A0A077Z0G6_TRITR Loading...

DUF2181 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z0G6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 557 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	34.6	Very low	28.6	Very low	239 Å²	239	153.8 Å²	153.8	100%	1.177	88%	0.884	S	S	*	*				0	131.9	0	-83.3	173.3	165.8	0	0	108.3
2	S	32.3	Very low	28.9	Very low	118 Å²	118	159.4 Å²	159.4	83%	0.825	89%	0.89	S	S	*	*			trans	53.5	115	159.3	60	0	0	0	0	122.2
3	H	27.1	Very low	28.5	Very low	204 Å²	204	156.1 Å²	156.1	94%	0.944	88%	0.876	S	S	*	*			trans	-17.4	154.7	141.6	-75.8	-65.6	0	0	0	121.2
4	G	28.7	Very low	28.2	Very low	76 Å²	76	154.4 Å²	154.4	78%	0.784	87%	0.865	S	S	*	*			trans	142.4	107.8	158.2	0	0	0	0	0	108.7
5	G	26	Very low	28	Very low	74 Å²	74	153.8 Å²	153.8	76%	0.763	86%	0.859	S	S	*	*			cis	89.4	89.4	48.4	0	0	0	0	0	108.4
6	N	33.1	Very low	28.1	Very low	172 Å²	172	150.8 Å²	150.8	92%	0.92	86%	0.86	S	S	*	*			trans	-146.8	93	164.3	-101.3	-5.6	0	0	0	109
7	E	25	Very low	27.7	Very low	185 Å²	185	150.6 Å²	150.6	86%	0.864	85%	0.854	S	S	*	*			trans	-79.4	159.1	155.5	-76.4	179.7	140.6	0	0	109.7
8	S	27.2	Very low	27.4	Very low	119 Å²	119	150.6 Å²	150.6	83%	0.832	85%	0.849	S	S	*	*			trans	86	96.2	163.6	76.3	0	0	0	0	118.5
9	E	31.3	Very low	27.1	Very low	200 Å²	200	148.7 Å²	148.7	94%	0.935	85%	0.847	S	S	*	*			trans	-148.2	80.9	136.8	-145.8	176.4	-174.6	0	0	109.2
10	F	21.9	Very low	26.9	Very low	218 Å²	218	145.1 Å²	145.1	96%	0.956	84%	0.843	S	S	*	*			trans	-129.4	88.4	168.8	-120.5	-81.1	0	0	0	106.9
11	A	27.6	Very low	26.6	Very low	87 Å²	87	149.4 Å²	149.4	72%	0.719	85%	0.847	S	S	*	*			trans	-168.8	92.8	165.1	0	0	0	0	0	110.9
12	K	31.6	Very low	26.3	Very low	221 Å²	221	142.2 Å²	142.2	96%	0.961	83%	0.826	S	S	*	*			trans	-132	99.1	145	-82.6	-168.8	179.7	175.5	0	109
13	T	24.3	Very low	25.7	Very low	116 Å²	116	141.7 Å²	141.7	71%	0.712	82%	0.822	S	S	*	*			trans	-78.8	147.7	170.9	34.2	0	0	0	0	111.9
14	N	23.9	Very low	25.7	Very low	133 Å²	133	141.7 Å²	141.7	71%	0.711	82%	0.82	S	S	*	*			trans	86.9	134.8	134.5	-72.7	4.7	0	0	0	122.8
15	D	25.8	Very low	25.4	Very low	145 Å²	145	143.1 Å²	143.1	78%	0.775	82%	0.818	S	S	*	*			trans	83.5	104.5	146.3	-56.8	-22.5	0	0	0	119.9
16	A	29.3	Very low	25.3	Very low	106 Å²	106	144.6 Å²	144.6	88%	0.876	82%	0.816	S	S	*	*				-169.4	136.9	109.8	0	0	0	0	0	112
17	I	21.6	Very low	25	Very low	148 Å²	148	141.8 Å²	141.8	76%	0.759	81%	0.807	S	S	*	*			trans	-111.9	144.3	-173.8	-85.9	176.3	0	0	0	107.7
18	I	22.8	Very low	24.9	Very low	149 Å²	149	139 Å²	139	76%	0.764	81%	0.808	S	S	*	*			trans	84	124.2	154	-72.1	163.5	0	0	0	121.6
19	S	21	Very low	24.6	Very low	116 Å²	116	142.4 Å²	142.4	81%	0.811	81%	0.808	S	S	*	*			trans	68.1	129.1	145.7	75.2	0	0	0	0	122.9
20	G	23.1	Very low	24.2	Very low	75 Å²	75	144.1 Å²	144.1	77%	0.773	81%	0.808	S	S	*	*			trans	-178.9	109.7	165.6	0	0	0	0	0	112.2
21	Y	20.8	Very low	24.1	Very low	237 Å²	237	138.8 Å²	138.8	93%	0.929	80%	0.798	S	S	*	*			trans	-51.6	147	179.3	-80.2	-109.8	0	0	0	115.6
22	A	27.9	Very low	23.7	Very low	88 Å²	88	142.4 Å²	142.4	73%	0.727	80%	0.803	S	S	*	*			trans	-156.5	104.3	143.7	0	0	0	0	0	111.6
23	S	20.5	Very low	23.2	Very low	106 Å²	106	140.5 Å²	140.5	74%	0.741	80%	0.798	S	S	*	*			trans	-55.4	131.5	164.3	45.1	0	0	0	0	113
24	F	26	Very low	23.1	Very low	205 Å²	205	139.8 Å²	139.8	90%	0.899	80%	0.795	S	S	*	*			trans	-114.4	102.6	157.8	-86.7	-83.1	0	0	0	109.5
25	S	22	Very low	22.9	Very low	106 Å²	106	141.5 Å²	141.5	74%	0.741	80%	0.802	S	S	*	*			trans	-83.5	131.7	165.3	50.2	0	0	0	0	110.6
26	S	23.9	Very low	22.7	Very low	105 Å²	105	140 Å²	140	73%	0.734	80%	0.803	S	S	*	*			trans	-45.5	161.9	156.1	54.2	0	0	0	0	113.2
27	P	27.6	Very low	22.3	Very low	112 Å²	112	145.9 Å²	145.9	73%	0.727	80%	0.803	S	S	*	*			cis	-153.7	157.9	45.6	39	-16.9	0	0	0	118.5
28	S	23.4	Very low	22.4	Very low	127 Å²	127	143.1 Å²	143.1	89%	0.888	80%	0.802	S	S	*	*			trans	-162.4	128.7	144	-8.2	0	0	0	0	111.5
29	F	20.2	Very low	22.4	Very low	190 Å²	190	141.3 Å²	141.3	83%	0.833	80%	0.802	S	S	*	*			trans	-65.9	143.7	176	-80.1	-112	0	0	0	112.5
30	Y	24.1	Very low	22.5	Very low	237 Å²	237	144.2 Å²	144.2	93%	0.929	80%	0.803	S	S	*	*				-160.1	134.7	128.5	-93.8	-70.1	0	0	0	111.3
31	S	20	Very low	22.5	Very low	106 Å²	106	148 Å²	148	74%	0.741	81%	0.806	S	S	*	*			trans	-68.2	141.1	-175.3	161.3	0	0	0	0	113.4
32	I	18.8	Very low	22.4	Very low	162 Å²	162	143.4 Å²	143.4	83%	0.831	81%	0.807	S	S	*	*			trans	-98	122.3	172.4	-63.9	170.2	0	0	0	108.2
33	Q	20	Very low	22.1	Very low	182 Å²	182	145.8 Å²	145.8	85%	0.85	81%	0.806	S	S	*	*			trans	-126.1	154.1	156.5	-91.4	-156.2	-18.9	0	0	111.2
34	P	21.7	Very low	22	Very low	100 Å²	100	152.3 Å²	152.3	65%	0.649	82%	0.815	S	S	*	*			trans	-108.3	150.3	-146.9	37.2	-28.4	0	0	0	116.2
35	I	20.3	Very low	21.9	Very low	169 Å²	169	146.2 Å²	146.2	87%	0.867	79%	0.791	S	S	*	*			trans	54.1	112.4	137.9	-54	167.7	0	0	0	118.8
36	S	21.7	Very low	21.7	Very low	113 Å²	113	147.8 Å²	147.8	79%	0.79	80%	0.796	S	S	*	*			trans	-138.9	105.1	151.8	165.3	0	0	0	0	110.9
37	R	22.2	Very low	21.9	Very low	231 Å²	231	146.3 Å²	146.3	87%	0.872	78%	0.779	S	S	*	*			trans	38.5	118.1	143.1	-69.9	-179	178.2	175	0.2	121.3
38	A	22.4	Very low	21.6	Very low	89 Å²	89	147.3 Å²	147.3	74%	0.736	78%	0.778	S	S	*	*				79.6	131.4	117.5	0	0	0	0	0	120.6
39	S	22.4	Very low	21.6	Very low	111 Å²	111	149.8 Å²	149.8	78%	0.776	78%	0.775	S	S	*	*			trans	81.8	108.5	163.2	80.3	0	0	0	0	117.3
40	Q	22.9	Very low	21.9	Very low	178 Å²	178	144.4 Å²	144.4	83%	0.832	76%	0.762	S	S	*	*			trans	145.2	118.5	141	-81.2	178.3	5.3	0	0	108.8
41	N	23.8	Very low	22	Very low	155 Å²	155	135.8 Å²	135.8	83%	0.829	75%	0.745	S	S	*	*			trans	-176.7	72.4	143.4	-85.5	-21	0	0	0	108.1	L43	N41-L43 PolarHBondContact O-N 3.08Å
42	C	19.7	Very low	22.4	Very low	140 Å²	140	135.6 Å²	135.6	95%	0.946	73%	0.729	S	S	*	*			trans	-79.1	100.8	157.4	-83.7	0	0	0	0	107.2
43	L	21.3	Very low	23	Very low	138 Å²	138	129.2 Å²	129.2	72%	0.723	70%	0.698	S	S	*	*			trans	-81	120.2	178.5	-146.7	84.5	0	0	0	109.7	N41 I45	N41-L43 PolarHBondContact O-N 3.08Å; L43-I45 HydrophobicContact CB-CG1 4.39Å; L43-I45 HydrophobicContact CD2-CD1 3.77Å; L43-I45 HydrophobicContact CD2-CG1 3.86Å; L43-I45 HydrophobicContact CG-CG1 4.24Å
44	R	18.6	Very low	23.6	Very low	243 Å²	243	123.2 Å²	123.2	92%	0.917	67%	0.67	S	S	*	*			trans	-89.3	117.9	174	-155.1	179.9	-159.7	169.9	4.6	107.6
45	I	22.5	Very low	24	Very low	76 Å²	76	121.2 Å²	121.2	39%	0.39	65%	0.652	S	S	.	*			trans	-124.4	126.7	-174.5	-42.8	178.2	0	0	0	111.1	L43 I47 Y76	L43-I45 HydrophobicContact CB-CG1 4.39Å; L43-I45 HydrophobicContact CD2-CD1 3.77Å; L43-I45 HydrophobicContact CD2-CG1 3.86Å; L43-I45 HydrophobicContact CG-CG1 4.24Å; I45-I47 HydrophobicContact CG2-CD1 3.7Å; I45-I47 HydrophobicContact CG2-CG1 3.59Å; I45-Y76 HydrophobicContact CD1-CE2 4.06Å
46	T	19.3	Very low	24.5	Very low	139 Å²	139	114.4 Å²	114.4	85%	0.853	62%	0.618	S	S	*	*			trans	-102.1	127.1	174.9	-38.4	0	0	0	0	107.8
47	I	26.4	Very low	25	Very low	74 Å²	74	117.4 Å²	117.4	38%	0.379	61%	0.613	S	S	.	*			trans	-141.8	135.8	-176.4	-51	-176.9	0	0	0	114	I45 Y76	I45-I47 HydrophobicContact CG2-CD1 3.7Å; I45-I47 HydrophobicContact CG2-CG1 3.59Å; I47-Y76 HydrophobicContact CD1-CD2 3.56Å; I47-Y76 HydrophobicContact CD1-CE2 3.49Å; I47-Y76 VanDerWaalsContact CD1-CE2 3.49Å; I47-Y76 HydrophobicContact CD1-CG 4.49Å
48	D	22	Very low	25.5	Very low	133 Å²	133	106.9 Å²	106.9	71%	0.711	57%	0.573	S	S	*	*			trans	-74.3	170.7	-178.1	-156.4	0.2	0	0	0	115.7
49	H	23.6	Very low	26.1	Very low	179 Å²	179	104.4 Å²	104.4	83%	0.829	55%	0.55	S	S	*	.			trans	-89.2	117.4	-164.7	-65.9	-84	0	0	0	114.3
50	S	25.8	Very low	26.6	Very low	78 Å²	78	102.7 Å²	102.7	55%	0.545	53%	0.528	S	S	.	.			trans	-159.5	145.3	151.1	35.6	0	0	0	0	110.3	Y52	S50-Y52 WeakPolarHBondContact O-CD2 3.28Å; S50-Y52 WeakPolarHBondContact OG-CE2 3.18Å
51	G	27.4	Very low	26.8	Very low	56 Å²	56	99.4 Å²	99.4	58%	0.577	52%	0.522	S	S	*	.			trans	-73.1	128.2	-171.4	0	0	0	0	0	112.5
52	Y	28.7	Very low	26.9	Very low	102 Å²	102	99.4 Å²	99.4	40%	0.4	52%	0.522	S	S	.	.			trans	-149.8	148.1	-177.9	-69.1	-64.1	0	0	0	111.5	S50 T78	S50-Y52 WeakPolarHBondContact O-CD2 3.28Å; S50-Y52 WeakPolarHBondContact OG-CE2 3.18Å; Y52-T78 HydrophobicContact CD1-CG2 3.6Å; Y52-T78 HydrophobicContact CD2-CG2 4.34Å; Y52-T78 HydrophobicContact CE1-CG2 4.38Å; Y52-T78 HydrophobicContact CG-CG2 3.58Å
53	S	30.3	Very low	27	Very low	28 Å²	28	104 Å²	104	20%	0.196	52%	0.519	C	S	.	.			trans	-63.5	128.8	158.9	48.5	0	0	0	0	108.7
54	Q	32.1	Very low	27.2	Very low	56 Å²	56	102 Å²	102	26%	0.262	52%	0.516	S	S	.	.	B	Isolated β-bridge	trans	-102	125.7	-178.7	-74.8	176.9	7.6	0	0	109.4	S291	Q54-S291 VanDerWaalsContact NE2-CB 3.3Å
55	F	29.8	Very low	27.3	Very low	58 Å²	58	100.2 Å²	100.2	25%	0.254	52%	0.518	S	S	.	.			trans	-111.2	122.6	167.2	-159.5	-87.9	0	0	0	107.4	R57 F58 T254 F280	F55-R57 PolarHBondContact O-N 3.37Å; F55-F58 HydrophobicContact CD1-CD2 4.31Å; F55-F58 HydrophobicContact CD1-CE2 4.43Å; F55-F58 AromaticContact CE1-CD2 3.24Å; F55-F58 HydrophobicContact CE1-CD2 3.24Å; F55-F58 HydrophobicContact CE1-CE1 4.47Å; F55-F58 AromaticContact CE1-CE2 3.17Å; F55-F58 HydrophobicContact CE1-CE2 3.17Å; F55-F58 AromaticContact CE1-CG 3.99Å; F55-F58 HydrophobicContact CE1-CG 3.99Å; F55-F58 AromaticContact CE1-CZ 3.84Å; F55-F58 HydrophobicContact CE1-CZ 3.84Å; F55-F58 HydrophobicContact CE2-CE2 4.22Å; F55-F58 AromaticContact CZ-CD2 3.68Å; F55-F58 HydrophobicContact CZ-CD2 3.68Å; F55-F58 HydrophobicContact CZ-CE1 4.34Å; F55-F58 AromaticContact CZ-CE2 3.03Å; F55-F58 HydrophobicContact CZ-CE2 3.03Å; F55-F58 AromaticContact CZ-CZ 3.44Å; F55-F58 HydrophobicContact CZ-CZ 3.44Å; F55-F58 VanDerWaalsContact CZ-CZ 3.44Å; F55-T254 HydrophobicContact CE2-CG2 3.57Å; F55-T254 HydrophobicContact CZ-CG2 3.63Å; F55-F280 WeakPolarHBondContact CD2-O 3.49Å; F55-F280 WeakPolarHBondContact CE2-O 3.32Å
56	C	32.4	Very low	27.3	Very low	25 Å²	25	100.3 Å²	100.3	17%	0.169	53%	0.526	C	S	.	.	P	Polyproline II helix	trans	-68.5	124.7	168.8	-67.3	0	0	0	0	108.1	F58 A303	C56-F58 PolarHBondContact O-N 2.98Å; C56-A303 HydrophobicContact CB-CB 4.03Å
57	R	30.5	Very low	27.4	Very low	177 Å²	177	100.7 Å²	100.7	67%	0.668	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-46.7	123.8	-176.5	-178.1	176	-175.1	171.2	2.1	111.4	F55	F55-R57 PolarHBondContact O-N 3.37Å
58	F	34.5	Very low	27.3	Very low	9 Å²	9	106.4 Å²	106.4	4%	0.039	55%	0.55	C	S	.	*	P	Polyproline II helix	trans	-68.8	135.1	159.5	-74.8	-65.8	0	0	0	108.8	F55 C56 F60 I226 Y252 T254	F55-F58 HydrophobicContact CD1-CD2 4.31Å; F55-F58 HydrophobicContact CD1-CE2 4.43Å; F55-F58 AromaticContact CE1-CD2 3.24Å; F55-F58 HydrophobicContact CE1-CD2 3.24Å; F55-F58 HydrophobicContact CE1-CE1 4.47Å; F55-F58 AromaticContact CE1-CE2 3.17Å; F55-F58 HydrophobicContact CE1-CE2 3.17Å; F55-F58 AromaticContact CE1-CG 3.99Å; F55-F58 HydrophobicContact CE1-CG 3.99Å; F55-F58 AromaticContact CE1-CZ 3.84Å; F55-F58 HydrophobicContact CE1-CZ 3.84Å; F55-F58 HydrophobicContact CE2-CE2 4.22Å; F55-F58 AromaticContact CZ-CD2 3.68Å; F55-F58 HydrophobicContact CZ-CD2 3.68Å; F55-F58 HydrophobicContact CZ-CE1 4.34Å; F55-F58 AromaticContact CZ-CE2 3.03Å; F55-F58 HydrophobicContact CZ-CE2 3.03Å; F55-F58 AromaticContact CZ-CZ 3.44Å; F55-F58 HydrophobicContact CZ-CZ 3.44Å; F55-F58 VanDerWaalsContact CZ-CZ 3.44Å; C56-F58 PolarHBondContact O-N 2.98Å; F58-F60 HydrophobicContact CB-CD1 4.46Å; F58-F60 HydrophobicContact CB-CD2 4.05Å; F58-F60 HydrophobicContact CB-CE1 4.17Å; F58-F60 HydrophobicContact CB-CE2 3.75Å; F58-F60 HydrophobicContact CB-CG 4.39Å; F58-F60 HydrophobicContact CB-CZ 3.8Å; F58-F60 HydrophobicContact CD2-CE1 4.33Å; F58-F60 HydrophobicContact CD2-CE2 4.28Å; F58-F60 AromaticContact CD2-CZ 3.72Å; F58-F60 HydrophobicContact CD2-CZ 3.72Å; F58-F60 HydrophobicContact CG-CZ 4.17Å; F58-F60 PolarHBondContact O-N 3.06Å; F58-I226 HydrophobicContact CE2-CD1 3.9Å; F58-I226 HydrophobicContact CZ-CD1 4.31Å; F58-Y252 AromaticContact CD1-CD1 3.75Å; F58-Y252 HydrophobicContact CD1-CD1 3.75Å; F58-Y252 HydrophobicContact CD1-CE1 4.34Å; F58-Y252 HydrophobicContact CD1-CG 4.23Å; F58-Y252 AromaticContact CE1-CD1 3.79Å; F58-Y252 HydrophobicContact CE1-CD1 3.79Å; F58-Y252 AromaticContact CE1-CG 3.95Å; F58-Y252 HydrophobicContact CE1-CG 3.95Å; F58-T254 HydrophobicContact CE2-CG2 4.32Å; F58-T254 HydrophobicContact CZ-CG2 3.87Å
59	P	33.9	Very low	27.3	Very low	38 Å²	38	103.3 Å²	103.3	25%	0.247	55%	0.55	C	S	.	.			trans	-69.6	84.7	160.2	28.3	-28.8	0	0	0	107.3	A303	P59-A303 WeakPolarHBondContact CD-O 3.35Å
60	F	33.8	Very low	27.2	Very low	75 Å²	75	102 Å²	102	33%	0.329	56%	0.555	S	S	.	*			trans	-64.6	137.6	166.6	-67.7	-72.5	0	0	0	108.1	F58 L62 I183	F58-F60 HydrophobicContact CB-CD1 4.46Å; F58-F60 HydrophobicContact CB-CD2 4.05Å; F58-F60 HydrophobicContact CB-CE1 4.17Å; F58-F60 HydrophobicContact CB-CE2 3.75Å; F58-F60 HydrophobicContact CB-CG 4.39Å; F58-F60 HydrophobicContact CB-CZ 3.8Å; F58-F60 HydrophobicContact CD2-CE1 4.33Å; F58-F60 HydrophobicContact CD2-CE2 4.28Å; F58-F60 AromaticContact CD2-CZ 3.72Å; F58-F60 HydrophobicContact CD2-CZ 3.72Å; F58-F60 HydrophobicContact CG-CZ 4.17Å; F58-F60 PolarHBondContact O-N 3.06Å; F60-L62 PolarHBondContact O-N 3.49Å; F60-I183 HydrophobicContact CE1-CD1 3.65Å; F60-I183 HydrophobicContact CZ-CD1 4.22Å
61	P	27.1	Very low	27.2	Very low	108 Å²	108	106.8 Å²	106.8	70%	0.701	57%	0.568	S	S	*	*			trans	-60.3	106.1	168.9	22.8	-29.1	0	0	0	107.9	R63	P61-R63 PolarHBondContact O-N 2.76Å
62	L	25.8	Very low	27	Very low	156 Å²	156	107.7 Å²	107.7	82%	0.817	58%	0.578	S	S	*	*			trans	-59.3	102.3	177	-75.5	163.3	0	0	0	108.3	F60 S64	F60-L62 PolarHBondContact O-N 3.49Å; L62-S64 PolarHBondContact O-N 3.36Å
63	R	22.1	Very low	26.9	Very low	237 Å²	237	110.1 Å²	110.1	89%	0.894	59%	0.592	S	S	*	*			trans	-77.8	109.3	168.8	-147.7	-179.3	-166.2	-169.7	4.1	107.6	P61	P61-R63 PolarHBondContact O-N 2.76Å
64	S	23.8	Very low	26.7	Very low	95 Å²	95	113.7 Å²	113.7	66%	0.664	61%	0.609	S	S	*	*			trans	57.9	123.7	169.4	63.3	0	0	0	0	117.2	L62 S66	L62-S64 PolarHBondContact O-N 3.36Å; S64-S66 PolarHBondContact O-N 2.9Å
65	Q	22.4	Very low	26.7	Very low	206 Å²	206	114.4 Å²	114.4	96%	0.963	63%	0.632	S	S	*	*			trans	-50.5	97	160	-65.2	168.8	-4.7	0	0	109.6
66	S	22.2	Very low	27.2	Very low	78 Å²	78	117.7 Å²	117.7	55%	0.545	64%	0.644	S	S	.	*			trans	-116.6	116.1	159.9	60	0	0	0	0	107.9	S64 F68	S64-S66 PolarHBondContact O-N 2.9Å; S66-F68 PolarHBondContact O-N 3.03Å
67	T	20.9	Very low	27.6	Very low	146 Å²	146	120.4 Å²	120.4	90%	0.896	65%	0.654	S	S	*	*			trans	-48.2	99.2	172.3	44.4	0	0	0	0	110.9
68	F	23.7	Very low	29.2	Very low	194 Å²	194	113 Å²	113	85%	0.851	63%	0.629	S	S	*	*			trans	-104.7	131	163.2	-93	-85.4	0	0	0	109.5	S66	S66-F68 PolarHBondContact O-N 3.03Å
69	G	21.6	Very low	31	Very low	68 Å²	68	114 Å²	114	70%	0.701	63%	0.632	S	S	*	*			trans	-65.2	164.2	-156.6	0	0	0	0	0	117	H71	G69-H71 PolarHBondContact O-N 3.47Å
70	T	23.4	Very low	33.3	Very low	151 Å²	151	112.6 Å²	112.6	93%	0.926	62%	0.622	S	S	*	*	S	Bend	trans	-69.5	39.5	-176.5	42.7	0	0	0	0	115
71	H	24.4	Very low	35.8	Very low	179 Å²	179	109.7 Å²	109.7	83%	0.829	61%	0.61	S	S	*	*			trans	-96	94	161.4	-81.5	-53.3	0	0	0	109.3	G69 H73	G69-H71 PolarHBondContact O-N 3.47Å; H71-H73 VanDerWaalsContact C-N 3.31Å; H71-H73 PolarHBondContact O-N 2.86Å
72	G	23.6	Very low	38.8	Very low	76 Å²	76	104.5 Å²	104.5	78%	0.784	58%	0.577	S	S	*	*			trans	-64.5	78.2	-177.2	0	0	0	0	0	114.1
73	H	25.8	Very low	41.9	Very low	152 Å²	152	97.7 Å²	97.7	70%	0.704	54%	0.541	S	S	*	.			trans	-90.2	104.3	153	-78.9	-57.8	0	0	0	108.8	H71 G75	H71-H73 VanDerWaalsContact C-N 3.31Å; H71-H73 PolarHBondContact O-N 2.86Å; H73-G75 PolarHBondContact O-N 3.44Å
74	N	26.9	Very low	45.2	Very low	103 Å²	103	86.5 Å²	86.5	55%	0.551	50%	0.499	S	S	*	.			trans	-30	122.7	174	-73.7	-31	0	0	0	113.3	Y76	N74-Y76 PolarHBondContact O-N 3.02Å
75	G	32.9	Very low	48.5	Very low	72 Å²	72	84.1 Å²	84.1	74%	0.742	48%	0.477	S	S	*	.	S	Bend	trans	-69.2	44.4	-172.7	0	0	0	0	0	116.9	H73	H73-G75 PolarHBondContact O-N 3.44Å
76	Y	38.7	Very low	51.8	Low	126 Å²	126	76.4 Å²	76.4	49%	0.494	44%	0.44	S	S	.	.			trans	-117.4	16.2	175.4	-68.8	-82.9	0	0	0	112.6	I45 I47 N74 T78 F300	I45-Y76 HydrophobicContact CD1-CE2 4.06Å; I47-Y76 HydrophobicContact CD1-CD2 3.56Å; I47-Y76 HydrophobicContact CD1-CE2 3.49Å; I47-Y76 VanDerWaalsContact CD1-CE2 3.49Å; I47-Y76 HydrophobicContact CD1-CG 4.49Å; N74-Y76 PolarHBondContact O-N 3.02Å; Y76-T78 PolarHBondContact O-N 2.89Å; Y76-F300 HydrophobicContact CE1-CZ 4.43Å
77	Q	42.2	Very low	54.9	Low	83 Å²	83	76 Å²	76	39%	0.388	43%	0.431	S	S	.	.			trans	-65.3	102.1	-171.8	-80.7	-172.2	-8.9	0	0	112.8	R120	Q77-R120 HydrophobicContact CB-CG 4.16Å
78	T	63.5	Low	57.8	Low	22 Å²	22	74.8 Å²	74.8	14%	0.135	43%	0.426	C	S	.	.			trans	-29.6	129.2	165.6	58.4	0	0	0	0	114.5	Y52 Y76 R120	Y52-T78 HydrophobicContact CD1-CG2 3.6Å; Y52-T78 HydrophobicContact CD2-CG2 4.34Å; Y52-T78 HydrophobicContact CE1-CG2 4.38Å; Y52-T78 HydrophobicContact CG-CG2 3.58Å; Y76-T78 PolarHBondContact O-N 2.89Å; T78-R120 WeakPolarHBondContact O-CD 3.47Å; T78-R120 PolarHBondContact OG1-NH1 3.37Å
79	R	71.8	Confident	60.7	Low	30 Å²	30	73.3 Å²	73.3	11%	0.113	43%	0.427	C	S	.	.			trans	-59	135.4	162.6	-169.5	-179.3	74.3	-161.4	-10.9	110	D81 S121 R123 H281	R79-D81 IonicContact CZ-OD1 3.71Å; R79-D81 IonicContact CZ-OD2 3.68Å; R79-D81 IonicContact NE-OD1 3.79Å; R79-D81 PolarHBondContact NE-OD1 2.84Å; R79-D81 IonicContact NE-OD2 3.44Å; R79-D81 IonicContact NH2-OD1 3.49Å; R79-D81 PolarHBondContact NH2-OD1 2.79Å; R79-D81 IonicContact NH2-OD2 3.72Å; R79-D81 PolarHBondContact NH2-OD2 3.09Å; R79-S121 CarbonylContact C-O 3.6Å; R79-S121 VanDerWaalsContact CA-O 3.31Å; R79-S121 WeakPolarHBondContact CA-O 3.27Å; R79-S121 WeakPolarHBondContact CA-OG 3.16Å; R79-S121 WeakPolarHBondContact CB-OG 3.37Å; R79-S121 WeakPolarHBondContact CG-OG 3.49Å; R79-R123 HydrophobicContact CG-CB 4.14Å; R79-H281 PolarHBondContact NH2-ND1 2.95Å; R79-H281 VanDerWaalsContact NH2-ND1 3.15Å
80	L	82.9	Confident	63.6	Low	8 Å²	8	72.8 Å²	72.8	4%	0.042	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	124.1	171.8	-63.4	175.4	0	0	0	109.2	W111 W114 A115 T118 R120 S121 V122 R123	L80-W111 HydrophobicContact CB-CH2 3.97Å; L80-W111 HydrophobicContact CB-CZ2 3.82Å; L80-W114 HydrophobicContact CD1-CE3 4.26Å; L80-W114 HydrophobicContact CD1-CH2 4.13Å; L80-W114 HydrophobicContact CD1-CZ3 3.72Å; L80-W114 HydrophobicContact CD2-CH2 3.71Å; L80-W114 HydrophobicContact CD2-CZ3 3.96Å; L80-W114 HydrophobicContact CG-CZ3 4.37Å; L80-A115 HydrophobicContact CD1-CB 3.67Å; L80-T118 HydrophobicContact CD1-CG2 4.26Å; L80-T118 WeakPolarHBondContact CD1-OG1 3.42Å; L80-R120 HydrophobicContact CD1-CB 4.19Å; L80-R120 HydrophobicContact CG-CB 4.05Å; L80-S121 PolarHBondContact N-O 3.41Å; L80-V122 HydrophobicContact CB-CG1 4.37Å; L80-V122 CarbonylContact O-C 3.53Å; L80-V122 WeakPolarHBondContact O-CA 2.97Å; L80-R123 PolarHBondContact O-N 2.92Å
81	D	85.5	Confident	66.4	Low	13 Å²	13	74.4 Å²	74.4	7%	0.07	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	124.9	-177.1	-68	-2.1	0	0	0	110	R79 K99 R123 H281	R79-D81 IonicContact CZ-OD1 3.71Å; R79-D81 IonicContact CZ-OD2 3.68Å; R79-D81 IonicContact NE-OD1 3.79Å; R79-D81 PolarHBondContact NE-OD1 2.84Å; R79-D81 IonicContact NE-OD2 3.44Å; R79-D81 IonicContact NH2-OD1 3.49Å; R79-D81 PolarHBondContact NH2-OD1 2.79Å; R79-D81 IonicContact NH2-OD2 3.72Å; R79-D81 PolarHBondContact NH2-OD2 3.09Å; D81-K99 PolarHBondContact O-N 2.78Å; D81-R123 WeakPolarHBondContact CA-O 3.15Å; D81-R123 WeakPolarHBondContact OD1-CB 3.3Å; D81-H281 IonicContact OD2-CE1 3.22Å; D81-H281 PolarHBondContact OD2-CE1 3.48Å; D81-H281 VanDerWaalsContact OD2-CE1 3.31Å; D81-H281 IonicContact OD2-ND1 3.41Å
82	C	89.9	Confident	69.3	Low	0 Å²	0	70.7 Å²	70.7	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	151.1	171	74.9	0	0	0	0	113.3	R97 W111 R123 I124 N125	C82-R97 CarbonylContact C-O 3.51Å; C82-R97 VanDerWaalsContact CA-O 3.32Å; C82-R97 WeakPolarHBondContact CA-O 3.31Å; C82-R97 WeakPolarHBondContact CB-O 3.32Å; C82-W111 HydrophobicContact CB-CD2 4.17Å; C82-W111 HydrophobicContact CB-CH2 4.08Å; C82-W111 HydrophobicContact CB-CZ2 3.56Å; C82-W111 VanDerWaalsContact SG-CH2 3.53Å; C82-W111 VanDerWaalsContact SG-CZ3 3.54Å; C82-R123 PolarHBondContact N-O 3.05Å; C82-I124 WeakPolarHBondContact SG-CD1 3.46Å; C82-N125 PolarHBondContact O-N 2.95Å
