact N-O 2.95Å; V611-N637 PolarHBondContact O-N 3.33Å
612	F	98.3	Very high	94.2	Very high	24 Å²	24	38.2 Å²	38.2	11%	0.105	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	151.3	-177.5	68.8	-85.6	0	0	0	113.8	F475 Y479 V576 E598 G599 L601 S635 I636	F475-F612 HydrophobicContact CE1-CB 4.44Å; F475-F612 HydrophobicContact CE1-CD1 4.05Å; F475-F612 HydrophobicContact CE1-CG 4.43Å; F475-F612 HydrophobicContact CZ-CB 4.33Å; F475-F612 AromaticContact CZ-CD1 3.58Å; F475-F612 HydrophobicContact CZ-CD1 3.58Å; F475-F612 AromaticContact CZ-CE1 3.92Å; F475-F612 HydrophobicContact CZ-CE1 3.92Å; F475-F612 AromaticContact CZ-CG 3.92Å; F475-F612 HydrophobicContact CZ-CG 3.92Å; Y479-F612 HydrophobicContact CD2-CD2 4.45Å; Y479-F612 AromaticContact CE2-CD2 3.97Å; Y479-F612 HydrophobicContact CE2-CD2 3.97Å; Y479-F612 HydrophobicContact CE2-CE2 4.43Å; V576-F612 HydrophobicContact CG1-CE1 4.07Å; V576-F612 HydrophobicContact CG1-CZ 3.88Å; E598-F612 WeakPolarHBondContact CA-O 3.17Å; G599-F612 VanDerWaalsContact C-CD1 3.49Å; G599-F612 PolarHBondContact N-O 3.08Å; G599-F612 WeakPolarHBondContact O-CD1 3.41Å; G599-F612 PolarHBondContact O-N 2.72Å; L601-F612 HydrophobicContact CB-CE1 4.32Å; F612-S635 VanDerWaalsContact CA-O 3.27Å; F612-S635 WeakPolarHBondContact CA-O 3.33Å; F612-I636 HydrophobicContact CB-CB 4.42Å; F612-I636 HydrophobicContact CB-CG1 3.85Å
613	T	96.9	Very high	93	Very high	42 Å²	42	40.4 Å²	40.4	26%	0.258	21%	0.212	S	C	.	.			trans	-111.1	174.8	177.6	51.2	0	0	0	0	111.4	Y479 V634 S635	Y479-T613 PolarHBondContact OH-O 2.94Å; T613-V634 VanDerWaalsContact O-CG1 3.29Å; T613-V634 WeakPolarHBondContact O-CG1 3.36Å; T613-S635 PolarHBondContact N-O 3.2Å; T613-S635 PolarHBondContact OG1-N 3.46Å; T613-S635 VanDerWaalsContact OG1-N 3.09Å; T613-S635 PolarHBondContact OG1-OG 3.19Å
614	L	95.1	Very high	92	Very high	33 Å²	33	44.9 Å²	44.9	17%	0.173	24%	0.239	C	C	.	.			trans	-115.8	150.4	-179.7	-71.9	167.3	0	0	0	111.8	Y449 F483 V580 M595 V634	Y449-L614 HydrophobicContact CE1-CD1 3.75Å; F483-L614 HydrophobicContact CE1-CD2 4.48Å; F483-L614 HydrophobicContact CZ-CD2 4.46Å; V580-L614 HydrophobicContact CB-CD1 4.49Å; V580-L614 HydrophobicContact CG1-CD1 4.08Å; V580-L614 HydrophobicContact CG2-CD1 3.52Å; M595-L614 HydrophobicContact CB-CB 3.85Å; M595-L614 HydrophobicContact CG-CB 4.25Å; L614-V634 VanDerWaalsContact C-CG2 3.46Å
615	P	95.4	Very high	91.3	Very high	5 Å²	5	46.4 Å²	46.4	3%	0.032	25%	0.25	C	S	.	.			trans	-69.7	156.4	177.7	30.6	-35.5	0	0	0	111.6	Y479 F483 M595 L630 V634 F649	Y479-P615 WeakPolarHBondContact OH-CD 3.1Å; F483-P615 HydrophobicContact CE1-CG 3.84Å; F483-P615 HydrophobicContact CZ-CG 4.01Å; M595-P615 WeakPolarHBondContact CG-O 3.41Å; P615-L630 HydrophobicContact CG-CD1 4.23Å; P615-L630 HydrophobicContact CG-CD2 4.28Å; P615-V634 HydrophobicContact CB-CG2 4.17Å; P615-F649 HydrophobicContact CB-CD2 3.64Å; P615-F649 HydrophobicContact CB-CE2 3.91Å; P615-F649 HydrophobicContact CB-CG 4.04Å; P615-F649 HydrophobicContact CG-CD2 4.27Å; P615-F649 HydrophobicContact CG-CE2 4.07Å; P615-F649 HydrophobicContact CG-CZ 4.3Å
616	C	93.9	Very high	90.8	Very high	27 Å²	27	42.9 Å²	42.9	18%	0.182	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	152.2	164.5	-64.2	0	0	0	0	109.9	V593 Y618 L630 G631	V593-C616 WeakPolarHBondContact O-CA 3.19Å; C616-Y618 HydrophobicContact CB-CE2 3.99Å; C616-L630 CarbonylContact O-C 3.47Å; C616-L630 WeakPolarHBondContact O-CA 3.37Å; C616-G631 WeakPolarHBondContact CA-O 3.41Å; C616-G631 WeakPolarHBondContact CB-O 3.04Å; C616-G631 PolarHBondContact N-O 3.28Å; C616-G631 PolarHBondContact O-N 3.42Å
617	A	92.8	Very high	90.4	Very high	8 Å²	8	43.5 Å²	43.5	7%	0.066	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	146.6	172.9	0	0	0	0	0	110.4	V593 E629 L630	V593-A617 WeakPolarHBondContact CA-O 3.38Å; V593-A617 HydrophobicContact CB-CB 4.49Å; V593-A617 WeakPolarHBondContact CB-O 3.4Å; V593-A617 PolarHBondContact N-O 3.24Å; V593-A617 PolarHBondContact O-N 3.3Å; A617-E629 CarbonylContact C-O 3.59Å; A617-E629 WeakPolarHBondContact CA-O 3.24Å; A617-L630 HydrophobicContact CB-CD2 4.13Å
618	Y	91.7	Very high	90.1	Very high	48 Å²	48	38.7 Å²	38.7	19%	0.188	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	123.4	177.6	-59	-93	0	0	0	109.3	M587 V591 C616 R620 V628 E629 T651	M587-Y618 HydrophobicContact CE-CE1 4.35Å; M587-Y618 HydrophobicContact SD-CD1 3.94Å; M587-Y618 HydrophobicContact SD-CE1 3.84Å; V591-Y618 CarbonylContact O-C 3.59Å; V591-Y618 VanDerWaalsContact O-CA 3.25Å; V591-Y618 WeakPolarHBondContact O-CA 3.43Å; C616-Y618 HydrophobicContact CB-CE2 3.99Å; Y618-R620 PolarHBondContact O-N 2.99Å; Y618-V628 WeakPolarHBondContact O-CA 3.45Å; Y618-E629 PolarHBondContact N-O 3.18Å; Y618-E629 PolarHBondContact O-N 3.07Å; Y618-T651 HydrophobicContact CD2-CG2 3.97Å; Y618-T651 HydrophobicContact CE2-CG2 3.83Å
619	A	90.6	Very high	89.8	Confident	29 Å²	29	38.2 Å²	38.2	24%	0.24	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	107.4	163.4	0	0	0	0	0	107.5	A492 S590 V591 I622	A492-A619 HydrophobicContact CB-CB 4.44Å; S590-A619 CarbonylContact C-O 3.52Å; S590-A619 WeakPolarHBondContact CA-O 3.5Å; S590-A619 WeakPolarHBondContact CB-O 3.5Å; V591-A619 HydrophobicContact CB-CB 4.31Å; V591-A619 PolarHBondContact N-O 2.73Å; V591-A619 PolarHBondContact O-N 2.7Å; A619-I622 HydrophobicContact CB-CG2 4.23Å; A619-I622 WeakPolarHBondContact O-CG2 3.12Å
620	R	87.9	Confident	89.6	Confident	51 Å²	51	33.5 Å²	33.5	19%	0.192	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	166.5	177.9	-61.7	-56.9	-164.4	168.5	4	110.4	S590 Y618 I622 P626 W627 E629	S590-R620 VanDerWaalsContact OG-CD 3.24Å; S590-R620 WeakPolarHBondContact OG-CD 3.26Å; S590-R620 PolarHBondContact OG-NH1 3.06Å; Y618-R620 PolarHBondContact O-N 2.99Å; R620-I622 VanDerWaalsContact C-N 3.29Å; R620-I622 PolarHBondContact O-N 3.39Å; R620-I622 VanDerWaalsContact O-N 3.15Å; R620-P626 WeakPolarHBondContact O-CA 3.22Å; R620-W627 HydrophobicContact CB-CD2 3.87Å; R620-W627 HydrophobicContact CB-CG 4.16Å; R620-W627 HydrophobicContact CB-CH2 4.44Å; R620-W627 HydrophobicContact CB-CZ2 3.69Å; R620-W627 HydrophobicContact CG-CD2 4.25Å; R620-W627 HydrophobicContact CG-CH2 3.96Å; R620-W627 HydrophobicContact CG-CZ2 3.65Å; R620-W627 HydrophobicContact CG-CZ3 4.39Å; R620-W627 PolarHBondContact N-O 3.28Å; R620-W627 PolarHBondContact O-N 3.28Å; R620-E629 HydrophobicContact CG-CB 4.07Å; R620-E629 IonicContact CZ-OE2 3.48Å; R620-E629 IonicContact NE-OE2 2.8Å; R620-E629 PolarHBondContact NE-OE2 3.37Å; R620-E629 IonicContact NH2-OE2 3.33Å; R620-E629 PolarHBondContact NH2-OE2 3.1Å
621	S	84	Confident	89.4	Confident	39 Å²	39	33.5 Å²	33.5	27%	0.273	19%	0.187	S	C	.	.			trans	54.6	34.3	169.7	-60.2	0	0	0	0	116	M589 L623 T624 V625 W627	M589-S621 PolarHBondContact O-N 3.29Å; S621-L623 PolarHBondContact O-N 3.19Å; S621-T624 CarbonylContact O-C 3.54Å; S621-T624 PolarHBondContact O-N 3.27Å; S621-T624 PolarHBondContact O-OG1 3.02Å; S621-V625 VanDerWaalsContact CB-O 3.23Å; S621-V625 WeakPolarHBondContact CB-O 3.13Å; S621-W627 PolarHBondContact OG-NE1 3.18Å; S621-W627 VanDerWaalsContact OG-NE1 3.16Å
622	I	83.1	Confident	89.2	Confident	23 Å²	23	33 Å²	33	12%	0.118	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-2	-173.4	68.9	-179.4	0	0	0	116.2	L421 F586 G588 V591 A619 R620 P626	L421-I622 HydrophobicContact CD2-CD1 3.86Å; L421-I622 HydrophobicContact CD2-CG1 4.43Å; F586-I622 HydrophobicContact CD2-CD1 4.29Å; F586-I622 HydrophobicContact CE2-CD1 3.68Å; G588-I622 WeakPolarHBondContact O-CD1 3.43Å; V591-I622 HydrophobicContact CG2-CD1 4.13Å; A619-I622 HydrophobicContact CB-CG2 4.23Å; A619-I622 WeakPolarHBondContact O-CG2 3.12Å; R620-I622 VanDerWaalsContact C-N 3.29Å; R620-I622 PolarHBondContact O-N 3.39Å; R620-I622 VanDerWaalsContact O-N 3.15Å; I622-P626 HydrophobicContact CG2-CB 4.49Å
623	L	74.2	Confident	89.1	Confident	49 Å²	49	38.6 Å²	38.6	26%	0.257	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-7.5	171.9	-86.8	-179.7	0	0	0	113.5	L79 L418 L421 M589 S621	L79-L623 HydrophobicContact CB-CD1 4.42Å; L79-L623 HydrophobicContact CD1-CD1 4.01Å; L79-L623 HydrophobicContact CD1-CD2 4.49Å; L79-L623 HydrophobicContact CD1-CG 4.09Å; L79-L623 HydrophobicContact CD2-CD1 3.96Å; L79-L623 HydrophobicContact CG-CD1 4.38Å; L418-L623 HydrophobicContact CD2-CD2 3.72Å; L421-L623 HydrophobicContact CD1-CD2 3.33Å; L421-L623 HydrophobicContact CD1-CG 3.87Å; M589-L623 HydrophobicContact CE-CB 4.14Å; M589-L623 HydrophobicContact CE-CD1 4Å; M589-L623 HydrophobicContact CE-CG 4.49Å; M589-L623 HydrophobicContact SD-CD1 3.79Å; S621-L623 PolarHBondContact O-N 3.19Å
624	T	76.4	Confident	89.1	Confident	93 Å²	93	36.6 Å²	36.6	57%	0.571	20%	0.203	S	C	*	.	S	Bend	trans	-128.5	-125.1	178	59	0	0	0	0	108.4	S621 P626	S621-T624 CarbonylContact O-C 3.54Å; S621-T624 PolarHBondContact O-N 3.27Å; S621-T624 PolarHBondContact O-OG1 3.02Å; T624-P626 WeakPolarHBondContact O-CD 3.31Å
625	V	79.4	Confident	89.2	Confident	78 Å²	78	36.8 Å²	36.8	47%	0.473	21%	0.206	S	C	.	.	S	Bend	trans	-89.6	112.5	171.1	-177.5	0	0	0	0	107.6	V491 S621	V491-V625 HydrophobicContact CG1-CG1 4.38Å; V491-V625 HydrophobicContact CG2-CG1 3.87Å; S621-V625 VanDerWaalsContact CB-O 3.23Å; S621-V625 WeakPolarHBondContact CB-O 3.13Å
626	P	84.4	Confident	89.4	Confident	18 Å²	18	36.5 Å²	36.5	12%	0.117	21%	0.205	C	C	.	.			trans	-74.7	144.5	-178.3	33	-36.3	0	0	0	110.4	V491 A492 R620 I622 T624	V491-P626 CarbonylContact C-O 3.57Å; V491-P626 WeakPolarHBondContact CA-O 3.17Å; V491-P626 HydrophobicContact CG1-CG 4.08Å; A492-P626 HydrophobicContact CB-CB 4.1Å; A492-P626 HydrophobicContact CB-CG 4.48Å; A492-P626 PolarHBondContact N-O 3.38Å; R620-P626 WeakPolarHBondContact O-CA 3.22Å; I622-P626 HydrophobicContact CG2-CB 4.49Å; T624-P626 WeakPolarHBondContact O-CD 3.31Å
627	W	86.2	Confident	89.6	Confident	61 Å²	61	38.1 Å²	38.1	23%	0.231	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	153.3	179	62.6	-83.1	0	0	0	111.5	A490 R620 S621 E629 V659	A490-W627 WeakPolarHBondContact O-CB 3.45Å; R620-W627 HydrophobicContact CB-CD2 3.87Å; R620-W627 HydrophobicContact CB-CG 4.16Å; R620-W627 HydrophobicContact CB-CH2 4.44Å; R620-W627 HydrophobicContact CB-CZ2 3.69Å; R620-W627 HydrophobicContact CG-CD2 4.25Å; R620-W627 HydrophobicContact CG-CH2 3.96Å; R620-W627 HydrophobicContact CG-CZ2 3.65Å; R620-W627 HydrophobicContact CG-CZ3 4.39Å; R620-W627 PolarHBondContact N-O 3.28Å; R620-W627 PolarHBondContact O-N 3.28Å; S621-W627 PolarHBondContact OG-NE1 3.18Å; S621-W627 VanDerWaalsContact OG-NE1 3.16Å; W627-E629 HydrophobicContact CE3-CB 4.27Å; W627-E629 HydrophobicContact CH2-CB 4.11Å; W627-E629 HydrophobicContact CH2-CG 4.29Å; W627-E629 WeakPolarHBondContact CH2-OE1 3.33Å; W627-E629 HydrophobicContact CZ3-CB 3.64Å; W627-E629 HydrophobicContact CZ3-CG 4.05Å; W627-V659 HydrophobicContact CH2-CG1 3.7Å; W627-V659 HydrophobicContact CZ3-CB 4.42Å; W627-V659 HydrophobicContact CZ3-CG1 3.96Å
628	V	89.6	Confident	89.9	Confident	20 Å²	20	37.9 Å²	37.9	12%	0.121	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	130.1	-174.5	-176.8	0	0	0	0	110.9	A492 Y618 H660	A492-V628 HydrophobicContact CB-CG2 3.46Å; A492-V628 VanDerWaalsContact CB-CG2 3.46Å; Y618-V628 WeakPolarHBondContact O-CA 3.45Å; V628-H660 PolarHBondContact O-CE1 3.08Å
629	E	91.8	Very high	90.1	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	132.2	170.9	-172.5	173.3	-119.3	0	0	110	A617 Y618 R620 W627 T651 K652	A617-E629 CarbonylContact C-O 3.59Å; A617-E629 WeakPolarHBondContact CA-O 3.24Å; Y618-E629 PolarHBondContact N-O 3.18Å; Y618-E629 PolarHBondContact O-N 3.07Å; R620-E629 HydrophobicContact CG-CB 4.07Å; R620-E629 IonicContact CZ-OE2 3.48Å; R620-E629 IonicContact NE-OE2 2.8Å; R620-E629 PolarHBondContact NE-OE2 3.37Å; R620-E629 IonicContact NH2-OE2 3.33Å; R620-E629 PolarHBondContact NH2-OE2 3.1Å; W627-E629 HydrophobicContact CE3-CB 4.27Å; W627-E629 HydrophobicContact CH2-CB 4.11Å; W627-E629 HydrophobicContact CH2-CG 4.29Å; W627-E629 WeakPolarHBondContact CH2-OE1 3.33Å; W627-E629 HydrophobicContact CZ3-CB 3.64Å; W627-E629 HydrophobicContact CZ3-CG 4.05Å; E629-T651 HydrophobicContact CG-CG2 4.38Å; E629-T651 WeakPolarHBondContact OE2-CB 3.49Å; E629-T651 WeakPolarHBondContact OE2-CG2 3.26Å; E629-K652 VanDerWaalsContact OE1-CB 3.29Å; E629-K652 WeakPolarHBondContact OE1-CB 3.42Å; E629-K652 PolarHBondContact OE1-N 3.2Å
630	L	93.9	Very high	90.4	Very high	12 Å²	12	47.4 Å²	47.4	6%	0.063	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	145.4	168.9	-61.7	-177.7	0	0	0	109.9	F483 P615 C616 A617 F649 W682	F483-L630 HydrophobicContact CB-CD1 3.95Å; F483-L630 HydrophobicContact CD1-CD1 3.83Å; F483-L630 HydrophobicContact CG-CD1 3.87Å; P615-L630 HydrophobicContact CG-CD1 4.23Å; P615-L630 HydrophobicContact CG-CD2 4.28Å; C616-L630 CarbonylContact O-C 3.47Å; C616-L630 WeakPolarHBondContact O-CA 3.37Å; A617-L630 HydrophobicContact CB-CD2 4.13Å; L630-F649 HydrophobicContact CB-CB 4.19Å; L630-F649 HydrophobicContact CB-CD1 3.69Å; L630-F649 HydrophobicContact CB-CE1 4.39Å; L630-F649 HydrophobicContact CB-CG 4.13Å; L630-F649 HydrophobicContact CD1-CD1 4Å; L630-F649 HydrophobicContact CD1-CE1 3.84Å; L630-W682 HydrophobicContact CB-CZ2 4.38Å; L630-W682 HydrophobicContact CD1-CD2 3.87Å; L630-W682 HydrophobicContact CD1-CE3 4.19Å; L630-W682 HydrophobicContact CD1-CG 4.36Å; L630-W682 HydrophobicContact CD1-CH2 4.31Å; L630-W682 HydrophobicContact CD1-CZ2 3.95Å; L630-W682 HydrophobicContact CD1-CZ3 4.4Å; L630-W682 HydrophobicContact CG-CD2 4.49Å; L630-W682 HydrophobicContact CG-CH2 4.36Å; L630-W682 HydrophobicContact CG-CZ2 3.76Å