83	D	91.4	Very high	72.5	Confident	13 Å²	13	71 Å²	71	7%	0.07	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	135.6	171.1	-57.3	-17	0	0	0	108.9	S96 R97 N125 Y127	D83-S96 CarbonylContact O-C 3.56Å; D83-S96 VanDerWaalsContact O-CA 3.23Å; D83-S96 WeakPolarHBondContact O-CA 3.48Å; D83-R97 PolarHBondContact N-O 3.48Å; D83-R97 PolarHBondContact O-N 3.19Å; D83-R97 IonicContact OD2-CZ 2.69Å; D83-R97 IonicContact OD2-NE 3.06Å; D83-R97 PolarHBondContact OD2-NE 3.4Å; D83-R97 IonicContact OD2-NH2 3.27Å; D83-R97 PolarHBondContact OD2-NH2 3.37Å; D83-N125 PolarHBondContact OD1-ND2 3.43Å; D83-Y127 HydrophobicContact CB-CE2 3.82Å; D83-Y127 PolarHBondContact OD1-OH 3.21Å
84	V	92.1	Very high	75.8	Confident	1 Å²	1	64 Å²	64	1%	0.006	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	129.7	178.5	169.2	0	0	0	0	111.1	L94 M95 L108 I124 N125 L126 A135	V84-L94 HydrophobicContact CG1-CB 4.43Å; V84-L94 HydrophobicContact CG1-CD1 4.3Å; V84-L94 HydrophobicContact CG1-CD2 3.94Å; V84-L94 HydrophobicContact CG1-CG 4.48Å; V84-M95 WeakPolarHBondContact CA-O 3.48Å; V84-L108 HydrophobicContact CG1-CD2 4Å; V84-L108 HydrophobicContact CG2-CD1 3.69Å; V84-L108 HydrophobicContact CG2-CD2 4.11Å; V84-L108 HydrophobicContact CG2-CG 4.42Å; V84-I124 HydrophobicContact CB-CG2 3.84Å; V84-I124 HydrophobicContact CG2-CD1 4.37Å; V84-I124 HydrophobicContact CG2-CG2 3.43Å; V84-I124 VanDerWaalsContact CG2-CG2 3.43Å; V84-N125 PolarHBondContact N-O 3.3Å; V84-L126 HydrophobicContact CB-CD2 3.8Å; V84-L126 HydrophobicContact CG1-CD2 4.02Å; V84-A135 HydrophobicContact CG1-CB 4.12Å
85	F	91.8	Very high	79	Confident	46 Å²	46	60.1 Å²	60.1	20%	0.202	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	160.8	-173.3	57.9	-82.3	0	0	0	111.9	L87 M95 R97 V105	F85-L87 HydrophobicContact CE2-CD2 4.22Å; F85-M95 HydrophobicContact CD2-CB 4.28Å; F85-M95 HydrophobicContact CE1-CB 4.41Å; F85-M95 HydrophobicContact CE2-CB 3.88Å; F85-M95 HydrophobicContact CZ-CB 3.96Å; F85-M95 PolarHBondContact N-O 3.27Å; F85-M95 VanDerWaalsContact N-O 3.14Å; F85-M95 PolarHBondContact O-N 3.04Å; F85-R97 HydrophobicContact CE1-CB 3.68Å; F85-R97 HydrophobicContact CZ-CB 4.24Å; F85-V105 HydrophobicContact CE2-CG1 4.24Å; F85-V105 HydrophobicContact CZ-CG1 3.64Å; F85-V105 HydrophobicContact CZ-CG2 4.09Å
86	F	91.7	Very high	81.8	Confident	44 Å²	44	56.7 Å²	56.7	19%	0.193	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	149.5	162.3	-71.7	-62.6	0	0	0	110	R91 Q93 L94 V131 P134	F86-R91 HydrophobicContact CB-CG 4.35Å; F86-R91 HydrophobicContact CD1-CB 4.27Å; F86-R91 WeakPolarHBondContact CE1-O 3.24Å; F86-R91 HydrophobicContact CG-CB 4.36Å; F86-R91 HydrophobicContact CG-CG 4.3Å; F86-Q93 WeakPolarHBondContact CD1-O 3.37Å; F86-L94 HydrophobicContact CD1-CD2 3.93Å; F86-L94 HydrophobicContact CD2-CD2 4.37Å; F86-L94 HydrophobicContact CE1-CD2 3.56Å; F86-L94 HydrophobicContact CE1-CG 3.93Å; F86-L94 HydrophobicContact CE2-CD2 4.02Å; F86-L94 HydrophobicContact CG-CD2 4.32Å; F86-L94 HydrophobicContact CZ-CD2 3.6Å; F86-L94 HydrophobicContact CZ-CG 4.2Å; F86-V131 HydrophobicContact CD2-CG1 3.5Å; F86-V131 VanDerWaalsContact CD2-CG1 3.5Å; F86-V131 HydrophobicContact CE2-CB 4.49Å; F86-V131 HydrophobicContact CE2-CG1 3.76Å; F86-V131 HydrophobicContact CG-CG1 4.3Å; F86-P134 HydrophobicContact CZ-CB 4.23Å; F86-P134 HydrophobicContact CZ-CG 4.1Å
87	L	88	Confident	84.2	Confident	68 Å²	68	54.8 Å²	54.8	36%	0.356	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	147.9	167.7	-68.7	169.6	0	0	0	109.1	F85 N89 D90 M95	F85-L87 HydrophobicContact CE2-CD2 4.22Å; L87-N89 PolarHBondContact O-N 3.16Å; L87-D90 HydrophobicContact CB-CB 4.15Å; L87-D90 PolarHBondContact N-O 3.18Å; L87-D90 CarbonylContact O-C 3.56Å; L87-D90 PolarHBondContact O-N 3.19Å; L87-D90 VanDerWaalsContact O-N 3.08Å; L87-M95 HydrophobicContact CD1-CG 4.12Å; L87-M95 HydrophobicContact CD2-CG 4.31Å; L87-M95 HydrophobicContact CG-CG 3.81Å
88	P	82.2	Confident	86.2	Confident	121 Å²	121	52.6 Å²	52.6	79%	0.786	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-33.7	-175.6	-29.6	35.3	0	0	0	114.7
89	N	83.5	Confident	86.6	Confident	164 Å²	164	55.5 Å²	55.5	88%	0.877	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.2	4.5	-177.1	-61.2	-22.4	0	0	0	113.7	L87	L87-N89 PolarHBondContact O-N 3.16Å
90	D	84	Confident	86.4	Confident	57 Å²	57	57.9 Å²	57.9	31%	0.305	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	105.4	179.9	-177.4	8.7	0	0	0	110.6	L87 S92	L87-D90 HydrophobicContact CB-CB 4.15Å; L87-D90 PolarHBondContact N-O 3.18Å; L87-D90 CarbonylContact O-C 3.56Å; L87-D90 PolarHBondContact O-N 3.19Å; L87-D90 VanDerWaalsContact O-N 3.08Å; D90-S92 WeakPolarHBondContact OD1-CA 3.46Å; D90-S92 WeakPolarHBondContact OD1-CB 3.23Å; D90-S92 PolarHBondContact OD1-N 2.86Å; D90-S92 PolarHBondContact OD1-OG 2.85Å; D90-S92 PolarHBondContact OD2-OG 3.43Å
91	R	82.5	Confident	85.9	Confident	184 Å²	184	61.5 Å²	61.5	69%	0.694	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.7	5.8	174.9	-62.9	-172.6	179	-173.9	0.5	113	F86	F86-R91 HydrophobicContact CB-CG 4.35Å; F86-R91 HydrophobicContact CD1-CB 4.27Å; F86-R91 WeakPolarHBondContact CE1-O 3.24Å; F86-R91 HydrophobicContact CG-CB 4.36Å; F86-R91 HydrophobicContact CG-CG 4.3Å
92	S	85.3	Confident	85.1	Confident	101 Å²	101	64.5 Å²	64.5	71%	0.706	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78	-26.6	-179.1	74.5	0	0	0	0	112.4	D90	D90-S92 WeakPolarHBondContact OD1-CA 3.46Å; D90-S92 WeakPolarHBondContact OD1-CB 3.23Å; D90-S92 PolarHBondContact OD1-N 2.86Å; D90-S92 PolarHBondContact OD1-OG 2.85Å; D90-S92 PolarHBondContact OD2-OG 3.43Å
93	Q	90.6	Very high	84.6	Confident	83 Å²	83	72 Å²	72	39%	0.388	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	130.6	-176	-177.1	167.5	82.5	0	0	112	F86 M95 P107	F86-Q93 WeakPolarHBondContact CD1-O 3.37Å; Q93-M95 HydrophobicContact CG-SD 4.14Å; Q93-P107 HydrophobicContact CG-CB 4.33Å
94	L	93.4	Very high	84.2	Confident	5 Å²	5	77.8 Å²	77.8	3%	0.026	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	130.5	168.5	-72.5	173.3	0	0	0	110.4	V84 F86 L108 V131 P134 A135 Y138	V84-L94 HydrophobicContact CG1-CB 4.43Å; V84-L94 HydrophobicContact CG1-CD1 4.3Å; V84-L94 HydrophobicContact CG1-CD2 3.94Å; V84-L94 HydrophobicContact CG1-CG 4.48Å; F86-L94 HydrophobicContact CD1-CD2 3.93Å; F86-L94 HydrophobicContact CD2-CD2 4.37Å; F86-L94 HydrophobicContact CE1-CD2 3.56Å; F86-L94 HydrophobicContact CE1-CG 3.93Å; F86-L94 HydrophobicContact CE2-CD2 4.02Å; F86-L94 HydrophobicContact CG-CD2 4.32Å; F86-L94 HydrophobicContact CZ-CD2 3.6Å; F86-L94 HydrophobicContact CZ-CG 4.2Å; L94-L108 HydrophobicContact CB-CB 3.92Å; L94-L108 HydrophobicContact CB-CD2 4.06Å; L94-L108 HydrophobicContact CD1-CD2 3.69Å; L94-L108 PolarHBondContact O-N 3.08Å; L94-V131 HydrophobicContact CD2-CB 4.17Å; L94-V131 HydrophobicContact CD2-CG1 4.12Å; L94-P134 HydrophobicContact CD1-CB 3.85Å; L94-P134 HydrophobicContact CD2-CB 4.47Å; L94-P134 HydrophobicContact CG-CB 4.3Å; L94-A135 HydrophobicContact CD1-CB 4.02Å; L94-Y138 HydrophobicContact CD1-CD2 3.84Å; L94-Y138 HydrophobicContact CD1-CE2 4.28Å
95	M	94.1	Very high	84.1	Confident	21 Å²	21	80.7 Å²	80.7	10%	0.103	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	157.4	171.8	-56.4	-53	-75.9	0	0	110.1	V84 F85 L87 Q93 V105 P107	V84-M95 WeakPolarHBondContact CA-O 3.48Å; F85-M95 HydrophobicContact CD2-CB 4.28Å; F85-M95 HydrophobicContact CE1-CB 4.41Å; F85-M95 HydrophobicContact CE2-CB 3.88Å; F85-M95 HydrophobicContact CZ-CB 3.96Å; F85-M95 PolarHBondContact N-O 3.27Å; F85-M95 VanDerWaalsContact N-O 3.14Å; F85-M95 PolarHBondContact O-N 3.04Å; L87-M95 HydrophobicContact CD1-CG 4.12Å; L87-M95 HydrophobicContact CD2-CG 4.31Å; L87-M95 HydrophobicContact CG-CG 3.81Å; Q93-M95 HydrophobicContact CG-SD 4.14Å; M95-V105 HydrophobicContact CB-CG1 3.79Å; M95-V105 HydrophobicContact CE-CG1 3.77Å; M95-V105 HydrophobicContact CG-CG1 4.28Å; M95-P107 HydrophobicContact CE-CG 4.18Å; M95-P107 HydrophobicContact SD-CB 4.48Å; M95-P107 HydrophobicContact SD-CG 4.35Å
96	S	92.3	Very high	84.1	Confident	0 Å²	0	80.7 Å²	80.7	0%	0	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	140.5	176	58.8	0	0	0	0	109.6	D83 V105 V106 W111	D83-S96 CarbonylContact O-C 3.56Å; D83-S96 VanDerWaalsContact O-CA 3.23Å; D83-S96 WeakPolarHBondContact O-CA 3.48Å; S96-V105 WeakPolarHBondContact O-CA 3.37Å; S96-V106 PolarHBondContact N-O 3.48Å; S96-V106 PolarHBondContact O-N 3.1Å; S96-V106 WeakPolarHBondContact OG-CG2 3.28Å; S96-V106 PolarHBondContact OG-O 3.39Å; S96-W111 WeakPolarHBondContact OG-CB 3.44Å
97	R	90.1	Very high	84.2	Confident	87 Å²	87	80.3 Å²	80.3	33%	0.328	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	122.2	174.9	177.7	178.9	62.2	-158.8	1.5	108.7	C82 D83 F85 P102 V105	C82-R97 CarbonylContact C-O 3.51Å; C82-R97 VanDerWaalsContact CA-O 3.32Å; C82-R97 WeakPolarHBondContact CA-O 3.31Å; C82-R97 WeakPolarHBondContact CB-O 3.32Å; D83-R97 PolarHBondContact N-O 3.48Å; D83-R97 PolarHBondContact O-N 3.19Å; D83-R97 IonicContact OD2-CZ 2.69Å; D83-R97 IonicContact OD2-NE 3.06Å; D83-R97 PolarHBondContact OD2-NE 3.4Å; D83-R97 IonicContact OD2-NH2 3.27Å; D83-R97 PolarHBondContact OD2-NH2 3.37Å; F85-R97 HydrophobicContact CE1-CB 3.68Å; F85-R97 HydrophobicContact CZ-CB 4.24Å; R97-P102 WeakPolarHBondContact CD-O 3.27Å; R97-P102 WeakPolarHBondContact CG-O 3.13Å; R97-V105 HydrophobicContact CB-CG2 4.33Å; R97-V105 HydrophobicContact CG-CG2 4.41Å
98	E	83.9	Confident	84.4	Confident	37 Å²	37	77.2 Å²	77.2	17%	0.173	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	134.9	177.5	-170	179.3	172.4	0	0	110.2	N100 H101	E98-N100 PolarHBondContact O-N 3.03Å; E98-H101 HydrophobicContact CB-CB 4.42Å; E98-H101 CarbonylContact O-C 3.41Å; E98-H101 PolarHBondContact O-N 3.39Å; E98-H101 IonicContact OE2-CD2 3.88Å; E98-H101 PolarHBondContact OE2-CD2 3.2Å
99	K	71.3	Confident	84.9	Confident	82 Å²	82	77.4 Å²	77.4	36%	0.357	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-31	-175.8	-168.6	166	-176.6	161	0	113.1	D81	D81-K99 PolarHBondContact O-N 2.78Å
100	N	67.9	Low	85.3	Confident	80 Å²	80	74.5 Å²	74.5	43%	0.428	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-13.9	178.2	-63.4	-33.7	0	0	0	113.5	E98	E98-N100 PolarHBondContact O-N 3.03Å
101	H	72.1	Confident	85.8	Confident	85 Å²	85	72.2 Å²	72.2	39%	0.394	36%	0.359	S	S	.	.			trans	-134.1	67.5	-178.3	-63.9	-51.8	0	0	0	110.1	E98 N103 K104	E98-H101 HydrophobicContact CB-CB 4.42Å; E98-H101 CarbonylContact O-C 3.41Å; E98-H101 PolarHBondContact O-N 3.39Å; E98-H101 IonicContact OE2-CD2 3.88Å; E98-H101 PolarHBondContact OE2-CD2 3.2Å; H101-N103 PolarHBondContact O-N 2.92Å; H101-K104 HydrophobicContact CB-CB 4.09Å; H101-K104 HydrophobicContact CB-CD 4Å; H101-K104 HydrophobicContact CB-CG 4.12Å; H101-K104 PolarHBondContact O-N 2.73Å
102	P	70	Confident	86.2	Confident	75 Å²	75	63.5 Å²	63.5	49%	0.487	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-24.1	-172.3	24.5	-34.9	0	0	0	113.5	R97 K104	R97-P102 WeakPolarHBondContact CD-O 3.27Å; R97-P102 WeakPolarHBondContact CG-O 3.13Å; P102-K104 VanDerWaalsContact C-N 3.3Å; P102-K104 PolarHBondContact O-N 2.73Å
103	N	77.8	Confident	86.5	Confident	158 Å²	158	64.4 Å²	64.4	85%	0.845	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-8.5	177.9	-60.6	-15.2	0	0	0	113.2	H101	H101-N103 PolarHBondContact O-N 2.92Å
104	K	82.9	Confident	86.4	Confident	135 Å²	135	65.9 Å²	65.9	59%	0.587	32%	0.319	S	S	*	.			trans	-101.2	98.6	179.6	-65.9	-173	-178.1	177.3	0	109.7	H101 P102	H101-K104 HydrophobicContact CB-CB 4.09Å; H101-K104 HydrophobicContact CB-CD 4Å; H101-K104 HydrophobicContact CB-CG 4.12Å; H101-K104 PolarHBondContact O-N 2.73Å; P102-K104 VanDerWaalsContact C-N 3.3Å; P102-K104 PolarHBondContact O-N 2.73Å
105	V	89.8	Confident	86.2	Confident	62 Å²	62	65.6 Å²	65.6	38%	0.376	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	125.1	173.7	-178.2	0	0	0	0	108.6	F85 M95 S96 R97	F85-V105 HydrophobicContact CE2-CG1 4.24Å; F85-V105 HydrophobicContact CZ-CG1 3.64Å; F85-V105 HydrophobicContact CZ-CG2 4.09Å; M95-V105 HydrophobicContact CB-CG1 3.79Å; M95-V105 HydrophobicContact CE-CG1 3.77Å; M95-V105 HydrophobicContact CG-CG1 4.28Å; S96-V105 WeakPolarHBondContact O-CA 3.37Å; R97-V105 HydrophobicContact CB-CG2 4.33Å; R97-V105 HydrophobicContact CG-CG2 4.41Å
106	V	92.1	Very high	86	Confident	46 Å²	46	65.8 Å²	65.8	28%	0.279	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	154.5	178.7	-62.1	0	0	0	0	110.4	S96 L108 L110 W111	S96-V106 PolarHBondContact N-O 3.48Å; S96-V106 PolarHBondContact O-N 3.1Å; S96-V106 WeakPolarHBondContact OG-CG2 3.28Å; S96-V106 PolarHBondContact OG-O 3.39Å; V106-L108 PolarHBondContact O-N 3.3Å; V106-L110 HydrophobicContact CB-CD2 4.49Å; V106-W111 HydrophobicContact CG2-CB 3.87Å
107	P	93.5	Very high	85.8	Confident	36 Å²	36	71.8 Å²	71.8	23%	0.234	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.7	136.6	174.2	-25.9	35.5	0	0	0	111.3	Q93 M95 K109 L110 W111	Q93-P107 HydrophobicContact CG-CB 4.33Å; M95-P107 HydrophobicContact CE-CG 4.18Å; M95-P107 HydrophobicContact SD-CB 4.48Å; M95-P107 HydrophobicContact SD-CG 4.35Å; P107-K109 PolarHBondContact O-N 3.49Å; P107-K109 VanDerWaalsContact O-N 3.12Å; P107-L110 HydrophobicContact CB-CB 4.47Å; P107-L110 WeakPolarHBondContact O-CA 3.26Å; P107-L110 WeakPolarHBondContact O-CB 3.42Å; P107-L110 PolarHBondContact O-N 3.41Å; P107-W111 PolarHBondContact O-N 2.7Å; P107-W111 VanDerWaalsContact O-N 3.11Å
108	L	94.1	Very high	85.6	Confident	2 Å²	2	69.3 Å²	69.3	1%	0.01	35%	0.349	C	S	.	.	H	α-helix	trans	-54.7	-37.8	-177.8	175.3	59.8	0	0	0	111.9	V84 L94 V106 L110 W111 L112 I124	V84-L108 HydrophobicContact CG1-CD2 4Å; V84-L108 HydrophobicContact CG2-CD1 3.69Å; V84-L108 HydrophobicContact CG2-CD2 4.11Å; V84-L108 HydrophobicContact CG2-CG 4.42Å; L94-L108 HydrophobicContact CB-CB 3.92Å; L94-L108 HydrophobicContact CB-CD2 4.06Å; L94-L108 HydrophobicContact CD1-CD2 3.69Å; L94-L108 PolarHBondContact O-N 3.08Å; V106-L108 PolarHBondContact O-N 3.3Å; L108-L110 VanDerWaalsContact C-N 3.28Å; L108-L110 PolarHBondContact O-N 2.89Å; L108-W111 HydrophobicContact CD1-CE3 4.37Å; L108-W111 PolarHBondContact O-N 2.83Å; L108-L112 HydrophobicContact CD1-CD1 3.98Å; L108-L112 HydrophobicContact CD1-CD2 4.37Å; L108-L112 HydrophobicContact CD1-CG 3.82Å; L108-L112 HydrophobicContact CD2-CD1 4.45Å; L108-L112 HydrophobicContact CG-CD1 3.87Å; L108-L112 HydrophobicContact CG-CG 4.19Å; L108-L112 WeakPolarHBondContact O-CB 3.43Å; L108-L112 WeakPolarHBondContact O-CG 3.35Å; L108-L112 PolarHBondContact O-N 3Å; L108-I124 HydrophobicContact CD1-CD1 4.37Å
109	K	92.3	Very high	85.5	Confident	125 Å²	125	69.6 Å²	69.6	54%	0.543	36%	0.362	S	S	.	.	H	α-helix	trans	-58.4	-39.2	176.2	-175.1	179.9	179.3	-178.2	0	112.7	P107 K113 Y138	P107-K109 PolarHBondContact O-N 3.49Å; P107-K109 VanDerWaalsContact O-N 3.12Å; K109-K113 PolarHBondContact O-N 3.11Å; K109-Y138 HydrophobicContact CB-CE1 4.41Å
110	L	92.3	Very high	86	Confident	103 Å²	103	68.1 Å²	68.1	54%	0.539	35%	0.354	S	S	.	.	H	α-helix	trans	-73.1	-43.2	179.1	-176.7	61.8	0	0	0	110.6	V106 P107 L108 L112 K113 W114	V106-L110 HydrophobicContact CB-CD2 4.49Å; P107-L110 HydrophobicContact CB-CB 4.47Å; P107-L110 WeakPolarHBondContact O-CA 3.26Å; P107-L110 WeakPolarHBondContact O-CB 3.42Å; P107-L110 PolarHBondContact O-N 3.41Å; L108-L110 VanDerWaalsContact C-N 3.28Å; L108-L110 PolarHBondContact O-N 2.89Å; L110-L112 PolarHBondContact O-N 3.17Å; L110-K113 PolarHBondContact O-N 2.98Å; L110-W114 PolarHBondContact O-N 2.84Å
111	W	92.7	Very high	86.8	Confident	10 Å²	10	65.6 Å²	65.6	4%	0.038	34%	0.343	C	S	.	.	H	α-helix	trans	-61.7	-43.3	176.2	-173.2	90.1	0	0	0	112.4	L80 C82 S96 V106 P107 L108 K113 W114 A115 V122 I124	L80-W111 HydrophobicContact CB-CH2 3.97Å; L80-W111 HydrophobicContact CB-CZ2 3.82Å; C82-W111 HydrophobicContact CB-CD2 4.17Å; C82-W111 HydrophobicContact CB-CH2 4.08Å; C82-W111 HydrophobicContact CB-CZ2 3.56Å; C82-W111 VanDerWaalsContact SG-CH2 3.53Å; C82-W111 VanDerWaalsContact SG-CZ3 3.54Å; S96-W111 WeakPolarHBondContact OG-CB 3.44Å; V106-W111 HydrophobicContact CG2-CB 3.87Å; P107-W111 PolarHBondContact O-N 2.7Å; P107-W111 VanDerWaalsContact O-N 3.11Å; L108-W111 HydrophobicContact CD1-CE3 4.37Å; L108-W111 PolarHBondContact O-N 2.83Å; W111-K113 VanDerWaalsContact C-N 3.32Å; W111-K113 PolarHBondContact O-N 2.87Å; W111-W114 AromaticContact NE1-CZ3 3.79Å; W111-W114 PolarHBondContact O-N 2.81Å; W111-A115 HydrophobicContact CE3-CB 4.27Å; W111-A115 HydrophobicContact CH2-CB 4.37Å; W111-A115 HydrophobicContact CZ3-CB 4.1Å; W111-A115 WeakPolarHBondContact O-CB 3.38Å; W111-A115 PolarHBondContact O-N 3.24Å; W111-V122 HydrophobicContact CH2-CB 4.13Å; W111-V122 HydrophobicContact CH2-CG1 4.04Å; W111-V122 HydrophobicContact CZ3-CB 4.29Å; W111-V122 HydrophobicContact CZ3-CG1 4.15Å; W111-I124 HydrophobicContact CE3-CD1 4.29Å; W111-I124 HydrophobicContact CH2-CD1 4.11Å; W111-I124 HydrophobicContact CZ3-CD1 3.59Å
112	L	92.2	Very high	87.6	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-65.5	-34.3	177.3	-72.3	174.1	0	0	0	112.8	L108 L110 A115 A116 L139 L146	L108-L112 HydrophobicContact CD1-CD1 3.98Å; L108-L112 HydrophobicContact CD1-CD2 4.37Å; L108-L112 HydrophobicContact CD1-CG 3.82Å; L108-L112 HydrophobicContact CD2-CD1 4.45Å; L108-L112 HydrophobicContact CG-CD1 3.87Å; L108-L112 HydrophobicContact CG-CG 4.19Å; L108-L112 WeakPolarHBondContact O-CB 3.43Å; L108-L112 WeakPolarHBondContact O-CG 3.35Å; L108-L112 PolarHBondContact O-N 3Å; L110-L112 PolarHBondContact O-N 3.17Å; L112-A115 PolarHBondContact O-N 2.85Å; L112-A116 WeakPolarHBondContact O-CB 3.41Å; L112-A116 PolarHBondContact O-N 3.34Å; L112-L139 HydrophobicContact CD1-CD2 4.13Å; L112-L139 HydrophobicContact CD2-CD2 3.69Å; L112-L146 HydrophobicContact CD2-CD1 4.17Å
113	K	91	Very high	88.5	Confident	120 Å²	120	58.8 Å²	58.8	52%	0.522	30%	0.304	S	S	.	.	H	α-helix	trans	-63.1	-49.9	173.2	-175.4	-177.7	177.8	-175.3	0	110.2	K109 L110 W111 A115 A116 D117	K109-K113 PolarHBondContact O-N 3.11Å; L110-K113 PolarHBondContact O-N 2.98Å; W111-K113 VanDerWaalsContact C-N 3.32Å; W111-K113 PolarHBondContact O-N 2.87Å; K113-A115 VanDerWaalsContact C-N 3.34Å; K113-A115 PolarHBondContact O-N 2.79Å; K113-A116 WeakPolarHBondContact O-CB 3.22Å; K113-A116 PolarHBondContact O-N 2.96Å; K113-D117 PolarHBondContact O-N 3.27Å
114	W	89.5	Confident	89.2	Confident	113 Å²	113	51.3 Å²	51.3	43%	0.428	26%	0.264	S	S	.	.	H	α-helix	trans	-58.7	-44.9	175.6	171.1	75.3	0	0	0	112	L80 L110 W111 A116 D117 T118	L80-W114 HydrophobicContact CD1-CE3 4.26Å; L80-W114 HydrophobicContact CD1-CH2 4.13Å; L80-W114 HydrophobicContact CD1-CZ3 3.72Å; L80-W114 HydrophobicContact CD2-CH2 3.71Å; L80-W114 HydrophobicContact CD2-CZ3 3.96Å; L80-W114 HydrophobicContact CG-CZ3 4.37Å; L110-W114 PolarHBondContact O-N 2.84Å; W111-W114 AromaticContact NE1-CZ3 3.79Å; W111-W114 PolarHBondContact O-N 2.81Å; W114-A116 VanDerWaalsContact C-N 3.34Å; W114-A116 PolarHBondContact O-N 2.87Å; W114-D117 PolarHBondContact O-N 2.82Å; W114-T118 HydrophobicContact CZ2-CG2 4.39Å; W114-T118 WeakPolarHBondContact O-CG2 2.89Å; W114-T118 PolarHBondContact O-N 3.38Å
115	A	88.8	Confident	89.7	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.4	-41.4	178.9	0	0	0	0	0	112.2	L80 W111 L112 K113 D117 T118 V122 L146	L80-A115 HydrophobicContact CD1-CB 3.67Å; W111-A115 HydrophobicContact CE3-CB 4.27Å; W111-A115 HydrophobicContact CH2-CB 4.37Å; W111-A115 HydrophobicContact CZ3-CB 4.1Å; W111-A115 WeakPolarHBondContact O-CB 3.38Å; W111-A115 PolarHBondContact O-N 3.24Å; L112-A115 PolarHBondContact O-N 2.85Å; K113-A115 VanDerWaalsContact C-N 3.34Å; K113-A115 PolarHBondContact O-N 2.79Å; A115-D117 VanDerWaalsContact C-N 3.32Å; A115-D117 PolarHBondContact O-N 2.82Å; A115-T118 PolarHBondContact O-N 2.99Å; A115-T118 VanDerWaalsContact O-N 3.12Å; A115-T118 PolarHBondContact O-OG1 3.37Å; A115-V122 HydrophobicContact CB-CG1 3.75Å; A115-L146 HydrophobicContact CB-CD2 4.33Å
116	A	88.9	Confident	89.9	Confident	24 Å²	24	42.3 Å²	42.3	20%	0.198	22%	0.22	C	C	.	.	H	α-helix	trans	-59.8	-40.5	175.4	0	0	0	0	0	112.5	L112 K113 W114 T118 G119 H145 L146	L112-A116 WeakPolarHBondContact O-CB 3.41Å; L112-A116 PolarHBondContact O-N 3.34Å; K113-A116 WeakPolarHBondContact O-CB 3.22Å; K113-A116 PolarHBondContact O-N 2.96Å; W114-A116 VanDerWaalsContact C-N 3.34Å; W114-A116 PolarHBondContact O-N 2.87Å; A116-T118 PolarHBondContact O-N 2.75Å; A116-G119 PolarHBondContact O-N 2.98Å; A116-H145 WeakPolarHBondContact CA-O 3.34Å; A116-H145 HydrophobicContact CB-CB 3.85Å; A116-H145 WeakPolarHBondContact CB-O 3.25Å; A116-L146 HydrophobicContact CB-CD2 4.18Å
117	D	88.3	Confident	89.8	Confident	126 Å²	126	45.3 Å²	45.3	67%	0.674	23%	0.227	S	C	*	.	H	α-helix	trans	-65.1	-20.5	178.3	-62.1	-25.3	0	0	0	112.5	K113 W114 A115	K113-D117 PolarHBondContact O-N 3.27Å; W114-D117 PolarHBondContact O-N 2.82Å; A115-D117 VanDerWaalsContact C-N 3.32Å; A115-D117 PolarHBondContact O-N 2.82Å
118	T	86	Confident	89.7	Confident	35 Å²	35	46.3 Å²	46.3	22%	0.215	23%	0.23	C	C	.	.	H	α-helix	trans	-83.8	-18.2	178.2	73	0	0	0	0	114.6	L80 W114 A115 A116 R120	L80-T118 HydrophobicContact CD1-CG2 4.26Å; L80-T118 WeakPolarHBondContact CD1-OG1 3.42Å; W114-T118 HydrophobicContact CZ2-CG2 4.39Å; W114-T118 WeakPolarHBondContact O-CG2 2.89Å; W114-T118 PolarHBondContact O-N 3.38Å; A115-T118 PolarHBondContact O-N 2.99Å; A115-T118 VanDerWaalsContact O-N 3.12Å; A115-T118 PolarHBondContact O-OG1 3.37Å; A116-T118 PolarHBondContact O-N 2.75Å; T118-R120 PolarHBondContact O-N 3Å; T118-R120 WeakPolarHBondContact OG1-CB 3.16Å; T118-R120 VanDerWaalsContact OG1-CG 3.31Å; T118-R120 WeakPolarHBondContact OG1-CG 3.2Å; T118-R120 PolarHBondContact OG1-N 2.64Å
119	G	82.2	Confident	89.6	Confident	43 Å²	43	47.5 Å²	47.5	44%	0.443	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	3	-171.2	0	0	0	0	0	115.3	A116 S147	A116-G119 PolarHBondContact O-N 2.98Å; G119-S147 WeakPolarHBondContact O-CB 3.27Å; G119-S147 PolarHBondContact O-OG 2.93Å
120	R	81.6	Confident	89.6	Confident	52 Å²	52	46 Å²	46	20%	0.196	24%	0.237	C	C	.	.			trans	-80.1	156.3	-174.9	-60.4	179.6	-178.8	-169.4	2.7	112.2	Q77 T78 L80 T118 S147	Q77-R120 HydrophobicContact CB-CG 4.16Å; T78-R120 WeakPolarHBondContact O-CD 3.47Å; T78-R120 PolarHBondContact OG1-NH1 3.37Å; L80-R120 HydrophobicContact CD1-CB 4.19Å; L80-R120 HydrophobicContact CG-CB 4.05Å; T118-R120 PolarHBondContact O-N 3Å; T118-R120 WeakPolarHBondContact OG1-CB 3.16Å; T118-R120 VanDerWaalsContact OG1-CG 3.31Å; T118-R120 WeakPolarHBondContact OG1-CG 3.2Å; T118-R120 PolarHBondContact OG1-N 2.64Å; R120-S147 PolarHBondContact O-OG 2.62Å; R120-S147 VanDerWaalsContact O-OG 3.07Å
121	S	84.3	Confident	89.7	Confident	27 Å²	27	41.4 Å²	41.4	19%	0.189	21%	0.213	C	C	.	.			trans	-67.8	149.7	169.7	59.9	0	0	0	0	110.1	R79 L80 S147 Q148	R79-S121 CarbonylContact C-O 3.6Å; R79-S121 VanDerWaalsContact CA-O 3.31Å; R79-S121 WeakPolarHBondContact CA-O 3.27Å; R79-S121 WeakPolarHBondContact CA-OG 3.16Å; R79-S121 WeakPolarHBondContact CB-OG 3.37Å; R79-S121 WeakPolarHBondContact CG-OG 3.49Å; L80-S121 PolarHBondContact N-O 3.41Å; S121-S147 PolarHBondContact N-OG 3.02Å; S121-Q148 WeakPolarHBondContact CA-O 3.38Å
122	V	88.7	Confident	89.8	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	141.1	-179.3	-61.3	0	0	0	0	110.9	L80 W111 A115 L146 Q148 I149 T150	L80-V122 HydrophobicContact CB-CG1 4.37Å; L80-V122 CarbonylContact O-C 3.53Å; L80-V122 WeakPolarHBondContact O-CA 2.97Å; W111-V122 HydrophobicContact CH2-CB 4.13Å; W111-V122 HydrophobicContact CH2-CG1 4.04Å; W111-V122 HydrophobicContact CZ3-CB 4.29Å; W111-V122 HydrophobicContact CZ3-CG1 4.15Å; A115-V122 HydrophobicContact CB-CG1 3.75Å; V122-L146 HydrophobicContact CG1-CD2 3.99Å; V122-L146 HydrophobicContact CG2-CD1 4.17Å; V122-L146 HydrophobicContact CG2-CD2 4.39Å; V122-Q148 PolarHBondContact N-O 2.91Å; V122-I149 HydrophobicContact CG2-CB 4.27Å; V122-I149 HydrophobicContact CG2-CG1 3.92Å; V122-I149 HydrophobicContact CG2-CG2 4.24Å; V122-T150 PolarHBondContact O-N 2.87Å
123	R	89.7	Confident	90	Very high	16 Å²	16	44.7 Å²	44.7	6%	0.06	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	127.4	165.1	176.1	179.9	173.8	167.6	6.9	109.6	R79 L80 D81 C82 N125 T150 H152	R79-R123 HydrophobicContact CG-CB 4.14Å; L80-R123 PolarHBondContact O-N 2.92Å; D81-R123 WeakPolarHBondContact CA-O 3.15Å; D81-R123 WeakPolarHBondContact OD1-CB 3.3Å; C82-R123 PolarHBondContact N-O 3.05Å; R123-N125 PolarHBondContact NE-OD1 2.81Å; R123-T150 CarbonylContact C-O 3.54Å; R123-T150 VanDerWaalsContact CA-O 3.24Å; R123-T150 WeakPolarHBondContact CA-O 2.96Å; R123-T150 HydrophobicContact CG-CG2 4.31Å; R123-H152 HydrophobicContact CG-CB 4.01Å; R123-H152 PolarHBondContact NH2-CD2 3.45Å; R123-H152 PolarHBondContact NH2-CE1 2.94Å; R123-H152 PolarHBondContact NH2-ND1 3.13Å; R123-H152 PolarHBondContact NH2-NE2 3.31Å
124	I	93	Very high	90.2	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	123.2	174	-57	-58.1	0	0	0	108.4	C82 V84 L108 W111 L126 L139 T150 H152	C82-I124 WeakPolarHBondContact SG-CD1 3.46Å; V84-I124 HydrophobicContact CB-CG2 3.84Å; V84-I124 HydrophobicContact CG2-CD1 4.37Å; V84-I124 HydrophobicContact CG2-CG2 3.43Å; V84-I124 VanDerWaalsContact CG2-CG2 3.43Å; L108-I124 HydrophobicContact CD1-CD1 4.37Å; W111-I124 HydrophobicContact CE3-CD1 4.29Å; W111-I124 HydrophobicContact CH2-CD1 4.11Å; W111-I124 HydrophobicContact CZ3-CD1 3.59Å; I124-L126 HydrophobicContact CG2-CD2 3.67Å; I124-L126 HydrophobicContact CG2-CG 4.21Å; I124-L139 HydrophobicContact CD1-CD2 4.45Å; I124-L139 HydrophobicContact CG1-CD1 3.99Å; I124-L139 HydrophobicContact CG1-CD2 3.92Å; I124-L139 HydrophobicContact CG1-CG 4.5Å; I124-T150 PolarHBondContact N-O 3.35Å; I124-H152 PolarHBondContact O-N 3.49Å
125	N	92.5	Very high	90.5	Very high	5 Å²	5	35.8 Å²	35.8	3%	0.027	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	124.6	173.4	-53.3	-43.9	0	0	0	109.6	C82 D83 V84 R123 Y127 H152	C82-N125 PolarHBondContact O-N 2.95Å; D83-N125 PolarHBondContact OD1-ND2 3.43Å; V84-N125 PolarHBondContact N-O 3.3Å; R123-N125 PolarHBondContact NE-OD1 2.81Å; N125-Y127 HydrophobicContact CB-CE2 3.91Å; N125-H152 CarbonylContact C-O 3.03Å; N125-H152 WeakPolarHBondContact CA-O 3.31Å; N125-H152 PolarHBondContact OD1-CD2 3.33Å
126	L	94.5	Very high	90.9	Very high	3 Å²	3	35.8 Å²	35.8	2%	0.016	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	132.7	179.4	-56.1	-178.9	0	0	0	109.7	V84 I124 V131 V132 A135 V151 H152 A153 M166 F171	V84-L126 HydrophobicContact CB-CD2 3.8Å; V84-L126 HydrophobicContact CG1-CD2 4.02Å; I124-L126 HydrophobicContact CG2-CD2 3.67Å; I124-L126 HydrophobicContact CG2-CG 4.21Å; L126-V131 HydrophobicContact CB-CG2 4.24Å; L126-V131 HydrophobicContact CD2-CG2 3.93Å; L126-V132 HydrophobicContact CD1-CB 4.43Å; L126-V132 HydrophobicContact CD1-CG2 4.05Å; L126-A135 HydrophobicContact CD2-CB 4Å; L126-V151 HydrophobicContact CD1-CG1 3.69Å; L126-V151 HydrophobicContact CG-CG1 4.31Å; L126-H152 PolarHBondContact N-O 3.04Å; L126-A153 HydrophobicContact CB-CB 4.49Å; L126-A153 WeakPolarHBondContact O-CB 3.36Å; L126-M166 VanDerWaalsContact C-CE 3.47Å; L126-M166 HydrophobicContact CB-CE 3.62Å; L126-M166 VanDerWaalsContact O-CE 3.28Å; L126-M166 WeakPolarHBondContact O-CE 3.34Å; L126-F171 HydrophobicContact CD1-CE2 4.15Å
127	Y	89.6	Confident	91.2	Very high	110 Å²	110	39.7 Å²	39.7	43%	0.431	21%	0.214	S	C	.	.			trans	-114.4	-7.9	-175.6	-61.8	-83.8	0	0	0	113.6	D83 N125 S165	D83-Y127 HydrophobicContact CB-CE2 3.82Å; D83-Y127 PolarHBondContact OD1-OH 3.21Å; N125-Y127 HydrophobicContact CB-CE2 3.91Å; Y127-S165 PolarHBondContact O-OG 2.97Å
128	N	90.7	Very high	91.4	Very high	56 Å²	56	38 Å²	38	30%	0.299	20%	0.199	S	C	.	.	B	Isolated β-bridge	trans	-142.7	140.2	-177.1	-169.3	-48.8	0	0	0	111.7	N130 V131 S165 M166	N128-N130 PolarHBondContact O-N 2.76Å; N128-N130 WeakPolarHBondContact OD1-CB 3.43Å; N128-N130 PolarHBondContact OD1-N 2.68Å; N128-N130 PolarHBondContact OD1-ND2 3Å; N128-V131 HydrophobicContact CB-CG2 4.42Å; N128-V131 WeakPolarHBondContact O-CG2 3.32Å; N128-V131 PolarHBondContact O-N 3.1Å; N128-S165 WeakPolarHBondContact CA-OG 3.27Å; N128-S165 PolarHBondContact ND2-OG 2.68Å; N128-S165 VanDerWaalsContact ND2-OG 3.14Å; N128-M166 VanDerWaalsContact N-CE 3.33Å
129	S	93.1	Very high	91.8	Very high	27 Å²	27	36.4 Å²	36.4	19%	0.189	19%	0.189	C	C	.	.	H	α-helix	trans	-56.4	-34.1	176.7	-59.7	0	0	0	0	113.3	V131 V132 S165 M166 E167	S129-V131 PolarHBondContact O-N 3.15Å; S129-V132 WeakPolarHBondContact O-CB 3.4Å; S129-V132 WeakPolarHBondContact O-CG2 3.44Å; S129-V132 PolarHBondContact O-N 2.82Å; S129-S165 PolarHBondContact OG-O 3.38Å; S129-M166 WeakPolarHBondContact OG-CA 3.4Å; S129-E167 PolarHBondContact OG-N 3.08Å
130	N	92.3	Very high	92.3	Very high	95 Å²	95	37.3 Å²	37.3	51%	0.508	18%	0.181	S	C	.	.	H	α-helix	trans	-66.5	-21.5	-178	-65.5	-32.2	0	0	0	113.8	N128	N128-N130 PolarHBondContact O-N 2.76Å; N128-N130 WeakPolarHBondContact OD1-CB 3.43Å; N128-N130 PolarHBondContact OD1-N 2.68Å; N128-N130 PolarHBondContact OD1-ND2 3Å
131	V	93.8	Very high	92.8	Very high	6 Å²	6	38.8 Å²	38.8	4%	0.036	20%	0.199	C	C	.	.	H	α-helix	trans	-90.4	-14.2	178.6	-61	0	0	0	0	112.9	F86 L94 L126 N128 S129 A135	F86-V131 HydrophobicContact CD2-CG1 3.5Å; F86-V131 VanDerWaalsContact CD2-CG1 3.5Å; F86-V131 HydrophobicContact CE2-CB 4.49Å; F86-V131 HydrophobicContact CE2-CG1 3.76Å; F86-V131 HydrophobicContact CG-CG1 4.3Å; L94-V131 HydrophobicContact CD2-CB 4.17Å; L94-V131 HydrophobicContact CD2-CG1 4.12Å; L126-V131 HydrophobicContact CB-CG2 4.24Å; L126-V131 HydrophobicContact CD2-CG2 3.93Å; N128-V131 HydrophobicContact CB-CG2 4.42Å; N128-V131 WeakPolarHBondContact O-CG2 3.32Å; N128-V131 PolarHBondContact O-N 3.1Å; S129-V131 PolarHBondContact O-N 3.15Å; V131-A135 WeakPolarHBondContact O-CB 3.49Å; V131-A135 PolarHBondContact O-N 2.9Å
132	V	95.5	Very high	93.1	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.006	21%	0.205	C	C	.	.	H	α-helix	trans	-61.1	-62.8	-171.9	176.8	0	0	0	0	111.4	L126 S129 A135 L136 M166 F171	L126-V132 HydrophobicContact CD1-CB 4.43Å; L126-V132 HydrophobicContact CD1-CG2 4.05Å; S129-V132 WeakPolarHBondContact O-CB 3.4Å; S129-V132 WeakPolarHBondContact O-CG2 3.44Å; S129-V132 PolarHBondContact O-N 2.82Å; V132-A135 PolarHBondContact O-N 2.9Å; V132-L136 HydrophobicContact CG1-CD1 3.64Å; V132-L136 HydrophobicContact CG1-CG 4.3Å; V132-L136 WeakPolarHBondContact O-CB 3.37Å; V132-L136 VanDerWaalsContact O-CG 3.23Å; V132-L136 WeakPolarHBondContact O-CG 3.2Å; V132-L136 PolarHBondContact O-N 3.38Å; V132-M166 HydrophobicContact CG2-CE 3.96Å; V132-M166 HydrophobicContact CG2-SD 3.61Å; V132-F171 HydrophobicContact CG1-CD2 4.3Å; V132-F171 HydrophobicContact CG2-CD2 4.19Å
133	I	96.1	Very high	93.1	Very high	79 Å²	79	46.5 Å²	46.5	41%	0.405	22%	0.224	S	C	.	.	H	α-helix	trans	-59.5	-48.7	-176.2	-66.8	169.1	0	0	0	111.6	A135 L136 H137 L178	I133-A135 PolarHBondContact O-N 3.01Å; I133-L136 PolarHBondContact O-N 3.05Å; I133-H137 PolarHBondContact O-CD2 2.88Å; I133-H137 VanDerWaalsContact O-CD2 3.28Å; I133-H137 PolarHBondContact O-N 3.1Å; I133-H137 VanDerWaalsContact O-N 3.09Å; I133-L178 HydrophobicContact CB-CD1 4.39Å; I133-L178 HydrophobicContact CG1-CD1 4.18Å; I133-L178 HydrophobicContact CG2-CD1 4.07Å
134	P	94.8	Very high	93	Very high	44 Å²	44	53.9 Å²	53.9	29%	0.286	26%	0.257	S	S	.	.	H	α-helix	trans	-57.1	-45	175.9	-28.4	37.8	0	0	0	113.3	F86 L94 H137 Y138	F86-P134 HydrophobicContact CZ-CB 4.23Å; F86-P134 HydrophobicContact CZ-CG 4.1Å; L94-P134 HydrophobicContact CD1-CB 3.85Å; L94-P134 HydrophobicContact CD2-CB 4.47Å; L94-P134 HydrophobicContact CG-CB 4.3Å; P134-H137 PolarHBondContact O-N 3.05Å; P134-Y138 WeakPolarHBondContact O-CD2 3.46Å; P134-Y138 PolarHBondContact O-N 3.13Å
135	A	95.9	Very high	92.8	Very high	1 Å²	1	59.1 Å²	59.1	1%	0.008	28%	0.281	C	S	.	.	H	α-helix	trans	-65.3	-42.1	-178.9	0	0	0	0	0	111.6	V84 L94 L126 V131 V132 I133 Y138 L139	V84-A135 HydrophobicContact CG1-CB 4.12Å; L94-A135 HydrophobicContact CD1-CB 4.02Å; L126-A135 HydrophobicContact CD2-CB 4Å; V131-A135 WeakPolarHBondContact O-CB 3.49Å; V131-A135 PolarHBondContact O-N 2.9Å; V132-A135 PolarHBondContact O-N 2.9Å; I133-A135 PolarHBondContact O-N 3.01Å; A135-Y138 PolarHBondContact O-N 3.44Å; A135-L139 VanDerWaalsContact O-CG 3.32Å; A135-L139 WeakPolarHBondContact O-CG 3.47Å; A135-L139 PolarHBondContact O-N 2.65Å
136	L	96.8	Very high	92.6	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-62.6	-42.4	178.4	-68.4	174.8	0	0	0	112.1	V132 I133 Y138 L139 E140 V151 S174 T175 L178 L179	V132-L136 HydrophobicContact CG1-CD1 3.64Å; V132-L136 HydrophobicContact CG1-CG 4.3Å; V132-L136 WeakPolarHBondContact O-CB 3.37Å; V132-L136 VanDerWaalsContact O-CG 3.23Å; V132-L136 WeakPolarHBondContact O-CG 3.2Å; V132-L136 PolarHBondContact O-N 3.38Å; I133-L136 PolarHBondContact O-N 3.05Å; L136-Y138 VanDerWaalsContact C-N 3.35Å; L136-Y138 PolarHBondContact O-N 2.85Å; L136-L139 PolarHBondContact O-N 2.92Å; L136-E140 WeakPolarHBondContact O-CB 3.23Å; L136-E140 PolarHBondContact O-N 2.8Å; L136-V151 HydrophobicContact CD2-CG1 4.31Å; L136-V151 HydrophobicContact CD2-CG2 3.95Å; L136-S174 WeakPolarHBondContact CD1-O 3.44Å; L136-T175 HydrophobicContact CD2-CG2 4.24Å; L136-L178 HydrophobicContact CB-CB 4.08Å; L136-L178 HydrophobicContact CB-CD1 4.19Å; L136-L178 HydrophobicContact CD1-CB 4.27Å; L136-L178 HydrophobicContact CD1-CD1 4.13Å; L136-L179 HydrophobicContact CD2-CB 4.02Å; L136-L179 HydrophobicContact CD2-CD2 3.93Å
137	H	95	Very high	92.1	Very high	106 Å²	106	63.2 Å²	63.2	49%	0.491	31%	0.309	S	S	.	.	H	α-helix	trans	-61.2	-41.6	174.8	-77.3	-54.9	0	0	0	112.7	I133 P134 S141	I133-H137 PolarHBondContact O-CD2 2.88Å; I133-H137 VanDerWaalsContact O-CD2 3.28Å; I133-H137 PolarHBondContact O-N 3.1Å; I133-H137 VanDerWaalsContact O-N 3.09Å; P134-H137 PolarHBondContact O-N 3.05Å; H137-S141 PolarHBondContact O-N 3.02Å; H137-S141 VanDerWaalsContact O-N 3.12Å
138	Y	92.6	Very high	92	Very high	92 Å²	92	60.7 Å²	60.7	36%	0.361	30%	0.301	S	S	.	.	H	α-helix	trans	-63.2	-43.5	175.3	-88.8	-71.4	0	0	0	112	L94 K109 P134 A135 L136 S141 R142	L94-Y138 HydrophobicContact CD1-CD2 3.84Å; L94-Y138 HydrophobicContact CD1-CE2 4.28Å; K109-Y138 HydrophobicContact CB-CE1 4.41Å; P134-Y138 WeakPolarHBondContact O-CD2 3.46Å; P134-Y138 PolarHBondContact O-N 3.13Å; A135-Y138 PolarHBondContact O-N 3.44Å; L136-Y138 VanDerWaalsContact C-N 3.35Å; L136-Y138 PolarHBondContact O-N 2.85Å; Y138-S141 PolarHBondContact O-N 3.11Å; Y138-S141 PolarHBondContact O-OG 3.03Å; Y138-R142 PolarHBondContact O-N 2.87Å
139	L	94.7	Very high	92	Very high	1 Å²	1	58.3 Å²	58.3	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-64.6	-45.7	178.2	-71.5	167.5	0	0	0	112.1	L112 I124 A135 L136 S141 R142 R143 L146 I149 V151 L179	L112-L139 HydrophobicContact CD1-CD2 4.13Å; L112-L139 HydrophobicContact CD2-CD2 3.69Å; I124-L139 HydrophobicContact CD1-CD2 4.45Å; I124-L139 HydrophobicContact CG1-CD1 3.99Å; I124-L139 HydrophobicContact CG1-CD2 3.92Å; I124-L139 HydrophobicContact CG1-CG 4.5Å; A135-L139 VanDerWaalsContact O-CG 3.32Å; A135-L139 WeakPolarHBondContact O-CG 3.47Å; A135-L139 PolarHBondContact O-N 2.65Å; L136-L139 PolarHBondContact O-N 2.92Å; L139-S141 VanDerWaalsContact C-N 3.29Å; L139-S141 PolarHBondContact O-N 2.96Å; L139-R142 CarbonylContact O-C 3.48Å; L139-R142 PolarHBondContact O-N 2.86Å; L139-R143 PolarHBondContact O-N 2.67Å; L139-L146 HydrophobicContact CD2-CD1 4.43Å; L139-I149 HydrophobicContact CB-CD1 4.5Å; L139-I149 HydrophobicContact CD1-CG2 4.26Å; L139-I149 HydrophobicContact CD2-CG2 4.23Å; L139-V151 HydrophobicContact CD1-CG2 4.15Å; L139-L179 HydrophobicContact CB-CD2 3.76Å; L139-L179 HydrophobicContact CD1-CD2 4.04Å
140	E	94	Very high	92	Very high	62 Å²	62	57.1 Å²	57.1	29%	0.29	28%	0.28	S	S	.	.	H	α-helix	trans	-59	-41.9	178.1	-179.5	56.1	-150.3	0	0	111.1	L136 R142 R143 L179	L136-E140 WeakPolarHBondContact O-CB 3.23Å; L136-E140 PolarHBondContact O-N 2.8Å; E140-R142 PolarHBondContact O-N 2.83Å; E140-R142 VanDerWaalsContact O-N 3.11Å; E140-R143 WeakPolarHBondContact O-CG 3.36Å; E140-R143 PolarHBondContact O-N 2.95Å; E140-R143 VanDerWaalsContact OE1-CD 3.23Å; E140-R143 WeakPolarHBondContact OE1-CD 3.44Å; E140-R143 IonicContact OE1-CZ 2.73Å; E140-R143 IonicContact OE1-NE 3.24Å; E140-R143 PolarHBondContact OE1-NE 3.45Å; E140-R143 VanDerWaalsContact OE2-CD 3.31Å; E140-R143 WeakPolarHBondContact OE2-CD 3.29Å; E140-R143 IonicContact OE2-NE 3.57Å; E140-L179 HydrophobicContact CB-CD1 4.14Å; E140-L179 WeakPolarHBondContact OE2-CD1 3.46Å
141	S	91.4	Very high	92.1	Very high	82 Å²	82	52.6 Å²	52.6	57%	0.573	26%	0.256	S	S	*	.	H	α-helix	trans	-62.2	-21	177.1	79.4	0	0	0	0	114.2	H137 Y138 L139	H137-S141 PolarHBondContact O-N 3.02Å; H137-S141 VanDerWaalsContact O-N 3.12Å; Y138-S141 PolarHBondContact O-N 3.11Å; Y138-S141 PolarHBondContact O-OG 3.03Å; L139-S141 VanDerWaalsContact C-N 3.29Å; L139-S141 PolarHBondContact O-N 2.96Å
142	R	89.5	Confident	92.2	Very high	84 Å²	84	52.9 Å²	52.9	32%	0.317	26%	0.257	S	S	.	.	H	α-helix	trans	-113.2	-0.3	-176.7	-67.5	-64.8	-177.9	168.9	-3.8	113.8	Y138 L139 E140 K144 H145 L146	Y138-R142 PolarHBondContact O-N 2.87Å; L139-R142 CarbonylContact O-C 3.48Å; L139-R142 PolarHBondContact O-N 2.86Å; E140-R142 PolarHBondContact O-N 2.83Å; E140-R142 VanDerWaalsContact O-N 3.11Å; R142-K144 PolarHBondContact O-N 2.79Å; R142-H145 PolarHBondContact O-N 2.82Å; R142-L146 HydrophobicContact CB-CD1 4.25Å
143	R	89.2	Confident	92.1	Very high	106 Å²	106	52.8 Å²	52.8	40%	0.4	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-54.7	-34.7	-170.9	74	178.6	172.4	86.7	-3	114.7	L139 E140 H145 L146 I149	L139-R143 PolarHBondContact O-N 2.67Å; E140-R143 WeakPolarHBondContact O-CG 3.36Å; E140-R143 PolarHBondContact O-N 2.95Å; E140-R143 VanDerWaalsContact OE1-CD 3.23Å; E140-R143 WeakPolarHBondContact OE1-CD 3.44Å; E140-R143 IonicContact OE1-CZ 2.73Å; E140-R143 IonicContact OE1-NE 3.24Å; E140-R143 PolarHBondContact OE1-NE 3.45Å; E140-R143 VanDerWaalsContact OE2-CD 3.31Å; E140-R143 WeakPolarHBondContact OE2-CD 3.29Å; E140-R143 IonicContact OE2-NE 3.57Å; R143-H145 PolarHBondContact O-N 2.89Å; R143-L146 PolarHBondContact O-N 2.75Å; R143-L146 VanDerWaalsContact O-O 3.11Å; R143-I149 HydrophobicContact CB-CD1 4.11Å
144	K	88.4	Confident	92	Very high	170 Å²	170	51 Å²	51	74%	0.739	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-67.5	-17.3	-178.9	-65.5	-175	-179.8	179.5	0	113.1	R142	R142-K144 PolarHBondContact O-N 2.79Å
145	H	88.8	Confident	91.9	Very high	112 Å²	112	49.4 Å²	49.4	52%	0.519	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-104.6	-0.7	-178.9	-53.6	-68.7	0	0	0	112.8	A116 R142 R143	A116-H145 WeakPolarHBondContact CA-O 3.34Å; A116-H145 HydrophobicContact CB-CB 3.85Å; A116-H145 WeakPolarHBondContact CB-O 3.25Å; R142-H145 PolarHBondContact O-N 2.82Å; R143-H145 PolarHBondContact O-N 2.89Å
146	L	87.3	Confident	91.8	Very high	15 Å²	15	50.1 Å²	50.1	8%	0.079	24%	0.24	C	C	.	.			trans	-113.5	132.4	-179.5	-62.9	169.4	0	0	0	108.2	L112 A115 A116 V122 L139 R142 R143 I149	L112-L146 HydrophobicContact CD2-CD1 4.17Å; A115-L146 HydrophobicContact CB-CD2 4.33Å; A116-L146 HydrophobicContact CB-CD2 4.18Å; V122-L146 HydrophobicContact CG1-CD2 3.99Å; V122-L146 HydrophobicContact CG2-CD1 4.17Å; V122-L146 HydrophobicContact CG2-CD2 4.39Å; L139-L146 HydrophobicContact CD2-CD1 4.43Å; R142-L146 HydrophobicContact CB-CD1 4.25Å; R143-L146 PolarHBondContact O-N 2.75Å; R143-L146 VanDerWaalsContact O-O 3.11Å; L146-I149 HydrophobicContact CB-CD1 4.31Å; L146-I149 HydrophobicContact CB-CG1 4.04Å; L146-I149 HydrophobicContact CD1-CD1 3.81Å; L146-I149 HydrophobicContact CD1-CG1 3.99Å
147	S	83.6	Confident	91.3	Very high	78 Å²	78	56.1 Å²	56.1	55%	0.545	26%	0.262	S	S	.	.	S	Bend	trans	-70	-39.6	-174.9	52.1	0	0	0	0	112.9	G119 R120 S121	G119-S147 WeakPolarHBondContact O-CB 3.27Å; G119-S147 PolarHBondContact O-OG 2.93Å; R120-S147 PolarHBondContact O-OG 2.62Å; R120-S147 VanDerWaalsContact O-OG 3.07Å; S121-S147 PolarHBondContact N-OG 3.02Å
148	Q	87.7	Confident	90.5	Very high	57 Å²	57	51.7 Å²	51.7	27%	0.266	24%	0.243	S	C	.	.			trans	-157.1	139.8	173.2	-174.4	176.8	-60.7	0	0	110	S121 V122 I183	S121-Q148 WeakPolarHBondContact CA-O 3.38Å; V122-Q148 PolarHBondContact N-O 2.91Å; Q148-I183 HydrophobicContact CG-CD1 4.27Å