631	G	94	Very high	90.8	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	164.4	-179.4	0	0	0	0	0	114.4	C616 F649	C616-G631 WeakPolarHBondContact CA-O 3.41Å; C616-G631 WeakPolarHBondContact CB-O 3.04Å; C616-G631 PolarHBondContact N-O 3.28Å; C616-G631 PolarHBondContact O-N 3.42Å; G631-F649 CarbonylContact C-O 3.55Å; G631-F649 VanDerWaalsContact CA-O 3.32Å; G631-F649 WeakPolarHBondContact CA-O 3.39Å
632	G	93.5	Very high	91.5	Very high	33 Å²	33	44.7 Å²	44.7	34%	0.34	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	94.1	178.7	177.5	0	0	0	0	0	113.5	F649	G632-F649 PolarHBondContact N-O 2.96Å; G632-F649 PolarHBondContact O-N 3Å
633	K	96	Very high	92.2	Very high	141 Å²	141	45 Å²	45	61%	0.613	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-100.8	133.3	-178	175.7	168.3	169.2	160.8	0	110.7	T646 V647	K633-T646 HydrophobicContact CD-CG2 3.85Å; K633-T646 WeakPolarHBondContact CE-OG1 3.29Å; K633-T646 HydrophobicContact CG-CG2 4.16Å; K633-T646 PolarHBondContact NZ-OG1 2.91Å; K633-V647 CarbonylContact C-O 3.54Å; K633-V647 WeakPolarHBondContact CA-O 3.3Å
634	V	97.4	Very high	93.4	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.006	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	149.2	171.9	165	0	0	0	0	108.7	Y479 T613 L614 P615 V647 F649	Y479-V634 HydrophobicContact CE1-CG1 3.95Å; T613-V634 VanDerWaalsContact O-CG1 3.29Å; T613-V634 WeakPolarHBondContact O-CG1 3.36Å; L614-V634 VanDerWaalsContact C-CG2 3.46Å; P615-V634 HydrophobicContact CB-CG2 4.17Å; V634-V647 HydrophobicContact CB-CB 4.19Å; V634-V647 HydrophobicContact CG1-CB 4.48Å; V634-V647 PolarHBondContact N-O 3.27Å; V634-V647 PolarHBondContact O-N 2.93Å; V634-F649 HydrophobicContact CG2-CE2 4.35Å
635	S	97.7	Very high	94.4	Very high	36 Å²	36	39 Å²	39	25%	0.252	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	143.6	171.9	54.1	0	0	0	0	110.1	F612 T613 A645	F612-S635 VanDerWaalsContact CA-O 3.27Å; F612-S635 WeakPolarHBondContact CA-O 3.33Å; T613-S635 PolarHBondContact N-O 3.2Å; T613-S635 PolarHBondContact OG1-N 3.46Å; T613-S635 VanDerWaalsContact OG1-N 3.09Å; T613-S635 PolarHBondContact OG1-OG 3.19Å; S635-A645 WeakPolarHBondContact CA-O 3.24Å
636	I	98.6	Very high	95.3	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	121.3	167.2	-59.9	172.7	0	0	0	106.2	F475 V476 Y479 Y610 V611 F612 S644 A645	F475-I636 HydrophobicContact CD1-CG2 3.54Å; F475-I636 HydrophobicContact CE1-CG2 3.49Å; F475-I636 VanDerWaalsContact CE1-CG2 3.49Å; V476-I636 HydrophobicContact CG2-CD1 4.09Å; Y479-I636 HydrophobicContact CD1-CD1 4.17Å; Y479-I636 HydrophobicContact CD2-CD1 4.32Å; Y479-I636 HydrophobicContact CG-CD1 3.94Å; Y610-I636 HydrophobicContact CD1-CG2 4.24Å; V611-I636 CarbonylContact O-C 3.28Å; V611-I636 WeakPolarHBondContact O-CA 3.36Å; F612-I636 HydrophobicContact CB-CB 4.42Å; F612-I636 HydrophobicContact CB-CG1 3.85Å; I636-S644 CarbonylContact O-C 3.58Å; I636-S644 WeakPolarHBondContact O-CA 3.31Å; I636-A645 HydrophobicContact CB-CB 4.27Å; I636-A645 PolarHBondContact N-O 3.13Å; I636-A645 PolarHBondContact O-N 3.24Å
637	N	98.3	Very high	96	Very high	61 Å²	61	36.5 Å²	36.5	33%	0.326	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	130.2	-172.7	-53.6	-56.5	0	0	0	111.2	Y610 V611 S644	Y610-N637 CarbonylContact C-O 3.52Å; Y610-N637 WeakPolarHBondContact CA-O 3.38Å; V611-N637 PolarHBondContact N-O 2.95Å; V611-N637 PolarHBondContact O-N 3.33Å; N637-S644 VanDerWaalsContact OD1-CB 3.24Å; N637-S644 WeakPolarHBondContact OD1-CB 3.24Å
638	C	98.3	Very high	96.6	Very high	3 Å²	3	35.4 Å²	35.4	2%	0.02	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	114.6	165.1	177	0	0	0	0	109.4	E609 Y610 S641 G642 Y643	E609-C638 WeakPolarHBondContact O-CA 3.27Å; E609-C638 WeakPolarHBondContact O-CB 3.46Å; E609-C638 PolarHBondContact O-SG 2.61Å; E609-C638 VanDerWaalsContact O-SG 3.4Å; Y610-C638 HydrophobicContact CD1-CB 3.57Å; Y610-C638 HydrophobicContact CD2-CB 4.48Å; Y610-C638 HydrophobicContact CE1-CB 3.55Å; Y610-C638 HydrophobicContact CE2-CB 4.47Å; Y610-C638 HydrophobicContact CG-CB 4.06Å; C638-S641 WeakPolarHBondContact CB-OG 3.25Å; C638-S641 PolarHBondContact SG-OG 3.42Å; C638-G642 PolarHBondContact O-N 2.87Å; C638-Y643 PolarHBondContact N-O 3.35Å
639	I	96.7	Very high	96.9	Very high	158 Å²	158	34.6 Å²	34.6	81%	0.81	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-45.3	-176.4	-62.5	175.9	0	0	0	110.2	S641 G642	I639-S641 PolarHBondContact O-N 3.49Å; I639-G642 PolarHBondContact O-N 2.86Å
640	K	96.8	Very high	96.9	Very high	118 Å²	118	36.7 Å²	36.7	51%	0.513	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-45.7	-175.8	178.6	-178.8	172.3	177.7	0	113.2	H606 D607 E608 G642	H606-K640 PolarHBondContact O-NZ 2.8Å; D607-K640 VanDerWaalsContact CG-NZ 3.29Å; D607-K640 WeakPolarHBondContact O-CD 3.32Å; D607-K640 WeakPolarHBondContact O-CE 3.26Å; D607-K640 PolarHBondContact O-NZ 3.24Å; D607-K640 IonicContact OD2-NZ 2.69Å; D607-K640 PolarHBondContact OD2-NZ 3.21Å; E608-K640 HydrophobicContact CG-CD 4.25Å; K640-G642 VanDerWaalsContact C-N 3.34Å
641	S	97.1	Very high	96.8	Very high	18 Å²	18	38.7 Å²	38.7	13%	0.126	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-9.3	-179.1	68.2	0	0	0	0	113.5	C638 I639 Y643	C638-S641 WeakPolarHBondContact CB-OG 3.25Å; C638-S641 PolarHBondContact SG-OG 3.42Å; I639-S641 PolarHBondContact O-N 3.49Å; S641-Y643 VanDerWaalsContact O-CD2 3.22Å; S641-Y643 WeakPolarHBondContact O-CD2 3.49Å; S641-Y643 PolarHBondContact O-N 2.92Å
642	G	97.5	Very high	96.2	Very high	15 Å²	15	43.5 Å²	43.5	16%	0.155	23%	0.232	C	C	.	.			trans	70.9	3.3	-176.8	0	0	0	0	0	114.4	C638 I639 K640 N669	C638-G642 PolarHBondContact O-N 2.87Å; I639-G642 PolarHBondContact O-N 2.86Å; K640-G642 VanDerWaalsContact C-N 3.34Å; G642-N669 VanDerWaalsContact O-CB 3.24Å; G642-N669 WeakPolarHBondContact O-CB 3.45Å; G642-N669 PolarHBondContact O-N 3.44Å; G642-N669 PolarHBondContact O-ND2 3.1Å
643	Y	98.6	Very high	95.1	Very high	31 Å²	31	45 Å²	45	12%	0.122	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	144.9	178.1	-74.9	-92.4	0	0	0	112.4	A468 E469 I472 C638 S641 K667 H668 V675	A468-Y643 HydrophobicContact CB-CD2 4.14Å; A468-Y643 HydrophobicContact CB-CE2 4.1Å; E469-Y643 HydrophobicContact CB-CE1 3.96Å; E469-Y643 HydrophobicContact CG-CE1 4.12Å; E469-Y643 PolarHBondContact OE2-OH 2.87Å; I472-Y643 HydrophobicContact CG2-CD1 3.87Å; I472-Y643 HydrophobicContact CG2-CG 3.98Å; C638-Y643 PolarHBondContact N-O 3.35Å; S641-Y643 VanDerWaalsContact O-CD2 3.22Å; S641-Y643 WeakPolarHBondContact O-CD2 3.49Å; S641-Y643 PolarHBondContact O-N 2.92Å; Y643-K667 WeakPolarHBondContact CA-O 3.39Å; Y643-H668 HydrophobicContact CD1-CB 3.97Å; Y643-H668 AromaticContact CD2-CD2 3.76Å; Y643-H668 HydrophobicContact CE1-CB 3.59Å; Y643-H668 AromaticContact CE2-CD2 3.46Å; Y643-H668 VanDerWaalsContact CE2-CD2 3.46Å; Y643-H668 WeakPolarHBondContact CE2-CD2 3.45Å; Y643-H668 AromaticContact CZ-CD2 3.63Å; Y643-H668 AromaticContact CZ-CG 3.9Å; Y643-V675 HydrophobicContact CD1-CG2 4.26Å; Y643-V675 HydrophobicContact CE1-CG1 4.13Å; Y643-V675 HydrophobicContact CE1-CG2 4Å
644	S	98.4	Very high	93.1	Very high	14 Å²	14	47.5 Å²	47.5	10%	0.098	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	159.5	168.6	62.8	0	0	0	0	111.6	I636 N637 V666 K667 N669	I636-S644 CarbonylContact O-C 3.58Å; I636-S644 WeakPolarHBondContact O-CA 3.31Å; N637-S644 VanDerWaalsContact OD1-CB 3.24Å; N637-S644 WeakPolarHBondContact OD1-CB 3.24Å; S644-V666 WeakPolarHBondContact O-CA 3.48Å; S644-K667 PolarHBondContact N-O 3.39Å; S644-K667 PolarHBondContact O-N 2.75Å; S644-N669 WeakPolarHBondContact CB-ND2 3.46Å; S644-N669 PolarHBondContact OG-ND2 2.81Å; S644-N669 VanDerWaalsContact OG-ND2 3.07Å; S644-N669 PolarHBondContact OG-OD1 3.11Å; S644-N669 VanDerWaalsContact OG-OD1 3.07Å
645	A	98.7	Very high	90.9	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.008	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	137.1	167.4	0	0	0	0	0	110.7	I472 V476 S635 I636 E665 V666	I472-A645 HydrophobicContact CD1-CB 4.49Å; V476-A645 HydrophobicContact CG2-CB 3.51Å; S635-A645 WeakPolarHBondContact CA-O 3.24Å; I636-A645 HydrophobicContact CB-CB 4.27Å; I636-A645 PolarHBondContact N-O 3.13Å; I636-A645 PolarHBondContact O-N 3.24Å; A645-E665 CarbonylContact C-O 3.26Å; A645-E665 VanDerWaalsContact CA-O 3.26Å; A645-E665 WeakPolarHBondContact CA-O 3.21Å; A645-V666 HydrophobicContact CB-CB 4.46Å; A645-V666 HydrophobicContact CB-CG1 4.45Å; A645-V666 HydrophobicContact CB-CG2 4.02Å
646	T	98.6	Very high	89	Confident	43 Å²	43	59 Å²	59	26%	0.264	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	122.5	165.4	-81.1	0	0	0	0	107.8	K633 A664 E665	K633-T646 HydrophobicContact CD-CG2 3.85Å; K633-T646 WeakPolarHBondContact CE-OG1 3.29Å; K633-T646 HydrophobicContact CG-CG2 4.16Å; K633-T646 PolarHBondContact NZ-OG1 2.91Å; T646-A664 CarbonylContact O-C 3.57Å; T646-A664 VanDerWaalsContact O-CA 3.23Å; T646-A664 WeakPolarHBondContact O-CA 3.42Å; T646-E665 PolarHBondContact N-O 3Å; T646-E665 PolarHBondContact O-N 3.13Å
647	V	98.6	Very high	87.6	Confident	0 Å²	0	62 Å²	62	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	130.6	171.2	-175.9	0	0	0	0	108.3	Y479 L480 K633 V634 F649 V662 T663 A664	Y479-V647 HydrophobicContact CD1-CG2 4.48Å; L480-V647 HydrophobicContact CD2-CG1 3.69Å; K633-V647 CarbonylContact C-O 3.54Å; K633-V647 WeakPolarHBondContact CA-O 3.3Å; V634-V647 HydrophobicContact CB-CB 4.19Å; V634-V647 HydrophobicContact CG1-CB 4.48Å; V634-V647 PolarHBondContact N-O 3.27Å; V634-V647 PolarHBondContact O-N 2.93Å; V647-F649 HydrophobicContact CG1-CD2 4.09Å; V647-F649 HydrophobicContact CG1-CE2 3.6Å; V647-F649 HydrophobicContact CG1-CZ 4.2Å; V647-V662 HydrophobicContact CG1-CG2 3.73Å; V647-T663 CarbonylContact C-O 3.37Å; V647-A664 HydrophobicContact CB-CB 4.43Å; V647-A664 HydrophobicContact CG1-CB 4.44Å; V647-A664 HydrophobicContact CG2-CB 3.88Å
648	T	98	Very high	86.8	Confident	39 Å²	39	65.7 Å²	65.7	24%	0.239	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	116	177.7	-55.6	0	0	0	0	109.5	H650 V662 T663	T648-H650 PolarHBondContact O-CD2 3.29Å; T648-H650 PolarHBondContact O-NE2 2.89Å; T648-V662 WeakPolarHBondContact O-CA 3.1Å; T648-T663 PolarHBondContact N-O 2.75Å; T648-T663 PolarHBondContact O-N 2.77Å
649	F	96.9	Very high	86.2	Confident	3 Å²	3	67.6 Å²	67.6	1%	0.013	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	122.6	168.5	-67.1	-98.8	0	0	0	107.9	Y479 L480 F483 P615 L630 G631 G632 V634 V647 V662 W682	Y479-F649 HydrophobicContact CE1-CE2 4.26Å; Y479-F649 HydrophobicContact CE1-CZ 4.39Å; L480-F649 HydrophobicContact CD2-CZ 4.5Å; F483-F649 HydrophobicContact CD2-CE1 4.16Å; F483-F649 AromaticContact CD2-CZ 3.85Å; F483-F649 HydrophobicContact CD2-CZ 3.85Å; F483-F649 HydrophobicContact CE2-CE1 4.43Å; F483-F649 AromaticContact CE2-CZ 3.69Å; F483-F649 HydrophobicContact CE2-CZ 3.69Å; F483-F649 HydrophobicContact CZ-CZ 4.35Å; P615-F649 HydrophobicContact CB-CD2 3.64Å; P615-F649 HydrophobicContact CB-CE2 3.91Å; P615-F649 HydrophobicContact CB-CG 4.04Å; P615-F649 HydrophobicContact CG-CD2 4.27Å; P615-F649 HydrophobicContact CG-CE2 4.07Å; P615-F649 HydrophobicContact CG-CZ 4.3Å; L630-F649 HydrophobicContact CB-CB 4.19Å; L630-F649 HydrophobicContact CB-CD1 3.69Å; L630-F649 HydrophobicContact CB-CE1 4.39Å; L630-F649 HydrophobicContact CB-CG 4.13Å; L630-F649 HydrophobicContact CD1-CD1 4Å; L630-F649 HydrophobicContact CD1-CE1 3.84Å; G631-F649 CarbonylContact C-O 3.55Å; G631-F649 VanDerWaalsContact CA-O 3.32Å; G631-F649 WeakPolarHBondContact CA-O 3.39Å; G632-F649 PolarHBondContact N-O 2.96Å; G632-F649 PolarHBondContact O-N 3Å; V634-F649 HydrophobicContact CG2-CE2 4.35Å; V647-F649 HydrophobicContact CG1-CD2 4.09Å; V647-F649 HydrophobicContact CG1-CE2 3.6Å; V647-F649 HydrophobicContact CG1-CZ 4.2Å; F649-V662 HydrophobicContact CD1-CB 4.29Å; F649-V662 HydrophobicContact CD1-CG2 3.95Å; F649-V662 HydrophobicContact CD2-CG2 4.36Å; F649-V662 HydrophobicContact CE1-CB 4.46Å; F649-V662 HydrophobicContact CE1-CG2 3.94Å; F649-V662 HydrophobicContact CE2-CG2 4.35Å; F649-V662 HydrophobicContact CG-CG2 4.17Å; F649-V662 HydrophobicContact CZ-CG2 4.14Å; F649-W682 AromaticContact CD1-CD1 3.69Å; F649-W682 HydrophobicContact CD1-CG 4.22Å; F649-W682 HydrophobicContact CE1-CB 4.02Å; F649-W682 AromaticContact CE1-CD1 3.97Å; F649-W682 HydrophobicContact CE1-CG 4.04Å
650	H	92.4	Very high	85.9	Confident	44 Å²	44	61.4 Å²	61.4	20%	0.204	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-97	117.4	-174.9	-62	-101.6	0	0	0	109.7	T648 R661 T663	T648-H650 PolarHBondContact O-CD2 3.29Å; T648-H650 PolarHBondContact O-NE2 2.89Å; H650-R661 HydrophobicContact CB-CB 4.14Å; H650-R661 WeakPolarHBondContact CB-O 3.47Å; H650-R661 PolarHBondContact CD2-O 3.36Å; H650-R661 PolarHBondContact N-O 3.21Å; H650-R661 PolarHBondContact ND1-NH2 2.96Å; H650-T663 PolarHBondContact NE2-OG1 3.43Å
651	T	90.3	Very high	85.8	Confident	53 Å²	53	61.4 Å²	61.4	33%	0.325	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-67.7	144.7	165.4	56.8	0	0	0	0	110.3	Y618 E629	Y618-T651 HydrophobicContact CD2-CG2 3.97Å; Y618-T651 HydrophobicContact CE2-CG2 3.83Å; E629-T651 HydrophobicContact CG-CG2 4.38Å; E629-T651 WeakPolarHBondContact OE2-CB 3.49Å; E629-T651 WeakPolarHBondContact OE2-CG2 3.26Å
652	K	81.1	Confident	85.8	Confident	102 Å²	102	60.6 Å²	60.6	44%	0.443	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-51.7	125.3	179.9	-169.5	-173.6	-176.5	172.1	0	111.6	E629 V659	E629-K652 VanDerWaalsContact OE1-CB 3.29Å; E629-K652 WeakPolarHBondContact OE1-CB 3.42Å; E629-K652 PolarHBondContact OE1-N 3.2Å; K652-V659 HydrophobicContact CB-CG1 4.26Å; K652-V659 HydrophobicContact CD-CG1 3.82Å; K652-V659 HydrophobicContact CG-CG1 4.2Å
653	P	70.4	Confident	85.9	Confident	63 Å²	63	62 Å²	62	41%	0.409	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-61	155.3	171.9	-23.3	34.7	0	0	0	112.5	Y655	P653-Y655 PolarHBondContact O-N 3.12Å