149	I	92	Very high	89.9	Confident	7 Å²	7	54.6 Å²	54.6	4%	0.036	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	128.6	180	-55.3	171.1	0	0	0	109.1	V122 L139 R143 L146 V151 L179 A182 I183	V122-I149 HydrophobicContact CG2-CB 4.27Å; V122-I149 HydrophobicContact CG2-CG1 3.92Å; V122-I149 HydrophobicContact CG2-CG2 4.24Å; L139-I149 HydrophobicContact CB-CD1 4.5Å; L139-I149 HydrophobicContact CD1-CG2 4.26Å; L139-I149 HydrophobicContact CD2-CG2 4.23Å; R143-I149 HydrophobicContact CB-CD1 4.11Å; L146-I149 HydrophobicContact CB-CD1 4.31Å; L146-I149 HydrophobicContact CB-CG1 4.04Å; L146-I149 HydrophobicContact CD1-CD1 3.81Å; L146-I149 HydrophobicContact CD1-CG1 3.99Å; I149-V151 HydrophobicContact CG2-CG2 4.19Å; I149-L179 HydrophobicContact CD1-CD1 4.4Å; I149-L179 HydrophobicContact CD1-CD2 4.47Å; I149-L179 HydrophobicContact CG2-CD2 4.04Å; I149-A182 HydrophobicContact CB-CB 4.11Å; I149-A182 HydrophobicContact CG2-CB 4.07Å; I149-A182 WeakPolarHBondContact O-CA 3.39Å; I149-I183 PolarHBondContact O-N 2.61Å
150	T	92.3	Very high	89	Confident	2 Å²	2	59.4 Å²	59.4	1%	0.012	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	123.8	167.3	-53.6	0	0	0	0	108.5	V122 R123 I124 I183	V122-T150 PolarHBondContact O-N 2.87Å; R123-T150 CarbonylContact C-O 3.54Å; R123-T150 VanDerWaalsContact CA-O 3.24Å; R123-T150 WeakPolarHBondContact CA-O 2.96Å; R123-T150 HydrophobicContact CG-CG2 4.31Å; I124-T150 PolarHBondContact N-O 3.35Å; T150-I183 CarbonylContact C-O 3.51Å; T150-I183 WeakPolarHBondContact CA-O 3.27Å; T150-I183 HydrophobicContact CG2-CB 4.37Å; T150-I183 HydrophobicContact CG2-CG2 4.35Å
151	V	95.7	Very high	88.2	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	121.7	172.3	-171	0	0	0	0	107.2	L126 L136 L139 I149 F171 T175 L179 A182 I183 S185	L126-V151 HydrophobicContact CD1-CG1 3.69Å; L126-V151 HydrophobicContact CG-CG1 4.31Å; L136-V151 HydrophobicContact CD2-CG1 4.31Å; L136-V151 HydrophobicContact CD2-CG2 3.95Å; L139-V151 HydrophobicContact CD1-CG2 4.15Å; I149-V151 HydrophobicContact CG2-CG2 4.19Å; V151-F171 HydrophobicContact CB-CZ 4.47Å; V151-F171 HydrophobicContact CG1-CE2 3.64Å; V151-F171 HydrophobicContact CG1-CZ 3.96Å; V151-T175 HydrophobicContact CB-CG2 4.32Å; V151-T175 HydrophobicContact CG2-CG2 4.27Å; V151-L179 HydrophobicContact CG2-CD2 3.97Å; V151-A182 HydrophobicContact CG2-CB 4.06Å; V151-I183 PolarHBondContact N-O 2.78Å; V151-S185 PolarHBondContact O-N 2.92Å
152	H	94.2	Very high	87.6	Confident	11 Å²	11	58.2 Å²	58.2	5%	0.051	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	138.9	-175.2	175.7	70.6	0	0	0	111.7	R123 I124 N125 L126 D154 S185	R123-H152 HydrophobicContact CG-CB 4.01Å; R123-H152 PolarHBondContact NH2-CD2 3.45Å; R123-H152 PolarHBondContact NH2-CE1 2.94Å; R123-H152 PolarHBondContact NH2-ND1 3.13Å; R123-H152 PolarHBondContact NH2-NE2 3.31Å; I124-H152 PolarHBondContact O-N 3.49Å; N125-H152 CarbonylContact C-O 3.03Å; N125-H152 WeakPolarHBondContact CA-O 3.31Å; N125-H152 PolarHBondContact OD1-CD2 3.33Å; L126-H152 PolarHBondContact N-O 3.04Å; H152-D154 IonicContact CE1-OD1 2.72Å; H152-D154 IonicContact NE2-OD1 3.05Å; H152-S185 VanDerWaalsContact CA-O 3.27Å; H152-S185 WeakPolarHBondContact CA-O 3.37Å; H152-S185 PolarHBondContact ND1-O 3.1Å; H152-S185 PolarHBondContact ND1-OG 2.83Å
153	A	94.9	Very high	87.2	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	144.7	167.3	0	0	0	0	0	111	L126 V155 M166 F171 S185 V186 G187	L126-A153 HydrophobicContact CB-CB 4.49Å; L126-A153 WeakPolarHBondContact O-CB 3.36Å; A153-V155 HydrophobicContact CB-CG1 3.68Å; A153-V155 PolarHBondContact O-N 2.82Å; A153-M166 HydrophobicContact CB-CE 3.84Å; A153-M166 HydrophobicContact CB-CG 4.03Å; A153-M166 HydrophobicContact CB-SD 4.42Å; A153-F171 HydrophobicContact CB-CD1 4.25Å; A153-F171 HydrophobicContact CB-CD2 4.04Å; A153-F171 HydrophobicContact CB-CE1 4.01Å; A153-F171 HydrophobicContact CB-CE2 3.79Å; A153-F171 HydrophobicContact CB-CG 4.26Å; A153-F171 HydrophobicContact CB-CZ 3.77Å; A153-S185 PolarHBondContact N-O 2.96Å; A153-S185 VanDerWaalsContact N-O 3.08Å; A153-V186 WeakPolarHBondContact O-CA 3.31Å; A153-G187 PolarHBondContact O-N 2.9Å; A153-G187 VanDerWaalsContact O-N 3.07Å
154	D	92.7	Very high	86.9	Confident	41 Å²	41	57.5 Å²	57.5	22%	0.219	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	101.7	166.1	-66.8	-38	0	0	0	108.3	H152 T164 G187 T189	H152-D154 IonicContact CE1-OD1 2.72Å; H152-D154 IonicContact NE2-OD1 3.05Å; D154-T164 PolarHBondContact O-OG1 2.8Å; D154-G187 CarbonylContact C-O 3.46Å; D154-G187 WeakPolarHBondContact CA-O 3.36Å; D154-G187 WeakPolarHBondContact OD1-CA 3.45Å; D154-T189 HydrophobicContact CB-CG2 4.03Å
155	V	94.2	Very high	86.9	Confident	11 Å²	11	52.5 Å²	52.5	7%	0.067	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	-15.8	-171.4	-53	0	0	0	0	112.9	A153 M166 A168 F171 V186 G187	A153-V155 HydrophobicContact CB-CG1 3.68Å; A153-V155 PolarHBondContact O-N 2.82Å; V155-M166 HydrophobicContact CB-CG 4.43Å; V155-M166 HydrophobicContact CG1-CB 4.46Å; V155-M166 HydrophobicContact CG1-CG 3.61Å; V155-A168 HydrophobicContact CB-CB 3.73Å; V155-A168 HydrophobicContact CG2-CB 3.77Å; V155-F171 HydrophobicContact CG1-CB 4.4Å; V155-F171 HydrophobicContact CG1-CD1 3.81Å; V155-F171 HydrophobicContact CG1-CE1 4.41Å; V155-F171 HydrophobicContact CG1-CG 4.21Å; V155-V186 HydrophobicContact CG2-CB 4.03Å; V155-V186 HydrophobicContact CG2-CG1 3.96Å; V155-G187 PolarHBondContact N-O 2.96Å
156	F	92.6	Very high	87.1	Confident	15 Å²	15	47.7 Å²	47.7	7%	0.066	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	150.3	176.7	-55.6	-70.6	0	0	0	110.1	V186 G187 W188 T189 M214 V217	F156-V186 HydrophobicContact CE2-CB 3.87Å; F156-V186 HydrophobicContact CE2-CG2 3.85Å; F156-G187 WeakPolarHBondContact CD2-O 3.39Å; F156-G187 PolarHBondContact N-O 3.14Å; F156-G187 VanDerWaalsContact N-O 3.11Å; F156-W188 HydrophobicContact CB-CB 4.49Å; F156-W188 HydrophobicContact CB-CD2 3.37Å; F156-W188 HydrophobicContact CB-CE3 3.48Å; F156-W188 VanDerWaalsContact CB-CE3 3.48Å; F156-W188 HydrophobicContact CB-CG 3.87Å; F156-W188 HydrophobicContact CB-CH2 3.86Å; F156-W188 HydrophobicContact CB-CZ2 3.78Å; F156-W188 HydrophobicContact CB-CZ3 3.74Å; F156-W188 HydrophobicContact CD1-CZ2 4.46Å; F156-W188 HydrophobicContact CG-CD2 4.3Å; F156-W188 HydrophobicContact CG-CH2 4.4Å; F156-W188 HydrophobicContact CG-CZ2 4.05Å; F156-W188 CarbonylContact O-C 3.58Å; F156-W188 VanDerWaalsContact O-CA 3.32Å; F156-W188 WeakPolarHBondContact O-CA 3.24Å; F156-T189 PolarHBondContact O-N 3Å; F156-T189 PolarHBondContact O-OG1 2.9Å; F156-M214 HydrophobicContact CD1-CG 4.33Å; F156-M214 HydrophobicContact CD2-CG 3.86Å; F156-M214 HydrophobicContact CE1-CB 4.49Å; F156-M214 HydrophobicContact CE1-CG 4.13Å; F156-M214 HydrophobicContact CE2-CB 4.16Å; F156-M214 HydrophobicContact CE2-CE 4.49Å; F156-M214 HydrophobicContact CE2-CG 3.64Å; F156-M214 HydrophobicContact CG-CG 4.22Å; F156-M214 VanDerWaalsContact CZ-CA 3.47Å; F156-M214 HydrophobicContact CZ-CB 4.01Å; F156-M214 HydrophobicContact CZ-CG 3.82Å; F156-V217 HydrophobicContact CE1-CB 4.19Å; F156-V217 HydrophobicContact CE1-CG2 3.81Å; F156-V217 HydrophobicContact CZ-CB 3.98Å; F156-V217 HydrophobicContact CZ-CG1 4.16Å; F156-V217 HydrophobicContact CZ-CG2 4.12Å
157	R	87	Confident	87.4	Confident	126 Å²	126	52 Å²	52	48%	0.475	26%	0.262	S	S	.	.			trans	-139.7	139.4	-177.7	172.1	178.7	176.8	174.8	13.8	109.9	D163 W188	R157-D163 IonicContact CZ-OD1 2.67Å; R157-D163 IonicContact NH1-OD1 3.81Å; R157-D163 PolarHBondContact NH1-OD1 2.99Å; R157-D163 IonicContact NH2-OD1 2.98Å; R157-D163 PolarHBondContact NH2-OD1 3.18Å; R157-W188 WeakPolarHBondContact O-CZ3 3.27Å
158	D	78.6	Confident	88	Confident	14 Å²	14	49.2 Å²	49.2	8%	0.075	24%	0.243	C	C	.	.			trans	-109.4	-178.1	164	69.9	22.1	0	0	0	111.6	Y160 G161 W188 K210	D158-Y160 PolarHBondContact O-N 2.94Å; D158-Y160 VanDerWaalsContact O-N 3.15Å; D158-Y160 WeakPolarHBondContact OD1-CA 3.12Å; D158-Y160 WeakPolarHBondContact OD1-CB 3.48Å; D158-Y160 PolarHBondContact OD1-N 2.89Å; D158-G161 PolarHBondContact O-N 2.96Å; D158-G161 PolarHBondContact OD1-N 3.12Å; D158-W188 HydrophobicContact CB-CE3 4.47Å; D158-K210 IonicContact OD2-NZ 2.63Å; D158-K210 PolarHBondContact OD2-NZ 3.13Å
159	Q	78.1	Confident	88.2	Confident	152 Å²	152	53.1 Å²	53.1	71%	0.71	26%	0.261	S	S	*	.	S	Bend	trans	-64.8	-14.2	-179.5	67.8	-171.9	11.5	0	0	114
160	Y	77	Confident	88.3	Confident	103 Å²	103	54.1 Å²	54.1	40%	0.404	27%	0.268	S	S	.	.	S	Bend	trans	-104.8	-19.4	179.9	-49.6	-72.5	0	0	0	112.3	D158 P191 P203 D204	D158-Y160 PolarHBondContact O-N 2.94Å; D158-Y160 VanDerWaalsContact O-N 3.15Å; D158-Y160 WeakPolarHBondContact OD1-CA 3.12Å; D158-Y160 WeakPolarHBondContact OD1-CB 3.48Å; D158-Y160 PolarHBondContact OD1-N 2.89Å; Y160-P191 WeakPolarHBondContact O-CA 3.48Å; Y160-P191 WeakPolarHBondContact O-CB 3.32Å; Y160-P203 HydrophobicContact CD2-CB 3.87Å; Y160-P203 HydrophobicContact CD2-CG 4.22Å; Y160-P203 HydrophobicContact CE2-CB 3.83Å; Y160-P203 HydrophobicContact CG-CB 4.35Å; Y160-D204 HydrophobicContact CE2-CB 4.06Å
161	G	76.8	Confident	88.6	Confident	7 Å²	7	54 Å²	54	7%	0.072	27%	0.267	C	S	.	.	S	Bend	trans	-69.4	151.8	-179.1	0	0	0	0	0	114.4	D158 T189	D158-G161 PolarHBondContact O-N 2.96Å; D158-G161 PolarHBondContact OD1-N 3.12Å; G161-T189 WeakPolarHBondContact CA-O 3.04Å; G161-T189 WeakPolarHBondContact CA-OG1 3.32Å
162	E	79.8	Confident	88.7	Confident	111 Å²	111	54.4 Å²	54.4	52%	0.519	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-57.3	152.2	172.1	-74.1	179.4	-172.9	0	0	112.8	T164 T189 W190 A192	E162-T164 PolarHBondContact O-N 2.86Å; E162-T189 WeakPolarHBondContact O-CB 3.43Å; E162-T189 PolarHBondContact O-OG1 2.8Å; E162-W190 PolarHBondContact N-O 2.84Å; E162-W190 VanDerWaalsContact N-O 3.15Å; E162-A192 HydrophobicContact CG-CB 3.93Å; E162-A192 WeakPolarHBondContact OE1-CB 3.37Å
163	D	80.2	Confident	88.8	Confident	132 Å²	132	60.1 Å²	60.1	71%	0.706	29%	0.291	S	S	*	.	P	Polyproline II helix	trans	-61.2	121.4	169.4	-72	-33.7	0	0	0	109.5	R157	R157-D163 IonicContact CZ-OD1 2.67Å; R157-D163 IonicContact NH1-OD1 3.81Å; R157-D163 PolarHBondContact NH1-OD1 2.99Å; R157-D163 IonicContact NH2-OD1 2.98Å; R157-D163 PolarHBondContact NH2-OD1 3.18Å
164	T	83.8	Confident	88.9	Confident	43 Å²	43	60.4 Å²	60.4	26%	0.264	29%	0.293	S	S	.	.			trans	-110.3	137.6	171.2	-177.8	0	0	0	0	110.3	D154 E162 M166 T189	D154-T164 PolarHBondContact O-OG1 2.8Å; E162-T164 PolarHBondContact O-N 2.86Å; T164-M166 VanDerWaalsContact C-N 3.3Å; T164-M166 VanDerWaalsContact OG1-CB 3.23Å; T164-M166 WeakPolarHBondContact OG1-CB 3.41Å; T164-M166 PolarHBondContact OG1-N 2.89Å; T164-M166 VanDerWaalsContact OG1-N 3.08Å; T164-T189 HydrophobicContact CG2-CG2 3.87Å
165	S	88.1	Confident	89.1	Confident	66 Å²	66	58.4 Å²	58.4	46%	0.462	28%	0.282	S	S	.	.	B	Isolated β-bridge	trans	-93	5.4	170.3	61.8	0	0	0	0	112.1	Y127 N128 S129	Y127-S165 PolarHBondContact O-OG 2.97Å; N128-S165 WeakPolarHBondContact CA-OG 3.27Å; N128-S165 PolarHBondContact ND2-OG 2.68Å; N128-S165 VanDerWaalsContact ND2-OG 3.14Å; S129-S165 PolarHBondContact OG-O 3.38Å
166	M	93.2	Very high	89.2	Confident	11 Å²	11	59.1 Å²	59.1	5%	0.054	29%	0.288	C	S	.	.			trans	-80.5	120.1	-180	-166.7	62.8	75	0	0	110.5	L126 N128 S129 V132 A153 V155 T164 F171	L126-M166 VanDerWaalsContact C-CE 3.47Å; L126-M166 HydrophobicContact CB-CE 3.62Å; L126-M166 VanDerWaalsContact O-CE 3.28Å; L126-M166 WeakPolarHBondContact O-CE 3.34Å; N128-M166 VanDerWaalsContact N-CE 3.33Å; S129-M166 WeakPolarHBondContact OG-CA 3.4Å; V132-M166 HydrophobicContact CG2-CE 3.96Å; V132-M166 HydrophobicContact CG2-SD 3.61Å; A153-M166 HydrophobicContact CB-CE 3.84Å; A153-M166 HydrophobicContact CB-CG 4.03Å; A153-M166 HydrophobicContact CB-SD 4.42Å; V155-M166 HydrophobicContact CB-CG 4.43Å; V155-M166 HydrophobicContact CG1-CB 4.46Å; V155-M166 HydrophobicContact CG1-CG 3.61Å; T164-M166 VanDerWaalsContact C-N 3.3Å; T164-M166 VanDerWaalsContact OG1-CB 3.23Å; T164-M166 WeakPolarHBondContact OG1-CB 3.41Å; T164-M166 PolarHBondContact OG1-N 2.89Å; T164-M166 VanDerWaalsContact OG1-N 3.08Å; M166-F171 HydrophobicContact CG-CB 4.35Å; M166-F171 HydrophobicContact SD-CB 4.1Å; M166-F171 HydrophobicContact SD-CD2 4.27Å; M166-F171 HydrophobicContact SD-CG 4.43Å
167	E	93.6	Very high	89.4	Confident	106 Å²	106	64.1 Å²	64.1	50%	0.495	31%	0.311	S	S	.	.			trans	-88.4	116.2	173.2	-172.5	-170.8	-173	0	0	109.5	S129 E169 T170 F171	S129-E167 PolarHBondContact OG-N 3.08Å; E167-E169 PolarHBondContact O-N 2.75Å; E167-T170 PolarHBondContact O-N 2.87Å; E167-T170 VanDerWaalsContact OE2-CB 3.23Å; E167-T170 WeakPolarHBondContact OE2-CB 3.46Å; E167-T170 PolarHBondContact OE2-OG1 2.91Å; E167-F171 WeakPolarHBondContact O-CB 3.33Å; E167-F171 PolarHBondContact O-N 3.3Å
168	A	94.8	Very high	89.9	Confident	18 Å²	18	60.3 Å²	60.3	15%	0.149	30%	0.3	C	S	.	.	H	α-helix	trans	-60.2	-47.4	-170.3	0	0	0	0	0	113.5	V155 F171 V172 V217	V155-A168 HydrophobicContact CB-CB 3.73Å; V155-A168 HydrophobicContact CG2-CB 3.77Å; A168-F171 PolarHBondContact O-N 3.32Å; A168-V172 PolarHBondContact O-N 2.72Å; A168-V172 VanDerWaalsContact O-N 3.08Å; A168-V217 HydrophobicContact CB-CG1 3.88Å; A168-V217 HydrophobicContact CB-CG2 3.88Å
169	E	93.4	Very high	90.7	Very high	139 Å²	139	59.6 Å²	59.6	65%	0.65	30%	0.296	S	S	*	.	H	α-helix	trans	-66.1	-45.7	-179.9	-66	-174.3	-178.3	0	0	111.7	E167 F171 V172 R173	E167-E169 PolarHBondContact O-N 2.75Å; E169-F171 VanDerWaalsContact C-N 3.34Å; E169-F171 PolarHBondContact O-N 3.23Å; E169-V172 PolarHBondContact O-N 2.85Å; E169-R173 WeakPolarHBondContact O-CB 3.28Å; E169-R173 PolarHBondContact O-N 3.3Å
170	T	94.2	Very high	91.5	Very high	28 Å²	28	56.1 Å²	56.1	17%	0.172	29%	0.287	C	S	.	.	H	α-helix	trans	-60.8	-42.6	175.6	-70.7	0	0	0	0	111.6	E167 S174	E167-T170 PolarHBondContact O-N 2.87Å; E167-T170 VanDerWaalsContact OE2-CB 3.23Å; E167-T170 WeakPolarHBondContact OE2-CB 3.46Å; E167-T170 PolarHBondContact OE2-OG1 2.91Å; T170-S174 VanDerWaalsContact O-CB 3.22Å; T170-S174 WeakPolarHBondContact O-CB 3.39Å; T170-S174 PolarHBondContact O-N 3.01Å; T170-S174 PolarHBondContact O-OG 2.94Å; T170-S174 VanDerWaalsContact O-OG 3.07Å
171	F	97.5	Very high	92.2	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-58	-51.3	176.1	170.5	-108.5	0	0	0	112.6	L126 V132 V151 A153 V155 M166 E167 A168 E169 T175 I184 V186	L126-F171 HydrophobicContact CD1-CE2 4.15Å; V132-F171 HydrophobicContact CG1-CD2 4.3Å; V132-F171 HydrophobicContact CG2-CD2 4.19Å; V151-F171 HydrophobicContact CB-CZ 4.47Å; V151-F171 HydrophobicContact CG1-CE2 3.64Å; V151-F171 HydrophobicContact CG1-CZ 3.96Å; A153-F171 HydrophobicContact CB-CD1 4.25Å; A153-F171 HydrophobicContact CB-CD2 4.04Å; A153-F171 HydrophobicContact CB-CE1 4.01Å; A153-F171 HydrophobicContact CB-CE2 3.79Å; A153-F171 HydrophobicContact CB-CG 4.26Å; A153-F171 HydrophobicContact CB-CZ 3.77Å; V155-F171 HydrophobicContact CG1-CB 4.4Å; V155-F171 HydrophobicContact CG1-CD1 3.81Å; V155-F171 HydrophobicContact CG1-CE1 4.41Å; V155-F171 HydrophobicContact CG1-CG 4.21Å; M166-F171 HydrophobicContact CG-CB 4.35Å; M166-F171 HydrophobicContact SD-CB 4.1Å; M166-F171 HydrophobicContact SD-CD2 4.27Å; M166-F171 HydrophobicContact SD-CG 4.43Å; E167-F171 WeakPolarHBondContact O-CB 3.33Å; E167-F171 PolarHBondContact O-N 3.3Å; A168-F171 PolarHBondContact O-N 3.32Å; E169-F171 VanDerWaalsContact C-N 3.34Å; E169-F171 PolarHBondContact O-N 3.23Å; F171-T175 WeakPolarHBondContact O-CB 3.35Å; F171-T175 PolarHBondContact O-N 2.79Å; F171-T175 PolarHBondContact O-OG1 2.66Å; F171-I184 HydrophobicContact CE1-CG2 4.06Å; F171-V186 HydrophobicContact CD1-CG1 4.18Å; F171-V186 HydrophobicContact CE1-CG1 3.8Å
172	V	97.3	Very high	93	Very high	9 Å²	9	54.5 Å²	54.5	6%	0.055	29%	0.289	C	S	.	.	H	α-helix	trans	-67.8	-44.3	-178.5	170.9	0	0	0	0	111.6	A168 E169 T175 S176 I184 V217 V218 A221	A168-V172 PolarHBondContact O-N 2.72Å; A168-V172 VanDerWaalsContact O-N 3.08Å; E169-V172 PolarHBondContact O-N 2.85Å; V172-T175 PolarHBondContact O-N 2.81Å; V172-S176 WeakPolarHBondContact O-CB 3.29Å; V172-S176 PolarHBondContact O-N 3Å; V172-S176 PolarHBondContact O-OG 3.43Å; V172-I184 HydrophobicContact CG1-CD1 4.16Å; V172-I184 HydrophobicContact CG2-CG2 4.39Å; V172-V217 HydrophobicContact CB-CG1 4.44Å; V172-V217 WeakPolarHBondContact CG1-O 3.35Å; V172-V217 HydrophobicContact CG2-CG1 3.63Å; V172-V218 HydrophobicContact CG2-CG1 4.14Å; V172-A221 HydrophobicContact CG1-CB 3.89Å
173	R	96.3	Very high	93.6	Very high	130 Å²	130	49.8 Å²	49.8	49%	0.491	27%	0.267	S	S	.	.	H	α-helix	trans	-62.2	-51.9	179.2	-178	174.2	62.9	91.6	-1.4	111.3	E169 T175 S176 E177	E169-R173 WeakPolarHBondContact O-CB 3.28Å; E169-R173 PolarHBondContact O-N 3.3Å; R173-T175 VanDerWaalsContact C-N 3.31Å; R173-T175 PolarHBondContact O-N 3.2Å; R173-S176 PolarHBondContact O-N 3.16Å; R173-S176 VanDerWaalsContact O-N 3.11Å; R173-E177 HydrophobicContact CG-CG 4.44Å; R173-E177 WeakPolarHBondContact CG-OE1 3.12Å; R173-E177 IonicContact NH1-OE1 3.76Å; R173-E177 IonicContact NH1-OE2 2.77Å; R173-E177 WeakPolarHBondContact O-CG 3.3Å; R173-E177 PolarHBondContact O-N 2.96Å
174	S	97.3	Very high	94.4	Very high	6 Å²	6	43.5 Å²	43.5	4%	0.042	23%	0.234	C	C	.	.	H	α-helix	trans	-61	-39.1	178.4	-65.8	0	0	0	0	112.1	L136 T170 S176 E177 L178	L136-S174 WeakPolarHBondContact CD1-O 3.44Å; T170-S174 VanDerWaalsContact O-CB 3.22Å; T170-S174 WeakPolarHBondContact O-CB 3.39Å; T170-S174 PolarHBondContact O-N 3.01Å; T170-S174 PolarHBondContact O-OG 2.94Å; T170-S174 VanDerWaalsContact O-OG 3.07Å; S174-S176 VanDerWaalsContact C-N 3.33Å; S174-S176 PolarHBondContact O-N 3.27Å; S174-E177 PolarHBondContact O-N 3.05Å; S174-L178 VanDerWaalsContact O-CB 3.24Å; S174-L178 WeakPolarHBondContact O-CB 3.49Å; S174-L178 WeakPolarHBondContact O-CG 3.33Å; S174-L178 PolarHBondContact O-N 3.02Å
175	T	97.7	Very high	94.9	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65.7	-38.3	176.2	-54.7	0	0	0	0	111.5	L136 V151 F171 V172 R173 L179 I184 Q223	L136-T175 HydrophobicContact CD2-CG2 4.24Å; V151-T175 HydrophobicContact CB-CG2 4.32Å; V151-T175 HydrophobicContact CG2-CG2 4.27Å; F171-T175 WeakPolarHBondContact O-CB 3.35Å; F171-T175 PolarHBondContact O-N 2.79Å; F171-T175 PolarHBondContact O-OG1 2.66Å; V172-T175 PolarHBondContact O-N 2.81Å; R173-T175 VanDerWaalsContact C-N 3.31Å; R173-T175 PolarHBondContact O-N 3.2Å; T175-L179 CarbonylContact O-C 3.56Å; T175-L179 WeakPolarHBondContact O-CA 3.13Å; T175-L179 PolarHBondContact O-N 2.96Å; T175-L179 VanDerWaalsContact O-O 3.11Å; T175-I184 HydrophobicContact CG2-CD1 4.16Å; T175-I184 HydrophobicContact CG2-CG1 3.64Å; T175-Q223 PolarHBondContact O-NE2 3.24Å
176	S	96.8	Very high	95.2	Very high	26 Å²	26	38.3 Å²	38.3	18%	0.182	20%	0.2	C	C	.	.	H	α-helix	trans	-67.7	-38.4	176.6	-54.2	0	0	0	0	114	V172 R173 S174 Q223	V172-S176 WeakPolarHBondContact O-CB 3.29Å; V172-S176 PolarHBondContact O-N 3Å; V172-S176 PolarHBondContact O-OG 3.43Å; R173-S176 PolarHBondContact O-N 3.16Å; R173-S176 VanDerWaalsContact O-N 3.11Å; S174-S176 VanDerWaalsContact C-N 3.33Å; S174-S176 PolarHBondContact O-N 3.27Å; S176-Q223 PolarHBondContact OG-NE2 2.8Å; S176-Q223 PolarHBondContact OG-OE1 3.19Å
177	E	96.5	Very high	95.2	Very high	119 Å²	119	37.8 Å²	37.8	56%	0.556	20%	0.197	S	C	*	.	H	α-helix	trans	-78.6	-45.3	179.3	-69.3	169.7	-178.2	0	0	112.1	R173 S174	R173-E177 HydrophobicContact CG-CG 4.44Å; R173-E177 WeakPolarHBondContact CG-OE1 3.12Å; R173-E177 IonicContact NH1-OE1 3.76Å; R173-E177 IonicContact NH1-OE2 2.77Å; R173-E177 WeakPolarHBondContact O-CG 3.3Å; R173-E177 PolarHBondContact O-N 2.96Å; S174-E177 PolarHBondContact O-N 3.05Å
178	L	96.9	Very high	95	Very high	46 Å²	46	33.3 Å²	33.3	24%	0.241	18%	0.175	C	C	.	.	H	α-helix	trans	-94.2	-24.1	-169.6	-57.7	177.8	0	0	0	114	I133 L136 S174	I133-L178 HydrophobicContact CB-CD1 4.39Å; I133-L178 HydrophobicContact CG1-CD1 4.18Å; I133-L178 HydrophobicContact CG2-CD1 4.07Å; L136-L178 HydrophobicContact CB-CB 4.08Å; L136-L178 HydrophobicContact CB-CD1 4.19Å; L136-L178 HydrophobicContact CD1-CB 4.27Å; L136-L178 HydrophobicContact CD1-CD1 4.13Å; S174-L178 VanDerWaalsContact O-CB 3.24Å; S174-L178 WeakPolarHBondContact O-CB 3.49Å; S174-L178 WeakPolarHBondContact O-CG 3.33Å; S174-L178 PolarHBondContact O-N 3.02Å
179	L	95.9	Very high	94.6	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.172	C	C	.	.			trans	-144.9	61.7	-178.1	-168.7	61.2	0	0	0	111.5	L136 L139 E140 I149 V151 T175 S181 A182	L136-L179 HydrophobicContact CD2-CB 4.02Å; L136-L179 HydrophobicContact CD2-CD2 3.93Å; L139-L179 HydrophobicContact CB-CD2 3.76Å; L139-L179 HydrophobicContact CD1-CD2 4.04Å; E140-L179 HydrophobicContact CB-CD1 4.14Å; E140-L179 WeakPolarHBondContact OE2-CD1 3.46Å; I149-L179 HydrophobicContact CD1-CD1 4.4Å; I149-L179 HydrophobicContact CD1-CD2 4.47Å; I149-L179 HydrophobicContact CG2-CD2 4.04Å; V151-L179 HydrophobicContact CG2-CD2 3.97Å; T175-L179 CarbonylContact O-C 3.56Å; T175-L179 WeakPolarHBondContact O-CA 3.13Å; T175-L179 PolarHBondContact O-N 2.96Å; T175-L179 VanDerWaalsContact O-O 3.11Å; L179-S181 PolarHBondContact O-N 3.02Å; L179-A182 HydrophobicContact CB-CB 4.44Å; L179-A182 HydrophobicContact CD2-CB 3.56Å; L179-A182 HydrophobicContact CG-CB 3.58Å; L179-A182 PolarHBondContact O-N 3.38Å
180	P	94.5	Very high	93.7	Very high	78 Å²	78	28 Å²	28	51%	0.506	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-12.2	-176.2	25.8	-35.8	0	0	0	114.3	Q223	P180-Q223 WeakPolarHBondContact O-CG 3.29Å
181	S	91.2	Very high	92.3	Very high	75 Å²	75	27.9 Å²	27.9	52%	0.524	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-13.5	176.5	63.1	0	0	0	0	114	L179	L179-S181 PolarHBondContact O-N 3.02Å
182	A	94	Very high	90.5	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.008	18%	0.175	C	C	.	.	S	Bend	trans	-81.1	154.2	179.9	0	0	0	0	0	112.6	I149 V151 L179 Q223	I149-A182 HydrophobicContact CB-CB 4.11Å; I149-A182 HydrophobicContact CG2-CB 4.07Å; I149-A182 WeakPolarHBondContact O-CA 3.39Å; V151-A182 HydrophobicContact CG2-CB 4.06Å; L179-A182 HydrophobicContact CB-CB 4.44Å; L179-A182 HydrophobicContact CD2-CB 3.56Å; L179-A182 HydrophobicContact CG-CB 3.58Å; L179-A182 PolarHBondContact O-N 3.38Å; A182-Q223 VanDerWaalsContact O-CB 3.27Å; A182-Q223 WeakPolarHBondContact O-CB 3.44Å; A182-Q223 WeakPolarHBondContact O-CG 3.12Å
183	I	92.9	Very high	88.5	Confident	12 Å²	12	40 Å²	40	6%	0.062	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	130.5	166.7	-58.5	-172.9	0	0	0	108.4	F60 Q148 I149 T150 V151 T224 I226	F60-I183 HydrophobicContact CE1-CD1 3.65Å; F60-I183 HydrophobicContact CZ-CD1 4.22Å; Q148-I183 HydrophobicContact CG-CD1 4.27Å; I149-I183 PolarHBondContact O-N 2.61Å; T150-I183 CarbonylContact C-O 3.51Å; T150-I183 WeakPolarHBondContact CA-O 3.27Å; T150-I183 HydrophobicContact CG2-CB 4.37Å; T150-I183 HydrophobicContact CG2-CG2 4.35Å; V151-I183 PolarHBondContact N-O 2.78Å; I183-T224 HydrophobicContact CD1-CG2 4.43Å; I183-T224 HydrophobicContact CG2-CG2 4.12Å; I183-T224 WeakPolarHBondContact CG2-O 2.86Å; I183-I226 HydrophobicContact CG2-CD1 3.63Å; I183-I226 HydrophobicContact CG2-CG1 3.73Å
184	I	95.8	Very high	86.7	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	131	172.4	-69.3	169.5	0	0	0	107.9	F171 V172 T175 V186 A221 T224 V225 I226	F171-I184 HydrophobicContact CE1-CG2 4.06Å; V172-I184 HydrophobicContact CG1-CD1 4.16Å; V172-I184 HydrophobicContact CG2-CG2 4.39Å; T175-I184 HydrophobicContact CG2-CD1 4.16Å; T175-I184 HydrophobicContact CG2-CG1 3.64Å; I184-V186 HydrophobicContact CG2-CG1 3.98Å; I184-A221 HydrophobicContact CD1-CB 4.08Å; I184-T224 PolarHBondContact N-O 3Å; I184-V225 HydrophobicContact CB-CG2 4.18Å; I184-V225 HydrophobicContact CG2-CG2 4.41Å; I184-V225 CarbonylContact O-C 3.6Å; I184-V225 VanDerWaalsContact O-CA 3.24Å; I184-V225 WeakPolarHBondContact O-CA 3.31Å; I184-I226 PolarHBondContact O-N 3.26Å
185	S	94.9	Very high	85.1	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.007	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	129.1	169.3	-177.7	0	0	0	0	109.9	V151 H152 A153 I226 S228	V151-S185 PolarHBondContact O-N 2.92Å; H152-S185 VanDerWaalsContact CA-O 3.27Å; H152-S185 WeakPolarHBondContact CA-O 3.37Å; H152-S185 PolarHBondContact ND1-O 3.1Å; H152-S185 PolarHBondContact ND1-OG 2.83Å; A153-S185 PolarHBondContact N-O 2.96Å; A153-S185 VanDerWaalsContact N-O 3.08Å; S185-I226 CarbonylContact C-O 3.6Å; S185-I226 WeakPolarHBondContact CA-O 3.36Å; S185-I226 PolarHBondContact OG-O 2.84Å; S185-S228 PolarHBondContact OG-OG 3.22Å
186	V	95.3	Very high	83.2	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	141.6	-179.9	-68.5	0	0	0	0	110	A153 V155 F156 F171 I184 V218 V225 I226 F227 S228	A153-V186 WeakPolarHBondContact O-CA 3.31Å; V155-V186 HydrophobicContact CG2-CB 4.03Å; V155-V186 HydrophobicContact CG2-CG1 3.96Å; F156-V186 HydrophobicContact CE2-CB 3.87Å; F156-V186 HydrophobicContact CE2-CG2 3.85Å; F171-V186 HydrophobicContact CD1-CG1 4.18Å; F171-V186 HydrophobicContact CE1-CG1 3.8Å; I184-V186 HydrophobicContact CG2-CG1 3.98Å; V186-V218 HydrophobicContact CG1-CG1 4.32Å; V186-V218 HydrophobicContact CG2-CG1 4Å; V186-V225 HydrophobicContact CG2-CG1 4.3Å; V186-I226 PolarHBondContact N-O 2.75Å; V186-F227 HydrophobicContact CG2-CD1 3.71Å; V186-F227 HydrophobicContact CG2-CE1 4.05Å; V186-S228 PolarHBondContact O-N 3.42Å
187	G	92.3	Very high	81.8	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	-179.2	177.4	0	0	0	0	0	113	A153 D154 V155 F156	A153-G187 PolarHBondContact O-N 2.9Å; A153-G187 VanDerWaalsContact O-N 3.07Å; D154-G187 CarbonylContact C-O 3.46Å; D154-G187 WeakPolarHBondContact CA-O 3.36Å; D154-G187 WeakPolarHBondContact OD1-CA 3.45Å; V155-G187 PolarHBondContact N-O 2.96Å; F156-G187 WeakPolarHBondContact CD2-O 3.39Å; F156-G187 PolarHBondContact N-O 3.14Å; F156-G187 VanDerWaalsContact N-O 3.11Å
188	W	90.3	Very high	80.3	Confident	11 Å²	11	49.2 Å²	49.2	4%	0.042	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	140.6	175.4	-67.7	76.5	0	0	0	109.5	F156 R157 D158 W190 Y206 K210 M214	F156-W188 HydrophobicContact CB-CB 4.49Å; F156-W188 HydrophobicContact CB-CD2 3.37Å; F156-W188 HydrophobicContact CB-CE3 3.48Å; F156-W188 VanDerWaalsContact CB-CE3 3.48Å; F156-W188 HydrophobicContact CB-CG 3.87Å; F156-W188 HydrophobicContact CB-CH2 3.86Å; F156-W188 HydrophobicContact CB-CZ2 3.78Å; F156-W188 HydrophobicContact CB-CZ3 3.74Å; F156-W188 HydrophobicContact CD1-CZ2 4.46Å; F156-W188 HydrophobicContact CG-CD2 4.3Å; F156-W188 HydrophobicContact CG-CH2 4.4Å; F156-W188 HydrophobicContact CG-CZ2 4.05Å; F156-W188 CarbonylContact O-C 3.58Å; F156-W188 VanDerWaalsContact O-CA 3.32Å; F156-W188 WeakPolarHBondContact O-CA 3.24Å; R157-W188 WeakPolarHBondContact O-CZ3 3.27Å; D158-W188 HydrophobicContact CB-CE3 4.47Å; W188-W190 HydrophobicContact CB-CZ2 3.94Å; W188-W190 VanDerWaalsContact O-CD1 3.29Å; W188-W190 PolarHBondContact O-NE1 2.67Å; W188-Y206 AromaticContact CD1-CE1 3.66Å; W188-Y206 HydrophobicContact CD2-CE1 4.4Å; W188-Y206 HydrophobicContact CG-CE1 4.05Å; W188-Y206 AromaticContact NE1-CD1 3.92Å; W188-Y206 AromaticContact NE1-CE1 3.82Å; W188-K210 HydrophobicContact CE3-CD 4.44Å; W188-K210 HydrophobicContact CH2-CB 3.6Å; W188-K210 HydrophobicContact CH2-CD 3.72Å; W188-K210 HydrophobicContact CH2-CG 3.42Å; W188-K210 VanDerWaalsContact CH2-CG 3.42Å; W188-K210 HydrophobicContact CZ2-CB 3.48Å; W188-K210 VanDerWaalsContact CZ2-CB 3.48Å; W188-K210 HydrophobicContact CZ2-CD 4.01Å; W188-K210 HydrophobicContact CZ2-CG 3.82Å; W188-K210 HydrophobicContact CZ3-CD 3.93Å; W188-K210 HydrophobicContact CZ3-CG 4.05Å; W188-M214 HydrophobicContact CZ2-CG 3.89Å; W188-M214 HydrophobicContact CZ2-SD 3.94Å; W188-M214 PolarHBondContact NE1-SD 2.89Å
189	T	86	Confident	78.7	Confident	11 Å²	11	50.5 Å²	50.5	7%	0.067	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-65.1	134.7	166.3	60.9	0	0	0	0	109	D154 F156 G161 E162 T164	D154-T189 HydrophobicContact CB-CG2 4.03Å; F156-T189 PolarHBondContact O-N 3Å; F156-T189 PolarHBondContact O-OG1 2.9Å; G161-T189 WeakPolarHBondContact CA-O 3.04Å; G161-T189 WeakPolarHBondContact CA-OG1 3.32Å; E162-T189 WeakPolarHBondContact O-CB 3.43Å; E162-T189 PolarHBondContact O-OG1 2.8Å; T164-T189 HydrophobicContact CG2-CG2 3.87Å
190	W	73.5	Confident	77.4	Confident	36 Å²	36	55.5 Å²	55.5	14%	0.136	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-100.4	159	179	-72.7	101.5	0	0	0	111.3	E162 W188 A192 Y206 Y230 C233	E162-W190 PolarHBondContact N-O 2.84Å; E162-W190 VanDerWaalsContact N-O 3.15Å; W188-W190 HydrophobicContact CB-CZ2 3.94Å; W188-W190 VanDerWaalsContact O-CD1 3.29Å; W188-W190 PolarHBondContact O-NE1 2.67Å; W190-A192 PolarHBondContact O-N 3.22Å; W190-Y206 HydrophobicContact CH2-CE1 4.1Å; W190-Y206 AromaticContact CH2-CZ 3.84Å; W190-Y206 WeakPolarHBondContact CH2-OH 3.42Å; W190-Y206 HydrophobicContact CZ2-CE1 4.26Å; W190-Y206 AromaticContact CZ2-CZ 3.95Å; W190-Y206 WeakPolarHBondContact CZ2-OH 3.27Å; W190-Y230 HydrophobicContact CD2-CG 4.24Å; W190-Y230 HydrophobicContact CE3-CD1 4.05Å; W190-Y230 HydrophobicContact CE3-CG 4.18Å; W190-Y230 VanDerWaalsContact CH2-CB 3.42Å; W190-Y230 HydrophobicContact CH2-CD1 4.15Å; W190-Y230 HydrophobicContact CH2-CG 4.21Å; W190-Y230 HydrophobicContact CZ2-CG 4.24Å; W190-Y230 AromaticContact CZ3-CD1 3.81Å; W190-Y230 HydrophobicContact CZ3-CD1 3.81Å; W190-Y230 HydrophobicContact CZ3-CG 4.15Å; W190-C233 HydrophobicContact CH2-CB 4.42Å
191	P	65.6	Low	76.4	Confident	25 Å²	25	58.3 Å²	58.3	16%	0.162	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-66.3	120.5	172.2	-3.9	16.3	0	0	0	109.5	Y160 K193 I194	Y160-P191 WeakPolarHBondContact O-CA 3.48Å; Y160-P191 WeakPolarHBondContact O-CB 3.32Å; P191-K193 PolarHBondContact O-N 2.85Å; P191-I194 HydrophobicContact CB-CG1 3.93Å; P191-I194 HydrophobicContact CG-CD1 4.01Å; P191-I194 HydrophobicContact CG-CG1 3.83Å
192	A	58.9	Low	75.9	Confident	71 Å²	71	55.8 Å²	55.8	59%	0.587	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-24.9	172.1	0	0	0	0	0	113.1	E162 W190	E162-A192 HydrophobicContact CG-CB 3.93Å; E162-A192 WeakPolarHBondContact OE1-CB 3.37Å; W190-A192 PolarHBondContact O-N 3.22Å
193	K	55.7	Low	75	Confident	192 Å²	192	56.9 Å²	56.9	84%	0.835	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.9	50.1	-166.7	-59.1	-178	-175.4	177.7	0	112.3	P191 E195	P191-K193 PolarHBondContact O-N 2.85Å; K193-E195 PolarHBondContact O-N 3.23Å
194	I	59.5	Low	74.5	Confident	35 Å²	35	58.8 Å²	58.8	18%	0.179	30%	0.298	C	S	.	.			trans	-71.7	116.6	160.9	-60	179.8	0	0	0	106.8	P191 N198 F259	P191-I194 HydrophobicContact CB-CG1 3.93Å; P191-I194 HydrophobicContact CG-CD1 4.01Å; P191-I194 HydrophobicContact CG-CG1 3.83Å; I194-N198 VanDerWaalsContact CG2-C 3.47Å; I194-N198 HydrophobicContact CG2-CB 3.72Å; I194-N198 VanDerWaalsContact CG2-O 3.3Å; I194-N198 WeakPolarHBondContact CG2-O 3.34Å; I194-F259 HydrophobicContact CB-CZ 4.27Å; I194-F259 HydrophobicContact CD1-CE2 4.43Å; I194-F259 HydrophobicContact CD1-CZ 4.49Å
195	E	62.2	Low	74.2	Confident	130 Å²	130	61.5 Å²	61.5	61%	0.607	31%	0.31	S	S	*	.			trans	-53.3	143.2	172.5	-70.6	-179.1	169.9	0	0	109.9	K193 D197 N198	K193-E195 PolarHBondContact O-N 3.23Å; E195-D197 PolarHBondContact O-N 2.03Å; E195-N198 PolarHBondContact O-N 2.77Å
196	P	59.7	Low	74	Confident	82 Å²	82	61.5 Å²	61.5	53%	0.532	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-50.2	-30.8	-177.8	-29.3	35.4	0	0	0	115.2	N198 R199	P196-N198 VanDerWaalsContact C-N 3.3Å; P196-N198 PolarHBondContact O-N 2.79Å; P196-R199 WeakPolarHBondContact O-CD 3.21Å; P196-R199 WeakPolarHBondContact O-CG 3.36Å; P196-R199 PolarHBondContact O-NE 3.41Å
197	D	66	Low	73.9	Confident	155 Å²	155	63.5 Å²	63.5	83%	0.829	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-77.6	-16.8	-179.2	-64.6	-14.4	0	0	0	112.8	E195	E195-D197 PolarHBondContact O-N 2.03Å
198	N	65.7	Low	73.9	Confident	73 Å²	73	64.6 Å²	64.6	39%	0.39	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-100.8	14.7	-179.4	-69.6	-33.2	0	0	0	113.3	I194 E195 P196 H200 Y201	I194-N198 VanDerWaalsContact CG2-C 3.47Å; I194-N198 HydrophobicContact CG2-CB 3.72Å; I194-N198 VanDerWaalsContact CG2-O 3.3Å; I194-N198 WeakPolarHBondContact CG2-O 3.34Å; E195-N198 PolarHBondContact O-N 2.77Å; P196-N198 VanDerWaalsContact C-N 3.3Å; P196-N198 PolarHBondContact O-N 2.79Å; N198-H200 PolarHBondContact O-N 2.93Å; N198-H200 VanDerWaalsContact O-N 3.09Å; N198-Y201 VanDerWaalsContact O-CB 3.29Å; N198-Y201 WeakPolarHBondContact O-CB 3.28Å; N198-Y201 PolarHBondContact O-N 2.78Å
199	R	64	Low	74	Confident	73 Å²	73	67 Å²	67	28%	0.275	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-11.4	-177.7	-71.3	175.3	-178.7	179.5	9.2	115.9	P196 Y230 F259 E261	P196-R199 WeakPolarHBondContact O-CD 3.21Å; P196-R199 WeakPolarHBondContact O-CG 3.36Å; P196-R199 PolarHBondContact O-NE 3.41Å; R199-Y230 PolarHBondContact O-OH 2.81Å; R199-F259 HydrophobicContact CB-CB 4.1Å; R199-F259 HydrophobicContact CB-CD1 4.09Å; R199-F259 HydrophobicContact CB-CD2 3.74Å; R199-F259 HydrophobicContact CB-CE1 4.49Å; R199-F259 HydrophobicContact CB-CE2 4.17Å; R199-F259 HydrophobicContact CB-CG 3.69Å; R199-F259 VanDerWaalsContact CD-CD1 3.41Å; R199-F259 HydrophobicContact CG-CB 4.25Å; R199-F259 HydrophobicContact CG-CD1 3.4Å; R199-F259 VanDerWaalsContact CG-CD1 3.4Å; R199-F259 HydrophobicContact CG-CD2 3.91Å; R199-F259 HydrophobicContact CG-CE1 3.6Å; R199-F259 HydrophobicContact CG-CE2 4.08Å; R199-F259 HydrophobicContact CG-CG 3.56Å; R199-F259 HydrophobicContact CG-CZ 3.94Å; R199-F259 WeakPolarHBondContact O-CD2 3.08Å; R199-E261 IonicContact NH1-OE2 2.97Å
200	H	67.4	Low	74.3	Confident	105 Å²	105	67.2 Å²	67.2	49%	0.486	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.1	4	176.1	-61.2	-41.2	0	0	0	112.7	N198	N198-H200 PolarHBondContact O-N 2.93Å; N198-H200 VanDerWaalsContact O-N 3.09Å
201	Y	73.8	Confident	75.4	Confident	137 Å²	137	65.5 Å²	65.5	54%	0.537	33%	0.328	S	S	.	.			trans	-88.2	135	-179	179	-115.8	0	0	0	110.1	N198 P203	N198-Y201 VanDerWaalsContact O-CB 3.29Å; N198-Y201 WeakPolarHBondContact O-CB 3.28Å; N198-Y201 PolarHBondContact O-N 2.78Å; Y201-P203 HydrophobicContact CD1-CB 4.26Å; Y201-P203 HydrophobicContact CE1-CB 3.91Å; Y201-P203 WeakPolarHBondContact O-CD 3.23Å
202	C	80.2	Confident	76.8	Confident	22 Å²	22	64.3 Å²	64.3	15%	0.149	32%	0.321	C	S	.	.			trans	-93.6	109.8	165.2	179.6	0	0	0	0	108.5	D204 C233 V236	C202-D204 VanDerWaalsContact C-N 3.28Å; C202-D204 PolarHBondContact O-N 3.09Å; C202-D204 PolarHBondContact SG-O 3.39Å; C202-C233 WeakPolarHBondContact CA-SG 3.49Å; C202-C233 HydrophobicContact CB-CB 3.98Å; C202-C233 WeakPolarHBondContact CB-SG 3.15Å; C202-C233 WeakPolarHBondContact SG-CA 3.32Å; C202-C233 WeakPolarHBondContact SG-CB 3.43Å; C202-C233 CovalentContact SG-SG 2.05Å; C202-C233 PolarHBondContact SG-SG 2.79Å; C202-V236 HydrophobicContact CB-CG2 4.11Å
203	P	76	Confident	78.4	Confident	23 Å²	23	62.8 Å²	62.8	15%	0.149	30%	0.303	C	S	.	.	S	Bend	trans	-67.3	-31.4	179.9	27.8	-34.7	0	0	0	112.6	Y160 Y201	Y160-P203 HydrophobicContact CD2-CB 3.87Å; Y160-P203 HydrophobicContact CD2-CG 4.22Å; Y160-P203 HydrophobicContact CE2-CB 3.83Å; Y160-P203 HydrophobicContact CG-CB 4.35Å; Y201-P203 HydrophobicContact CD1-CB 4.26Å; Y201-P203 HydrophobicContact CE1-CB 3.91Å; Y201-P203 WeakPolarHBondContact O-CD 3.23Å
204	D	82.4	Confident	80.3	Confident	52 Å²	52	53.6 Å²	53.6	28%	0.278	26%	0.263	S	S	.	.	S	Bend	trans	-156.1	124.8	175.6	-176.5	24.6	0	0	0	111	Y160 C202 K210 C233	Y160-D204 HydrophobicContact CE2-CB 4.06Å; C202-D204 VanDerWaalsContact C-N 3.28Å; C202-D204 PolarHBondContact O-N 3.09Å; C202-D204 PolarHBondContact SG-O 3.39Å; D204-K210 VanDerWaalsContact CG-NZ 3.29Å; D204-K210 WeakPolarHBondContact OD2-CE 3.13Å; D204-K210 IonicContact OD2-NZ 2.79Å; D204-K210 PolarHBondContact OD2-NZ 3.02Å; D204-C233 PolarHBondContact O-SG 3Å
205	K	88.5	Confident	82	Confident	58 Å²	58	52 Å²	52	25%	0.252	25%	0.254	S	S	.	.			trans	-64.9	163.4	-178.7	74.5	162.2	-176.6	158.6	0	111.4	T207 V236 S237 E240 N473	K205-T207 VanDerWaalsContact C-N 3.26Å; K205-T207 HydrophobicContact CG-CG2 3.98Å; K205-T207 PolarHBondContact O-N 2.63Å; K205-V236 HydrophobicContact CB-CG2 3.79Å; K205-S237 WeakPolarHBondContact CB-OG 3.47Å; K205-E240 IonicContact NZ-OE1 2.8Å; K205-E240 PolarHBondContact NZ-OE1 3.44Å; K205-N473 PolarHBondContact NZ-OD1 2.75Å
206	Y	91.6	Very high	83.5	Confident	0 Å²	0	48 Å²	48	0%	0	23%	0.234	C	C	.	.			trans	-76.4	81.8	169.7	-56.1	-67.9	0	0	0	109.8	W188 W190 K210 F229 Y230 C233 S237 E240 I241	W188-Y206 AromaticContact CD1-CE1 3.66Å; W188-Y206 HydrophobicContact CD2-CE1 4.4Å; W188-Y206 HydrophobicContact CG-CE1 4.05Å; W188-Y206 AromaticContact NE1-CD1 3.92Å; W188-Y206 AromaticContact NE1-CE1 3.82Å; W190-Y206 HydrophobicContact CH2-CE1 4.1Å; W190-Y206 AromaticContact CH2-CZ 3.84Å; W190-Y206 WeakPolarHBondContact CH2-OH 3.42Å; W190-Y206 HydrophobicContact CZ2-CE1 4.26Å; W190-Y206 AromaticContact CZ2-CZ 3.95Å; W190-Y206 WeakPolarHBondContact CZ2-OH 3.27Å; Y206-K210 HydrophobicContact CD1-CD 4.23Å; Y206-F229 AromaticContact CD1-CD1 3.86Å; Y206-F229 HydrophobicContact CD1-CD1 3.86Å; Y206-F229 AromaticContact CD1-CE1 3.82Å; Y206-F229 HydrophobicContact CD1-CE1 3.82Å; Y206-F229 AromaticContact CD2-CD1 3.71Å; Y206-F229 HydrophobicContact CD2-CD1 3.71Å; Y206-F229 HydrophobicContact CD2-CE1 4.01Å; Y206-F229 HydrophobicContact CD2-CG 4.35Å; Y206-F229 AromaticContact CE1-CD1 3.58Å; Y206-F229 HydrophobicContact CE1-CD1 3.58Å; Y206-F229 AromaticContact CE1-CE1 3.99Å; Y206-F229 HydrophobicContact CE1-CE1 3.99Å; Y206-F229 HydrophobicContact CE2-CB 3.81Å; Y206-F229 AromaticContact CE2-CD1 3.37Å; Y206-F229 HydrophobicContact CE2-CD1 3.37Å; Y206-F229 HydrophobicContact CE2-CE1 4.13Å; Y206-F229 AromaticContact CE2-CG 3.87Å; Y206-F229 HydrophobicContact CE2-CG 3.87Å; Y206-F229 AromaticContact CG-CD1 3.93Å; Y206-F229 HydrophobicContact CG-CD1 3.93Å; Y206-F229 AromaticContact CG-CE1 3.85Å; Y206-F229 HydrophobicContact CG-CE1 3.85Å; Y206-F229 AromaticContact CZ-CD1 3.31Å; Y206-Y230 PolarHBondContact OH-N 3.1Å; Y206-C233 HydrophobicContact CD2-CB 4.08Å; Y206-C233 HydrophobicContact CE2-CB 3.44Å; Y206-C233 VanDerWaalsContact CE2-CB 3.44Å; Y206-S237 PolarHBondContact N-OG 3.33Å; Y206-E240 WeakPolarHBondContact O-CB 3.29Å; Y206-E240 VanDerWaalsContact O-CG 3.31Å; Y206-E240 WeakPolarHBondContact O-CG 3.49Å; Y206-I241 HydrophobicContact CD2-CD1 4.15Å
207	T	91.8	Very high	85.2	Confident	43 Å²	43	45.4 Å²	45.4	26%	0.264	22%	0.216	S	C	.	.			trans	-60.4	163.8	177.5	64.6	0	0	0	0	111.9	K205 R209 K210 V211	K205-T207 VanDerWaalsContact C-N 3.26Å; K205-T207 HydrophobicContact CG-CG2 3.98Å; K205-T207 PolarHBondContact O-N 2.63Å; T207-R209 PolarHBondContact O-N 2.79Å; T207-R209 VanDerWaalsContact O-N 3.12Å; T207-K210 WeakPolarHBondContact O-CB 3.16Å; T207-K210 PolarHBondContact O-N 3.46Å; T207-K210 PolarHBondContact OG1-N 3.45Å; T207-V211 PolarHBondContact O-N 2.77Å
208	W	93.8	Very high	86.6	Confident	22 Å²	22	38 Å²	38	8%	0.083	18%	0.177	C	C	.	.	H	α-helix	trans	-47.9	-40.6	171.2	-72	117.7	0	0	0	112.7	K210 V211 L212 E239 E240 W243 V374 L521	W208-K210 PolarHBondContact O-N 3.36Å; W208-V211 HydrophobicContact CE3-CG2 3.82Å; W208-V211 HydrophobicContact CZ3-CG2 4.35Å; W208-V211 VanDerWaalsContact O-CG2 3.27Å; W208-V211 WeakPolarHBondContact O-CG2 3.36Å; W208-V211 PolarHBondContact O-N 2.8Å; W208-L212 WeakPolarHBondContact O-CB 3.21Å; W208-L212 WeakPolarHBondContact O-CG 3.38Å; W208-L212 PolarHBondContact O-N 2.85Å; W208-E239 HydrophobicContact CH2-CG 4.44Å; W208-E239 HydrophobicContact CZ2-CG 4.27Å; W208-E239 WeakPolarHBondContact CZ2-OE1 3.36Å; W208-E240 HydrophobicContact CD2-CG 3.86Å; W208-E240 HydrophobicContact CE3-CB 4.42Å; W208-E240 HydrophobicContact CE3-CG 4.03Å; W208-E240 HydrophobicContact CG-CG 4.36Å; W208-E240 HydrophobicContact CH2-CG 4.3Å; W208-E240 HydrophobicContact CZ2-CG 4.15Å; W208-E240 HydrophobicContact CZ3-CB 4.37Å; W208-E240 HydrophobicContact CZ3-CG 4.24Å; W208-W243 HydrophobicContact CH2-CB 3.73Å; W208-W243 HydrophobicContact CH2-CD2 4.42Å; W208-W243 AromaticContact CH2-CG 3.78Å; W208-W243 HydrophobicContact CH2-CG 3.78Å; W208-W243 HydrophobicContact CZ3-CB 3.66Å; W208-W243 AromaticContact CZ3-CD2 3.7Å; W208-W243 HydrophobicContact CZ3-CD2 3.7Å; W208-W243 HydrophobicContact CZ3-CE3 4.02Å; W208-W243 AromaticContact CZ3-CG 3.51Å; W208-W243 HydrophobicContact CZ3-CG 3.51Å; W208-V374 HydrophobicContact CB-CG1 4.15Å; W208-V374 HydrophobicContact CB-CG2 3.74Å; W208-V374 HydrophobicContact CG-CG2 4.48Å; W208-L521 HydrophobicContact CD2-CD2 3.5Å; W208-L521 HydrophobicContact CE3-CD2 3.51Å; W208-L521 HydrophobicContact CG-CD2 4.19Å; W208-L521 HydrophobicContact CH2-CD2 3.79Å; W208-L521 HydrophobicContact CZ2-CD2 3.78Å; W208-L521 HydrophobicContact CZ3-CD2 3.66Å