654	F	54.3	Low	85.9	Confident	194 Å²	194	60.6 Å²	60.6	85%	0.851	32%	0.318	S	S	*	.	S	Bend	trans	-63.6	-26.6	177.4	-69.8	-78.7	0	0	0	113.6
655	Y	51.2	Low	85.9	Confident	224 Å²	224	64 Å²	64	88%	0.878	33%	0.332	S	S	*	.	S	Bend	trans	-119.4	104.3	-178.7	-58.8	-75.5	0	0	0	111	P653	P653-Y655 PolarHBondContact O-N 3.12Å
656	G	58.3	Low	85.8	Confident	54 Å²	54	64 Å²	64	56%	0.557	33%	0.332	S	S	*	.	S	Bend	trans	63.9	-156.1	177.8	0	0	0	0	0	114.1
657	G	69	Low	85.8	Confident	63 Å²	63	65 Å²	65	65%	0.649	33%	0.333	S	S	*	.			trans	84.6	161.6	178.2	0	0	0	0	0	115.2
658	K	81.2	Confident	85.8	Confident	139 Å²	139	66.8 Å²	66.8	60%	0.604	34%	0.341	S	S	*	.			trans	-80	148.6	174.2	-68.5	-178.4	160	-161.1	0	110.9	E681	K658-E681 WeakPolarHBondContact CD-OE1 3.49Å; K658-E681 WeakPolarHBondContact CE-OE1 3.39Å; K658-E681 IonicContact NZ-OE1 3.22Å; K658-E681 PolarHBondContact NZ-OE1 2.59Å
659	V	87.1	Confident	85.7	Confident	43 Å²	43	68.3 Å²	68.3	26%	0.261	35%	0.348	S	S	.	.	S	Bend	trans	-77.3	169.4	166.2	-76	0	0	0	0	110.2	W627 K652 R661	W627-V659 HydrophobicContact CH2-CG1 3.7Å; W627-V659 HydrophobicContact CZ3-CB 4.42Å; W627-V659 HydrophobicContact CZ3-CG1 3.96Å; K652-V659 HydrophobicContact CB-CG1 4.26Å; K652-V659 HydrophobicContact CD-CG1 3.82Å; K652-V659 HydrophobicContact CG-CG1 4.2Å; V659-R661 PolarHBondContact O-N 2.8Å
660	H	89.9	Confident	85.7	Confident	28 Å²	28	72.9 Å²	72.9	13%	0.13	38%	0.378	C	S	.	.	S	Bend	trans	57.2	15.9	171.3	-47	-66.7	0	0	0	116.4	V628 V662 E681 W682 N683	V628-H660 PolarHBondContact O-CE1 3.08Å; H660-V662 PolarHBondContact O-N 3.44Å; H660-E681 WeakPolarHBondContact O-CA 3.2Å; H660-W682 HydrophobicContact CB-CD2 4.47Å; H660-W682 HydrophobicContact CB-CG 4.4Å; H660-W682 HydrophobicContact CB-CZ2 4.45Å; H660-W682 AromaticContact CE1-CZ2 3.99Å; H660-W682 AromaticContact CG-NE1 3.98Å; H660-W682 AromaticContact ND1-CE2 3.57Å; H660-W682 AromaticContact ND1-CZ2 3.24Å; H660-W682 WeakPolarHBondContact ND1-CZ2 3.41Å; H660-W682 AromaticContact ND1-NE1 3.7Å; H660-W682 PolarHBondContact O-N 3.48Å; H660-W682 VanDerWaalsContact O-N 3.09Å; H660-N683 WeakPolarHBondContact CB-OD1 3.05Å; H660-N683 PolarHBondContact CD2-ND2 2.71Å; H660-N683 VanDerWaalsContact CD2-ND2 3.29Å; H660-N683 PolarHBondContact CD2-OD1 3.16Å; H660-N683 VanDerWaalsContact CG-OD1 3.28Å
661	R	94.6	Very high	85.9	Confident	118 Å²	118	74.6 Å²	74.6	45%	0.445	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	135.1	-178.7	-175.1	-177.2	74.3	-178.2	1.4	110.7	H650 V659 G680	H650-R661 HydrophobicContact CB-CB 4.14Å; H650-R661 WeakPolarHBondContact CB-O 3.47Å; H650-R661 PolarHBondContact CD2-O 3.36Å; H650-R661 PolarHBondContact N-O 3.21Å; H650-R661 PolarHBondContact ND1-NH2 2.96Å; V659-R661 PolarHBondContact O-N 2.8Å; R661-G680 CarbonylContact C-O 3.5Å; R661-G680 VanDerWaalsContact CA-O 3.24Å; R661-G680 WeakPolarHBondContact CA-O 3.43Å
662	V	97.3	Very high	86.1	Confident	1 Å²	1	77.5 Å²	77.5	1%	0.006	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	148.6	174.5	66.8	0	0	0	0	110	L480 V647 T648 F649 H660 Q679 G680 W682 L686	L480-V662 HydrophobicContact CD2-CG1 4.22Å; L480-V662 HydrophobicContact CD2-CG2 3.59Å; V647-V662 HydrophobicContact CG1-CG2 3.73Å; T648-V662 WeakPolarHBondContact O-CA 3.1Å; F649-V662 HydrophobicContact CD1-CB 4.29Å; F649-V662 HydrophobicContact CD1-CG2 3.95Å; F649-V662 HydrophobicContact CD2-CG2 4.36Å; F649-V662 HydrophobicContact CE1-CB 4.46Å; F649-V662 HydrophobicContact CE1-CG2 3.94Å; F649-V662 HydrophobicContact CE2-CG2 4.35Å; F649-V662 HydrophobicContact CG-CG2 4.17Å; F649-V662 HydrophobicContact CZ-CG2 4.14Å; H660-V662 PolarHBondContact O-N 3.44Å; V662-Q679 WeakPolarHBondContact O-CA 3.44Å; V662-G680 PolarHBondContact N-O 2.71Å; V662-G680 PolarHBondContact O-N 3.27Å; V662-W682 HydrophobicContact CB-CB 4.44Å; V662-W682 HydrophobicContact CG1-CB 4.12Å; V662-L686 HydrophobicContact CG1-CD2 3.45Å; V662-L686 VanDerWaalsContact CG1-CD2 3.45Å
663	T	98.3	Very high	86.9	Confident	45 Å²	45	76 Å²	76	28%	0.276	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	139.8	170.8	56.4	0	0	0	0	109.8	V647 T648 H650 A678 Q679	V647-T663 CarbonylContact C-O 3.37Å; T648-T663 PolarHBondContact N-O 2.75Å; T648-T663 PolarHBondContact O-N 2.77Å; H650-T663 PolarHBondContact NE2-OG1 3.43Å; T663-A678 CarbonylContact C-O 3.57Å; T663-A678 VanDerWaalsContact CA-O 3.24Å; T663-A678 WeakPolarHBondContact CA-O 3.45Å; T663-Q679 HydrophobicContact CG2-CB 4.29Å
664	A	98.6	Very high	88.1	Confident	2 Å²	2	76.5 Å²	76.5	2%	0.017	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	148	173	0	0	0	0	0	111.7	V476 L480 T646 V647 K677 A678	V476-A664 HydrophobicContact CG1-CB 4.05Å; L480-A664 HydrophobicContact CD1-CB 4.22Å; T646-A664 CarbonylContact O-C 3.57Å; T646-A664 VanDerWaalsContact O-CA 3.23Å; T646-A664 WeakPolarHBondContact O-CA 3.42Å; V647-A664 HydrophobicContact CB-CB 4.43Å; V647-A664 HydrophobicContact CG1-CB 4.44Å; V647-A664 HydrophobicContact CG2-CB 3.88Å; A664-K677 CarbonylContact O-C 3.57Å; A664-K677 WeakPolarHBondContact O-CA 3.35Å; A664-A678 HydrophobicContact CB-CB 4.05Å; A664-A678 PolarHBondContact N-O 2.93Å; A664-A678 PolarHBondContact O-N 3.09Å
665	E	98.3	Very high	90.2	Very high	85 Å²	85	67.7 Å²	67.7	40%	0.397	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	126.4	167.9	-62.9	-166.3	138.4	0	0	109.1	A645 T646 K677	A645-E665 CarbonylContact C-O 3.26Å; A645-E665 VanDerWaalsContact CA-O 3.26Å; A645-E665 WeakPolarHBondContact CA-O 3.21Å; T646-E665 PolarHBondContact N-O 3Å; T646-E665 PolarHBondContact O-N 3.13Å; E665-K677 HydrophobicContact CG-CD 4.42Å; E665-K677 HydrophobicContact CG-CG 4.3Å; E665-K677 WeakPolarHBondContact OE1-CE 3.34Å; E665-K677 IonicContact OE1-NZ 3.52Å; E665-K677 PolarHBondContact OE1-NZ 2.89Å
666	V	98.5	Very high	92.4	Very high	1 Å²	1	57.1 Å²	57.1	1%	0.006	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	129.8	177.4	-169	0	0	0	0	108.6	I472 V473 V476 S644 A645 I674 V675 C676	I472-V666 HydrophobicContact CD1-CG1 4.21Å; I472-V666 HydrophobicContact CG1-CG1 4.19Å; I472-V666 HydrophobicContact CG2-CG1 3.61Å; V473-V666 HydrophobicContact CG2-CG1 4.37Å; V476-V666 HydrophobicContact CB-CG2 4.32Å; V476-V666 HydrophobicContact CG1-CG2 4.29Å; V476-V666 HydrophobicContact CG2-CG2 3.9Å; S644-V666 WeakPolarHBondContact O-CA 3.48Å; A645-V666 HydrophobicContact CB-CB 4.46Å; A645-V666 HydrophobicContact CB-CG1 4.45Å; A645-V666 HydrophobicContact CB-CG2 4.02Å; V666-I674 CarbonylContact O-C 3.59Å; V666-I674 WeakPolarHBondContact O-CA 3.39Å; V666-I674 WeakPolarHBondContact O-CG2 3.42Å; V666-V675 HydrophobicContact CB-CG2 3.93Å; V666-V675 HydrophobicContact CG1-CG2 3.67Å; V666-V675 WeakPolarHBondContact O-CG2 3.14Å; V666-V675 PolarHBondContact O-N 2.99Å; V666-C676 HydrophobicContact CB-CB 3.97Å; V666-C676 HydrophobicContact CG2-CB 3.86Å; V666-C676 PolarHBondContact N-O 3.16Å
667	K	97.8	Very high	94.3	Very high	63 Å²	63	59.1 Å²	59.1	27%	0.274	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	134	-166.7	-178.7	-171.7	177.3	-175.9	0	111	Y643 S644 N672 T673	Y643-K667 WeakPolarHBondContact CA-O 3.39Å; S644-K667 PolarHBondContact N-O 3.39Å; S644-K667 PolarHBondContact O-N 2.75Å; K667-N672 WeakPolarHBondContact CE-OD1 3.48Å; K667-N672 PolarHBondContact NZ-OD1 3.19Å; K667-T673 WeakPolarHBondContact CA-O 3.23Å
668	H	97.9	Very high	95.7	Very high	38 Å²	38	56.4 Å²	56.4	18%	0.176	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	114.1	162.4	-173.4	-126	0	0	0	108.7	Y643 T671 N672 T673	Y643-H668 HydrophobicContact CD1-CB 3.97Å; Y643-H668 AromaticContact CD2-CD2 3.76Å; Y643-H668 HydrophobicContact CE1-CB 3.59Å; Y643-H668 AromaticContact CE2-CD2 3.46Å; Y643-H668 VanDerWaalsContact CE2-CD2 3.46Å; Y643-H668 WeakPolarHBondContact CE2-CD2 3.45Å; Y643-H668 AromaticContact CZ-CD2 3.63Å; Y643-H668 AromaticContact CZ-CG 3.9Å; H668-T671 PolarHBondContact ND1-OG1 2.91Å; H668-N672 WeakPolarHBondContact O-CA 3.49Å; H668-N672 PolarHBondContact O-N 2.68Å; H668-T673 PolarHBondContact N-O 3.23Å; H668-T673 PolarHBondContact O-N 3.46Å
669	N	96.6	Very high	96.5	Very high	72 Å²	72	54.7 Å²	54.7	39%	0.385	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-43.5	-172.2	-68.3	-44.7	0	0	0	113.8	G642 S644 T671 N672	G642-N669 VanDerWaalsContact O-CB 3.24Å; G642-N669 WeakPolarHBondContact O-CB 3.45Å; G642-N669 PolarHBondContact O-N 3.44Å; G642-N669 PolarHBondContact O-ND2 3.1Å; S644-N669 WeakPolarHBondContact CB-ND2 3.46Å; S644-N669 PolarHBondContact OG-ND2 2.81Å; S644-N669 VanDerWaalsContact OG-ND2 3.07Å; S644-N669 PolarHBondContact OG-OD1 3.11Å; S644-N669 VanDerWaalsContact OG-OD1 3.07Å; N669-T671 PolarHBondContact O-N 2.79Å; N669-N672 PolarHBondContact O-N 2.65Å
670	P	97	Very high	96.9	Very high	99 Å²	99	53.6 Å²	53.6	64%	0.643	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-37.8	-179.8	-26	35.3	0	0	0	114.7
671	T	96.5	Very high	97.1	Very high	79 Å²	79	54.5 Å²	54.5	49%	0.485	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-5.7	-179.1	53.6	0	0	0	0	113.3	H668 N669 T673	H668-T671 PolarHBondContact ND1-OG1 2.91Å; N669-T671 PolarHBondContact O-N 2.79Å; T671-T673 PolarHBondContact O-N 3.14Å; T671-T673 VanDerWaalsContact O-N 3.13Å; T671-T673 PolarHBondContact OG1-OG1 2.62Å
672	N	95.3	Very high	97	Very high	115 Å²	115	49 Å²	49	62%	0.615	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	15.3	-172.6	-163.7	52.9	0	0	0	114.4	K667 H668 N669	K667-N672 WeakPolarHBondContact CE-OD1 3.48Å; K667-N672 PolarHBondContact NZ-OD1 3.19Å; H668-N672 WeakPolarHBondContact O-CA 3.49Å; H668-N672 PolarHBondContact O-N 2.68Å; N669-N672 PolarHBondContact O-N 2.65Å
673	T	96.3	Very high	96.7	Very high	70 Å²	70	51.5 Å²	51.5	43%	0.429	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	132.9	-175.3	50.6	0	0	0	0	112	K667 H668 T671	K667-T673 WeakPolarHBondContact CA-O 3.23Å; H668-T673 PolarHBondContact N-O 3.23Å; H668-T673 PolarHBondContact O-N 3.46Å; T671-T673 PolarHBondContact O-N 3.14Å; T671-T673 VanDerWaalsContact O-N 3.13Å; T671-T673 PolarHBondContact OG1-OG1 2.62Å
674	I	97.1	Very high	96.5	Very high	74 Å²	74	50 Å²	50	38%	0.379	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	128.2	170.1	-58.9	176.5	0	0	0	108.2	V666 K677	V666-I674 CarbonylContact O-C 3.59Å; V666-I674 WeakPolarHBondContact O-CA 3.39Å; V666-I674 WeakPolarHBondContact O-CG2 3.42Å; I674-K677 HydrophobicContact CG2-CG 3.8Å
675	V	96.7	Very high	96.4	Very high	8 Å²	8	53.1 Å²	53.1	5%	0.048	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	-23.3	-174.8	-64.4	0	0	0	0	113.2	E469 Y643 V666 S691	E469-V675 HydrophobicContact CG-CB 3.9Å; E469-V675 HydrophobicContact CG-CG1 4.21Å; E469-V675 HydrophobicContact CG-CG2 3.98Å; E469-V675 WeakPolarHBondContact OE2-CG1 3.49Å; Y643-V675 HydrophobicContact CD1-CG2 4.26Å; Y643-V675 HydrophobicContact CE1-CG1 4.13Å; Y643-V675 HydrophobicContact CE1-CG2 4Å; V666-V675 HydrophobicContact CB-CG2 3.93Å; V666-V675 HydrophobicContact CG1-CG2 3.67Å; V666-V675 WeakPolarHBondContact O-CG2 3.14Å; V666-V675 PolarHBondContact O-N 2.99Å; V675-S691 PolarHBondContact O-N 2.93Å
676	C	97.8	Very high	96.3	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.014	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	142.3	172.2	179.7	0	0	0	0	109.9	V473 V666 T689 Y690	V473-C676 HydrophobicContact CG1-CB 4.46Å; V473-C676 HydrophobicContact CG2-CB 3.71Å; V666-C676 HydrophobicContact CB-CB 3.97Å; V666-C676 HydrophobicContact CG2-CB 3.86Å; V666-C676 PolarHBondContact N-O 3.16Å; C676-T689 CarbonylContact C-O 3.55Å; C676-T689 WeakPolarHBondContact CA-O 3.3Å; C676-Y690 HydrophobicContact CB-CD1 4.21Å
677	K	98.3	Very high	96.3	Very high	96 Å²	96	52.4 Å²	52.4	42%	0.417	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	146.1	164.1	-60.2	-163.1	-179.5	-152.2	0	108.9	A664 E665 I674 F688 T689	A664-K677 CarbonylContact O-C 3.57Å; A664-K677 WeakPolarHBondContact O-CA 3.35Å; E665-K677 HydrophobicContact CG-CD 4.42Å; E665-K677 HydrophobicContact CG-CG 4.3Å; E665-K677 WeakPolarHBondContact OE1-CE 3.34Å; E665-K677 IonicContact OE1-NZ 3.52Å; E665-K677 PolarHBondContact OE1-NZ 2.89Å; I674-K677 HydrophobicContact CG2-CG 3.8Å; K677-F688 CarbonylContact O-C 3.57Å; K677-F688 WeakPolarHBondContact O-CA 3.4Å; K677-T689 PolarHBondContact N-O 2.81Å; K677-T689 PolarHBondContact O-N 3.26Å
678	A	98.1	Very high	96.3	Very high	6 Å²	6	49.4 Å²	49.4	5%	0.05	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	147.4	169.8	0	0	0	0	0	110.8	L480 T663 A664 E687 F688	L480-A678 HydrophobicContact CD1-CB 3.86Å; T663-A678 CarbonylContact C-O 3.57Å; T663-A678 VanDerWaalsContact CA-O 3.24Å; T663-A678 WeakPolarHBondContact CA-O 3.45Å; A664-A678 HydrophobicContact CB-CB 4.05Å; A664-A678 PolarHBondContact N-O 2.93Å; A664-A678 PolarHBondContact O-N 3.09Å; A678-E687 CarbonylContact C-O 3.58Å; A678-E687 WeakPolarHBondContact CA-O 3.24Å; A678-F688 HydrophobicContact CB-CD1 3.57Å; A678-F688 HydrophobicContact CB-CE1 3.61Å; A678-F688 HydrophobicContact CB-CG 4.06Å; A678-F688 HydrophobicContact CB-CZ 4.13Å
679	Q	97.7	Very high	96.3	Very high	103 Å²	103	50.3 Å²	50.3	48%	0.481	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	153.5	175.5	62.1	178.4	0.8	0	0	110.7	V662 T663 E687	V662-Q679 WeakPolarHBondContact O-CA 3.44Å; T663-Q679 HydrophobicContact CG2-CB 4.29Å; Q679-E687 HydrophobicContact CG-CB 4.32Å; Q679-E687 PolarHBondContact N-O 3.39Å; Q679-E687 PolarHBondContact NE2-OE2 2.73Å; Q679-E687 PolarHBondContact O-N 3.11Å
680	G	96.1	Very high	96.2	Very high	21 Å²	21	48.7 Å²	48.7	22%	0.216	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	149.4	-146.6	174.6	0	0	0	0	0	112.9	R661 V662 T685	R661-G680 CarbonylContact C-O 3.5Å; R661-G680 VanDerWaalsContact CA-O 3.24Å; R661-G680 WeakPolarHBondContact CA-O 3.43Å; V662-G680 PolarHBondContact N-O 2.71Å; V662-G680 PolarHBondContact O-N 3.27Å; G680-T685 CarbonylContact C-O 3.53Å; G680-T685 VanDerWaalsContact CA-O 3.26Å; G680-T685 WeakPolarHBondContact CA-O 3.25Å