209	R	92	Very high	88	Confident	62 Å²	62	37.7 Å²	37.7	23%	0.234	17%	0.171	C	C	.	.	H	α-helix	trans	-60.5	-48.2	177.5	179.3	61.3	-156.1	-171	3.7	111.8	T207 L212 D213 R216 V374 T375 D519	T207-R209 PolarHBondContact O-N 2.79Å; T207-R209 VanDerWaalsContact O-N 3.12Å; R209-L212 PolarHBondContact O-N 2.89Å; R209-D213 IonicContact CZ-OD1 3.54Å; R209-D213 IonicContact CZ-OD2 3.44Å; R209-D213 VanDerWaalsContact CZ-OD2 3.24Å; R209-D213 VanDerWaalsContact NE-CG 3.3Å; R209-D213 IonicContact NE-OD1 3.01Å; R209-D213 PolarHBondContact NE-OD1 3.22Å; R209-D213 IonicContact NE-OD2 3.02Å; R209-D213 PolarHBondContact NE-OD2 2.98Å; R209-D213 IonicContact NH1-OD1 2.67Å; R209-D213 IonicContact NH2-OD1 3.25Å; R209-D213 PolarHBondContact NH2-OD1 2.8Å; R209-D213 IonicContact NH2-OD2 2.89Å; R209-D213 PolarHBondContact NH2-OD2 3.18Å; R209-D213 PolarHBondContact O-N 2.8Å; R209-R216 VanDerWaalsContact CZ-NH1 3.25Å; R209-V374 HydrophobicContact CB-CG1 3.69Å; R209-T375 WeakPolarHBondContact CD-O 3.44Å; R209-D519 IonicContact NH1-OD2 2.79Å; R209-D519 PolarHBondContact NH1-OD2 2.97Å
210	K	93.1	Very high	89.3	Confident	15 Å²	15	39.3 Å²	39.3	7%	0.065	19%	0.185	C	C	.	.	H	α-helix	trans	-59.5	-47.9	179.1	-71.4	-167.8	178.7	173.2	0	111.4	D158 W188 D204 Y206 T207 W208 L212 D213 M214	D158-K210 IonicContact OD2-NZ 2.63Å; D158-K210 PolarHBondContact OD2-NZ 3.13Å; W188-K210 HydrophobicContact CE3-CD 4.44Å; W188-K210 HydrophobicContact CH2-CB 3.6Å; W188-K210 HydrophobicContact CH2-CD 3.72Å; W188-K210 HydrophobicContact CH2-CG 3.42Å; W188-K210 VanDerWaalsContact CH2-CG 3.42Å; W188-K210 HydrophobicContact CZ2-CB 3.48Å; W188-K210 VanDerWaalsContact CZ2-CB 3.48Å; W188-K210 HydrophobicContact CZ2-CD 4.01Å; W188-K210 HydrophobicContact CZ2-CG 3.82Å; W188-K210 HydrophobicContact CZ3-CD 3.93Å; W188-K210 HydrophobicContact CZ3-CG 4.05Å; D204-K210 VanDerWaalsContact CG-NZ 3.29Å; D204-K210 WeakPolarHBondContact OD2-CE 3.13Å; D204-K210 IonicContact OD2-NZ 2.79Å; D204-K210 PolarHBondContact OD2-NZ 3.02Å; Y206-K210 HydrophobicContact CD1-CD 4.23Å; T207-K210 WeakPolarHBondContact O-CB 3.16Å; T207-K210 PolarHBondContact O-N 3.46Å; T207-K210 PolarHBondContact OG1-N 3.45Å; W208-K210 PolarHBondContact O-N 3.36Å; K210-L212 PolarHBondContact O-N 3.08Å; K210-D213 PolarHBondContact O-N 3.12Å; K210-M214 VanDerWaalsContact O-CG 3.27Å; K210-M214 WeakPolarHBondContact O-CG 3.33Å; K210-M214 PolarHBondContact O-N 3.17Å
211	V	94.8	Very high	90.6	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-69.9	-33.1	-179.1	-61.7	0	0	0	0	113.1	T207 W208 M214 L215 E240 L244	T207-V211 PolarHBondContact O-N 2.77Å; W208-V211 HydrophobicContact CE3-CG2 3.82Å; W208-V211 HydrophobicContact CZ3-CG2 4.35Å; W208-V211 VanDerWaalsContact O-CG2 3.27Å; W208-V211 WeakPolarHBondContact O-CG2 3.36Å; W208-V211 PolarHBondContact O-N 2.8Å; V211-M214 WeakPolarHBondContact O-CB 3.28Å; V211-M214 PolarHBondContact O-N 3.28Å; V211-L215 WeakPolarHBondContact O-CB 3.45Å; V211-L215 PolarHBondContact O-N 3.38Å; V211-E240 HydrophobicContact CG1-CB 3.8Å; V211-E240 HydrophobicContact CG2-CB 4.04Å; V211-L244 HydrophobicContact CB-CB 4.39Å; V211-L244 HydrophobicContact CB-CD2 4.4Å; V211-L244 HydrophobicContact CG1-CD2 4.45Å
212	L	95.2	Very high	91.4	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-68	-37.1	174.2	-70.9	-178.7	0	0	0	111.9	W208 R209 K210 L215 R216 W243 A342 L344 V374 D519	W208-L212 WeakPolarHBondContact O-CB 3.21Å; W208-L212 WeakPolarHBondContact O-CG 3.38Å; W208-L212 PolarHBondContact O-N 2.85Å; R209-L212 PolarHBondContact O-N 2.89Å; K210-L212 PolarHBondContact O-N 3.08Å; L212-L215 PolarHBondContact O-N 3.19Å; L212-R216 VanDerWaalsContact O-CG 3.32Å; L212-R216 WeakPolarHBondContact O-CG 3.47Å; L212-R216 PolarHBondContact O-N 3.37Å; L212-W243 HydrophobicContact CD2-CH2 3.56Å; L212-W243 HydrophobicContact CD2-CZ3 3.62Å; L212-A342 HydrophobicContact CD2-CB 4.38Å; L212-L344 HydrophobicContact CB-CD2 4.45Å; L212-L344 HydrophobicContact CD1-CD2 3.67Å; L212-L344 HydrophobicContact CD2-CD1 4.31Å; L212-L344 HydrophobicContact CD2-CD2 3.67Å; L212-L344 HydrophobicContact CG-CD2 4.12Å; L212-V374 HydrophobicContact CD1-CB 4.23Å; L212-V374 HydrophobicContact CD1-CG1 4.11Å; L212-V374 HydrophobicContact CD1-CG2 4.2Å; L212-D519 HydrophobicContact CD1-CB 4.04Å
213	D	93.2	Very high	91.9	Very high	39 Å²	39	32.3 Å²	32.3	21%	0.209	17%	0.165	C	C	.	.	H	α-helix	trans	-66.9	-38.4	173.8	-73.4	-16.2	0	0	0	112.3	R209 K210 L215 R216 V217	R209-D213 IonicContact CZ-OD1 3.54Å; R209-D213 IonicContact CZ-OD2 3.44Å; R209-D213 VanDerWaalsContact CZ-OD2 3.24Å; R209-D213 VanDerWaalsContact NE-CG 3.3Å; R209-D213 IonicContact NE-OD1 3.01Å; R209-D213 PolarHBondContact NE-OD1 3.22Å; R209-D213 IonicContact NE-OD2 3.02Å; R209-D213 PolarHBondContact NE-OD2 2.98Å; R209-D213 IonicContact NH1-OD1 2.67Å; R209-D213 IonicContact NH2-OD1 3.25Å; R209-D213 PolarHBondContact NH2-OD1 2.8Å; R209-D213 IonicContact NH2-OD2 2.89Å; R209-D213 PolarHBondContact NH2-OD2 3.18Å; R209-D213 PolarHBondContact O-N 2.8Å; K210-D213 PolarHBondContact O-N 3.12Å; D213-L215 VanDerWaalsContact C-N 3.34Å; D213-R216 PolarHBondContact O-N 2.79Å; D213-R216 IonicContact OD1-CZ 3.43Å; D213-R216 IonicContact OD1-NH1 3.32Å; D213-R216 PolarHBondContact OD1-NH1 2.68Å; D213-V217 PolarHBondContact O-N 3.33Å
214	M	95.7	Very high	92.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-59.7	-47.7	170.8	-65.6	171.5	71.6	0	0	111.4	F156 W188 K210 V211 R216 V217 V218 F227 F229 L244	F156-M214 HydrophobicContact CD1-CG 4.33Å; F156-M214 HydrophobicContact CD2-CG 3.86Å; F156-M214 HydrophobicContact CE1-CB 4.49Å; F156-M214 HydrophobicContact CE1-CG 4.13Å; F156-M214 HydrophobicContact CE2-CB 4.16Å; F156-M214 HydrophobicContact CE2-CE 4.49Å; F156-M214 HydrophobicContact CE2-CG 3.64Å; F156-M214 HydrophobicContact CG-CG 4.22Å; F156-M214 VanDerWaalsContact CZ-CA 3.47Å; F156-M214 HydrophobicContact CZ-CB 4.01Å; F156-M214 HydrophobicContact CZ-CG 3.82Å; W188-M214 HydrophobicContact CZ2-CG 3.89Å; W188-M214 HydrophobicContact CZ2-SD 3.94Å; W188-M214 PolarHBondContact NE1-SD 2.89Å; K210-M214 VanDerWaalsContact O-CG 3.27Å; K210-M214 WeakPolarHBondContact O-CG 3.33Å; K210-M214 PolarHBondContact O-N 3.17Å; V211-M214 WeakPolarHBondContact O-CB 3.28Å; V211-M214 PolarHBondContact O-N 3.28Å; M214-R216 PolarHBondContact O-N 3.37Å; M214-V217 PolarHBondContact O-N 3.23Å; M214-V218 WeakPolarHBondContact O-CG2 3.34Å; M214-V218 PolarHBondContact O-N 2.81Å; M214-F227 HydrophobicContact CB-CE1 4.11Å; M214-F227 HydrophobicContact CE-CB 3.84Å; M214-F227 HydrophobicContact CE-CD1 3.25Å; M214-F227 HydrophobicContact CE-CE1 3.98Å; M214-F227 HydrophobicContact CE-CG 3.8Å; M214-F229 HydrophobicContact CE-CD1 4.43Å; M214-F229 HydrophobicContact CE-CE1 3.46Å; M214-F229 VanDerWaalsContact CE-CE1 3.46Å; M214-F229 HydrophobicContact CE-CE2 4.35Å; M214-F229 HydrophobicContact CE-CZ 3.4Å; M214-F229 HydrophobicContact SD-CE1 3.56Å; M214-F229 VanDerWaalsContact SD-CE1 3.56Å; M214-F229 HydrophobicContact SD-CZ 3.8Å; M214-L244 HydrophobicContact CB-CD2 4.38Å; M214-L244 HydrophobicContact CE-CD2 4.11Å; M214-L244 HydrophobicContact SD-CD2 4.34Å
215	L	95.5	Very high	93.1	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-59.2	-48.5	179.7	-172.3	61.5	0	0	0	111.4	V211 L212 D213 V217 V218 Y219 W243 L244 A247 R248 I335 L344	V211-L215 WeakPolarHBondContact O-CB 3.45Å; V211-L215 PolarHBondContact O-N 3.38Å; L212-L215 PolarHBondContact O-N 3.19Å; D213-L215 VanDerWaalsContact C-N 3.34Å; L215-V217 VanDerWaalsContact C-N 3.26Å; L215-V217 PolarHBondContact O-N 2.87Å; L215-V218 PolarHBondContact O-N 3.5Å; L215-V218 VanDerWaalsContact O-N 3.13Å; L215-Y219 HydrophobicContact CD1-CD2 3.73Å; L215-Y219 HydrophobicContact CD2-CD2 4.4Å; L215-Y219 HydrophobicContact CG-CD2 3.95Å; L215-Y219 WeakPolarHBondContact O-CA 3.45Å; L215-Y219 WeakPolarHBondContact O-CB 3.1Å; L215-Y219 PolarHBondContact O-N 3.28Å; L215-W243 HydrophobicContact CD2-CH2 3.83Å; L215-W243 HydrophobicContact CD2-CZ3 3.82Å; L215-L244 HydrophobicContact CB-CD1 3.85Å; L215-L244 HydrophobicContact CD1-CD1 4Å; L215-L244 HydrophobicContact CG-CD1 4.44Å; L215-A247 HydrophobicContact CD1-CB 4.33Å; L215-A247 HydrophobicContact CD2-CB 3.96Å; L215-R248 HydrophobicContact CD1-CB 4.04Å; L215-I335 HydrophobicContact CD2-CD1 3.7Å; L215-I335 HydrophobicContact CG-CD1 4.35Å; L215-L344 HydrophobicContact CD2-CD1 4.47Å
216	R	94.1	Very high	93.2	Very high	47 Å²	47	28.1 Å²	28.1	18%	0.177	15%	0.145	C	C	.	.	H	α-helix	trans	-49	-46.9	178.5	-78.6	172.8	165	127.7	1.5	113.1	R209 L212 D213 M214 F331 D519	R209-R216 VanDerWaalsContact CZ-NH1 3.25Å; L212-R216 VanDerWaalsContact O-CG 3.32Å; L212-R216 WeakPolarHBondContact O-CG 3.47Å; L212-R216 PolarHBondContact O-N 3.37Å; D213-R216 PolarHBondContact O-N 2.79Å; D213-R216 IonicContact OD1-CZ 3.43Å; D213-R216 IonicContact OD1-NH1 3.32Å; D213-R216 PolarHBondContact OD1-NH1 2.68Å; M214-R216 PolarHBondContact O-N 3.37Å; R216-F331 HydrophobicContact CB-CD1 4.23Å; R216-F331 HydrophobicContact CB-CE1 4.48Å; R216-F331 HydrophobicContact CB-CG 4.36Å; R216-F331 HydrophobicContact CG-CB 4.32Å; R216-F331 HydrophobicContact CG-CD1 3.51Å; R216-F331 HydrophobicContact CG-CE1 3.9Å; R216-F331 HydrophobicContact CG-CG 4.01Å; R216-D519 IonicContact CZ-OD1 2.91Å; R216-D519 IonicContact CZ-OD2 3.31Å; R216-D519 VanDerWaalsContact CZ-OD2 3.27Å; R216-D519 IonicContact NH1-OD2 3.79Å; R216-D519 PolarHBondContact NH1-OD2 2.67Å; R216-D519 IonicContact NH2-OD1 3.79Å; R216-D519 PolarHBondContact NH2-OD1 2.77Å; R216-D519 IonicContact NH2-OD2 3.98Å; R216-D519 PolarHBondContact NH2-OD2 3.19Å
217	V	95	Very high	93.3	Very high	27 Å²	27	28.1 Å²	28.1	16%	0.164	15%	0.145	C	C	.	.	H	α-helix	trans	-68.6	-36.2	-175.8	166.9	0	0	0	0	112	F156 A168 V172 D213 M214 L215	F156-V217 HydrophobicContact CE1-CB 4.19Å; F156-V217 HydrophobicContact CE1-CG2 3.81Å; F156-V217 HydrophobicContact CZ-CB 3.98Å; F156-V217 HydrophobicContact CZ-CG1 4.16Å; F156-V217 HydrophobicContact CZ-CG2 4.12Å; A168-V217 HydrophobicContact CB-CG1 3.88Å; A168-V217 HydrophobicContact CB-CG2 3.88Å; V172-V217 HydrophobicContact CB-CG1 4.44Å; V172-V217 WeakPolarHBondContact CG1-O 3.35Å; V172-V217 HydrophobicContact CG2-CG1 3.63Å; D213-V217 PolarHBondContact O-N 3.33Å; M214-V217 PolarHBondContact O-N 3.23Å; L215-V217 VanDerWaalsContact C-N 3.26Å; L215-V217 PolarHBondContact O-N 2.87Å
218	V	95.8	Very high	93.2	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-111.2	-2	-170.7	-53.9	0	0	0	0	114.9	V172 V186 M214 L215 D220 A221 V225 F227 R248	V172-V218 HydrophobicContact CG2-CG1 4.14Å; V186-V218 HydrophobicContact CG1-CG1 4.32Å; V186-V218 HydrophobicContact CG2-CG1 4Å; M214-V218 WeakPolarHBondContact O-CG2 3.34Å; M214-V218 PolarHBondContact O-N 2.81Å; L215-V218 PolarHBondContact O-N 3.5Å; L215-V218 VanDerWaalsContact O-N 3.13Å; V218-D220 PolarHBondContact O-N 2.93Å; V218-A221 WeakPolarHBondContact O-CB 2.99Å; V218-A221 PolarHBondContact O-N 3.35Å; V218-V225 HydrophobicContact CB-CG1 4.22Å; V218-V225 HydrophobicContact CB-CG2 4.04Å; V218-V225 HydrophobicContact CG1-CG1 4.14Å; V218-V225 HydrophobicContact CG1-CG2 4.5Å; V218-V225 HydrophobicContact CG2-CG1 4.15Å; V218-V225 HydrophobicContact CG2-CG2 4.46Å; V218-F227 HydrophobicContact CG1-CE1 4.48Å; V218-F227 HydrophobicContact CG2-CE1 3.61Å; V218-F227 HydrophobicContact CG2-CZ 3.52Å; V218-R248 PolarHBondContact O-NE 2.87Å
219	Y	94	Very high	92.9	Very high	66 Å²	66	25.5 Å²	25.5	26%	0.259	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-49.8	-169.5	-175.5	-86.3	0	0	0	112.2	L215 A221 F331 I335	L215-Y219 HydrophobicContact CD1-CD2 3.73Å; L215-Y219 HydrophobicContact CD2-CD2 4.4Å; L215-Y219 HydrophobicContact CG-CD2 3.95Å; L215-Y219 WeakPolarHBondContact O-CA 3.45Å; L215-Y219 WeakPolarHBondContact O-CB 3.1Å; L215-Y219 PolarHBondContact O-N 3.28Å; Y219-A221 VanDerWaalsContact C-N 3.28Å; Y219-A221 PolarHBondContact O-N 3.23Å; Y219-F331 HydrophobicContact CD1-CE2 4.19Å; Y219-F331 HydrophobicContact CD1-CZ 4.08Å; Y219-F331 HydrophobicContact CD2-CZ 4.23Å; Y219-F331 HydrophobicContact CG-CE2 4.08Å; Y219-F331 AromaticContact CG-CZ 3.68Å; Y219-F331 HydrophobicContact CG-CZ 3.68Å; Y219-I335 HydrophobicContact CD2-CD1 3.59Å; Y219-I335 HydrophobicContact CD2-CG1 4.42Å; Y219-I335 HydrophobicContact CE2-CB 4.44Å; Y219-I335 HydrophobicContact CE2-CD1 3.36Å; Y219-I335 HydrophobicContact CE2-CG1 3.7Å; Y219-I335 HydrophobicContact CE2-CG2 3.86Å; Y219-I335 HydrophobicContact CG-CD1 4.45Å
220	D	91.9	Very high	92.5	Very high	107 Å²	107	22.8 Å²	22.8	57%	0.572	12%	0.122	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-1.1	-177.4	-63.6	-52.8	0	0	0	113.1	V218 P222 R333	V218-D220 PolarHBondContact O-N 2.93Å; D220-P222 WeakPolarHBondContact O-CD 3.47Å; D220-R333 IonicContact OD1-CZ 3.53Å; D220-R333 IonicContact OD1-NH1 2.75Å; D220-R333 PolarHBondContact OD1-NH1 2.9Å; D220-R333 IonicContact OD1-NH2 2.96Å; D220-R333 IonicContact OD2-NH1 3.41Å; D220-R333 PolarHBondContact OD2-NH1 3.3Å
221	A	93.9	Very high	91.9	Very high	9 Å²	9	22.1 Å²	22.1	7%	0.074	12%	0.119	C	C	.	.			trans	-65.1	121.5	176.5	0	0	0	0	0	109.7	V172 I184 V218 Y219 Q223 V225 R248	V172-A221 HydrophobicContact CG1-CB 3.89Å; I184-A221 HydrophobicContact CD1-CB 4.08Å; V218-A221 WeakPolarHBondContact O-CB 2.99Å; V218-A221 PolarHBondContact O-N 3.35Å; Y219-A221 VanDerWaalsContact C-N 3.28Å; Y219-A221 PolarHBondContact O-N 3.23Å; A221-Q223 VanDerWaalsContact C-N 3.26Å; A221-Q223 PolarHBondContact O-N 3.32Å; A221-V225 HydrophobicContact CB-CG2 4.46Å; A221-R248 PolarHBondContact O-NH2 3.34Å
222	P	91.4	Very high	91.2	Very high	97 Å²	97	22.4 Å²	22.4	63%	0.63	12%	0.121	S	C	*	.			trans	-70.7	-21.8	-177.3	26.9	-35.4	0	0	0	113.4	D220	D220-P222 WeakPolarHBondContact O-CD 3.47Å
223	Q	91.3	Very high	90.8	Very high	11 Å²	11	22.4 Å²	22.4	5%	0.051	12%	0.121	C	C	.	.	S	Bend	trans	-78.9	171.5	-175.1	-49	98	-53.1	0	0	112.8	T175 S176 P180 A182 A221 R248	T175-Q223 PolarHBondContact O-NE2 3.24Å; S176-Q223 PolarHBondContact OG-NE2 2.8Å; S176-Q223 PolarHBondContact OG-OE1 3.19Å; P180-Q223 WeakPolarHBondContact O-CG 3.29Å; A182-Q223 VanDerWaalsContact O-CB 3.27Å; A182-Q223 WeakPolarHBondContact O-CB 3.44Å; A182-Q223 WeakPolarHBondContact O-CG 3.12Å; A221-Q223 VanDerWaalsContact C-N 3.26Å; A221-Q223 PolarHBondContact O-N 3.32Å; Q223-R248 PolarHBondContact O-NH2 2.84Å
224	T	90.8	Very high	90.4	Very high	41 Å²	41	20.6 Å²	20.6	25%	0.252	11%	0.112	S	C	.	.			trans	-64.9	138.5	165.7	-63.1	0	0	0	0	109.8	I183 I184 N250 Y252	I183-T224 HydrophobicContact CD1-CG2 4.43Å; I183-T224 HydrophobicContact CG2-CG2 4.12Å; I183-T224 WeakPolarHBondContact CG2-O 2.86Å; I184-T224 PolarHBondContact N-O 3Å; T224-N250 WeakPolarHBondContact CA-O 3.44Å; T224-Y252 HydrophobicContact CG2-CD2 3.53Å; T224-Y252 HydrophobicContact CG2-CE2 3.55Å
225	V	92	Very high	89.9	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	138	175.8	174.5	0	0	0	0	110.4	I184 V186 V218 A221 F227 R248 N250 S251 Y252	I184-V225 HydrophobicContact CB-CG2 4.18Å; I184-V225 HydrophobicContact CG2-CG2 4.41Å; I184-V225 CarbonylContact O-C 3.6Å; I184-V225 VanDerWaalsContact O-CA 3.24Å; I184-V225 WeakPolarHBondContact O-CA 3.31Å; V186-V225 HydrophobicContact CG2-CG1 4.3Å; V218-V225 HydrophobicContact CB-CG1 4.22Å; V218-V225 HydrophobicContact CB-CG2 4.04Å; V218-V225 HydrophobicContact CG1-CG1 4.14Å; V218-V225 HydrophobicContact CG1-CG2 4.5Å; V218-V225 HydrophobicContact CG2-CG1 4.15Å; V218-V225 HydrophobicContact CG2-CG2 4.46Å; A221-V225 HydrophobicContact CB-CG2 4.46Å; V225-F227 HydrophobicContact CG1-CD1 4.18Å; V225-F227 HydrophobicContact CG1-CE1 3.93Å; V225-F227 HydrophobicContact CG1-CE2 4.39Å; V225-F227 HydrophobicContact CG1-CZ 4.05Å; V225-R248 VanDerWaalsContact CB-NH1 3.33Å; V225-R248 VanDerWaalsContact CG2-NH2 3.25Å; V225-N250 PolarHBondContact N-O 2.75Å; V225-N250 VanDerWaalsContact N-O 3.12Å; V225-S251 CarbonylContact O-C 3.58Å; V225-S251 VanDerWaalsContact O-CA 3.26Å; V225-S251 WeakPolarHBondContact O-CA 3.47Å; V225-Y252 PolarHBondContact O-N 3.13Å
226	I	91.5	Very high	89.4	Confident	4 Å²	4	26.1 Å²	26.1	2%	0.021	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	115.9	172.5	-63.8	175.7	0	0	0	109	F58 I183 I184 S185 V186 Y252 T254	F58-I226 HydrophobicContact CE2-CD1 3.9Å; F58-I226 HydrophobicContact CZ-CD1 4.31Å; I183-I226 HydrophobicContact CG2-CD1 3.63Å; I183-I226 HydrophobicContact CG2-CG1 3.73Å; I184-I226 PolarHBondContact O-N 3.26Å; S185-I226 CarbonylContact C-O 3.6Å; S185-I226 WeakPolarHBondContact CA-O 3.36Å; S185-I226 PolarHBondContact OG-O 2.84Å; V186-I226 PolarHBondContact N-O 2.75Å; I226-Y252 CarbonylContact C-O 3.52Å; I226-Y252 WeakPolarHBondContact CA-O 3.29Å; I226-T254 HydrophobicContact CG2-CG2 3.49Å; I226-T254 VanDerWaalsContact CG2-CG2 3.49Å; I226-T254 WeakPolarHBondContact CG2-OG1 3.39Å
227	F	93.6	Very high	89.3	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	119.6	171.1	-60.5	-65.6	0	0	0	110.1	V186 M214 V218 V225 F229 L244 L245 Y252 V253 T254	V186-F227 HydrophobicContact CG2-CD1 3.71Å; V186-F227 HydrophobicContact CG2-CE1 4.05Å; M214-F227 HydrophobicContact CB-CE1 4.11Å; M214-F227 HydrophobicContact CE-CB 3.84Å; M214-F227 HydrophobicContact CE-CD1 3.25Å; M214-F227 HydrophobicContact CE-CE1 3.98Å; M214-F227 HydrophobicContact CE-CG 3.8Å; V218-F227 HydrophobicContact CG1-CE1 4.48Å; V218-F227 HydrophobicContact CG2-CE1 3.61Å; V218-F227 HydrophobicContact CG2-CZ 3.52Å; V225-F227 HydrophobicContact CG1-CD1 4.18Å; V225-F227 HydrophobicContact CG1-CE1 3.93Å; V225-F227 HydrophobicContact CG1-CE2 4.39Å; V225-F227 HydrophobicContact CG1-CZ 4.05Å; F227-F229 HydrophobicContact CB-CD2 4.24Å; F227-F229 HydrophobicContact CB-CE2 3.64Å; F227-F229 HydrophobicContact CB-CZ 4.03Å; F227-L244 HydrophobicContact CD1-CD2 4.1Å; F227-L244 HydrophobicContact CD2-CD2 3.7Å; F227-L244 HydrophobicContact CD2-CG 4.08Å; F227-L244 HydrophobicContact CE1-CD2 4.03Å; F227-L244 HydrophobicContact CE2-CD1 4.05Å; F227-L244 HydrophobicContact CE2-CD2 3.63Å; F227-L244 HydrophobicContact CE2-CG 3.59Å; F227-L244 HydrophobicContact CG-CD2 3.91Å; F227-L244 HydrophobicContact CZ-CD1 3.82Å; F227-L244 HydrophobicContact CZ-CD2 3.78Å; F227-L244 HydrophobicContact CZ-CG 3.85Å; F227-L245 HydrophobicContact CD2-CD2 4.28Å; F227-Y252 PolarHBondContact N-O 3.16Å; F227-V253 HydrophobicContact CB-CG2 4.31Å; F227-V253 CarbonylContact O-C 3.57Å; F227-V253 WeakPolarHBondContact O-CA 3.21Å; F227-T254 PolarHBondContact O-N 3.18Å
228	S	89.3	Confident	88.9	Confident	10 Å²	10	24 Å²	24	7%	0.07	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	117.5	176.4	-61.4	0	0	0	0	109.8	S185 V186 T254	S185-S228 PolarHBondContact OG-OG 3.22Å; V186-S228 PolarHBondContact O-N 3.42Å; S228-T254 WeakPolarHBondContact CA-O 3.45Å; S228-T254 PolarHBondContact OG-OG1 2.88Å