681	E	94.6	Very high	95.8	Very high	46 Å²	46	47.8 Å²	47.8	22%	0.215	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	123.1	-179.2	-69.3	164.8	-99.4	0	0	108.9	K658 H660 N683 G684 T685	K658-E681 WeakPolarHBondContact CD-OE1 3.49Å; K658-E681 WeakPolarHBondContact CE-OE1 3.39Å; K658-E681 IonicContact NZ-OE1 3.22Å; K658-E681 PolarHBondContact NZ-OE1 2.59Å; H660-E681 WeakPolarHBondContact O-CA 3.2Å; E681-N683 PolarHBondContact O-N 3.36Å; E681-N683 VanDerWaalsContact O-N 3.11Å; E681-G684 CarbonylContact O-C 3.46Å; E681-G684 PolarHBondContact O-N 3.39Å; E681-T685 PolarHBondContact N-O 2.8Å
682	W	93.3	Very high	95.5	Very high	3 Å²	3	48 Å²	48	1%	0.011	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-12.2	-172.1	62.9	-103.3	0	0	0	114.6	F483 R487 L630 F649 H660 V662	F483-W682 HydrophobicContact CB-CD2 4.45Å; F483-W682 HydrophobicContact CB-CE3 3.74Å; F483-W682 HydrophobicContact CB-CZ3 4.21Å; R487-W682 HydrophobicContact CB-CH2 4.1Å; R487-W682 HydrophobicContact CB-CZ3 4.27Å; R487-W682 HydrophobicContact CG-CH2 4.41Å; L630-W682 HydrophobicContact CB-CZ2 4.38Å; L630-W682 HydrophobicContact CD1-CD2 3.87Å; L630-W682 HydrophobicContact CD1-CE3 4.19Å; L630-W682 HydrophobicContact CD1-CG 4.36Å; L630-W682 HydrophobicContact CD1-CH2 4.31Å; L630-W682 HydrophobicContact CD1-CZ2 3.95Å; L630-W682 HydrophobicContact CD1-CZ3 4.4Å; L630-W682 HydrophobicContact CG-CD2 4.49Å; L630-W682 HydrophobicContact CG-CH2 4.36Å; L630-W682 HydrophobicContact CG-CZ2 3.76Å; F649-W682 AromaticContact CD1-CD1 3.69Å; F649-W682 HydrophobicContact CD1-CG 4.22Å; F649-W682 HydrophobicContact CE1-CB 4.02Å; F649-W682 AromaticContact CE1-CD1 3.97Å; F649-W682 HydrophobicContact CE1-CG 4.04Å; H660-W682 HydrophobicContact CB-CD2 4.47Å; H660-W682 HydrophobicContact CB-CG 4.4Å; H660-W682 HydrophobicContact CB-CZ2 4.45Å; H660-W682 AromaticContact CE1-CZ2 3.99Å; H660-W682 AromaticContact CG-NE1 3.98Å; H660-W682 AromaticContact ND1-CE2 3.57Å; H660-W682 AromaticContact ND1-CZ2 3.24Å; H660-W682 WeakPolarHBondContact ND1-CZ2 3.41Å; H660-W682 AromaticContact ND1-NE1 3.7Å; H660-W682 PolarHBondContact O-N 3.48Å; H660-W682 VanDerWaalsContact O-N 3.09Å; V662-W682 HydrophobicContact CB-CB 4.44Å; V662-W682 HydrophobicContact CG1-CB 4.12Å
683	N	90.9	Very high	95.2	Very high	53 Å²	53	45.4 Å²	45.4	28%	0.283	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.8	27.7	173	63.4	-19.1	0	0	0	112.3	H484 H660 E681 T700	H484-N683 HydrophobicContact CB-CB 4.18Å; H660-N683 WeakPolarHBondContact CB-OD1 3.05Å; H660-N683 PolarHBondContact CD2-ND2 2.71Å; H660-N683 VanDerWaalsContact CD2-ND2 3.29Å; H660-N683 PolarHBondContact CD2-OD1 3.16Å; H660-N683 VanDerWaalsContact CG-OD1 3.28Å; E681-N683 PolarHBondContact O-N 3.36Å; E681-N683 VanDerWaalsContact O-N 3.11Å; N683-T700 VanDerWaalsContact C-OG1 3.23Å
684	G	93	Very high	95	Very high	15 Å²	15	48 Å²	48	16%	0.155	28%	0.279	C	S	.	.	S	Bend	trans	-153.8	-120.8	177.5	0	0	0	0	0	111.3	E681 T700	E681-G684 CarbonylContact O-C 3.46Å; E681-G684 PolarHBondContact O-N 3.39Å; G684-T700 PolarHBondContact N-OG1 3.36Å; G684-T700 VanDerWaalsContact N-OG1 3.13Å; G684-T700 PolarHBondContact O-N 2.85Å; G684-T700 PolarHBondContact O-OG1 2.78Å; G684-T700 VanDerWaalsContact O-OG1 3.13Å
685	T	95.9	Very high	94.9	Very high	67 Å²	67	48.3 Å²	48.3	41%	0.411	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	128.5	-179	-51.2	0	0	0	0	111.5	G680 E681 V697 I698	G680-T685 CarbonylContact C-O 3.53Å; G680-T685 VanDerWaalsContact CA-O 3.26Å; G680-T685 WeakPolarHBondContact CA-O 3.25Å; E681-T685 PolarHBondContact N-O 2.8Å; T685-V697 HydrophobicContact CG2-CG1 3.39Å; T685-I698 WeakPolarHBondContact CA-O 3.45Å
686	L	97.2	Very high	94.9	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	132.9	170.5	-63.3	168.5	0	0	0	109.1	L480 T481 V662 F688 V697 I698 T700	L480-L686 HydrophobicContact CB-CD1 3.81Å; T481-L686 HydrophobicContact CG2-CD1 4.31Å; V662-L686 HydrophobicContact CG1-CD2 3.45Å; V662-L686 VanDerWaalsContact CG1-CD2 3.45Å; L686-F688 HydrophobicContact CB-CE2 3.82Å; L686-V697 CarbonylContact O-C 3.59Å; L686-V697 WeakPolarHBondContact O-CA 3.42Å; L686-I698 HydrophobicContact CB-CB 4.42Å; L686-I698 PolarHBondContact N-O 2.89Å; L686-I698 PolarHBondContact O-N 3.39Å; L686-T700 HydrophobicContact CD1-CG2 4.04Å
687	E	98.1	Very high	94.8	Very high	70 Å²	70	55.2 Å²	55.2	33%	0.327	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	129.6	174.1	179.3	-176.6	-146	0	0	108.8	A678 Q679	A678-E687 CarbonylContact C-O 3.58Å; A678-E687 WeakPolarHBondContact CA-O 3.24Å; Q679-E687 HydrophobicContact CG-CB 4.32Å; Q679-E687 PolarHBondContact N-O 3.39Å; Q679-E687 PolarHBondContact NE2-OE2 2.73Å; Q679-E687 PolarHBondContact O-N 3.11Å
688	F	97.9	Very high	94.7	Very high	1 Å²	1	51.1 Å²	51.1	0%	0.004	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	141.5	174.9	-65.4	-105.5	0	0	0	109.1	V476 E477 L480 K677 A678 L686 Y690 T695 K696 I698	V476-F688 HydrophobicContact CG1-CE1 4.44Å; E477-F688 HydrophobicContact CB-CE1 4.4Å; E477-F688 HydrophobicContact CB-CZ 4.36Å; E477-F688 HydrophobicContact CG-CD1 4.14Å; E477-F688 HydrophobicContact CG-CE1 3.72Å; E477-F688 HydrophobicContact CG-CZ 3.99Å; L480-F688 HydrophobicContact CB-CZ 4.49Å; L480-F688 HydrophobicContact CD1-CE1 3.92Å; L480-F688 HydrophobicContact CD1-CZ 3.73Å; K677-F688 CarbonylContact O-C 3.57Å; K677-F688 WeakPolarHBondContact O-CA 3.4Å; A678-F688 HydrophobicContact CB-CD1 3.57Å; A678-F688 HydrophobicContact CB-CE1 3.61Å; A678-F688 HydrophobicContact CB-CG 4.06Å; A678-F688 HydrophobicContact CB-CZ 4.13Å; L686-F688 HydrophobicContact CB-CE2 3.82Å; F688-Y690 HydrophobicContact CB-CE1 4.16Å; F688-Y690 HydrophobicContact CB-CE2 4.34Å; F688-T695 CarbonylContact O-C 3.53Å; F688-T695 WeakPolarHBondContact O-CA 3.38Å; F688-T695 WeakPolarHBondContact O-CB 3.47Å; F688-K696 HydrophobicContact CB-CB 4.42Å; F688-K696 PolarHBondContact N-O 3.01Å; F688-K696 PolarHBondContact O-N 3.48Å; F688-I698 HydrophobicContact CD2-CD1 4.24Å; F688-I698 HydrophobicContact CD2-CG1 4.41Å; F688-I698 HydrophobicContact CE2-CD1 3.71Å; F688-I698 HydrophobicContact CE2-CG1 4.16Å; F688-I698 HydrophobicContact CZ-CD1 4.36Å
689	T	97.5	Very high	94.5	Very high	57 Å²	57	52.7 Å²	52.7	35%	0.35	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	125.1	174.1	-47.8	0	0	0	0	108.3	C676 K677 T695	C676-T689 CarbonylContact C-O 3.55Å; C676-T689 WeakPolarHBondContact CA-O 3.3Å; K677-T689 PolarHBondContact N-O 2.81Å; K677-T689 PolarHBondContact O-N 3.26Å; T689-T695 HydrophobicContact CG2-CG2 4.13Å
690	Y	94.2	Very high	94.2	Very high	38 Å²	38	47.9 Å²	47.9	15%	0.149	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	166.5	-175.3	-52.9	-71.7	0	0	0	112.7	V473 E477 C676 F688 S692 G693 E694 K696	V473-Y690 HydrophobicContact CG1-CD1 4.07Å; V473-Y690 HydrophobicContact CG1-CE1 3.58Å; E477-Y690 PolarHBondContact OE1-OH 2.85Å; C676-Y690 HydrophobicContact CB-CD1 4.21Å; F688-Y690 HydrophobicContact CB-CE1 4.16Å; F688-Y690 HydrophobicContact CB-CE2 4.34Å; Y690-S692 PolarHBondContact O-N 3.38Å; Y690-G693 PolarHBondContact O-N 3.4Å; Y690-E694 HydrophobicContact CD2-CB 4.06Å; Y690-E694 HydrophobicContact CD2-CG 4.22Å; Y690-E694 VanDerWaalsContact CD2-O 3.3Å; Y690-E694 WeakPolarHBondContact CD2-O 3.43Å; Y690-E694 PolarHBondContact N-O 2.95Å; Y690-K696 HydrophobicContact CE2-CB 3.72Å; Y690-K696 WeakPolarHBondContact OH-CB 3.46Å; Y690-K696 WeakPolarHBondContact OH-CD 3.36Å
691	S	89.3	Confident	93.8	Very high	79 Å²	79	51.4 Å²	51.4	55%	0.552	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-28.5	172.6	50.8	0	0	0	0	113.7	E469 V675 G693	E469-S691 PolarHBondContact OE1-OG 3.5Å; V675-S691 PolarHBondContact O-N 2.93Å; S691-G693 VanDerWaalsContact C-N 3.27Å; S691-G693 PolarHBondContact O-N 2.85Å
692	S	89.4	Confident	93.6	Very high	85 Å²	85	57 Å²	57	59%	0.594	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-12.4	174.6	59.3	0	0	0	0	114.8	Y690 E694	Y690-S692 PolarHBondContact O-N 3.38Å; S692-E694 VanDerWaalsContact OG-CB 3.3Å; S692-E694 WeakPolarHBondContact OG-CB 3.36Å; S692-E694 PolarHBondContact OG-N 3Å
693	G	89.3	Confident	93.5	Very high	60 Å²	60	58.9 Å²	58.9	62%	0.619	34%	0.343	S	S	*	.	S	Bend	trans	81.1	-3.6	-168.2	0	0	0	0	0	114.3	Y690 S691	Y690-G693 PolarHBondContact O-N 3.4Å; S691-G693 VanDerWaalsContact C-N 3.27Å; S691-G693 PolarHBondContact O-N 2.85Å
694	E	93.4	Very high	93.4	Very high	123 Å²	123	60.1 Å²	60.1	58%	0.575	35%	0.354	S	S	*	.			trans	-64.6	144.6	170.3	-178.2	-179.3	174.2	0	0	110.5	Y690 S692	Y690-E694 HydrophobicContact CD2-CB 4.06Å; Y690-E694 HydrophobicContact CD2-CG 4.22Å; Y690-E694 VanDerWaalsContact CD2-O 3.3Å; Y690-E694 WeakPolarHBondContact CD2-O 3.43Å; Y690-E694 PolarHBondContact N-O 2.95Å; S692-E694 VanDerWaalsContact OG-CB 3.3Å; S692-E694 WeakPolarHBondContact OG-CB 3.36Å; S692-E694 PolarHBondContact OG-N 3Å
695	T	95.3	Very high	93.3	Very high	81 Å²	81	62.1 Å²	62.1	50%	0.497	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	143.3	169.2	59.4	0	0	0	0	111.4	F688 T689	F688-T695 CarbonylContact O-C 3.53Å; F688-T695 WeakPolarHBondContact O-CA 3.38Å; F688-T695 WeakPolarHBondContact O-CB 3.47Å; T689-T695 HydrophobicContact CG2-CG2 4.13Å
696	K	95.4	Very high	93.2	Very high	63 Å²	63	60 Å²	60	27%	0.274	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	132	175.6	177.9	-170.8	-178.5	-179.5	0	109.5	E477 F688 Y690 I698	E477-K696 WeakPolarHBondContact OE1-CD 3.21Å; E477-K696 IonicContact OE1-NZ 3.69Å; E477-K696 PolarHBondContact OE1-NZ 2.86Å; E477-K696 IonicContact OE2-NZ 3.74Å; E477-K696 PolarHBondContact OE2-NZ 3.12Å; F688-K696 HydrophobicContact CB-CB 4.42Å; F688-K696 PolarHBondContact N-O 3.01Å; F688-K696 PolarHBondContact O-N 3.48Å; Y690-K696 HydrophobicContact CE2-CB 3.72Å; Y690-K696 WeakPolarHBondContact OH-CB 3.46Å; Y690-K696 WeakPolarHBondContact OH-CD 3.36Å; K696-I698 HydrophobicContact CD-CD1 4.41Å; K696-I698 HydrophobicContact CD-CG1 4.37Å; K696-I698 HydrophobicContact CG-CG1 4.34Å
697	V	96.9	Very high	93	Very high	92 Å²	92	68 Å²	68	56%	0.558	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108	129.2	175.9	-178.7	0	0	0	0	109.2	T685 L686	T685-V697 HydrophobicContact CG2-CG1 3.39Å; L686-V697 CarbonylContact O-C 3.59Å; L686-V697 WeakPolarHBondContact O-CA 3.42Å
698	I	95	Very high	92.8	Very high	11 Å²	11	65.1 Å²	65.1	6%	0.056	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	121.9	174.9	-58.3	-176.6	0	0	0	107.7	M458 T481 T685 L686 F688 K696 L703	M458-I698 HydrophobicContact CE-CD1 4.32Å; T481-I698 HydrophobicContact CG2-CG2 3.91Å; T685-I698 WeakPolarHBondContact CA-O 3.45Å; L686-I698 HydrophobicContact CB-CB 4.42Å; L686-I698 PolarHBondContact N-O 2.89Å; L686-I698 PolarHBondContact O-N 3.39Å; F688-I698 HydrophobicContact CD2-CD1 4.24Å; F688-I698 HydrophobicContact CD2-CG1 4.41Å; F688-I698 HydrophobicContact CE2-CD1 3.71Å; F688-I698 HydrophobicContact CE2-CG1 4.16Å; F688-I698 HydrophobicContact CZ-CD1 4.36Å; K696-I698 HydrophobicContact CD-CD1 4.41Å; K696-I698 HydrophobicContact CD-CG1 4.37Å; K696-I698 HydrophobicContact CG-CG1 4.34Å; I698-L703 HydrophobicContact CG2-CD1 3.77Å; I698-L703 HydrophobicContact CG2-CD2 4.1Å; I698-L703 HydrophobicContact CG2-CG 4.11Å
699	D	94.4	Very high	92.7	Very high	39 Å²	39	66.9 Å²	66.9	21%	0.209	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	104.6	172	-176.4	-17.6	0	0	0	108.5	C701 K702 L703	D699-C701 PolarHBondContact O-N 3.13Å; D699-C701 WeakPolarHBondContact OD1-CB 3.47Å; D699-C701 PolarHBondContact OD1-N 2.67Å; D699-C701 VanDerWaalsContact OD1-N 3.15Å; D699-K702 HydrophobicContact CB-CB 4.25Å; D699-K702 HydrophobicContact CB-CD 4.29Å; D699-K702 HydrophobicContact CB-CG 4.28Å; D699-K702 PolarHBondContact O-N 2.84Å; D699-K702 WeakPolarHBondContact OD2-CD 3.5Å; D699-K702 WeakPolarHBondContact OD2-CE 3.37Å; D699-K702 IonicContact OD2-NZ 3.81Å; D699-K702 PolarHBondContact OD2-NZ 2.69Å; D699-L703 PolarHBondContact O-N 2.94Å
700	T	92	Very high	92.6	Very high	1 Å²	1	64.6 Å²	64.6	1%	0.006	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-60.9	-31.2	-174.4	61.7	0	0	0	0	112.1	T481 H484 N683 G684 L686 K702 L703	T481-T700 HydrophobicContact CG2-CG2 4.37Å; H484-T700 PolarHBondContact CE1-O 3.28Å; H484-T700 VanDerWaalsContact CE1-O 3.24Å; N683-T700 VanDerWaalsContact C-OG1 3.23Å; G684-T700 PolarHBondContact N-OG1 3.36Å; G684-T700 VanDerWaalsContact N-OG1 3.13Å; G684-T700 PolarHBondContact O-N 2.85Å; G684-T700 PolarHBondContact O-OG1 2.78Å; G684-T700 VanDerWaalsContact O-OG1 3.13Å; L686-T700 HydrophobicContact CD1-CG2 4.04Å; T700-K702 PolarHBondContact O-N 2.91Å; T700-L703 PolarHBondContact O-N 2.82Å
701	C	87.4	Confident	92.6	Very high	95 Å²	95	63.9 Å²	63.9	64%	0.642	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-71.7	-13.5	179.1	-60.3	0	0	0	0	113.3	D699	D699-C701 PolarHBondContact O-N 3.13Å; D699-C701 WeakPolarHBondContact OD1-CB 3.47Å; D699-C701 PolarHBondContact OD1-N 2.67Å; D699-C701 VanDerWaalsContact OD1-N 3.15Å
702	K	90.6	Very high	92.9	Very high	164 Å²	164	61.7 Å²	61.7	71%	0.713	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-107.9	-5.7	177.3	-64.3	-174	-179.3	110.5	0	113.6	D699 T700	D699-K702 HydrophobicContact CB-CB 4.25Å; D699-K702 HydrophobicContact CB-CD 4.29Å; D699-K702 HydrophobicContact CB-CG 4.28Å; D699-K702 PolarHBondContact O-N 2.84Å; D699-K702 WeakPolarHBondContact OD2-CD 3.5Å; D699-K702 WeakPolarHBondContact OD2-CE 3.37Å; D699-K702 IonicContact OD2-NZ 3.81Å; D699-K702 PolarHBondContact OD2-NZ 2.69Å; T700-K702 PolarHBondContact O-N 2.91Å
703	L	90.1	Very high	93.1	Very high	42 Å²	42	59.2 Å²	59.2	22%	0.22	32%	0.321	C	S	.	.	S	Bend	trans	-69.2	135	179.3	-72.3	178.3	0	0	0	111	H455 M458 T481 I698 D699 T700 V705	H455-L703 WeakPolarHBondContact CE1-CB 3.36Å; M458-L703 HydrophobicContact SD-CD1 4.24Å; T481-L703 HydrophobicContact CG2-CD1 3.65Å; I698-L703 HydrophobicContact CG2-CD1 3.77Å; I698-L703 HydrophobicContact CG2-CD2 4.1Å; I698-L703 HydrophobicContact CG2-CG 4.11Å; D699-L703 PolarHBondContact O-N 2.94Å; T700-L703 PolarHBondContact O-N 2.82Å; L703-V705 PolarHBondContact O-N 2.85Å
704	P	88.8	Confident	93.3	Very high	80 Å²	80	63.4 Å²	63.4	52%	0.519	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-66.8	127.2	174.3	28.6	-33.6	0	0	0	110	H455	H455-P704 PolarHBondContact CE1-O 2.72Å; H455-P704 PolarHBondContact ND1-O 2.9Å
705	V	90.9	Very high	93.3	Very high	56 Å²	56	64.8 Å²	64.8	34%	0.339	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-93	126.5	175.6	-179.5	0	0	0	0	108.8	A454 E485 L703	A454-V705 HydrophobicContact CB-CG1 4.49Å; E485-V705 VanDerWaalsContact CD-CG2 3.47Å; E485-V705 HydrophobicContact CG-CG1 4.19Å; E485-V705 HydrophobicContact CG-CG2 3.79Å; E485-V705 WeakPolarHBondContact OE1-CG2 3.13Å; L703-V705 PolarHBondContact O-N 2.85Å
706	I	93.3	Very high	93.3	Very high	24 Å²	24	61.2 Å²	61.2	12%	0.123	30%	0.302	C	S	.	.			trans	-92.2	114.1	173.4	-58.6	174.7	0	0	0	106.9	A454 P456 D457 W508 V510	A454-I706 PolarHBondContact O-N 3.37Å; A454-I706 VanDerWaalsContact O-N 3.1Å; P456-I706 HydrophobicContact CG-CB 3.82Å; P456-I706 HydrophobicContact CG-CD1 3.94Å; P456-I706 HydrophobicContact CG-CG1 4.37Å; P456-I706 HydrophobicContact CG-CG2 4.15Å; D457-I706 HydrophobicContact CB-CD1 4.07Å; W508-I706 PolarHBondContact NE1-O 2.89Å; V510-I706 HydrophobicContact CG1-CD1 3.92Å
707	R	92.9	Very high	93.3	Very high	167 Å²	167	59.6 Å²	59.6	63%	0.63	30%	0.303	S	S	*	.			trans	-68.7	139.4	-177.6	-64.8	-163.8	180	122.2	-5.3	111	T397 D398	T397-R707 HydrophobicContact CG2-CB 3.93Å; D398-R707 WeakPolarHBondContact O-CD 3.16Å
708	K	94.6	Very high	93.2	Very high	10 Å²	10	65.1 Å²	65.1	4%	0.043	31%	0.314	C	S	.	.			trans	-63.5	150.6	171.3	65.1	-171.3	-168.8	-74.1	0	110.9	D398 E447 A450 N451 F504 C506 S507 W508 L710	D398-K708 HydrophobicContact CB-CG 3.89Å; D398-K708 WeakPolarHBondContact CB-O 3.43Å; D398-K708 PolarHBondContact N-O 2.83Å; D398-K708 WeakPolarHBondContact OD2-CE 3.39Å; D398-K708 IonicContact OD2-NZ 2.71Å; D398-K708 PolarHBondContact OD2-NZ 3.35Å; E447-K708 WeakPolarHBondContact OE1-CE 3.35Å; E447-K708 IonicContact OE1-NZ 2.84Å; E447-K708 PolarHBondContact OE1-NZ 2.75Å; A450-K708 HydrophobicContact CB-CD 4.48Å; N451-K708 PolarHBondContact OD1-NZ 3.05Å; F504-K708 HydrophobicContact CZ-CD 4.35Å; C506-K708 HydrophobicContact CB-CB 4.21Å; C506-K708 HydrophobicContact CB-CD 4.42Å; S507-K708 CarbonylContact O-C 3.56Å; S507-K708 WeakPolarHBondContact O-CA 3.15Å; W508-K708 HydrophobicContact CD2-CB 4.36Å; W508-K708 HydrophobicContact CZ2-CB 3.73Å; K708-L710 HydrophobicContact CG-CD2 4.38Å
709	K	95.9	Very high	93.2	Very high	38 Å²	38	68 Å²	68	17%	0.165	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	145.6	167.6	-59.2	-164.8	175.7	-173.8	0	109.5	E395 V396 C506 S507 E509	E395-K709 HydrophobicContact CB-CB 3.9Å; V396-K709 CarbonylContact O-C 3.52Å; V396-K709 WeakPolarHBondContact O-CA 3.38Å; C506-K709 CarbonylContact C-O 3.52Å; C506-K709 WeakPolarHBondContact CA-O 3.48Å; C506-K709 WeakPolarHBondContact CB-O 3.46Å; S507-K709 PolarHBondContact N-O 3.31Å; S507-K709 PolarHBondContact O-N 2.79Å; E509-K709 WeakPolarHBondContact OE1-CE 3.24Å; E509-K709 IonicContact OE1-NZ 2.67Å; E509-K709 PolarHBondContact OE1-NZ 2.86Å; E509-K709 WeakPolarHBondContact OE2-CE 3.3Å; E509-K709 IonicContact OE2-NZ 3.29Å; E509-K709 PolarHBondContact OE2-NZ 2.84Å
710	L	95.3	Very high	93.4	Very high	9 Å²	9	66.5 Å²	66.5	5%	0.047	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	157.1	-176.2	52.4	90.9	0	0	0	110.8	E395 V396 D398 K708 R722	E395-L710 WeakPolarHBondContact CA-O 3.34Å; V396-L710 WeakPolarHBondContact CG2-O 3.39Å; V396-L710 PolarHBondContact N-O 2.8Å; V396-L710 PolarHBondContact O-N 3.33Å; D398-L710 HydrophobicContact CB-CD2 3.86Å; D398-L710 HydrophobicContact CB-CG 4.43Å; K708-L710 HydrophobicContact CG-CD2 4.38Å; L710-R722 VanDerWaalsContact CD2-CZ 3.44Å
711	R	94.6	Very high	93.6	Very high	22 Å²	22	66.6 Å²	66.6	8%	0.083	32%	0.32	C	S	.	.			trans	-67.1	140.1	175.3	-65.2	-163.8	-70.5	-169.9	-0.6	110.8	I390 E394 E395 R715 Q716 E720	I390-R711 HydrophobicContact CG2-CG 3.88Å; E394-R711 HydrophobicContact CB-CG 4.14Å; E394-R711 VanDerWaalsContact OE2-CD 3.29Å; E394-R711 WeakPolarHBondContact OE2-CD 3.46Å; E394-R711 IonicContact OE2-NH1 2.9Å; E394-R711 PolarHBondContact OE2-NH1 2.73Å; E395-R711 HydrophobicContact CG-CG 4.34Å; R711-R715 HydrophobicContact CB-CB 4.48Å; R711-Q716 HydrophobicContact CB-CG 4.08Å; R711-Q716 PolarHBondContact O-NE2 2.79Å; R711-E720 IonicContact CZ-OE1 3.52Å; R711-E720 IonicContact NE-OE1 2.79Å; R711-E720 IonicContact NH2-OE1 2.72Å; R711-E720 PolarHBondContact NH2-OE1 3.3Å; R711-E720 IonicContact NH2-OE2 2.73Å
712	P	94.6	Very high	94	Very high	33 Å²	33	63.3 Å²	63.3	21%	0.214	30%	0.295	C	S	.	.			trans	-51.2	145.8	167.7	-25.9	34	0	0	0	111.7	E394 V396 E714 R715 Q716	E394-P712 VanDerWaalsContact O-CD 3.25Å; E394-P712 WeakPolarHBondContact O-CD 2.96Å; V396-P712 HydrophobicContact CG1-CG 4.25Å; V396-P712 HydrophobicContact CG2-CG 4.02Å; P712-E714 WeakPolarHBondContact CB-OE2 3.37Å; P712-E714 PolarHBondContact O-N 2.69Å; P712-E714 VanDerWaalsContact O-N 3.11Å; P712-R715 WeakPolarHBondContact O-CA 3.3Å; P712-R715 PolarHBondContact O-N 3.32Å; P712-Q716 PolarHBondContact O-N 3.12Å; P712-Q716 VanDerWaalsContact O-N 3.16Å
713	V	94.2	Very high	94.4	Very high	33 Å²	33	59.9 Å²	59.9	20%	0.2	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-30.4	-171.4	178.5	0	0	0	0	112.1	R715 Q716 R722 R723	V713-R715 VanDerWaalsContact C-N 3.27Å; V713-R715 PolarHBondContact O-N 2.97Å; V713-Q716 PolarHBondContact O-N 2.67Å; V713-R722 HydrophobicContact CG2-CB 4.21Å; V713-R723 HydrophobicContact CG1-CB 4.01Å; V713-R723 HydrophobicContact CG1-CG 4.35Å
714	E	93.8	Very high	94.7	Very high	149 Å²	149	59.7 Å²	59.7	70%	0.696	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-29	177.9	-52.7	69.2	-147	0	0	112.1	P712	P712-E714 WeakPolarHBondContact CB-OE2 3.37Å; P712-E714 PolarHBondContact O-N 2.69Å; P712-E714 VanDerWaalsContact O-N 3.11Å
715	R	93.9	Very high	95.1	Very high	151 Å²	151	56 Å²	56	57%	0.57	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-13.9	179.6	-63.4	-171.4	179.4	-174.2	1.1	113.8	R711 P712 V713	R711-R715 HydrophobicContact CB-CB 4.48Å; P712-R715 WeakPolarHBondContact O-CA 3.3Å; P712-R715 PolarHBondContact O-N 3.32Å; V713-R715 VanDerWaalsContact C-N 3.27Å; V713-R715 PolarHBondContact O-N 2.97Å
716	Q	95.2	Very high	95.4	Very high	6 Å²	6	56.8 Å²	56.8	3%	0.028	25%	0.252	C	S	.	.	S	Bend	trans	-66.9	149.3	176.7	-75.6	-178.5	21.5	0	0	112	R711 P712 V713 E720 R723	R711-Q716 HydrophobicContact CB-CG 4.08Å; R711-Q716 PolarHBondContact O-NE2 2.79Å; P712-Q716 PolarHBondContact O-N 3.12Å; P712-Q716 VanDerWaalsContact O-N 3.16Å; V713-Q716 PolarHBondContact O-N 2.67Å; Q716-E720 VanDerWaalsContact CA-OE1 3.27Å; Q716-E720 WeakPolarHBondContact CA-OE1 3.14Å; Q716-E720 HydrophobicContact CB-CB 3.96Å; Q716-E720 HydrophobicContact CG-CB 4.28Å; Q716-R723 HydrophobicContact CB-CB 3.89Å; Q716-R723 WeakPolarHBondContact O-CD 3.5Å; Q716-R723 PolarHBondContact O-NH1 2.88Å; Q716-R723 VanDerWaalsContact OE1-N 3.13Å
717	G	94.1	Very high	95.5	Very high	30 Å²	30	60 Å²	60	31%	0.309	27%	0.266	S	S	.	.			trans	-68.6	161.3	171.5	0	0	0	0	0	112.6	M719 E720	G717-M719 PolarHBondContact O-N 3.34Å; G717-M719 VanDerWaalsContact O-N 3.15Å; G717-E720 PolarHBondContact N-OE1 2.98Å; G717-E720 PolarHBondContact O-N 3.49Å; G717-E720 VanDerWaalsContact O-N 3.08Å
718	R	95.2	Very high	95.6	Very high	208 Å²	208	52.2 Å²	52.2	79%	0.785	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-26.8	-176.3	-66.3	-175.6	-178.7	-174.5	0.3	114.5
719	M	95.8	Very high	95.6	Very high	70 Å²	70	52.6 Å²	52.6	35%	0.345	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-1.7	-179.8	-60.4	-55.9	-66.3	0	0	113.5	V499 G501 E502 T503 G717	V499-M719 HydrophobicContact CG2-CE 4.1Å; G501-M719 WeakPolarHBondContact O-CE 3.3Å; E502-M719 WeakPolarHBondContact CA-O 3.31Å; E502-M719 WeakPolarHBondContact CG-O 3.35Å; T503-M719 PolarHBondContact N-O 3.41Å; G717-M719 PolarHBondContact O-N 3.34Å; G717-M719 VanDerWaalsContact O-N 3.15Å
720	E	97.4	Very high	95.5	Very high	9 Å²	9	56.1 Å²	56.1	4%	0.042	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-75	133.1	177.8	-78.8	-176.7	-97.3	0	0	111	T503 H505 R711 Q716 G717 R722 R723 L724	T503-E720 CarbonylContact O-C 3.52Å; T503-E720 VanDerWaalsContact O-CA 3.24Å; T503-E720 WeakPolarHBondContact O-CA 3.48Å; H505-E720 IonicContact CD2-OE2 3.42Å; R711-E720 IonicContact CZ-OE1 3.52Å; R711-E720 IonicContact NE-OE1 2.79Å; R711-E720 IonicContact NH2-OE1 2.72Å; R711-E720 PolarHBondContact NH2-OE1 3.3Å; R711-E720 IonicContact NH2-OE2 2.73Å; Q716-E720 VanDerWaalsContact CA-OE1 3.27Å; Q716-E720 WeakPolarHBondContact CA-OE1 3.14Å; Q716-E720 HydrophobicContact CB-CB 3.96Å; Q716-E720 HydrophobicContact CG-CB 4.28Å; G717-E720 PolarHBondContact N-OE1 2.98Å; G717-E720 PolarHBondContact O-N 3.49Å; G717-E720 VanDerWaalsContact O-N 3.08Å; E720-R722 VanDerWaalsContact C-N 3.35Å; E720-R722 PolarHBondContact O-N 3.39Å; E720-R722 VanDerWaalsContact O-N 3.13Å; E720-R723 PolarHBondContact O-N 3.15Å; E720-R723 VanDerWaalsContact O-N 3.12Å; E720-L724 WeakPolarHBondContact O-CB 3.41Å; E720-L724 PolarHBondContact O-N 3.36Å
721	S	97.7	Very high	95.5	Very high	2 Å²	2	55.8 Å²	55.8	1%	0.014	25%	0.254	C	S	.	.	H	α-helix	trans	-49.9	-45.9	-165.9	-58.5	0	0	0	0	114.7	E502 T503 L724 W725	E502-S721 VanDerWaalsContact OE1-CB 3.26Å; E502-S721 WeakPolarHBondContact OE1-CB 3.46Å; E502-S721 PolarHBondContact OE1-OG 2.9Å; T503-S721 PolarHBondContact O-N 2.79Å; T503-S721 PolarHBondContact O-OG 2.86Å; S721-L724 PolarHBondContact O-N 2.94Å; S721-W725 WeakPolarHBondContact O-CB 3.34Å; S721-W725 VanDerWaalsContact O-CD1 3.26Å; S721-W725 PolarHBondContact O-N 2.96Å
722	R	96.2	Very high	95.3	Very high	27 Å²	27	55.6 Å²	55.6	10%	0.102	26%	0.255	C	S	.	.	H	α-helix	trans	-69.2	-43.3	-176.8	-69.7	-169.5	176.1	-171	1.7	111.9	D398 E447 L710 V713 E720 Q726	D398-R722 IonicContact OD1-CZ 2.71Å; D398-R722 IonicContact OD1-NH1 2.79Å; D398-R722 PolarHBondContact OD1-NH1 3.22Å; D398-R722 IonicContact OD1-NH2 3.38Å; D398-R722 PolarHBondContact OD1-NH2 3.15Å; D398-R722 IonicContact OD2-CZ 2.74Å; D398-R722 IonicContact OD2-NH2 2.85Å; D398-R722 PolarHBondContact OD2-NH2 3.35Å; E447-R722 IonicContact OE1-CZ 3.62Å; E447-R722 IonicContact OE1-NE 3.69Å; E447-R722 IonicContact OE1-NH2 3.57Å; E447-R722 PolarHBondContact OE1-NH2 3.29Å; E447-R722 WeakPolarHBondContact OE2-CG 3.16Å; E447-R722 IonicContact OE2-CZ 3.22Å; E447-R722 IonicContact OE2-NE 3.68Å; E447-R722 PolarHBondContact OE2-NE 2.85Å; E447-R722 IonicContact OE2-NH2 2.67Å; L710-R722 VanDerWaalsContact CD2-CZ 3.44Å; V713-R722 HydrophobicContact CG2-CB 4.21Å; E720-R722 VanDerWaalsContact C-N 3.35Å; E720-R722 PolarHBondContact O-N 3.39Å; E720-R722 VanDerWaalsContact O-N 3.13Å; R722-Q726 VanDerWaalsContact O-CA 3.3Å; R722-Q726 WeakPolarHBondContact O-CA 3.43Å; R722-Q726 VanDerWaalsContact O-CB 3.3Å; R722-Q726 WeakPolarHBondContact O-CB 3.27Å; R722-Q726 PolarHBondContact O-N 3.46Å
723	R	97.1	Very high	95	Very high	91 Å²	91	58.7 Å²	58.7	34%	0.343	27%	0.265	S	S	.	.	H	α-helix	trans	-66	-40.4	174.2	-174.9	173.6	-178.1	166.1	10.3	112.6	V713 Q716 E720 Q726	V713-R723 HydrophobicContact CG1-CB 4.01Å; V713-R723 HydrophobicContact CG1-CG 4.35Å; Q716-R723 HydrophobicContact CB-CB 3.89Å; Q716-R723 WeakPolarHBondContact O-CD 3.5Å; Q716-R723 PolarHBondContact O-NH1 2.88Å; Q716-R723 VanDerWaalsContact OE1-N 3.13Å; E720-R723 PolarHBondContact O-N 3.15Å; E720-R723 VanDerWaalsContact O-N 3.12Å; R723-Q726 VanDerWaalsContact O-CG 3.25Å; R723-Q726 WeakPolarHBondContact O-CG 3.25Å
724	L	97.6	Very high	94.9	Very high	38 Å²	38	62.7 Å²	62.7	20%	0.199	28%	0.281	C	S	.	.	H	α-helix	trans	-64.9	-46.7	-179.6	179.8	64.1	0	0	0	111.8	V499 E502 E720 S721 L747	V499-L724 HydrophobicContact CG2-CD2 3.56Å; E502-L724 HydrophobicContact CB-CD2 4.21Å; E502-L724 HydrophobicContact CG-CD2 3.74Å; E720-L724 WeakPolarHBondContact O-CB 3.41Å; E720-L724 PolarHBondContact O-N 3.36Å; S721-L724 PolarHBondContact O-N 2.94Å; L724-L747 HydrophobicContact CD1-CD1 4.26Å; L724-L747 HydrophobicContact CG-CD1 4.17Å
725	W	97.3	Very high	94.5	Very high	3 Å²	3	58.2 Å²	58.2	1%	0.011	28%	0.275	C	S	.	.	H	α-helix	trans	-90.2	1.8	-178	-67.5	97.3	0	0	0	114.1	Y496 V499 E502 S721 H727 V728 T729 K744 L747	Y496-W725 HydrophobicContact CD1-CE3 4.26Å; Y496-W725 HydrophobicContact CD1-CZ3 4.49Å; Y496-W725 HydrophobicContact CD2-CB 3.69Å; Y496-W725 AromaticContact CD2-CD1 3.95Å; Y496-W725 AromaticContact CD2-CD2 3.46Å; Y496-W725 HydrophobicContact CD2-CD2 3.46Å; Y496-W725 VanDerWaalsContact CD2-CD2 3.46Å; Y496-W725 AromaticContact CD2-CE3 3.77Å; Y496-W725 HydrophobicContact CD2-CE3 3.77Å; Y496-W725 AromaticContact CD2-CG 3.41Å; Y496-W725 HydrophobicContact CD2-CG 3.41Å; Y496-W725 VanDerWaalsContact CD2-CG 3.41Å; Y496-W725 HydrophobicContact CE2-CB 3.61Å; Y496-W725 HydrophobicContact CE2-CD2 4.15Å; Y496-W725 HydrophobicContact CE2-CE3 4.25Å; Y496-W725 AromaticContact CE2-CG 3.89Å; Y496-W725 HydrophobicContact CE2-CG 3.89Å; Y496-W725 AromaticContact CG-CD2 3.78Å; Y496-W725 HydrophobicContact CG-CD2 3.78Å; Y496-W725 AromaticContact CG-CE3 3.78Å; Y496-W725 HydrophobicContact CG-CE3 3.78Å; Y496-W725 HydrophobicContact CG-CG 4.21Å; Y496-W725 HydrophobicContact CG-CZ3 4.2Å; V499-W725 HydrophobicContact CG1-CZ2 4.28Å; E502-W725 PolarHBondContact OE1-NE1 2.81Å; E502-W725 PolarHBondContact OE2-NE1 2.64Å; S721-W725 WeakPolarHBondContact O-CB 3.34Å; S721-W725 VanDerWaalsContact O-CD1 3.26Å; S721-W725 PolarHBondContact O-N 2.96Å; W725-H727 PolarHBondContact O-N 3.23Å; W725-V728 HydrophobicContact CE3-CB 4.13Å; W725-V728 HydrophobicContact CE3-CG1 4.38Å; W725-V728 HydrophobicContact CE3-CG2 3.92Å; W725-V728 HydrophobicContact CZ3-CG2 4.27Å; W725-V728 PolarHBondContact O-N 2.65Å; W725-T729 PolarHBondContact O-N 2.91Å; W725-K744 HydrophobicContact CZ3-CG 4.29Å; W725-L747 HydrophobicContact CD2-CD1 4.04Å; W725-L747 HydrophobicContact CE3-CD1 3.87Å; W725-L747 HydrophobicContact CH2-CD1 4.29Å; W725-L747 HydrophobicContact CH2-CD2 3.87Å; W725-L747 HydrophobicContact CZ2-CD1 4.45Å; W725-L747 HydrophobicContact CZ2-CD2 3.97Å; W725-L747 HydrophobicContact CZ3-CD1 4Å; W725-L747 HydrophobicContact CZ3-CD2 4.35Å