229	F	87.6	Confident	88.5	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	145.1	179.2	-67.8	-62	0	0	0	111	Y206 M214 F227 A234 I241 L244 V253 T254 F255 A256	Y206-F229 AromaticContact CD1-CD1 3.86Å; Y206-F229 HydrophobicContact CD1-CD1 3.86Å; Y206-F229 AromaticContact CD1-CE1 3.82Å; Y206-F229 HydrophobicContact CD1-CE1 3.82Å; Y206-F229 AromaticContact CD2-CD1 3.71Å; Y206-F229 HydrophobicContact CD2-CD1 3.71Å; Y206-F229 HydrophobicContact CD2-CE1 4.01Å; Y206-F229 HydrophobicContact CD2-CG 4.35Å; Y206-F229 AromaticContact CE1-CD1 3.58Å; Y206-F229 HydrophobicContact CE1-CD1 3.58Å; Y206-F229 AromaticContact CE1-CE1 3.99Å; Y206-F229 HydrophobicContact CE1-CE1 3.99Å; Y206-F229 HydrophobicContact CE2-CB 3.81Å; Y206-F229 AromaticContact CE2-CD1 3.37Å; Y206-F229 HydrophobicContact CE2-CD1 3.37Å; Y206-F229 HydrophobicContact CE2-CE1 4.13Å; Y206-F229 AromaticContact CE2-CG 3.87Å; Y206-F229 HydrophobicContact CE2-CG 3.87Å; Y206-F229 AromaticContact CG-CD1 3.93Å; Y206-F229 HydrophobicContact CG-CD1 3.93Å; Y206-F229 AromaticContact CG-CE1 3.85Å; Y206-F229 HydrophobicContact CG-CE1 3.85Å; Y206-F229 AromaticContact CZ-CD1 3.31Å; M214-F229 HydrophobicContact CE-CD1 4.43Å; M214-F229 HydrophobicContact CE-CE1 3.46Å; M214-F229 VanDerWaalsContact CE-CE1 3.46Å; M214-F229 HydrophobicContact CE-CE2 4.35Å; M214-F229 HydrophobicContact CE-CZ 3.4Å; M214-F229 HydrophobicContact SD-CE1 3.56Å; M214-F229 VanDerWaalsContact SD-CE1 3.56Å; M214-F229 HydrophobicContact SD-CZ 3.8Å; F227-F229 HydrophobicContact CB-CD2 4.24Å; F227-F229 HydrophobicContact CB-CE2 3.64Å; F227-F229 HydrophobicContact CB-CZ 4.03Å; F229-A234 HydrophobicContact CB-CB 4.15Å; F229-I241 HydrophobicContact CD2-CD1 3.84Å; F229-I241 HydrophobicContact CD2-CG1 4.08Å; F229-I241 HydrophobicContact CD2-CG2 4.45Å; F229-I241 HydrophobicContact CE1-CG1 4.47Å; F229-I241 HydrophobicContact CE2-CB 4.44Å; F229-I241 HydrophobicContact CE2-CD1 4Å; F229-I241 HydrophobicContact CE2-CG1 3.7Å; F229-I241 HydrophobicContact CE2-CG2 4.04Å; F229-I241 HydrophobicContact CG-CD1 4.16Å; F229-I241 HydrophobicContact CZ-CD1 4.42Å; F229-I241 HydrophobicContact CZ-CG1 3.9Å; F229-L244 HydrophobicContact CZ-CD2 4.02Å; F229-V253 HydrophobicContact CD2-CB 4.44Å; F229-V253 HydrophobicContact CD2-CG1 3.66Å; F229-V253 HydrophobicContact CD2-CG2 3.88Å; F229-V253 HydrophobicContact CE2-CG1 4.36Å; F229-V253 HydrophobicContact CE2-CG2 3.72Å; F229-T254 PolarHBondContact N-O 3.32Å; F229-F255 HydrophobicContact CB-CD1 4.3Å; F229-F255 CarbonylContact O-C 3.48Å; F229-F255 WeakPolarHBondContact O-CA 3.32Å; F229-A256 PolarHBondContact O-N 3.04Å
230	Y	83.9	Confident	88.4	Confident	5 Å²	5	25.2 Å²	25.2	2%	0.02	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	127.8	167.4	177.6	-128	0	0	0	109.4	W190 R199 Y206 P232 C233 A234 F259	W190-Y230 HydrophobicContact CD2-CG 4.24Å; W190-Y230 HydrophobicContact CE3-CD1 4.05Å; W190-Y230 HydrophobicContact CE3-CG 4.18Å; W190-Y230 VanDerWaalsContact CH2-CB 3.42Å; W190-Y230 HydrophobicContact CH2-CD1 4.15Å; W190-Y230 HydrophobicContact CH2-CG 4.21Å; W190-Y230 HydrophobicContact CZ2-CG 4.24Å; W190-Y230 AromaticContact CZ3-CD1 3.81Å; W190-Y230 HydrophobicContact CZ3-CD1 3.81Å; W190-Y230 HydrophobicContact CZ3-CG 4.15Å; R199-Y230 PolarHBondContact O-OH 2.81Å; Y206-Y230 PolarHBondContact OH-N 3.1Å; Y230-P232 HydrophobicContact CD1-CB 4.19Å; Y230-P232 HydrophobicContact CD1-CG 4.15Å; Y230-P232 HydrophobicContact CE1-CB 3.75Å; Y230-P232 HydrophobicContact CE1-CG 3.54Å; Y230-P232 HydrophobicContact CE2-CG 4.01Å; Y230-P232 VanDerWaalsContact CZ-CD 3.47Å; Y230-P232 VanDerWaalsContact CZ-CG 3.46Å; Y230-C233 HydrophobicContact CD1-CB 4.37Å; Y230-C233 PolarHBondContact O-N 2.72Å; Y230-C233 VanDerWaalsContact O-N 3.13Å; Y230-A234 PolarHBondContact O-N 2.91Å; Y230-F259 HydrophobicContact CE2-CD2 4.17Å; Y230-F259 HydrophobicContact CE2-CE2 4.1Å; Y230-F259 WeakPolarHBondContact OH-CD2 3.27Å; Y230-F259 VanDerWaalsContact OH-CE2 3.3Å; Y230-F259 WeakPolarHBondContact OH-CE2 3.3Å
231	L	79.5	Confident	88.4	Confident	2 Å²	2	20.1 Å²	20.1	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-57.3	-48.6	-167.3	176.5	71.5	0	0	0	113.3	C233 A234 F235 F255 A256 D257 F264 I272 F280	L231-C233 VanDerWaalsContact C-N 3.32Å; L231-C233 PolarHBondContact O-N 3.3Å; L231-A234 WeakPolarHBondContact O-CB 3.48Å; L231-A234 PolarHBondContact O-N 3.43Å; L231-A234 VanDerWaalsContact O-N 3.14Å; L231-F235 HydrophobicContact CD1-CD2 4.42Å; L231-F235 HydrophobicContact CD1-CE1 4.45Å; L231-F235 HydrophobicContact CD1-CE2 3.68Å; L231-F235 HydrophobicContact CD1-CZ 3.7Å; L231-F235 HydrophobicContact CD2-CE2 4.14Å; L231-F235 HydrophobicContact CG-CD2 4.28Å; L231-F235 HydrophobicContact CG-CE2 3.57Å; L231-F235 HydrophobicContact CG-CZ 4.07Å; L231-F235 VanDerWaalsContact O-CD2 3.23Å; L231-F235 WeakPolarHBondContact O-CD2 3.33Å; L231-F235 PolarHBondContact O-N 2.76Å; L231-F255 HydrophobicContact CB-CB 4.19Å; L231-F255 HydrophobicContact CD1-CB 3.66Å; L231-F255 HydrophobicContact CD1-CD1 4.3Å; L231-F255 HydrophobicContact CD1-CD2 4.42Å; L231-F255 HydrophobicContact CD1-CG 3.87Å; L231-A256 PolarHBondContact N-O 3.25Å; L231-D257 HydrophobicContact CB-CB 4.3Å; L231-D257 HydrophobicContact CD2-CB 3.96Å; L231-F264 HydrophobicContact CD1-CE1 4.24Å; L231-F264 HydrophobicContact CD2-CE1 3.52Å; L231-F264 HydrophobicContact CD2-CZ 3.84Å; L231-F264 HydrophobicContact CG-CE1 4.45Å; L231-I272 HydrophobicContact CD1-CD1 3.92Å; L231-F280 HydrophobicContact CD1-CE1 4.24Å
232	P	80.6	Confident	88.1	Confident	6 Å²	6	21.7 Å²	21.7	4%	0.039	12%	0.122	C	C	.	.	H	α-helix	trans	-56.1	-41.4	175.6	-29.8	38.6	0	0	0	114.4	Y230	Y230-P232 HydrophobicContact CD1-CB 4.19Å; Y230-P232 HydrophobicContact CD1-CG 4.15Å; Y230-P232 HydrophobicContact CE1-CB 3.75Å; Y230-P232 HydrophobicContact CE1-CG 3.54Å; Y230-P232 HydrophobicContact CE2-CG 4.01Å; Y230-P232 VanDerWaalsContact CZ-CD 3.47Å; Y230-P232 VanDerWaalsContact CZ-CG 3.46Å
233	C	86.3	Confident	88.1	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-72.6	-30.8	177.8	-72.9	0	0	0	0	113	W190 C202 D204 Y206 Y230 L231 F235 V236 S237	W190-C233 HydrophobicContact CH2-CB 4.42Å; C202-C233 WeakPolarHBondContact CA-SG 3.49Å; C202-C233 HydrophobicContact CB-CB 3.98Å; C202-C233 WeakPolarHBondContact CB-SG 3.15Å; C202-C233 WeakPolarHBondContact SG-CA 3.32Å; C202-C233 WeakPolarHBondContact SG-CB 3.43Å; C202-C233 CovalentContact SG-SG 2.05Å; C202-C233 PolarHBondContact SG-SG 2.79Å; D204-C233 PolarHBondContact O-SG 3Å; Y206-C233 HydrophobicContact CD2-CB 4.08Å; Y206-C233 HydrophobicContact CE2-CB 3.44Å; Y206-C233 VanDerWaalsContact CE2-CB 3.44Å; Y230-C233 HydrophobicContact CD1-CB 4.37Å; Y230-C233 PolarHBondContact O-N 2.72Å; Y230-C233 VanDerWaalsContact O-N 3.13Å; L231-C233 VanDerWaalsContact C-N 3.32Å; L231-C233 PolarHBondContact O-N 3.3Å; C233-F235 VanDerWaalsContact C-N 3.33Å; C233-F235 PolarHBondContact O-N 2.86Å; C233-V236 VanDerWaalsContact O-CG2 3.29Å; C233-V236 WeakPolarHBondContact O-CG2 3.46Å; C233-V236 PolarHBondContact O-N 3.06Å; C233-S237 WeakPolarHBondContact O-CB 3.49Å; C233-S237 PolarHBondContact O-N 2.88Å; C233-S237 PolarHBondContact O-OG 3.01Å
234	A	85.9	Confident	88.2	Confident	1 Å²	1	16.9 Å²	16.9	1%	0.008	9%	0.091	C	C	.	.	H	α-helix	trans	-63.4	-39.5	176	0	0	0	0	0	112.3	F229 Y230 L231 V236 S237 L238 I241 F255	F229-A234 HydrophobicContact CB-CB 4.15Å; Y230-A234 PolarHBondContact O-N 2.91Å; L231-A234 WeakPolarHBondContact O-CB 3.48Å; L231-A234 PolarHBondContact O-N 3.43Å; L231-A234 VanDerWaalsContact O-N 3.14Å; A234-V236 VanDerWaalsContact C-N 3.27Å; A234-V236 PolarHBondContact O-N 3.41Å; A234-S237 CarbonylContact O-C 3.57Å; A234-S237 PolarHBondContact O-N 2.72Å; A234-L238 WeakPolarHBondContact O-CD2 3.3Å; A234-L238 PolarHBondContact O-N 3.42Å; A234-I241 HydrophobicContact CB-CD1 3.7Å; A234-F255 HydrophobicContact CB-CD1 3.51Å; A234-F255 HydrophobicContact CB-CE1 3.43Å; A234-F255 VanDerWaalsContact CB-CE1 3.43Å
235	F	83.9	Confident	88.1	Confident	31 Å²	31	15.3 Å²	15.3	14%	0.136	8%	0.08	C	C	.	.	H	α-helix	trans	-61	-34	179.7	-73.2	-56.6	0	0	0	114.2	L231 C233 S237 L238 F264 D268 A271 I272	L231-F235 HydrophobicContact CD1-CD2 4.42Å; L231-F235 HydrophobicContact CD1-CE1 4.45Å; L231-F235 HydrophobicContact CD1-CE2 3.68Å; L231-F235 HydrophobicContact CD1-CZ 3.7Å; L231-F235 HydrophobicContact CD2-CE2 4.14Å; L231-F235 HydrophobicContact CG-CD2 4.28Å; L231-F235 HydrophobicContact CG-CE2 3.57Å; L231-F235 HydrophobicContact CG-CZ 4.07Å; L231-F235 VanDerWaalsContact O-CD2 3.23Å; L231-F235 WeakPolarHBondContact O-CD2 3.33Å; L231-F235 PolarHBondContact O-N 2.76Å; C233-F235 VanDerWaalsContact C-N 3.33Å; C233-F235 PolarHBondContact O-N 2.86Å; F235-S237 VanDerWaalsContact C-N 3.3Å; F235-L238 WeakPolarHBondContact O-CG 3.21Å; F235-F264 HydrophobicContact CZ-CD1 4.32Å; F235-F264 HydrophobicContact CZ-CE1 4.31Å; F235-D268 HydrophobicContact CE1-CB 3.77Å; F235-D268 WeakPolarHBondContact CE1-O 3.27Å; F235-D268 HydrophobicContact CE2-CB 4.41Å; F235-D268 HydrophobicContact CZ-CB 3.56Å; F235-A271 HydrophobicContact CD1-CB 4.1Å; F235-A271 HydrophobicContact CE1-CB 4.31Å; F235-I272 HydrophobicContact CD1-CG1 4.43Å; F235-I272 HydrophobicContact CE1-CD1 3.52Å; F235-I272 HydrophobicContact CE1-CG1 3.61Å; F235-I272 HydrophobicContact CZ-CD1 3.63Å; F235-I272 HydrophobicContact CZ-CG1 4.24Å
236	V	86	Confident	87.9	Confident	85 Å²	85	17.4 Å²	17.4	52%	0.515	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	4.2	178.2	-60.9	0	0	0	0	112.9	C202 K205 C233 A234	C202-V236 HydrophobicContact CB-CG2 4.11Å; K205-V236 HydrophobicContact CB-CG2 3.79Å; C233-V236 VanDerWaalsContact O-CG2 3.29Å; C233-V236 WeakPolarHBondContact O-CG2 3.46Å; C233-V236 PolarHBondContact O-N 3.06Å; A234-V236 VanDerWaalsContact C-N 3.27Å; A234-V236 PolarHBondContact O-N 3.41Å
237	S	90.5	Very high	87.9	Confident	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.8	26.6	-176.8	-34.6	0	0	0	0	112.7	K205 Y206 C233 A234 F235 E239 E240 I241	K205-S237 WeakPolarHBondContact CB-OG 3.47Å; Y206-S237 PolarHBondContact N-OG 3.33Å; C233-S237 WeakPolarHBondContact O-CB 3.49Å; C233-S237 PolarHBondContact O-N 2.88Å; C233-S237 PolarHBondContact O-OG 3.01Å; A234-S237 CarbonylContact O-C 3.57Å; A234-S237 PolarHBondContact O-N 2.72Å; F235-S237 VanDerWaalsContact C-N 3.3Å; S237-E239 PolarHBondContact O-N 3.08Å; S237-E240 VanDerWaalsContact CA-OE2 3.26Å; S237-E240 WeakPolarHBondContact CA-OE2 3.33Å; S237-E240 PolarHBondContact O-N 3.2Å; S237-I241 WeakPolarHBondContact O-CB 3.16Å; S237-I241 WeakPolarHBondContact O-CG1 3.47Å; S237-I241 PolarHBondContact O-N 3.49Å
238	L	86.7	Confident	87.7	Confident	29 Å²	29	18.1 Å²	18.1	15%	0.152	10%	0.095	C	C	.	.	H	α-helix	trans	-60.4	-35.8	-174.3	-62.1	170.1	0	0	0	111.9	A234 F235 N242 A271 I275	A234-L238 WeakPolarHBondContact O-CD2 3.3Å; A234-L238 PolarHBondContact O-N 3.42Å; F235-L238 WeakPolarHBondContact O-CG 3.21Å; L238-N242 VanDerWaalsContact O-CB 3.27Å; L238-N242 WeakPolarHBondContact O-CB 3.35Å; L238-N242 VanDerWaalsContact O-CG 3.29Å; L238-N242 PolarHBondContact O-N 3.25Å; L238-N242 PolarHBondContact O-ND2 3.31Å; L238-A271 HydrophobicContact CD1-CB 3.62Å; L238-A271 HydrophobicContact CD2-CB 4.5Å; L238-I275 HydrophobicContact CD2-CD1 3.43Å; L238-I275 VanDerWaalsContact CD2-CD1 3.43Å; L238-I275 HydrophobicContact CD2-CG1 4.11Å
239	E	87.3	Confident	87.3	Confident	85 Å²	85	21.8 Å²	21.8	40%	0.397	12%	0.119	S	C	.	.	H	α-helix	trans	-64.9	-52.3	179.8	-176.6	-179.2	101.5	0	0	111.1	W208 S237 I241 N242 W243 R523	W208-E239 HydrophobicContact CH2-CG 4.44Å; W208-E239 HydrophobicContact CZ2-CG 4.27Å; W208-E239 WeakPolarHBondContact CZ2-OE1 3.36Å; S237-E239 PolarHBondContact O-N 3.08Å; E239-I241 VanDerWaalsContact C-N 3.28Å; E239-I241 PolarHBondContact O-N 2.81Å; E239-N242 PolarHBondContact O-N 2.97Å; E239-W243 WeakPolarHBondContact O-CB 3.43Å; E239-W243 PolarHBondContact O-N 3.47Å; E239-R523 VanDerWaalsContact CD-CZ 3.43Å; E239-R523 VanDerWaalsContact CD-NH1 3.32Å; E239-R523 IonicContact OE1-CZ 2.63Å; E239-R523 IonicContact OE1-NH1 3.51Å; E239-R523 PolarHBondContact OE1-NH1 2.67Å; E239-R523 IonicContact OE1-NH2 3.01Å; E239-R523 PolarHBondContact OE1-NH2 3.37Å; E239-R523 IonicContact OE2-CZ 3.19Å; E239-R523 IonicContact OE2-NH1 2.61Å; E239-R523 PolarHBondContact OE2-NH1 3.27Å; E239-R523 IonicContact OE2-NH2 3.5Å; E239-R523 PolarHBondContact OE2-NH2 2.83Å
240	E	92.1	Very high	87.1	Confident	7 Å²	7	26.3 Å²	26.3	3%	0.033	14%	0.143	C	C	.	.	H	α-helix	trans	-62.1	-38.6	179.3	-62.1	93.1	153.5	0	0	111.2	K205 Y206 W208 V211 S237 L244	K205-E240 IonicContact NZ-OE1 2.8Å; K205-E240 PolarHBondContact NZ-OE1 3.44Å; Y206-E240 WeakPolarHBondContact O-CB 3.29Å; Y206-E240 VanDerWaalsContact O-CG 3.31Å; Y206-E240 WeakPolarHBondContact O-CG 3.49Å; W208-E240 HydrophobicContact CD2-CG 3.86Å; W208-E240 HydrophobicContact CE3-CB 4.42Å; W208-E240 HydrophobicContact CE3-CG 4.03Å; W208-E240 HydrophobicContact CG-CG 4.36Å; W208-E240 HydrophobicContact CH2-CG 4.3Å; W208-E240 HydrophobicContact CZ2-CG 4.15Å; W208-E240 HydrophobicContact CZ3-CB 4.37Å; W208-E240 HydrophobicContact CZ3-CG 4.24Å; V211-E240 HydrophobicContact CG1-CB 3.8Å; V211-E240 HydrophobicContact CG2-CB 4.04Å; S237-E240 VanDerWaalsContact CA-OE2 3.26Å; S237-E240 WeakPolarHBondContact CA-OE2 3.33Å; S237-E240 PolarHBondContact O-N 3.2Å; E240-L244 WeakPolarHBondContact O-CB 3.48Å; E240-L244 PolarHBondContact O-N 3.03Å
241	I	91.8	Very high	87.3	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-66.8	-46.6	176.6	-70	171.4	0	0	0	111.5	Y206 F229 A234 S237 E239 W243 L244 L245 V253 I275	Y206-I241 HydrophobicContact CD2-CD1 4.15Å; F229-I241 HydrophobicContact CD2-CD1 3.84Å; F229-I241 HydrophobicContact CD2-CG1 4.08Å; F229-I241 HydrophobicContact CD2-CG2 4.45Å; F229-I241 HydrophobicContact CE1-CG1 4.47Å; F229-I241 HydrophobicContact CE2-CB 4.44Å; F229-I241 HydrophobicContact CE2-CD1 4Å; F229-I241 HydrophobicContact CE2-CG1 3.7Å; F229-I241 HydrophobicContact CE2-CG2 4.04Å; F229-I241 HydrophobicContact CG-CD1 4.16Å; F229-I241 HydrophobicContact CZ-CD1 4.42Å; F229-I241 HydrophobicContact CZ-CG1 3.9Å; A234-I241 HydrophobicContact CB-CD1 3.7Å; S237-I241 WeakPolarHBondContact O-CB 3.16Å; S237-I241 WeakPolarHBondContact O-CG1 3.47Å; S237-I241 PolarHBondContact O-N 3.49Å; E239-I241 VanDerWaalsContact C-N 3.28Å; E239-I241 PolarHBondContact O-N 2.81Å; I241-W243 VanDerWaalsContact C-N 3.31Å; I241-W243 PolarHBondContact O-N 3.23Å; I241-L244 WeakPolarHBondContact O-CB 3.42Å; I241-L244 PolarHBondContact O-N 2.87Å; I241-L245 HydrophobicContact CG2-CD1 4.34Å; I241-L245 WeakPolarHBondContact O-CG 3.42Å; I241-L245 PolarHBondContact O-N 2.92Å; I241-V253 HydrophobicContact CG2-CG2 3.68Å; I241-I275 HydrophobicContact CG2-CD1 4.01Å
242	N	88.2	Confident	87.6	Confident	41 Å²	41	27.1 Å²	27.1	22%	0.219	15%	0.146	C	C	.	.	H	α-helix	trans	-62.9	-41.6	178.1	-81.9	-39.1	0	0	0	111.3	L238 E239 L244 L245 L246 I275	L238-N242 VanDerWaalsContact O-CB 3.27Å; L238-N242 WeakPolarHBondContact O-CB 3.35Å; L238-N242 VanDerWaalsContact O-CG 3.29Å; L238-N242 PolarHBondContact O-N 3.25Å; L238-N242 PolarHBondContact O-ND2 3.31Å; E239-N242 PolarHBondContact O-N 2.97Å; N242-L244 VanDerWaalsContact C-N 3.34Å; N242-L244 PolarHBondContact O-N 3.28Å; N242-L245 PolarHBondContact O-N 2.96Å; N242-L246 WeakPolarHBondContact O-CG 3.21Å; N242-L246 PolarHBondContact O-N 3.24Å; N242-I275 WeakPolarHBondContact OD1-CA 3.38Å
243	W	90.9	Very high	87.9	Confident	8 Å²	8	26.9 Å²	26.9	3%	0.03	14%	0.144	C	C	.	.	H	α-helix	trans	-59	-45.8	174.5	-176.1	96.7	0	0	0	111.5	W208 L212 L215 E239 I241 L245 L246 A247 A337 D340 A342 L521	W208-W243 HydrophobicContact CH2-CB 3.73Å; W208-W243 HydrophobicContact CH2-CD2 4.42Å; W208-W243 AromaticContact CH2-CG 3.78Å; W208-W243 HydrophobicContact CH2-CG 3.78Å; W208-W243 HydrophobicContact CZ3-CB 3.66Å; W208-W243 AromaticContact CZ3-CD2 3.7Å; W208-W243 HydrophobicContact CZ3-CD2 3.7Å; W208-W243 HydrophobicContact CZ3-CE3 4.02Å; W208-W243 AromaticContact CZ3-CG 3.51Å; W208-W243 HydrophobicContact CZ3-CG 3.51Å; L212-W243 HydrophobicContact CD2-CH2 3.56Å; L212-W243 HydrophobicContact CD2-CZ3 3.62Å; L215-W243 HydrophobicContact CD2-CH2 3.83Å; L215-W243 HydrophobicContact CD2-CZ3 3.82Å; E239-W243 WeakPolarHBondContact O-CB 3.43Å; E239-W243 PolarHBondContact O-N 3.47Å; I241-W243 VanDerWaalsContact C-N 3.31Å; I241-W243 PolarHBondContact O-N 3.23Å; W243-L245 VanDerWaalsContact C-N 3.31Å; W243-L245 PolarHBondContact O-N 3.01Å; W243-L246 PolarHBondContact O-N 3.37Å; W243-L246 VanDerWaalsContact O-N 3.14Å; W243-A247 HydrophobicContact CD2-CB 4.5Å; W243-A247 HydrophobicContact CE3-CB 4.14Å; W243-A247 HydrophobicContact CH2-CB 3.9Å; W243-A247 HydrophobicContact CZ2-CB 4.29Å; W243-A247 HydrophobicContact CZ3-CB 3.83Å; W243-A247 WeakPolarHBondContact O-CB 3.44Å; W243-A247 PolarHBondContact O-N 3.29Å; W243-A337 HydrophobicContact CD2-CB 4.13Å; W243-A337 HydrophobicContact CG-CB 4.15Å; W243-A337 HydrophobicContact CZ2-CB 4.17Å; W243-D340 VanDerWaalsContact CD1-OD2 3.31Å; W243-A342 HydrophobicContact CH2-CB 3.76Å; W243-A342 HydrophobicContact CZ2-CB 3.58Å; W243-L521 HydrophobicContact CZ2-CD1 3.89Å
244	L	93.7	Very high	87.6	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-58.3	-42.4	177.5	177.3	62.7	0	0	0	112.2	V211 M214 L215 F227 F229 E240 I241 N242 L246 A247 R248	V211-L244 HydrophobicContact CB-CB 4.39Å; V211-L244 HydrophobicContact CB-CD2 4.4Å; V211-L244 HydrophobicContact CG1-CD2 4.45Å; M214-L244 HydrophobicContact CB-CD2 4.38Å; M214-L244 HydrophobicContact CE-CD2 4.11Å; M214-L244 HydrophobicContact SD-CD2 4.34Å; L215-L244 HydrophobicContact CB-CD1 3.85Å; L215-L244 HydrophobicContact CD1-CD1 4Å; L215-L244 HydrophobicContact CG-CD1 4.44Å; F227-L244 HydrophobicContact CD1-CD2 4.1Å; F227-L244 HydrophobicContact CD2-CD2 3.7Å; F227-L244 HydrophobicContact CD2-CG 4.08Å; F227-L244 HydrophobicContact CE1-CD2 4.03Å; F227-L244 HydrophobicContact CE2-CD1 4.05Å; F227-L244 HydrophobicContact CE2-CD2 3.63Å; F227-L244 HydrophobicContact CE2-CG 3.59Å; F227-L244 HydrophobicContact CG-CD2 3.91Å; F227-L244 HydrophobicContact CZ-CD1 3.82Å; F227-L244 HydrophobicContact CZ-CD2 3.78Å; F227-L244 HydrophobicContact CZ-CG 3.85Å; F229-L244 HydrophobicContact CZ-CD2 4.02Å; E240-L244 WeakPolarHBondContact O-CB 3.48Å; E240-L244 PolarHBondContact O-N 3.03Å; I241-L244 WeakPolarHBondContact O-CB 3.42Å; I241-L244 PolarHBondContact O-N 2.87Å; N242-L244 VanDerWaalsContact C-N 3.34Å; N242-L244 PolarHBondContact O-N 3.28Å; L244-L246 VanDerWaalsContact C-N 3.32Å; L244-L246 PolarHBondContact O-N 2.88Å; L244-A247 PolarHBondContact O-N 3.38Å; L244-R248 PolarHBondContact O-N 2.92Å; L244-R248 VanDerWaalsContact O-N 3.16Å
245	L	89.3	Confident	87.2	Confident	7 Å²	7	27 Å²	27	4%	0.037	15%	0.145	C	C	.	.	H	α-helix	trans	-67.9	-31.1	178.4	-69.9	178.8	0	0	0	113.4	F227 I241 N242 W243 R248 S251 V253 I275 R277	F227-L245 HydrophobicContact CD2-CD2 4.28Å; I241-L245 HydrophobicContact CG2-CD1 4.34Å; I241-L245 WeakPolarHBondContact O-CG 3.42Å; I241-L245 PolarHBondContact O-N 2.92Å; N242-L245 PolarHBondContact O-N 2.96Å; W243-L245 VanDerWaalsContact C-N 3.31Å; W243-L245 PolarHBondContact O-N 3.01Å; L245-R248 CarbonylContact O-C 3.48Å; L245-R248 VanDerWaalsContact O-O 3.11Å; L245-S251 VanDerWaalsContact CD2-OG 3.29Å; L245-S251 WeakPolarHBondContact CD2-OG 3.48Å; L245-V253 HydrophobicContact CD1-CG2 3.82Å; L245-V253 HydrophobicContact CD2-CG2 3.94Å; L245-V253 HydrophobicContact CG-CG2 4.09Å; L245-I275 HydrophobicContact CD1-CG2 3.59Å; L245-R277 HydrophobicContact CD1-CB 4.26Å
246	L	87.3	Confident	86.7	Confident	45 Å²	45	26.7 Å²	26.7	24%	0.236	15%	0.148	C	C	.	.	H	α-helix	trans	-75.8	-42.3	174.1	-72.5	173.1	0	0	0	111.8	N242 W243 L244 R248 A337	N242-L246 WeakPolarHBondContact O-CG 3.21Å; N242-L246 PolarHBondContact O-N 3.24Å; W243-L246 PolarHBondContact O-N 3.37Å; W243-L246 VanDerWaalsContact O-N 3.14Å; L244-L246 VanDerWaalsContact C-N 3.32Å; L244-L246 PolarHBondContact O-N 2.88Å; L246-R248 PolarHBondContact O-N 3.07Å; L246-A337 HydrophobicContact CB-CB 3.84Å
247	A	91	Very high	85.8	Confident	6 Å²	6	23 Å²	23	5%	0.05	13%	0.125	C	C	.	.	H	α-helix	trans	-61	-28	177.5	0	0	0	0	0	112.2	L215 W243 L244 I335 A337	L215-A247 HydrophobicContact CD1-CB 4.33Å; L215-A247 HydrophobicContact CD2-CB 3.96Å; W243-A247 HydrophobicContact CD2-CB 4.5Å; W243-A247 HydrophobicContact CE3-CB 4.14Å; W243-A247 HydrophobicContact CH2-CB 3.9Å; W243-A247 HydrophobicContact CZ2-CB 4.29Å; W243-A247 HydrophobicContact CZ3-CB 3.83Å; W243-A247 WeakPolarHBondContact O-CB 3.44Å; W243-A247 PolarHBondContact O-N 3.29Å; L244-A247 PolarHBondContact O-N 3.38Å; A247-I335 HydrophobicContact CB-CG2 4.27Å; A247-A337 HydrophobicContact CB-CB 3.94Å