726	Q	96.3	Very high	94.3	Very high	73 Å²	73	54.1 Å²	54.1	34%	0.341	26%	0.264	S	S	.	.	H	α-helix	trans	-48.9	-40.4	-169.7	71.2	-173.6	2.2	0	0	114.2	R722 R723 K730	R722-Q726 VanDerWaalsContact O-CA 3.3Å; R722-Q726 WeakPolarHBondContact O-CA 3.43Å; R722-Q726 VanDerWaalsContact O-CB 3.3Å; R722-Q726 WeakPolarHBondContact O-CB 3.27Å; R722-Q726 PolarHBondContact O-N 3.46Å; R723-Q726 VanDerWaalsContact O-CG 3.25Å; R723-Q726 WeakPolarHBondContact O-CG 3.25Å; Q726-K730 VanDerWaalsContact O-CB 3.24Å; Q726-K730 WeakPolarHBondContact O-CB 3.4Å; Q726-K730 PolarHBondContact O-N 3.07Å
727	H	96.6	Very high	94	Very high	92 Å²	92	56.5 Å²	56.5	43%	0.426	28%	0.276	S	S	.	.	H	α-helix	trans	-74.4	-38.8	-177.4	-62.9	-69.7	0	0	0	112.2	W725 K730 S731 H743	W725-H727 PolarHBondContact O-N 3.23Å; H727-K730 PolarHBondContact O-N 3.16Å; H727-S731 PolarHBondContact O-N 2.92Å; H727-S731 PolarHBondContact O-OG 3.44Å; H727-H743 HydrophobicContact CB-CB 4.25Å
728	V	95.3	Very high	93.8	Very high	3 Å²	3	63 Å²	63	2%	0.018	30%	0.299	C	S	.	.	H	α-helix	trans	-65.3	-46.6	173.7	-177.9	0	0	0	0	109.8	Y496 W725 K730 L732 H743 K744	Y496-V728 HydrophobicContact CE1-CG1 3.96Å; W725-V728 HydrophobicContact CE3-CB 4.13Å; W725-V728 HydrophobicContact CE3-CG1 4.38Å; W725-V728 HydrophobicContact CE3-CG2 3.92Å; W725-V728 HydrophobicContact CZ3-CG2 4.27Å; W725-V728 PolarHBondContact O-N 2.65Å; V728-K730 VanDerWaalsContact C-N 3.34Å; V728-K730 PolarHBondContact O-N 3Å; V728-L732 HydrophobicContact CG1-CD1 3.96Å; V728-L732 WeakPolarHBondContact O-CB 3.48Å; V728-L732 VanDerWaalsContact O-CG 3.31Å; V728-L732 WeakPolarHBondContact O-CG 3.4Å; V728-L732 PolarHBondContact O-N 3.33Å; V728-H743 HydrophobicContact CG2-CB 3.73Å; V728-K744 HydrophobicContact CG1-CB 4.42Å; V728-K744 HydrophobicContact CG2-CB 4.04Å
729	T	94.1	Very high	93.7	Very high	17 Å²	17	56.8 Å²	56.8	10%	0.104	28%	0.279	C	S	.	.	H	α-helix	trans	-62.1	-39.3	176.4	-66	0	0	0	0	112.1	K442 Y496 W725 K733	K442-T729 HydrophobicContact CB-CG2 4.34Å; K442-T729 PolarHBondContact O-OG1 2.87Å; K442-T729 VanDerWaalsContact O-OG1 3.13Å; Y496-T729 WeakPolarHBondContact CE2-OG1 3.44Å; Y496-T729 WeakPolarHBondContact OH-CA 3.4Å; Y496-T729 PolarHBondContact OH-N 3.37Å; Y496-T729 PolarHBondContact OH-OG1 3.47Å; W725-T729 PolarHBondContact O-N 2.91Å; T729-K733 HydrophobicContact CG2-CD 4.09Å; T729-K733 WeakPolarHBondContact O-CB 3.38Å; T729-K733 VanDerWaalsContact O-CG 3.31Å; T729-K733 WeakPolarHBondContact O-CG 3.2Å; T729-K733 PolarHBondContact O-N 3.25Å
730	K	94.3	Very high	93.6	Very high	113 Å²	113	53.5 Å²	53.5	49%	0.491	26%	0.262	S	S	.	.	H	α-helix	trans	-62.5	-57	176.7	-175.3	-170.3	168.3	-162.4	0	111.2	Q726 H727 V728 L732 K733 E734	Q726-K730 VanDerWaalsContact O-CB 3.24Å; Q726-K730 WeakPolarHBondContact O-CB 3.4Å; Q726-K730 PolarHBondContact O-N 3.07Å; H727-K730 PolarHBondContact O-N 3.16Å; V728-K730 VanDerWaalsContact C-N 3.34Å; V728-K730 PolarHBondContact O-N 3Å; K730-L732 PolarHBondContact O-N 3.02Å; K730-K733 WeakPolarHBondContact O-CA 3.25Å; K730-K733 WeakPolarHBondContact O-CB 3.37Å; K730-K733 PolarHBondContact O-N 2.84Å; K730-E734 WeakPolarHBondContact CE-OE1 3.3Å; K730-E734 VanDerWaalsContact CE-OE2 3.28Å; K730-E734 WeakPolarHBondContact CE-OE2 3.3Å; K730-E734 IonicContact NZ-OE1 3.76Å; K730-E734 IonicContact NZ-OE2 2.7Å; K730-E734 PolarHBondContact O-N 3.22Å
731	S	94.3	Very high	93.4	Very high	2 Å²	2	56.1 Å²	56.1	1%	0.014	28%	0.279	C	S	.	.	H	α-helix	trans	-61.9	-31.8	-179	-55.9	0	0	0	0	112.1	H727 E734 G735 N736 E739	H727-S731 PolarHBondContact O-N 2.92Å; H727-S731 PolarHBondContact O-OG 3.44Å; S731-E734 CarbonylContact O-C 3.52Å; S731-E734 PolarHBondContact O-N 3.48Å; S731-G735 PolarHBondContact O-N 3Å; S731-N736 PolarHBondContact O-N 2.85Å; S731-E739 VanDerWaalsContact OG-CD 3.23Å; S731-E739 WeakPolarHBondContact OG-CG 3.43Å; S731-E739 PolarHBondContact OG-OE2 3.17Å
732	L	89.8	Confident	93.3	Very high	18 Å²	18	60.2 Å²	60.2	9%	0.094	30%	0.298	C	S	.	.	H	α-helix	trans	-69.7	-29.8	170.7	-76.8	172.5	0	0	0	114.4	T437 L440 K442 Y496 V728 K730 M737 A740	T437-L732 HydrophobicContact CG2-CD2 4.23Å; L440-L732 HydrophobicContact CB-CD1 4.38Å; K442-L732 WeakPolarHBondContact CE-O 3.29Å; K442-L732 HydrophobicContact CG-CB 4.3Å; Y496-L732 HydrophobicContact CE1-CD1 3.93Å; Y496-L732 WeakPolarHBondContact OH-CD1 3.25Å; V728-L732 HydrophobicContact CG1-CD1 3.96Å; V728-L732 WeakPolarHBondContact O-CB 3.48Å; V728-L732 VanDerWaalsContact O-CG 3.31Å; V728-L732 WeakPolarHBondContact O-CG 3.4Å; V728-L732 PolarHBondContact O-N 3.33Å; K730-L732 PolarHBondContact O-N 3.02Å; L732-M737 HydrophobicContact CD2-CE 3.56Å; L732-M737 HydrophobicContact CD2-SD 3.84Å; L732-A740 HydrophobicContact CD2-CB 4.12Å; L732-A740 HydrophobicContact CG-CB 3.9Å
733	K	89.1	Confident	93.3	Very high	97 Å²	97	60.7 Å²	60.7	42%	0.422	30%	0.301	S	S	.	.	H	α-helix	trans	-74.1	-30.7	171.3	-75.7	173.1	179.2	176.7	0	111.5	E400 K442 T729 K730	E400-K733 IonicContact OE1-NZ 3.54Å; E400-K733 PolarHBondContact OE1-NZ 2.95Å; E400-K733 IonicContact OE2-NZ 3.89Å; E400-K733 PolarHBondContact OE2-NZ 2.9Å; K442-K733 HydrophobicContact CD-CG 3.96Å; T729-K733 HydrophobicContact CG2-CD 4.09Å; T729-K733 WeakPolarHBondContact O-CB 3.38Å; T729-K733 VanDerWaalsContact O-CG 3.31Å; T729-K733 WeakPolarHBondContact O-CG 3.2Å; T729-K733 PolarHBondContact O-N 3.25Å; K730-K733 WeakPolarHBondContact O-CA 3.25Å; K730-K733 WeakPolarHBondContact O-CB 3.37Å; K730-K733 PolarHBondContact O-N 2.84Å
734	E	91.3	Very high	93.2	Very high	117 Å²	117	57.5 Å²	57.5	55%	0.547	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-2.3	177.7	-67.1	173	160.4	0	0	113.6	K730 S731 N736	K730-E734 WeakPolarHBondContact CE-OE1 3.3Å; K730-E734 VanDerWaalsContact CE-OE2 3.28Å; K730-E734 WeakPolarHBondContact CE-OE2 3.3Å; K730-E734 IonicContact NZ-OE1 3.76Å; K730-E734 IonicContact NZ-OE2 2.7Å; K730-E734 PolarHBondContact O-N 3.22Å; S731-E734 CarbonylContact O-C 3.52Å; S731-E734 PolarHBondContact O-N 3.48Å; E734-N736 PolarHBondContact O-N 3.44Å
735	G	86.6	Confident	93.1	Very high	55 Å²	55	60.1 Å²	60.1	57%	0.567	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.5	4.1	-177.7	0	0	0	0	0	115	S731 M737	S731-G735 PolarHBondContact O-N 3Å; G735-M737 PolarHBondContact O-N 3.49Å
736	N	89.5	Confident	93	Very high	65 Å²	65	66.6 Å²	66.6	35%	0.348	33%	0.325	S	S	.	.			trans	-79.5	84.1	-179.1	-171.3	-6.1	0	0	0	111.3	S731 E734 E738 E739 A740	S731-N736 PolarHBondContact O-N 2.85Å; E734-N736 PolarHBondContact O-N 3.44Å; N736-E738 VanDerWaalsContact C-N 3.33Å; N736-E738 PolarHBondContact O-N 3.07Å; N736-E739 HydrophobicContact CB-CB 4.32Å; N736-E739 VanDerWaalsContact CG-CB 3.42Å; N736-E739 WeakPolarHBondContact ND2-CB 3.39Å; N736-E739 PolarHBondContact ND2-OE2 2.95Å; N736-E739 PolarHBondContact OD1-N 2.98Å; N736-A740 WeakPolarHBondContact O-CB 3.49Å; N736-A740 PolarHBondContact O-N 3.13Å
737	M	88	Confident	92.9	Very high	56 Å²	56	64.5 Å²	64.5	28%	0.276	32%	0.316	S	S	.	.	H	α-helix	trans	-67	-30.1	-175.1	-64.3	-50.9	-40.5	0	0	114.3	T437 F438 L732 G735 T741	T437-M737 HydrophobicContact CG2-CE 3.97Å; F438-M737 HydrophobicContact CB-CE 3.69Å; F438-M737 HydrophobicContact CB-SD 4.13Å; L732-M737 HydrophobicContact CD2-CE 3.56Å; L732-M737 HydrophobicContact CD2-SD 3.84Å; G735-M737 PolarHBondContact O-N 3.49Å; M737-T741 WeakPolarHBondContact O-CB 3.29Å; M737-T741 PolarHBondContact O-N 2.71Å; M737-T741 VanDerWaalsContact O-N 3.14Å; M737-T741 PolarHBondContact O-OG1 2.98Å
738	E	89.5	Confident	92.7	Very high	168 Å²	168	61.8 Å²	61.8	79%	0.785	30%	0.304	S	S	*	.	H	α-helix	trans	-71	-50.4	-179.9	-63.6	-174.6	173.9	0	0	110.5	N736 A740 T741 E742	N736-E738 VanDerWaalsContact C-N 3.33Å; N736-E738 PolarHBondContact O-N 3.07Å; E738-A740 PolarHBondContact O-N 2.77Å; E738-T741 WeakPolarHBondContact O-CB 3.2Å; E738-T741 PolarHBondContact O-N 2.84Å; E738-T741 VanDerWaalsContact O-N 3.1Å; E738-E742 PolarHBondContact O-N 3.11Å
739	E	95.1	Very high	92.6	Very high	77 Å²	77	64.7 Å²	64.7	36%	0.36	32%	0.317	S	S	.	.	H	α-helix	trans	-64.9	-39.2	177.8	-172	-174.4	-140.6	0	0	112.1	S731 N736 T741 E742 H743	S731-E739 VanDerWaalsContact OG-CD 3.23Å; S731-E739 WeakPolarHBondContact OG-CG 3.43Å; S731-E739 PolarHBondContact OG-OE2 3.17Å; N736-E739 HydrophobicContact CB-CB 4.32Å; N736-E739 VanDerWaalsContact CG-CB 3.42Å; N736-E739 WeakPolarHBondContact ND2-CB 3.39Å; N736-E739 PolarHBondContact ND2-OE2 2.95Å; N736-E739 PolarHBondContact OD1-N 2.98Å; E739-T741 PolarHBondContact O-N 2.78Å; E739-E742 PolarHBondContact O-N 3.06Å; E739-H743 WeakPolarHBondContact O-CB 3.46Å; E739-H743 PolarHBondContact O-CD2 3.33Å; E739-H743 PolarHBondContact O-N 3.31Å; E739-H743 IonicContact OE1-NE2 3.84Å
740	A	93.3	Very high	92.6	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-58.7	-38.1	172.4	0	0	0	0	0	112	T437 L732 N736 E738 K744	T437-A740 HydrophobicContact CG2-CB 3.81Å; L732-A740 HydrophobicContact CD2-CB 4.12Å; L732-A740 HydrophobicContact CG-CB 3.9Å; N736-A740 WeakPolarHBondContact O-CB 3.49Å; N736-A740 PolarHBondContact O-N 3.13Å; E738-A740 PolarHBondContact O-N 2.77Å; A740-K744 VanDerWaalsContact O-CB 3.25Å; A740-K744 WeakPolarHBondContact O-CB 3.48Å; A740-K744 PolarHBondContact O-N 3.09Å
741	T	92.6	Very high	92.5	Very high	65 Å²	65	63.1 Å²	63.1	40%	0.399	32%	0.319	S	S	.	.	H	α-helix	trans	-70	-42.8	177.9	-57	0	0	0	0	111.5	T437 M737 E738 E739 K744 H745	T437-T741 WeakPolarHBondContact CB-OG1 3.27Å; T437-T741 WeakPolarHBondContact OG1-CB 3.18Å; T437-T741 PolarHBondContact OG1-OG1 3.19Å; M737-T741 WeakPolarHBondContact O-CB 3.29Å; M737-T741 PolarHBondContact O-N 2.71Å; M737-T741 VanDerWaalsContact O-N 3.14Å; M737-T741 PolarHBondContact O-OG1 2.98Å; E738-T741 WeakPolarHBondContact O-CB 3.2Å; E738-T741 PolarHBondContact O-N 2.84Å; E738-T741 VanDerWaalsContact O-N 3.1Å; E739-T741 PolarHBondContact O-N 2.78Å; T741-K744 PolarHBondContact O-N 3.23Å; T741-H745 VanDerWaalsContact O-CB 3.29Å; T741-H745 WeakPolarHBondContact O-CB 3.28Å; T741-H745 PolarHBondContact O-N 3.25Å
742	E	95.8	Very high	92.4	Very high	88 Å²	88	67.4 Å²	67.4	41%	0.411	34%	0.335	S	S	.	.	H	α-helix	trans	-66.5	-44.5	176.9	169.7	50.2	-152.9	0	0	112.1	E738 E739 K744 H745 R746	E738-E742 PolarHBondContact O-N 3.11Å; E739-E742 PolarHBondContact O-N 3.06Å; E742-K744 VanDerWaalsContact C-N 3.33Å; E742-K744 PolarHBondContact O-N 3.29Å; E742-H745 PolarHBondContact O-N 3.07Å; E742-R746 WeakPolarHBondContact O-CB 3.43Å; E742-R746 PolarHBondContact O-N 3.04Å; E742-R746 IonicContact OE1-CZ 2.88Å; E742-R746 IonicContact OE1-NE 2.8Å; E742-R746 PolarHBondContact OE1-NE 3.46Å; E742-R746 IonicContact OE1-NH2 3.4Å; E742-R746 PolarHBondContact OE1-NH2 3.47Å
743	H	96.7	Very high	92.6	Very high	36 Å²	36	70.3 Å²	70.3	17%	0.167	35%	0.353	C	S	.	.	H	α-helix	trans	-59.6	-43.6	174	-78.8	-44.5	0	0	0	112.1	H727 V728 E739 L747	H727-H743 HydrophobicContact CB-CB 4.25Å; V728-H743 HydrophobicContact CG2-CB 3.73Å; E739-H743 WeakPolarHBondContact O-CB 3.46Å; E739-H743 PolarHBondContact O-CD2 3.33Å; E739-H743 PolarHBondContact O-N 3.31Å; E739-H743 IonicContact OE1-NE2 3.84Å; H743-L747 WeakPolarHBondContact O-CB 3.41Å; H743-L747 PolarHBondContact O-N 3.04Å; H743-L747 VanDerWaalsContact O-N 3.17Å
744	K	94.9	Very high	92.7	Very high	24 Å²	24	69.6 Å²	69.6	10%	0.104	35%	0.351	C	S	.	.	H	α-helix	trans	-62.7	-45.9	175	175.4	178.9	178.9	-65.6	0	111.5	L440 W725 V728 A740 T741 E742 R746 L747 E748	L440-K744 HydrophobicContact CD1-CD 3.75Å; W725-K744 HydrophobicContact CZ3-CG 4.29Å; V728-K744 HydrophobicContact CG1-CB 4.42Å; V728-K744 HydrophobicContact CG2-CB 4.04Å; A740-K744 VanDerWaalsContact O-CB 3.25Å; A740-K744 WeakPolarHBondContact O-CB 3.48Å; A740-K744 PolarHBondContact O-N 3.09Å; T741-K744 PolarHBondContact O-N 3.23Å; E742-K744 VanDerWaalsContact C-N 3.33Å; E742-K744 PolarHBondContact O-N 3.29Å; K744-R746 PolarHBondContact O-N 2.97Å; K744-L747 PolarHBondContact O-N 3.29Å; K744-E748 WeakPolarHBondContact CE-OE1 3.44Å; K744-E748 IonicContact NZ-OE1 2.65Å; K744-E748 PolarHBondContact NZ-OE1 2.94Å; K744-E748 IonicContact NZ-OE2 2.79Å; K744-E748 PolarHBondContact NZ-OE2 3.45Å; K744-E748 WeakPolarHBondContact O-CG 3.37Å; K744-E748 PolarHBondContact O-N 2.91Å
745	H	94	Very high	92.7	Very high	94 Å²	94	66.8 Å²	66.8	44%	0.435	34%	0.338	S	S	.	.	H	α-helix	trans	-60.5	-45.3	180	176.1	-104.6	0	0	0	111.8	T741 E742 L747 E748 E749	T741-H745 VanDerWaalsContact O-CB 3.29Å; T741-H745 WeakPolarHBondContact O-CB 3.28Å; T741-H745 PolarHBondContact O-N 3.25Å; E742-H745 PolarHBondContact O-N 3.07Å; H745-L747 VanDerWaalsContact C-N 3.34Å; H745-L747 PolarHBondContact O-N 3.35Å; H745-E748 PolarHBondContact O-N 3.22Å; H745-E749 WeakPolarHBondContact O-CB 3.35Å; H745-E749 PolarHBondContact O-N 3.34Å
746	R	95.8	Very high	93	Very high	138 Å²	138	70.9 Å²	70.9	52%	0.521	34%	0.337	S	S	.	.	H	α-helix	trans	-60.2	-41.9	177.4	-170.2	-180	-55.4	161.7	6.6	112.7	E742 K744 S750	E742-R746 WeakPolarHBondContact O-CB 3.43Å; E742-R746 PolarHBondContact O-N 3.04Å; E742-R746 IonicContact OE1-CZ 2.88Å; E742-R746 IonicContact OE1-NE 2.8Å; E742-R746 PolarHBondContact OE1-NE 3.46Å; E742-R746 IonicContact OE1-NH2 3.4Å; E742-R746 PolarHBondContact OE1-NH2 3.47Å; K744-R746 PolarHBondContact O-N 2.97Å; R746-S750 WeakPolarHBondContact O-CB 3.17Å; R746-S750 PolarHBondContact O-N 3.1Å
747	L	94.5	Very high	93.2	Very high	29 Å²	29	74.2 Å²	74.2	15%	0.152	35%	0.348	C	S	.	.	H	α-helix	trans	-65.2	-49.3	177.9	-168.5	163.3	0	0	0	110.7	V499 L724 W725 H743 K744 H745 E749 S750 Q751	V499-L747 HydrophobicContact CG1-CD2 3.34Å; L724-L747 HydrophobicContact CD1-CD1 4.26Å; L724-L747 HydrophobicContact CG-CD1 4.17Å; W725-L747 HydrophobicContact CD2-CD1 4.04Å; W725-L747 HydrophobicContact CE3-CD1 3.87Å; W725-L747 HydrophobicContact CH2-CD1 4.29Å; W725-L747 HydrophobicContact CH2-CD2 3.87Å; W725-L747 HydrophobicContact CZ2-CD1 4.45Å; W725-L747 HydrophobicContact CZ2-CD2 3.97Å; W725-L747 HydrophobicContact CZ3-CD1 4Å; W725-L747 HydrophobicContact CZ3-CD2 4.35Å; H743-L747 WeakPolarHBondContact O-CB 3.41Å; H743-L747 PolarHBondContact O-N 3.04Å; H743-L747 VanDerWaalsContact O-N 3.17Å; K744-L747 PolarHBondContact O-N 3.29Å; H745-L747 VanDerWaalsContact C-N 3.34Å; H745-L747 PolarHBondContact O-N 3.35Å; L747-E749 PolarHBondContact O-N 3.26Å; L747-S750 PolarHBondContact O-N 2.8Å; L747-Q751 PolarHBondContact O-N 3.33Å; L747-Q751 VanDerWaalsContact O-N 3.13Å
748	E	91.7	Very high	93.5	Very high	36 Å²	36	73.3 Å²	73.3	17%	0.168	34%	0.342	C	S	.	.	H	α-helix	trans	-65.5	-37.6	177.7	-68.6	178.1	150.4	0	0	112.6	K744 H745 Q751 R752	K744-E748 WeakPolarHBondContact CE-OE1 3.44Å; K744-E748 IonicContact NZ-OE1 2.65Å; K744-E748 PolarHBondContact NZ-OE1 2.94Å; K744-E748 IonicContact NZ-OE2 2.79Å; K744-E748 PolarHBondContact NZ-OE2 3.45Å; K744-E748 WeakPolarHBondContact O-CG 3.37Å; K744-E748 PolarHBondContact O-N 2.91Å; H745-E748 PolarHBondContact O-N 3.22Å; E748-Q751 WeakPolarHBondContact O-CB 3.41Å; E748-Q751 PolarHBondContact O-N 2.87Å; E748-R752 WeakPolarHBondContact O-CG 3.34Å; E748-R752 PolarHBondContact O-N 2.92Å; E748-R752 IonicContact OE2-NH2 3.74Å
749	E	94.1	Very high	93.6	Very high	64 Å²	64	68.6 Å²	68.6	30%	0.299	33%	0.331	S	S	.	.	H	α-helix	trans	-70.1	-38.1	177.2	-174.5	55.6	-153.5	0	0	111.9	H745 L747 Q751 R752 V753 R756	H745-E749 WeakPolarHBondContact O-CB 3.35Å; H745-E749 PolarHBondContact O-N 3.34Å; L747-E749 PolarHBondContact O-N 3.26Å; E749-Q751 VanDerWaalsContact C-N 3.26Å; E749-Q751 PolarHBondContact O-N 2.82Å; E749-R752 PolarHBondContact O-N 2.89Å; E749-R752 VanDerWaalsContact O-N 3.14Å; E749-R752 WeakPolarHBondContact OE2-CD 3.44Å; E749-R752 IonicContact OE2-CZ 2.69Å; E749-R752 IonicContact OE2-NE 2.67Å; E749-R752 IonicContact OE2-NH1 3.32Å; E749-R752 PolarHBondContact OE2-NH1 2.65Å; E749-V753 WeakPolarHBondContact O-CG2 3.39Å; E749-V753 PolarHBondContact O-N 3.2Å; E749-R756 IonicContact OE1-CZ 3.25Å; E749-R756 IonicContact OE1-NH2 3.42Å; E749-R756 PolarHBondContact OE1-NH2 3.33Å
750	S	93.6	Very high	93.5	Very high	79 Å²	79	68.5 Å²	68.5	55%	0.552	34%	0.344	S	S	*	.	H	α-helix	trans	-56.4	-43.1	170.9	-172.7	0	0	0	0	111.2	R746 L747 V753 E754	R746-S750 WeakPolarHBondContact O-CB 3.17Å; R746-S750 PolarHBondContact O-N 3.1Å; L747-S750 PolarHBondContact O-N 2.8Å; S750-V753 PolarHBondContact O-N 3.3Å; S750-E754 PolarHBondContact O-N 3.25Å
751	Q	91.6	Very high	93.7	Very high	18 Å²	18	72.1 Å²	72.1	8%	0.084	36%	0.363	C	S	.	.	H	α-helix	trans	-61.9	-44.7	175.2	-168.8	-164.4	-4.8	0	0	111.9	V499 L500 H558 L747 E748 E749 V753 E754 E755	V499-Q751 HydrophobicContact CB-CG 4.15Å; V499-Q751 HydrophobicContact CG1-CB 4.48Å; V499-Q751 HydrophobicContact CG1-CG 4.42Å; V499-Q751 VanDerWaalsContact CG1-OE1 3.28Å; L500-Q751 VanDerWaalsContact N-NE2 3.17Å; H558-Q751 PolarHBondContact CD2-NE2 3.16Å; H558-Q751 PolarHBondContact CE1-NE2 2.9Å; H558-Q751 PolarHBondContact ND1-NE2 3.43Å; H558-Q751 VanDerWaalsContact ND1-NE2 3.16Å; L747-Q751 PolarHBondContact O-N 3.33Å; L747-Q751 VanDerWaalsContact O-N 3.13Å; E748-Q751 WeakPolarHBondContact O-CB 3.41Å; E748-Q751 PolarHBondContact O-N 2.87Å; E749-Q751 VanDerWaalsContact C-N 3.26Å; E749-Q751 PolarHBondContact O-N 2.82Å; Q751-V753 VanDerWaalsContact C-N 3.33Å; Q751-V753 PolarHBondContact O-N 2.72Å; Q751-E754 PolarHBondContact O-N 3.42Å; Q751-E755 WeakPolarHBondContact O-CB 3.23Å; Q751-E755 PolarHBondContact O-N 3.41Å
752	R	92.8	Very high	93.7	Very high	92 Å²	92	75.9 Å²	75.9	35%	0.347	38%	0.381	S	S	.	.	H	α-helix	trans	-64.5	-33.7	177.3	-67.5	176.9	-148.3	120.6	4.4	112.8	E748 E749 R756	E748-R752 WeakPolarHBondContact O-CG 3.34Å; E748-R752 PolarHBondContact O-N 2.92Å; E748-R752 IonicContact OE2-NH2 3.74Å; E749-R752 PolarHBondContact O-N 2.89Å; E749-R752 VanDerWaalsContact O-N 3.14Å; E749-R752 WeakPolarHBondContact OE2-CD 3.44Å; E749-R752 IonicContact OE2-CZ 2.69Å; E749-R752 IonicContact OE2-NE 2.67Å; E749-R752 IonicContact OE2-NH1 3.32Å; E749-R752 PolarHBondContact OE2-NH1 2.65Å; R752-R756 WeakPolarHBondContact O-CG 3.43Å; R752-R756 PolarHBondContact O-N 2.85Å; R752-R756 PolarHBondContact O-NE 2.96Å
753	V	94.6	Very high	93.5	Very high	78 Å²	78	78 Å²	78	47%	0.473	39%	0.389	S	S	.	.	H	α-helix	trans	-68.5	-46.5	174.4	171.4	0	0	0	0	110.3	E749 S750 Q751 E755 R756 K757	E749-V753 WeakPolarHBondContact O-CG2 3.39Å; E749-V753 PolarHBondContact O-N 3.2Å; S750-V753 PolarHBondContact O-N 3.3Å; Q751-V753 VanDerWaalsContact C-N 3.33Å; Q751-V753 PolarHBondContact O-N 2.72Å; V753-E755 PolarHBondContact O-N 2.85Å; V753-R756 VanDerWaalsContact CG2-NH2 3.28Å; V753-R756 PolarHBondContact O-N 3.27Å; V753-K757 PolarHBondContact O-N 3.1Å
754	E	91.8	Very high	93.1	Very high	82 Å²	82	81.9 Å²	81.9	38%	0.383	42%	0.417	S	S	.	.	H	α-helix	trans	-65	-39	179.1	-160.9	-156.6	117.4	0	0	112.2	S750 Q751 K757 R758	S750-E754 PolarHBondContact O-N 3.25Å; Q751-E754 PolarHBondContact O-N 3.42Å; E754-K757 PolarHBondContact O-N 3.14Å; E754-R758 WeakPolarHBondContact O-CB 3.24Å; E754-R758 PolarHBondContact O-N 3.24Å; E754-R758 IonicContact OE1-CZ 2.78Å; E754-R758 IonicContact OE1-NE 3.97Å; E754-R758 PolarHBondContact OE1-NE 2.73Å; E754-R758 IonicContact OE1-NH2 2.76Å; E754-R758 PolarHBondContact OE1-NH2 3.07Å
755	E	91.3	Very high	92.9	Very high	58 Å²	58	84.9 Å²	84.9	27%	0.271	43%	0.428	S	S	.	.	H	α-helix	trans	-62.8	-46.1	174.9	-175.9	173.4	-149.8	0	0	112.2	H559 Q751 V753 K757 R758 A759	H559-E755 IonicContact CD2-OE1 2.82Å; Q751-E755 WeakPolarHBondContact O-CB 3.23Å; Q751-E755 PolarHBondContact O-N 3.41Å; V753-E755 PolarHBondContact O-N 2.85Å; E755-K757 VanDerWaalsContact C-N 3.29Å; E755-K757 PolarHBondContact O-N 3.48Å; E755-R758 PolarHBondContact O-N 3.28Å; E755-A759 WeakPolarHBondContact O-CB 3.35Å; E755-A759 PolarHBondContact O-N 3.45Å
756	R	92.8	Very high	92.9	Very high	141 Å²	141	87.9 Å²	87.9	53%	0.532	44%	0.439	S	S	.	.	H	α-helix	trans	-57.9	-41.4	173.1	-81.3	175.6	-75.8	171.4	-11.7	112	E749 R752 V753 A759 A760	E749-R756 IonicContact OE1-CZ 3.25Å; E749-R756 IonicContact OE1-NH2 3.42Å; E749-R756 PolarHBondContact OE1-NH2 3.33Å; R752-R756 WeakPolarHBondContact O-CG 3.43Å; R752-R756 PolarHBondContact O-N 2.85Å; R752-R756 PolarHBondContact O-NE 2.96Å; V753-R756 VanDerWaalsContact CG2-NH2 3.28Å; V753-R756 PolarHBondContact O-N 3.27Å; R756-A759 PolarHBondContact O-N 3.42Å; R756-A760 WeakPolarHBondContact O-CB 3.38Å; R756-A760 PolarHBondContact O-N 2.95Å
757	K	94	Very high	92.9	Very high	135 Å²	135	81.9 Å²	81.9	59%	0.587	42%	0.419	S	S	*	.	H	α-helix	trans	-64.9	-48	176.4	-174.4	179.7	177.8	-178.4	0	111.8	V753 E754 E755 A759 A760 D761	V753-K757 PolarHBondContact O-N 3.1Å; E754-K757 PolarHBondContact O-N 3.14Å; E755-K757 VanDerWaalsContact C-N 3.29Å; E755-K757 PolarHBondContact O-N 3.48Å; K757-A759 VanDerWaalsContact C-N 3.29Å; K757-A759 PolarHBondContact O-N 3.05Å; K757-A760 PolarHBondContact O-N 3.01Å; K757-D761 WeakPolarHBondContact O-CB 3.31Å; K757-D761 PolarHBondContact O-N 2.96Å
758	R	93.1	Very high	92.9	Very high	38 Å²	38	84.7 Å²	84.7	14%	0.143	43%	0.43	C	S	.	.	H	α-helix	trans	-59.1	-39.1	176.8	-82.9	-172.2	-80.7	92.2	0.6	112.5	E754 E755 N762 K763	E754-R758 WeakPolarHBondContact O-CB 3.24Å; E754-R758 PolarHBondContact O-N 3.24Å; E754-R758 IonicContact OE1-CZ 2.78Å; E754-R758 IonicContact OE1-NE 3.97Å; E754-R758 PolarHBondContact OE1-NE 2.73Å; E754-R758 IonicContact OE1-NH2 2.76Å; E754-R758 PolarHBondContact OE1-NH2 3.07Å; E755-R758 PolarHBondContact O-N 3.28Å; R758-N762 PolarHBondContact O-N 2.7Å; R758-K763 WeakPolarHBondContact CB-O 3.43Å; R758-K763 PolarHBondContact O-N 3.36Å
759	A	91.1	Very high	93.1	Very high	68 Å²	68	83.3 Å²	83.3	56%	0.562	42%	0.423	S	S	*	.	H	α-helix	trans	-66	-45.5	174.4	0	0	0	0	0	112.3	E755 R756 K757 D761 N762	E755-A759 WeakPolarHBondContact O-CB 3.35Å; E755-A759 PolarHBondContact O-N 3.45Å; R756-A759 PolarHBondContact O-N 3.42Å; K757-A759 VanDerWaalsContact C-N 3.29Å; K757-A759 PolarHBondContact O-N 3.05Å; A759-D761 PolarHBondContact O-N 2.66Å; A759-N762 PolarHBondContact O-N 3.35Å
760	A	94.6	Very high	93.3	Very high	76 Å²	76	80.3 Å²	80.3	63%	0.628	41%	0.409	S	S	*	.	H	α-helix	trans	-63.1	-39.6	176.4	0	0	0	0	0	112.7	R756 K757 N762	R756-A760 WeakPolarHBondContact O-CB 3.38Å; R756-A760 PolarHBondContact O-N 2.95Å; K757-A760 PolarHBondContact O-N 3.01Å; A760-N762 PolarHBondContact O-N 2.93Å
761	D	95.6	Very high	93.4	Very high	76 Å²	76	79.7 Å²	79.7	41%	0.406	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-4.2	177.5	-72.5	-1.2	0	0	0	113.4	K757 A759 K763	K757-D761 WeakPolarHBondContact O-CB 3.31Å; K757-D761 PolarHBondContact O-N 2.96Å; A759-D761 PolarHBondContact O-N 2.66Å; D761-K763 HydrophobicContact CB-CB 4.34Å; D761-K763 HydrophobicContact CB-CD 3.95Å; D761-K763 HydrophobicContact CB-CG 4.12Å; D761-K763 PolarHBondContact O-N 2.69Å; D761-K763 IonicContact OD2-NZ 3.2Å
762	N	92.5	Very high	93.5	Very high	144 Å²	144	84.3 Å²	84.3	77%	0.77	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	35.1	-169.1	-70.5	-72.4	0	0	0	114.1	R758 A759 A760 P764	R758-N762 PolarHBondContact O-N 2.7Å; A759-N762 PolarHBondContact O-N 3.35Å; A760-N762 PolarHBondContact O-N 2.93Å; N762-P764 VanDerWaalsContact O-CD 3.29Å; N762-P764 WeakPolarHBondContact O-CD 3.34Å
763	K	92.1	Very high	93.4	Very high	132 Å²	132	84.4 Å²	84.4	57%	0.574	43%	0.426	S	S	*	.			trans	-105.4	96.1	179.8	-73.9	172.1	-170.1	163.9	0	110	R758 D761	R758-K763 WeakPolarHBondContact CB-O 3.43Å; R758-K763 PolarHBondContact O-N 3.36Å; D761-K763 HydrophobicContact CB-CB 4.34Å; D761-K763 HydrophobicContact CB-CD 3.95Å; D761-K763 HydrophobicContact CB-CG 4.12Å; D761-K763 PolarHBondContact O-N 2.69Å; D761-K763 IonicContact OD2-NZ 3.2Å
764	P	88.6	Confident	93.2	Very high	118 Å²	118	83.9 Å²	83.9	77%	0.766	44%	0.437	S	S	*	.			trans	-61.7	149.9	175.5	27.3	-34.6	0	0	0	110.4	N762 K766	N762-P764 VanDerWaalsContact O-CD 3.29Å; N762-P764 WeakPolarHBondContact O-CD 3.34Å; P764-K766 PolarHBondContact O-N 2.89Å
765	W	91.6	Very high	92.8	Very high	86 Å²	86	86.6 Å²	86.6	33%	0.326	45%	0.454	S	S	.	.			trans	-66	131.7	171.8	-179.6	-99.2	0	0	0	109.9	L500	L500-W765 HydrophobicContact CD1-CG 4.08Å; L500-W765 HydrophobicContact CD2-CB 3.59Å; L500-W765 HydrophobicContact CD2-CD2 4.1Å; L500-W765 HydrophobicContact CD2-CG 3.66Å; L500-W765 HydrophobicContact CG-CB 4.19Å; L500-W765 HydrophobicContact CG-CD2 3.97Å; L500-W765 HydrophobicContact CG-CG 3.71Å
766	K	93.3	Very high	92.8	Very high	157 Å²	157	84.5 Å²	84.5	68%	0.683	45%	0.447	S	S	*	.			trans	-110.5	112	171	-176.8	176.8	179.5	178.2	0	108.1	P764	P764-K766 PolarHBondContact O-N 2.89Å
767	P	95.6	Very high	92.9	Very high	13 Å²	13	79.2 Å²	79.2	8%	0.084	43%	0.427	C	S	.	.			trans	-59.9	149.6	176.5	-24.4	35.8	0	0	0	112.6	E554 V556 W777	E554-P767 WeakPolarHBondContact OE1-CA 3.5Å; E554-P767 WeakPolarHBondContact OE1-CB 3.44Å; E554-P767 WeakPolarHBondContact OE2-CB 3.31Å; V556-P767 HydrophobicContact CB-CB 4.33Å; V556-P767 HydrophobicContact CB-CG 3.9Å; V556-P767 HydrophobicContact CG1-CB 4.03Å; V556-P767 HydrophobicContact CG1-CG 4.14Å; P767-W777 HydrophobicContact CG-CH2 4.09Å; P767-W777 HydrophobicContact CG-CZ3 3.73Å
768	K	95.3	Very high	93	Very high	88 Å²	88	74.4 Å²	74.4	38%	0.383	41%	0.408	S	S	.	.	S	Bend	trans	-78.7	-39.8	-175.3	-177.5	176.5	173.7	-158.5	0	111.8	L387 E388 E554 N780	L387-K768 HydrophobicContact CD2-CG 4.01Å; E388-K768 IonicContact OE2-NZ 2.94Å; E388-K768 PolarHBondContact OE2-NZ 3.43Å; E554-K768 VanDerWaalsContact CD-N 3.33Å; E554-K768 PolarHBondContact OE1-N 3.46Å; E554-K768 PolarHBondContact OE2-N 3.5Å; K768-N780 PolarHBondContact O-ND2 3.35Å
769	Y	96	Very high	93.1	Very high	6 Å²	6	74 Å²	74	2%	0.024	41%	0.406	C	S	.	.	S	Bend	trans	-109.4	-18.5	-169.4	-67.3	-79.4	0	0	0	114.3	L387 T503 H505 V552 E554 Y779 N780	L387-Y769 HydrophobicContact CD2-CD1 3.65Å; L387-Y769 HydrophobicContact CD2-CE1 3.49Å; L387-Y769 VanDerWaalsContact CD2-CE1 3.49Å; L387-Y769 HydrophobicContact CD2-CG 4.43Å; T503-Y769 HydrophobicContact CG2-CD2 4.02Å; T503-Y769 HydrophobicContact CG2-CE2 3.82Å; H505-Y769 AromaticContact CE1-CE1 3.75Å; H505-Y769 AromaticContact CE1-CE2 3.65Å; H505-Y769 AromaticContact CE1-CZ 3.35Å; H505-Y769 PolarHBondContact CE1-OH 3.05Å; H505-Y769 AromaticContact NE2-CE2 3.62Å; H505-Y769 AromaticContact NE2-CZ 3.56Å; H505-Y769 PolarHBondContact NE2-OH 3.25Å; V552-Y769 HydrophobicContact CG1-CD1 3.84Å; V552-Y769 HydrophobicContact CG1-CD2 4.27Å; V552-Y769 HydrophobicContact CG1-CE1 4.37Å; V552-Y769 HydrophobicContact CG1-CG 3.8Å; E554-Y769 WeakPolarHBondContact OE2-CB 3.41Å; E554-Y769 PolarHBondContact OE2-N 3.05Å; Y769-Y779 AromaticContact CD1-CE2 3.93Å; Y769-Y779 HydrophobicContact CD1-CE2 3.93Å; Y769-Y779 HydrophobicContact CG-CE2 4.36Å; Y769-Y779 CarbonylContact O-C 3.58Å; Y769-Y779 WeakPolarHBondContact O-CA 3.5Å; Y769-Y779 WeakPolarHBondContact O-CD2 3.36Å; Y769-N780 VanDerWaalsContact C-ND2 3.26Å; Y769-N780 WeakPolarHBondContact O-CB 2.83Å; Y769-N780 VanDerWaalsContact O-CG 3.26Å; Y769-N780 PolarHBondContact O-N 3.45Å; Y769-N780 PolarHBondContact O-ND2 3.46Å
770	F	96.9	Very high	93.2	Very high	1 Å²	1	73 Å²	73	0%	0.004	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	150.1	-176.2	-61.5	-97	0	0	0	112.6	E554 V556 G564 W777 I778 Y779 N780	E554-F770 HydrophobicContact CB-CD2 3.8Å; E554-F770 HydrophobicContact CB-CE2 3.85Å; V556-F770 HydrophobicContact CG1-CB 3.77Å; V556-F770 HydrophobicContact CG1-CD2 3.97Å; V556-F770 HydrophobicContact CG1-CG 4.04Å; G564-F770 VanDerWaalsContact C-CZ 3.42Å; F770-W777 HydrophobicContact CB-CE3 4.21Å; F770-I778 CarbonylContact C-O 3.56Å; F770-I778 WeakPolarHBondContact CA-O 3.31Å; F770-Y779 HydrophobicContact CE1-CD2 4.13Å; F770-Y779 HydrophobicContact CE2-CD2 4.34Å; F770-Y779 HydrophobicContact CZ-CD2 4.02Å; F770-N780 PolarHBondContact N-ND2 3.28Å
771	T	95.8	Very high	93	Very high	66 Å²	66	73.3 Å²	73.3	41%	0.405	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	144.2	170.5	-66	0	0	0	0	109.1	E773 I778 N780	T771-E773 PolarHBondContact O-N 3.43Å; T771-I778 PolarHBondContact N-O 2.86Å; T771-I778 PolarHBondContact O-N 3.47Å; T771-N780 WeakPolarHBondContact CB-OD1 3.42Å; T771-N780 PolarHBondContact N-OD1 2.83Å; T771-N780 VanDerWaalsContact N-OD1 3.12Å; T771-N780 PolarHBondContact OG1-OD1 2.88Å
772	K	94.2	Very high	92.7	Very high	115 Å²	115	69.7 Å²	69.7	50%	0.5	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	121.4	175.7	-162.1	-173.3	-178.3	-158.1	0	109.5	G774 G776 W777	K772-G774 WeakPolarHBondContact CE-O 3.34Å; K772-G776 WeakPolarHBondContact CA-O 3.41Å; K772-G776 VanDerWaalsContact CG-O 3.29Å; K772-G776 WeakPolarHBondContact CG-O 3.25Å; K772-W777 HydrophobicContact CB-CD2 4.16Å; K772-W777 HydrophobicContact CB-CE3 3.89Å; K772-W777 HydrophobicContact CB-CH2 3.96Å; K772-W777 HydrophobicContact CB-CZ2 4.21Å; K772-W777 HydrophobicContact CB-CZ3 3.77Å; K772-W777 HydrophobicContact CD-CZ2 4.3Å; K772-W777 HydrophobicContact CG-CD2 4.26Å; K772-W777 HydrophobicContact CG-CE3 4.49Å; K772-W777 HydrophobicContact CG-CH2 4.46Å; K772-W777 HydrophobicContact CG-CZ2 4.21Å
773	E	91.6	Very high	92.5	Very high	94 Å²	94	63.2 Å²	63.2	44%	0.439	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	113.9	173.7	-64.8	-173.5	-163	0	0	107.8	T771 D775 G776 I778 K785	T771-E773 PolarHBondContact O-N 3.43Å; E773-D775 PolarHBondContact O-N 3.26Å; E773-G776 PolarHBondContact N-O 3.01Å; E773-G776 PolarHBondContact O-N 2.95Å; E773-G776 VanDerWaalsContact O-N 3.09Å; E773-I778 HydrophobicContact CB-CG1 3.85Å; E773-I778 HydrophobicContact CG-CB 4.24Å; E773-I778 HydrophobicContact CG-CG1 3.96Å; E773-K785 IonicContact OE1-NZ 2.65Å; E773-K785 PolarHBondContact OE1-NZ 3.4Å; E773-K785 IonicContact OE2-NZ 2.71Å
774	G	89.3	Confident	92.1	Very high	68 Å²	68	60.2 Å²	60.2	70%	0.701	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.9	-127.8	-171.1	0	0	0	0	0	112.4	K772	K772-G774 WeakPolarHBondContact CE-O 3.34Å
775	D	84.5	Confident	91.7	Very high	139 Å²	139	59.9 Å²	59.9	74%	0.743	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-12.6	172.7	-73.9	-40.3	0	0	0	113.6	E773	E773-D775 PolarHBondContact O-N 3.26Å
776	G	90.6	Very high	90.1	Very high	13 Å²	13	59.4 Å²	59.4	13%	0.134	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-179.6	-177.1	0	0	0	0	0	114.6	K772 E773	K772-G776 WeakPolarHBondContact CA-O 3.41Å; K772-G776 VanDerWaalsContact CG-O 3.29Å; K772-G776 WeakPolarHBondContact CG-O 3.25Å; E773-G776 PolarHBondContact N-O 3.01Å; E773-G776 PolarHBondContact O-N 2.95Å; E773-G776 VanDerWaalsContact O-N 3.09Å
777	W	95.1	Very high	87.8	Confident	30 Å²	30	59.3 Å²	59.3	11%	0.114	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	130.9	174.1	-65.5	86.1	0	0	0	110.1	V556 N577 H579 P767 F770 K772	V556-W777 HydrophobicContact CB-CD2 3.9Å; V556-W777 HydrophobicContact CB-CE3 3.86Å; V556-W777 HydrophobicContact CB-CH2 4.03Å; V556-W777 HydrophobicContact CB-CZ2 4.07Å; V556-W777 HydrophobicContact CB-CZ3 3.95Å; V556-W777 HydrophobicContact CG1-CD2 4.32Å; V556-W777 HydrophobicContact CG1-CE3 4.09Å; V556-W777 HydrophobicContact CG1-CZ3 4.46Å; V556-W777 HydrophobicContact CG2-CD2 3.57Å; V556-W777 VanDerWaalsContact CG2-CE2 3.47Å; V556-W777 HydrophobicContact CG2-CE3 4.08Å; V556-W777 HydrophobicContact CG2-CG 3.86Å; V556-W777 HydrophobicContact CG2-CH2 4.36Å; V556-W777 HydrophobicContact CG2-CZ2 3.89Å; V556-W777 HydrophobicContact CG2-CZ3 4.46Å; N577-W777 PolarHBondContact ND2-O 3.33Å; H579-W777 HydrophobicContact CB-CB 4.07Å; H579-W777 HydrophobicContact CB-CG 4.49Å; P767-W777 HydrophobicContact CG-CH2 4.09Å; P767-W777 HydrophobicContact CG-CZ3 3.73Å; F770-W777 HydrophobicContact CB-CE3 4.21Å; K772-W777 HydrophobicContact CB-CD2 4.16Å; K772-W777 HydrophobicContact CB-CE3 3.89Å; K772-W777 HydrophobicContact CB-CH2 3.96Å; K772-W777 HydrophobicContact CB-CZ2 4.21Å; K772-W777 HydrophobicContact CB-CZ3 3.77Å; K772-W777 HydrophobicContact CD-CZ2 4.3Å; K772-W777 HydrophobicContact CG-CD2 4.26Å; K772-W777 HydrophobicContact CG-CE3 4.49Å; K772-W777 HydrophobicContact CG-CH2 4.46Å; K772-W777 HydrophobicContact CG-CZ2 4.21Å
778	I	95.3	Very high	87.4	Confident	35 Å²	35	61.7 Å²	61.7	18%	0.179	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	134.2	-177.3	-56.7	-61.5	0	0	0	108.6	N577 F770 T771 E773 W784	N577-I778 WeakPolarHBondContact OD1-CA 3.34Å; F770-I778 CarbonylContact C-O 3.56Å; F770-I778 WeakPolarHBondContact CA-O 3.31Å; T771-I778 PolarHBondContact N-O 2.86Å; T771-I778 PolarHBondContact O-N 3.47Å; E773-I778 HydrophobicContact CB-CG1 3.85Å; E773-I778 HydrophobicContact CG-CB 4.24Å; E773-I778 HydrophobicContact CG-CG1 3.96Å; I778-W784 HydrophobicContact CG2-CH2 4.45Å; I778-W784 HydrophobicContact CG2-CZ2 3.89Å
779	Y	96.4	Very high	87	Confident	28 Å²	28	60.3 Å²	60.3	11%	0.11	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	143.7	173.7	-174.3	-114.6	0	0	0	110.7	V552 Y566 N577 Y769 F770 N781 P782	V552-Y779 HydrophobicContact CB-CE2 4.21Å; V552-Y779 HydrophobicContact CG1-CE2 4Å; V552-Y779 HydrophobicContact CG2-CE2 4.4Å; Y566-Y779 AromaticContact CD1-CD1 3.51Å; Y566-Y779 HydrophobicContact CD1-CD1 3.51Å; Y566-Y779 HydrophobicContact CD1-CD2 4.13Å; Y566-Y779 AromaticContact CD1-CE1 3.64Å; Y566-Y779 HydrophobicContact CD1-CE1 3.64Å; Y566-Y779 HydrophobicContact CD1-CE2 4.23Å; Y566-Y779 AromaticContact CD1-CG 3.78Å; Y566-Y779 HydrophobicContact CD1-CG 3.78Å; Y566-Y779 AromaticContact CD2-CD1 3.84Å; Y566-Y779 HydrophobicContact CD2-CD1 3.84Å; Y566-Y779 AromaticContact CD2-CG 3.77Å; Y566-Y779 HydrophobicContact CD2-CG 3.77Å; Y566-Y779 AromaticContact CE1-CD1 3.59Å; Y566-Y779 HydrophobicContact CE1-CD1 3.59Å; Y566-Y779 AromaticContact CE1-CE1 3.63Å; Y566-Y779 HydrophobicContact CE1-CE1 3.63Å; Y566-Y779 HydrophobicContact CE1-CG 4.31Å; Y566-Y779 AromaticContact CE2-CD1 3.92Å; Y566-Y779 HydrophobicContact CE2-CD1 3.92Å; Y566-Y779 HydrophobicContact CE2-CG 4.3Å; Y566-Y779 AromaticContact CG-CD1 3.63Å; Y566-Y779 HydrophobicContact CG-CD1 3.63Å; Y566-Y779 AromaticContact CG-CD2 3.93Å; Y566-Y779 HydrophobicContact CG-CD2 3.93Å; Y566-Y779 HydrophobicContact CG-CE1 4.22Å; Y566-Y779 HydrophobicContact CG-CE2 4.47Å; Y566-Y779 AromaticContact CG-CG 3.48Å; Y566-Y779 HydrophobicContact CG-CG 3.48Å; Y566-Y779 VanDerWaalsContact CG-CG 3.48Å; Y566-Y779 AromaticContact CZ-CD1 3.8Å; N577-Y779 PolarHBondContact OD1-N 3.07Å; Y769-Y779 AromaticContact CD1-CE2 3.93Å; Y769-Y779 HydrophobicContact CD1-CE2 3.93Å; Y769-Y779 HydrophobicContact CG-CE2 4.36Å; Y769-Y779 CarbonylContact O-C 3.58Å; Y769-Y779 WeakPolarHBondContact O-CA 3.5Å; Y769-Y779 WeakPolarHBondContact O-CD2 3.36Å; F770-Y779 HydrophobicContact CE1-CD2 4.13Å; F770-Y779 HydrophobicContact CE2-CD2 4.34Å; F770-Y779 HydrophobicContact CZ-CD2 4.02Å; Y779-N781 VanDerWaalsContact CD1-C 3.46Å; Y779-N781 WeakPolarHBondContact CD1-O 3.39Å; Y779-N781 HydrophobicContact CE1-CB 4.13Å; Y779-N781 VanDerWaalsContact CE1-O 3.23Å; Y779-N781 WeakPolarHBondContact CE1-O 3.28Å; Y779-N781 PolarHBondContact O-N 3.39Å; Y779-P782 HydrophobicContact CD1-CB 4.43Å; Y779-P782 VanDerWaalsContact O-CD 3.29Å; Y779-P782 WeakPolarHBondContact O-CD 3.47Å
780	N	93.6	Very high	86.5	Confident	47 Å²	47	63.3 Å²	63.3	25%	0.251	35%	0.35	S	S	.	.	S	Bend	trans	-70.1	-35.6	-170.7	-72.5	-20.8	0	0	0	113	K768 Y769 F770 T771 P782	K768-N780 PolarHBondContact O-ND2 3.35Å; Y769-N780 VanDerWaalsContact C-ND2 3.26Å; Y769-N780 WeakPolarHBondContact O-CB 2.83Å; Y769-N780 VanDerWaalsContact O-CG 3.26Å; Y769-N780 PolarHBondContact O-N 3.45Å; Y769-N780 PolarHBondContact O-ND2 3.46Å; F770-N780 PolarHBondContact N-ND2 3.28Å; T771-N780 WeakPolarHBondContact CB-OD1 3.42Å; T771-N780 PolarHBondContact N-OD1 2.83Å; T771-N780 VanDerWaalsContact N-OD1 3.12Å; T771-N780 PolarHBondContact OG1-OD1 2.88Å; N780-P782 VanDerWaalsContact C-CD 3.45Å; N780-P782 WeakPolarHBondContact O-CD 3.18Å
781	N	89.5	Confident	85.9	Confident	83 Å²	83	66.9 Å²	66.9	44%	0.444	37%	0.37	S	S	.	.	S	Bend	trans	-124	62	-178.6	-66.2	-18.1	0	0	0	111.4	L387 Y779	L387-N781 VanDerWaalsContact CD1-ND2 3.29Å; L387-N781 WeakPolarHBondContact CD1-ND2 3.26Å; Y779-N781 VanDerWaalsContact CD1-C 3.46Å; Y779-N781 WeakPolarHBondContact CD1-O 3.39Å; Y779-N781 HydrophobicContact CE1-CB 4.13Å; Y779-N781 VanDerWaalsContact CE1-O 3.23Å; Y779-N781 WeakPolarHBondContact CE1-O 3.28Å; Y779-N781 PolarHBondContact O-N 3.39Å
782	P	88.9	Confident	85.2	Confident	0 Å²	0	67 Å²	67	0%	0	37%	0.368	C	S	.	.			trans	-76.2	156	-175.9	35	-33.4	0	0	0	110.7	Y566 Y779 N780 W784 K785 S786	Y566-P782 HydrophobicContact CE2-CB 3.94Å; Y779-P782 HydrophobicContact CD1-CB 4.43Å; Y779-P782 VanDerWaalsContact O-CD 3.29Å; Y779-P782 WeakPolarHBondContact O-CD 3.47Å; N780-P782 VanDerWaalsContact C-CD 3.45Å; N780-P782 WeakPolarHBondContact O-CD 3.18Å; P782-W784 VanDerWaalsContact C-N 3.27Å; P782-W784 HydrophobicContact CB-CD2 3.75Å; P782-W784 HydrophobicContact CB-CE3 3.66Å; P782-W784 HydrophobicContact CB-CH2 3.43Å; P782-W784 VanDerWaalsContact CB-CH2 3.43Å; P782-W784 HydrophobicContact CB-CZ2 3.54Å; P782-W784 HydrophobicContact CB-CZ3 3.51Å; P782-W784 HydrophobicContact CG-CD2 4.02Å; P782-W784 HydrophobicContact CG-CE3 4.44Å; P782-W784 HydrophobicContact CG-CH2 4.07Å; P782-W784 HydrophobicContact CG-CZ2 3.64Å; P782-W784 HydrophobicContact CG-CZ3 4.47Å; P782-W784 PolarHBondContact O-N 3.07Å; P782-K785 HydrophobicContact CG-CB 3.85Å; P782-K785 HydrophobicContact CG-CD 3.61Å; P782-K785 HydrophobicContact CG-CG 3.64Å; P782-K785 PolarHBondContact O-N 2.93Å; P782-S786 PolarHBondContact O-N 2.98Å; P782-S786 PolarHBondContact O-OG 3.28Å
783	L	89.1	Confident	84.6	Confident	8 Å²	8	63.8 Å²	63.8	4%	0.042	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-59.4	-39.5	-172.7	-167.2	59.3	0	0	0	111.9	Y566 R570 C575 L604 K785 S786	Y566-L783 PolarHBondContact OH-N 3.35Å; R570-L783 HydrophobicContact CB-CD1 4.37Å; R570-L783 HydrophobicContact CG-CD1 3.83Å; C575-L783 HydrophobicContact CB-CB 4.32Å; L604-L783 HydrophobicContact CD1-CB 4.06Å; L604-L783 HydrophobicContact CD1-CD2 3.84Å; L604-L783 HydrophobicContact CD1-CG 3.65Å; L783-K785 VanDerWaalsContact C-N 3.29Å; L783-K785 PolarHBondContact O-N 2.79Å; L783-S786 WeakPolarHBondContact O-CB 3.28Å; L783-S786 PolarHBondContact O-N 2.82Å; L783-S786 VanDerWaalsContact O-N 3.09Å
784	W	83.3	Confident	84.1	Confident	70 Å²	70	61.6 Å²	61.6	27%	0.265	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-71.1	-13.6	178.2	70.7	87.8	0	0	0	115.3	Y566 N577 C602 L604 I778 P782	Y566-W784 HydrophobicContact CE2-CZ3 4.12Å; N577-W784 HydrophobicContact CB-CH2 3.71Å; N577-W784 HydrophobicContact CB-CZ3 4.19Å; C602-W784 HydrophobicContact CB-CE3 4.47Å; L604-W784 HydrophobicContact CD1-CB 4.48Å; L604-W784 HydrophobicContact CD2-CB 3.74Å; I778-W784 HydrophobicContact CG2-CH2 4.45Å; I778-W784 HydrophobicContact CG2-CZ2 3.89Å; P782-W784 VanDerWaalsContact C-N 3.27Å; P782-W784 HydrophobicContact CB-CD2 3.75Å; P782-W784 HydrophobicContact CB-CE3 3.66Å; P782-W784 HydrophobicContact CB-CH2 3.43Å; P782-W784 VanDerWaalsContact CB-CH2 3.43Å; P782-W784 HydrophobicContact CB-CZ2 3.54Å; P782-W784 HydrophobicContact CB-CZ3 3.51Å; P782-W784 HydrophobicContact CG-CD2 4.02Å; P782-W784 HydrophobicContact CG-CE3 4.44Å; P782-W784 HydrophobicContact CG-CH2 4.07Å; P782-W784 HydrophobicContact CG-CZ2 3.64Å; P782-W784 HydrophobicContact CG-CZ3 4.47Å; P782-W784 PolarHBondContact O-N 3.07Å
785	K	80	Confident	83.7	Confident	110 Å²	110	61.2 Å²	61.2	48%	0.478	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-96.3	-0.1	171.1	-66.5	-178.9	-172.9	174.7	0	112	E773 P782 L783	E773-K785 IonicContact OE1-NZ 2.65Å; E773-K785 PolarHBondContact OE1-NZ 3.4Å; E773-K785 IonicContact OE2-NZ 2.71Å; P782-K785 HydrophobicContact CG-CB 3.85Å; P782-K785 HydrophobicContact CG-CD 3.61Å; P782-K785 HydrophobicContact CG-CG 3.64Å; P782-K785 PolarHBondContact O-N 2.93Å; L783-K785 VanDerWaalsContact C-N 3.29Å; L783-K785 PolarHBondContact O-N 2.79Å
786	S	59	Low	83.7	Confident	76 Å²	76	54.7 Å²	54.7	53%	0.531	29%	0.292	S	S	.	.			trans	-106.5	2	-173.2	-55.3	0	0	0	0	114.3	P782 L783	P782-S786 PolarHBondContact O-N 2.98Å; P782-S786 PolarHBondContact O-OG 3.28Å; L783-S786 WeakPolarHBondContact O-CB 3.28Å; L783-S786 PolarHBondContact O-N 2.82Å; L783-S786 VanDerWaalsContact O-N 3.09Å
787	T	43.5	Very low	83.1	Confident	156 Å²	156	58.5 Å²	58.5	96%	0.957	31%	0.307	S	S	*	.			trans	-107.8	0	-179.1	49.5	0	0	0	0	111.8

Retrieved 787 of 787 residues in 137.3 ms (Link to these results)

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