248	R	89	Confident	84.3	Confident	13 Å²	13	28.2 Å²	28.2	5%	0.049	15%	0.149	C	C	.	.	S	Bend	trans	-126.3	92.9	177.8	-166.6	177.7	-179.7	-68.7	-6.4	111.9	L215 V218 A221 Q223 V225 L244 L245 L246 N250 S251	L215-R248 HydrophobicContact CD1-CB 4.04Å; V218-R248 PolarHBondContact O-NE 2.87Å; A221-R248 PolarHBondContact O-NH2 3.34Å; Q223-R248 PolarHBondContact O-NH2 2.84Å; V225-R248 VanDerWaalsContact CB-NH1 3.33Å; V225-R248 VanDerWaalsContact CG2-NH2 3.25Å; L244-R248 PolarHBondContact O-N 2.92Å; L244-R248 VanDerWaalsContact O-N 3.16Å; L245-R248 CarbonylContact O-C 3.48Å; L245-R248 VanDerWaalsContact O-O 3.11Å; L246-R248 PolarHBondContact O-N 3.07Å; R248-N250 VanDerWaalsContact NH1-C 3.3Å; R248-N250 PolarHBondContact NH1-O 3.4Å; R248-N250 PolarHBondContact O-N 3.47Å; R248-S251 WeakPolarHBondContact O-CB 3.12Å; R248-S251 PolarHBondContact O-N 3.36Å; R248-S251 VanDerWaalsContact O-N 3.09Å; R248-S251 PolarHBondContact O-OG 3.21Å
249	P	80.8	Confident	82.9	Confident	86 Å²	86	28.9 Å²	28.9	56%	0.558	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-24	-171.3	-29.9	35.8	0	0	0	117.2	R277	P249-R277 PolarHBondContact O-NH1 3.41Å
250	N	85.2	Confident	81.4	Confident	96 Å²	96	30 Å²	30	51%	0.513	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	39.2	177.6	-70.6	-20.6	0	0	0	112.5	T224 V225 R248	T224-N250 WeakPolarHBondContact CA-O 3.44Å; V225-N250 PolarHBondContact N-O 2.75Å; V225-N250 VanDerWaalsContact N-O 3.12Å; R248-N250 VanDerWaalsContact NH1-C 3.3Å; R248-N250 PolarHBondContact NH1-O 3.4Å; R248-N250 PolarHBondContact O-N 3.47Å
251	S	87.5	Confident	79.6	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	152.4	177.8	66.1	0	0	0	0	112.7	V225 L245 R248	V225-S251 CarbonylContact O-C 3.58Å; V225-S251 VanDerWaalsContact O-CA 3.26Å; V225-S251 WeakPolarHBondContact O-CA 3.47Å; L245-S251 VanDerWaalsContact CD2-OG 3.29Å; L245-S251 WeakPolarHBondContact CD2-OG 3.48Å; R248-S251 WeakPolarHBondContact O-CB 3.12Å; R248-S251 PolarHBondContact O-N 3.36Å; R248-S251 VanDerWaalsContact O-N 3.09Å; R248-S251 PolarHBondContact O-OG 3.21Å
252	Y	86.6	Confident	78.1	Confident	24 Å²	24	38 Å²	38	9%	0.094	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	162	179.5	-60.7	-93.4	0	0	0	109.6	F58 T224 V225 I226 F227 R277	F58-Y252 AromaticContact CD1-CD1 3.75Å; F58-Y252 HydrophobicContact CD1-CD1 3.75Å; F58-Y252 HydrophobicContact CD1-CE1 4.34Å; F58-Y252 HydrophobicContact CD1-CG 4.23Å; F58-Y252 AromaticContact CE1-CD1 3.79Å; F58-Y252 HydrophobicContact CE1-CD1 3.79Å; F58-Y252 AromaticContact CE1-CG 3.95Å; F58-Y252 HydrophobicContact CE1-CG 3.95Å; T224-Y252 HydrophobicContact CG2-CD2 3.53Å; T224-Y252 HydrophobicContact CG2-CE2 3.55Å; V225-Y252 PolarHBondContact O-N 3.13Å; I226-Y252 CarbonylContact C-O 3.52Å; I226-Y252 WeakPolarHBondContact CA-O 3.29Å; F227-Y252 PolarHBondContact N-O 3.16Å; Y252-R277 WeakPolarHBondContact CA-O 3.43Å; Y252-R277 HydrophobicContact CD1-CB 4.04Å; Y252-R277 HydrophobicContact CE1-CB 4.48Å
253	V	85.2	Confident	76.7	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	143.6	173.4	168.7	0	0	0	0	111.2	F227 F229 I241 L245 F255 R277 F278 G279	F227-V253 HydrophobicContact CB-CG2 4.31Å; F227-V253 CarbonylContact O-C 3.57Å; F227-V253 WeakPolarHBondContact O-CA 3.21Å; F229-V253 HydrophobicContact CD2-CB 4.44Å; F229-V253 HydrophobicContact CD2-CG1 3.66Å; F229-V253 HydrophobicContact CD2-CG2 3.88Å; F229-V253 HydrophobicContact CE2-CG1 4.36Å; F229-V253 HydrophobicContact CE2-CG2 3.72Å; I241-V253 HydrophobicContact CG2-CG2 3.68Å; L245-V253 HydrophobicContact CD1-CG2 3.82Å; L245-V253 HydrophobicContact CD2-CG2 3.94Å; L245-V253 HydrophobicContact CG-CG2 4.09Å; V253-F255 HydrophobicContact CB-CZ 4.34Å; V253-F255 HydrophobicContact CG1-CD1 3.78Å; V253-F255 HydrophobicContact CG1-CD2 4.43Å; V253-F255 HydrophobicContact CG1-CE1 3.29Å; V253-F255 HydrophobicContact CG1-CE2 4.02Å; V253-F255 HydrophobicContact CG1-CG 4.31Å; V253-F255 HydrophobicContact CG1-CZ 3.42Å; V253-F255 VanDerWaalsContact CG1-CZ 3.42Å; V253-R277 PolarHBondContact N-O 3.3Å; V253-F278 CarbonylContact O-C 3.5Å; V253-F278 WeakPolarHBondContact O-CA 3.05Å; V253-G279 PolarHBondContact O-N 3.45Å
254	T	80.8	Confident	75.5	Confident	2 Å²	2	43 Å²	43	1%	0.012	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	130	158.9	51.8	0	0	0	0	110.8	F55 F58 I226 F227 S228 F229 G279	F55-T254 HydrophobicContact CE2-CG2 3.57Å; F55-T254 HydrophobicContact CZ-CG2 3.63Å; F58-T254 HydrophobicContact CE2-CG2 4.32Å; F58-T254 HydrophobicContact CZ-CG2 3.87Å; I226-T254 HydrophobicContact CG2-CG2 3.49Å; I226-T254 VanDerWaalsContact CG2-CG2 3.49Å; I226-T254 WeakPolarHBondContact CG2-OG1 3.39Å; F227-T254 PolarHBondContact O-N 3.18Å; S228-T254 WeakPolarHBondContact CA-O 3.45Å; S228-T254 PolarHBondContact OG-OG1 2.88Å; F229-T254 PolarHBondContact N-O 3.32Å; T254-G279 WeakPolarHBondContact CA-O 3.31Å
255	F	78	Confident	74.3	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.009	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	126.6	170.9	-51.7	-67.5	0	0	0	110.4	F229 L231 A234 V253 I272 I275 F278 G279 F280 H281	F229-F255 HydrophobicContact CB-CD1 4.3Å; F229-F255 CarbonylContact O-C 3.48Å; F229-F255 WeakPolarHBondContact O-CA 3.32Å; L231-F255 HydrophobicContact CB-CB 4.19Å; L231-F255 HydrophobicContact CD1-CB 3.66Å; L231-F255 HydrophobicContact CD1-CD1 4.3Å; L231-F255 HydrophobicContact CD1-CD2 4.42Å; L231-F255 HydrophobicContact CD1-CG 3.87Å; A234-F255 HydrophobicContact CB-CD1 3.51Å; A234-F255 HydrophobicContact CB-CE1 3.43Å; A234-F255 VanDerWaalsContact CB-CE1 3.43Å; V253-F255 HydrophobicContact CB-CZ 4.34Å; V253-F255 HydrophobicContact CG1-CD1 3.78Å; V253-F255 HydrophobicContact CG1-CD2 4.43Å; V253-F255 HydrophobicContact CG1-CE1 3.29Å; V253-F255 HydrophobicContact CG1-CE2 4.02Å; V253-F255 HydrophobicContact CG1-CG 4.31Å; V253-F255 HydrophobicContact CG1-CZ 3.42Å; V253-F255 VanDerWaalsContact CG1-CZ 3.42Å; F255-I272 HydrophobicContact CD2-CG2 4.5Å; F255-I272 HydrophobicContact CE2-CG1 4.33Å; F255-I272 HydrophobicContact CE2-CG2 3.92Å; F255-I275 HydrophobicContact CE1-CD1 4.19Å; F255-I275 HydrophobicContact CZ-CD1 3.54Å; F255-F278 HydrophobicContact CE2-CB 3.81Å; F255-F278 HydrophobicContact CE2-CD2 4.12Å; F255-F278 HydrophobicContact CE2-CG 4.31Å; F255-F278 HydrophobicContact CZ-CB 4.43Å; F255-G279 PolarHBondContact N-O 2.93Å; F255-G279 VanDerWaalsContact N-O 3.14Å; F255-F280 HydrophobicContact CB-CD1 4.08Å; F255-F280 HydrophobicContact CB-CE1 4.41Å; F255-F280 HydrophobicContact CD2-CD1 4.01Å; F255-F280 AromaticContact CD2-CE1 3.91Å; F255-F280 HydrophobicContact CD2-CE1 3.91Å; F255-H281 PolarHBondContact O-N 3.48Å
256	A	72.2	Confident	73.2	Confident	24 Å²	24	53.3 Å²	53.3	20%	0.198	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	127.4	170.2	0	0	0	0	0	109.3	F229 L231	F229-A256 PolarHBondContact O-N 3.04Å; L231-A256 PolarHBondContact N-O 3.25Å
257	D	68.6	Low	72.4	Confident	7 Å²	7	57 Å²	57	4%	0.037	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	106.2	164.7	-175.2	-0.2	0	0	0	108.1	L231 F259 R262 Y282	L231-D257 HydrophobicContact CB-CB 4.3Å; L231-D257 HydrophobicContact CD2-CB 3.96Å; D257-F259 VanDerWaalsContact C-N 3.31Å; D257-F259 PolarHBondContact OD1-N 3.28Å; D257-R262 WeakPolarHBondContact OD2-CB 3.23Å; D257-Y282 HydrophobicContact CB-CD2 4.21Å; D257-Y282 HydrophobicContact CB-CE2 4.22Å
258	E	59.1	Low	71.5	Confident	110 Å²	110	57.7 Å²	57.7	51%	0.514	28%	0.277	S	S	.	.			trans	-76.9	-20.2	-179.9	-61.4	-150.7	138	0	0	112.7	R260	E258-R260 WeakPolarHBondContact O-CG 3.44Å; E258-R260 PolarHBondContact O-N 3.49Å
259	F	56.2	Low	70.5	Confident	43 Å²	43	58.2 Å²	58.2	19%	0.189	28%	0.281	C	S	.	.	S	Bend	trans	-92.5	8.8	-164.3	-65.7	-63.8	0	0	0	115.3	I194 R199 Y230 D257 E261	I194-F259 HydrophobicContact CB-CZ 4.27Å; I194-F259 HydrophobicContact CD1-CE2 4.43Å; I194-F259 HydrophobicContact CD1-CZ 4.49Å; R199-F259 HydrophobicContact CB-CB 4.1Å; R199-F259 HydrophobicContact CB-CD1 4.09Å; R199-F259 HydrophobicContact CB-CD2 3.74Å; R199-F259 HydrophobicContact CB-CE1 4.49Å; R199-F259 HydrophobicContact CB-CE2 4.17Å; R199-F259 HydrophobicContact CB-CG 3.69Å; R199-F259 VanDerWaalsContact CD-CD1 3.41Å; R199-F259 HydrophobicContact CG-CB 4.25Å; R199-F259 HydrophobicContact CG-CD1 3.4Å; R199-F259 VanDerWaalsContact CG-CD1 3.4Å; R199-F259 HydrophobicContact CG-CD2 3.91Å; R199-F259 HydrophobicContact CG-CE1 3.6Å; R199-F259 HydrophobicContact CG-CE2 4.08Å; R199-F259 HydrophobicContact CG-CG 3.56Å; R199-F259 HydrophobicContact CG-CZ 3.94Å; R199-F259 WeakPolarHBondContact O-CD2 3.08Å; Y230-F259 HydrophobicContact CE2-CD2 4.17Å; Y230-F259 HydrophobicContact CE2-CE2 4.1Å; Y230-F259 WeakPolarHBondContact OH-CD2 3.27Å; Y230-F259 VanDerWaalsContact OH-CE2 3.3Å; Y230-F259 WeakPolarHBondContact OH-CE2 3.3Å; D257-F259 VanDerWaalsContact C-N 3.31Å; D257-F259 PolarHBondContact OD1-N 3.28Å; F259-E261 WeakPolarHBondContact O-CB 3.33Å; F259-E261 WeakPolarHBondContact O-CG 3.33Å; F259-E261 PolarHBondContact O-N 3.21Å
260	R	56.6	Low	70	Confident	110 Å²	110	58.4 Å²	58.4	42%	0.415	27%	0.274	S	S	.	.	S	Bend	trans	55.4	5	162	-51.5	-178	147.1	175	-1.3	117.3	E258 Y282 N283 S285	E258-R260 WeakPolarHBondContact O-CG 3.44Å; E258-R260 PolarHBondContact O-N 3.49Å; R260-Y282 WeakPolarHBondContact CA-OH 3.29Å; R260-Y282 PolarHBondContact O-OH 2.99Å; R260-N283 HydrophobicContact CG-CB 4.38Å; R260-N283 VanDerWaalsContact CG-O 3.31Å; R260-N283 WeakPolarHBondContact CG-O 3.26Å; R260-N283 VanDerWaalsContact NE-CG 3.31Å; R260-N283 PolarHBondContact NE-ND2 2.92Å; R260-N283 PolarHBondContact NE-O 3.38Å; R260-N283 PolarHBondContact NE-OD1 3.24Å; R260-N283 PolarHBondContact NH2-ND2 3.06Å; R260-N283 PolarHBondContact NH2-OD1 3.22Å; R260-S285 WeakPolarHBondContact CD-OG 3.31Å; R260-S285 PolarHBondContact NE-OG 3.01Å; R260-S285 PolarHBondContact NH1-OG 2.59Å
261	E	54.6	Low	69.4	Low	131 Å²	131	54.7 Å²	54.7	61%	0.612	26%	0.257	S	S	*	.			trans	-129.8	-14.2	-167.4	-71.3	174.4	-179.5	0	0	114.9	R199 F259 L263 Y282	R199-E261 IonicContact NH1-OE2 2.97Å; F259-E261 WeakPolarHBondContact O-CB 3.33Å; F259-E261 WeakPolarHBondContact O-CG 3.33Å; F259-E261 PolarHBondContact O-N 3.21Å; E261-L263 PolarHBondContact O-N 2.99Å; E261-Y282 PolarHBondContact N-OH 3.07Å
262	R	59.8	Low	68.4	Low	42 Å²	42	54.7 Å²	54.7	16%	0.158	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-67.1	124.5	-175.2	-167.1	172.6	174.2	149.3	-3.3	111.1	D257 D268 Q290	D257-R262 WeakPolarHBondContact OD2-CB 3.23Å; R262-D268 IonicContact CZ-OD2 2.89Å; R262-D268 IonicContact NE-OD2 3.95Å; R262-D268 PolarHBondContact NE-OD2 3.27Å; R262-D268 VanDerWaalsContact NH2-CG 3.33Å; R262-D268 IonicContact NH2-OD1 3.18Å; R262-D268 PolarHBondContact NH2-OD1 3.19Å; R262-D268 IonicContact NH2-OD2 3.22Å; R262-D268 PolarHBondContact NH2-OD2 3.04Å; R262-Q290 PolarHBondContact O-NE2 2.79Å
263	L	59.5	Low	67.6	Low	128 Å²	128	55.7 Å²	55.7	67%	0.67	26%	0.263	S	S	*	.	P	Polyproline II helix	trans	-86.9	124.1	163	-67.3	172.4	0	0	0	107.4	E261 S265	E261-L263 PolarHBondContact O-N 2.99Å; L263-S265 PolarHBondContact O-N 3.1Å
264	F	65.7	Low	66.8	Low	26 Å²	26	61.5 Å²	61.5	11%	0.114	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-68	126.2	175.1	-66	-78	0	0	0	110.1	L231 F235 D268 L269 I272 F280 M293	L231-F264 HydrophobicContact CD1-CE1 4.24Å; L231-F264 HydrophobicContact CD2-CE1 3.52Å; L231-F264 HydrophobicContact CD2-CZ 3.84Å; L231-F264 HydrophobicContact CG-CE1 4.45Å; F235-F264 HydrophobicContact CZ-CD1 4.32Å; F235-F264 HydrophobicContact CZ-CE1 4.31Å; F264-D268 HydrophobicContact CB-CB 4.27Å; F264-D268 HydrophobicContact CD1-CB 4.04Å; F264-L269 HydrophobicContact CB-CD2 3.48Å; F264-L269 VanDerWaalsContact CB-CD2 3.48Å; F264-L269 HydrophobicContact CB-CG 4.06Å; F264-L269 HydrophobicContact CD1-CD2 4.27Å; F264-L269 HydrophobicContact CD2-CD2 4.43Å; F264-L269 HydrophobicContact CG-CD2 3.84Å; F264-I272 HydrophobicContact CE1-CD1 4.13Å; F264-F280 AromaticContact CE1-CE1 3.93Å; F264-F280 HydrophobicContact CE1-CE1 3.93Å; F264-F280 HydrophobicContact CE1-CZ 4.33Å; F264-F280 HydrophobicContact CZ-CD1 4.3Å; F264-F280 AromaticContact CZ-CE1 3.72Å; F264-F280 HydrophobicContact CZ-CE1 3.72Å; F264-F280 HydrophobicContact CZ-CZ 4.23Å; F264-M293 HydrophobicContact CB-CE 4.46Å
265	S	67.3	Low	66.1	Low	46 Å²	46	61.4 Å²	61.4	32%	0.322	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-71.1	167.6	166.3	86.8	0	0	0	0	110.2	L263 E267 D268 L269	L263-S265 PolarHBondContact O-N 3.1Å; S265-E267 WeakPolarHBondContact CB-OE2 3.39Å; S265-E267 PolarHBondContact O-N 3.21Å; S265-E267 PolarHBondContact OG-N 2.98Å; S265-E267 PolarHBondContact OG-OE2 2.55Å; S265-D268 PolarHBondContact N-OD2 2.58Å; S265-D268 WeakPolarHBondContact O-CB 3.43Å; S265-D268 PolarHBondContact O-N 3.37Å; S265-D268 PolarHBondContact OG-N 3.13Å; S265-D268 VanDerWaalsContact OG-N 3.13Å; S265-L269 WeakPolarHBondContact O-CG 3.21Å; S265-L269 PolarHBondContact O-N 2.87Å
266	R	67.3	Low	65.5	Low	179 Å²	179	67 Å²	67	68%	0.675	31%	0.311	S	S	*	.	H	α-helix	trans	-61.3	-38.1	175.4	178.7	179.4	168.4	178.2	-4.6	111.3	L269 E270	R266-L269 WeakPolarHBondContact O-CB 3.41Å; R266-L269 PolarHBondContact O-N 2.67Å; R266-E270 HydrophobicContact CG-CG 4.5Å; R266-E270 IonicContact CZ-OE1 2.66Å; R266-E270 IonicContact NE-OE1 3.85Å; R266-E270 PolarHBondContact NE-OE1 3.22Å; R266-E270 IonicContact NH2-OE1 2.81Å; R266-E270 PolarHBondContact NH2-OE1 3.46Å; R266-E270 WeakPolarHBondContact O-CG 3.42Å; R266-E270 PolarHBondContact O-N 2.72Å
267	E	70.4	Confident	65.2	Low	123 Å²	123	68.7 Å²	68.7	58%	0.575	31%	0.312	S	S	*	.	H	α-helix	trans	-65.6	-42.1	179.1	-56.1	69.4	-148.1	0	0	111	S265 L269 E270 A271	S265-E267 WeakPolarHBondContact CB-OE2 3.39Å; S265-E267 PolarHBondContact O-N 3.21Å; S265-E267 PolarHBondContact OG-N 2.98Å; S265-E267 PolarHBondContact OG-OE2 2.55Å; E267-L269 VanDerWaalsContact C-N 3.27Å; E267-L269 PolarHBondContact O-N 2.94Å; E267-E270 PolarHBondContact O-N 3.13Å; E267-A271 VanDerWaalsContact O-CB 3.3Å; E267-A271 WeakPolarHBondContact O-CB 3.19Å; E267-A271 PolarHBondContact O-N 3.25Å
268	D	71.3	Confident	64.9	Low	20 Å²	20	68.9 Å²	68.9	11%	0.107	31%	0.313	C	S	.	.	H	α-helix	trans	-56.9	-43.2	172.4	-75.9	-15.4	0	0	0	110.7	F235 R262 F264 S265 I272	F235-D268 HydrophobicContact CE1-CB 3.77Å; F235-D268 WeakPolarHBondContact CE1-O 3.27Å; F235-D268 HydrophobicContact CE2-CB 4.41Å; F235-D268 HydrophobicContact CZ-CB 3.56Å; R262-D268 IonicContact CZ-OD2 2.89Å; R262-D268 IonicContact NE-OD2 3.95Å; R262-D268 PolarHBondContact NE-OD2 3.27Å; R262-D268 VanDerWaalsContact NH2-CG 3.33Å; R262-D268 IonicContact NH2-OD1 3.18Å; R262-D268 PolarHBondContact NH2-OD1 3.19Å; R262-D268 IonicContact NH2-OD2 3.22Å; R262-D268 PolarHBondContact NH2-OD2 3.04Å; F264-D268 HydrophobicContact CB-CB 4.27Å; F264-D268 HydrophobicContact CD1-CB 4.04Å; S265-D268 PolarHBondContact N-OD2 2.58Å; S265-D268 WeakPolarHBondContact O-CB 3.43Å; S265-D268 PolarHBondContact O-N 3.37Å; S265-D268 PolarHBondContact OG-N 3.13Å; S265-D268 VanDerWaalsContact OG-N 3.13Å; D268-I272 WeakPolarHBondContact O-CG1 3.42Å; D268-I272 PolarHBondContact O-N 2.98Å; D268-I272 VanDerWaalsContact O-N 3.13Å
269	L	68.6	Low	64.9	Low	23 Å²	23	63.6 Å²	63.6	12%	0.12	29%	0.288	C	S	.	.	H	α-helix	trans	-66.4	-46	178.7	-60.3	-171.2	0	0	0	111.8	F264 S265 R266 E267 A271 I272 I273 L299	F264-L269 HydrophobicContact CB-CD2 3.48Å; F264-L269 VanDerWaalsContact CB-CD2 3.48Å; F264-L269 HydrophobicContact CB-CG 4.06Å; F264-L269 HydrophobicContact CD1-CD2 4.27Å; F264-L269 HydrophobicContact CD2-CD2 4.43Å; F264-L269 HydrophobicContact CG-CD2 3.84Å; S265-L269 WeakPolarHBondContact O-CG 3.21Å; S265-L269 PolarHBondContact O-N 2.87Å; R266-L269 WeakPolarHBondContact O-CB 3.41Å; R266-L269 PolarHBondContact O-N 2.67Å; E267-L269 VanDerWaalsContact C-N 3.27Å; E267-L269 PolarHBondContact O-N 2.94Å; L269-A271 VanDerWaalsContact C-N 3.34Å; L269-A271 PolarHBondContact O-N 2.66Å; L269-I272 PolarHBondContact O-N 3.5Å; L269-I273 WeakPolarHBondContact O-CB 3.49Å; L269-I273 VanDerWaalsContact O-CD1 3.32Å; L269-I273 WeakPolarHBondContact O-CD1 3.35Å; L269-I273 WeakPolarHBondContact O-CG1 3.28Å; L269-I273 PolarHBondContact O-N 3.09Å; L269-L299 HydrophobicContact CB-CD2 4.41Å; L269-L299 HydrophobicContact CB-CG 4.49Å; L269-L299 HydrophobicContact CD1-CD1 4.4Å; L269-L299 HydrophobicContact CD1-CG 4.22Å; L269-L299 HydrophobicContact CD2-CD1 3.16Å; L269-L299 HydrophobicContact CD2-CD2 3.87Å; L269-L299 HydrophobicContact CD2-CG 3.52Å; L269-L299 HydrophobicContact CG-CD1 4.32Å; L269-L299 HydrophobicContact CG-CG 4.28Å
270	E	69.5	Low	64.8	Low	91 Å²	91	62.1 Å²	62.1	43%	0.425	28%	0.281	S	S	.	.	H	α-helix	trans	-61.4	-43	178.4	-73.8	176.8	-176.3	0	0	111.2	R266 E267 I272 I273 Q274	R266-E270 HydrophobicContact CG-CG 4.5Å; R266-E270 IonicContact CZ-OE1 2.66Å; R266-E270 IonicContact NE-OE1 3.85Å; R266-E270 PolarHBondContact NE-OE1 3.22Å; R266-E270 IonicContact NH2-OE1 2.81Å; R266-E270 PolarHBondContact NH2-OE1 3.46Å; R266-E270 WeakPolarHBondContact O-CG 3.42Å; R266-E270 PolarHBondContact O-N 2.72Å; E267-E270 PolarHBondContact O-N 3.13Å; E270-I272 PolarHBondContact O-N 3.48Å; E270-I273 PolarHBondContact O-N 3.41Å; E270-Q274 WeakPolarHBondContact O-CG 3.41Å; E270-Q274 PolarHBondContact O-N 2.75Å
271	A	72.3	Confident	64.7	Low	17 Å²	17	58 Å²	58	14%	0.14	27%	0.267	C	S	.	.	H	α-helix	trans	-57.7	-45	174.7	0	0	0	0	0	112.7	F235 L238 E267 L269 Q274	F235-A271 HydrophobicContact CD1-CB 4.1Å; F235-A271 HydrophobicContact CE1-CB 4.31Å; L238-A271 HydrophobicContact CD1-CB 3.62Å; L238-A271 HydrophobicContact CD2-CB 4.5Å; E267-A271 VanDerWaalsContact O-CB 3.3Å; E267-A271 WeakPolarHBondContact O-CB 3.19Å; E267-A271 PolarHBondContact O-N 3.25Å; L269-A271 VanDerWaalsContact C-N 3.34Å; L269-A271 PolarHBondContact O-N 2.66Å; A271-Q274 WeakPolarHBondContact O-CB 3.38Å; A271-Q274 PolarHBondContact O-N 2.7Å
272	I	67.8	Low	64.5	Low	1 Å²	1	52.3 Å²	52.3	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-71.8	-36.8	-179	-70.3	169	0	0	0	111.6	L231 F235 F255 F264 D268 L269 E270 Q274 I275 F278 F280	L231-I272 HydrophobicContact CD1-CD1 3.92Å; F235-I272 HydrophobicContact CD1-CG1 4.43Å; F235-I272 HydrophobicContact CE1-CD1 3.52Å; F235-I272 HydrophobicContact CE1-CG1 3.61Å; F235-I272 HydrophobicContact CZ-CD1 3.63Å; F235-I272 HydrophobicContact CZ-CG1 4.24Å; F255-I272 HydrophobicContact CD2-CG2 4.5Å; F255-I272 HydrophobicContact CE2-CG1 4.33Å; F255-I272 HydrophobicContact CE2-CG2 3.92Å; F264-I272 HydrophobicContact CE1-CD1 4.13Å; D268-I272 WeakPolarHBondContact O-CG1 3.42Å; D268-I272 PolarHBondContact O-N 2.98Å; D268-I272 VanDerWaalsContact O-N 3.13Å; L269-I272 PolarHBondContact O-N 3.5Å; E270-I272 PolarHBondContact O-N 3.48Å; I272-Q274 PolarHBondContact O-N 3.03Å; I272-I275 WeakPolarHBondContact O-CA 3.45Å; I272-I275 WeakPolarHBondContact O-CB 3.45Å; I272-I275 PolarHBondContact O-N 2.85Å; I272-F278 HydrophobicContact CG2-CD1 4.43Å; I272-F278 HydrophobicContact CG2-CD2 3.35Å; I272-F278 HydrophobicContact CG2-CE1 4.29Å; I272-F278 HydrophobicContact CG2-CE2 3.27Å; I272-F278 HydrophobicContact CG2-CG 3.95Å; I272-F278 HydrophobicContact CG2-CZ 3.73Å; I272-F280 HydrophobicContact CB-CZ 4.32Å; I272-F280 HydrophobicContact CD1-CE1 3.5Å; I272-F280 VanDerWaalsContact CD1-CE1 3.5Å; I272-F280 HydrophobicContact CD1-CZ 3.33Å; I272-F280 HydrophobicContact CG1-CZ 4.31Å; I272-F280 HydrophobicContact CG2-CE1 4.46Å; I272-F280 HydrophobicContact CG2-CE2 4.02Å; I272-F280 HydrophobicContact CG2-CZ 3.65Å
273	I	67.8	Low	63.9	Low	45 Å²	45	52 Å²	52	23%	0.231	24%	0.242	C	C	.	.	H	α-helix	trans	-62.1	-27.2	176.6	-69.2	161.9	0	0	0	111.3	L269 E270 I275 L299 Y302	L269-I273 WeakPolarHBondContact O-CB 3.49Å; L269-I273 VanDerWaalsContact O-CD1 3.32Å; L269-I273 WeakPolarHBondContact O-CD1 3.35Å; L269-I273 WeakPolarHBondContact O-CG1 3.28Å; L269-I273 PolarHBondContact O-N 3.09Å; E270-I273 PolarHBondContact O-N 3.41Å; I273-I275 PolarHBondContact O-N 3.25Å; I273-L299 HydrophobicContact CD1-CD2 4.32Å; I273-L299 HydrophobicContact CG1-CD2 4.12Å; I273-Y302 HydrophobicContact CD1-CD2 3.5Å; I273-Y302 VanDerWaalsContact CD1-CD2 3.5Å; I273-Y302 HydrophobicContact CD1-CE2 3.9Å; I273-Y302 HydrophobicContact CD1-CG 4.03Å; I273-Y302 HydrophobicContact CG1-CD2 3.99Å; I273-Y302 HydrophobicContact CG1-CG 4.01Å; I273-Y302 HydrophobicContact CG2-CD1 3.88Å; I273-Y302 HydrophobicContact CG2-CD2 4.47Å; I273-Y302 HydrophobicContact CG2-CE1 4.27Å; I273-Y302 HydrophobicContact CG2-CG 4.02Å
274	Q	68.4	Low	63.2	Low	122 Å²	122	47 Å²	47	57%	0.57	22%	0.219	S	C	*	.	H	α-helix	trans	-62.5	-32.1	171.9	-65.1	174.5	9.9	0	0	112.2	E270 A271 I272 R276	E270-Q274 WeakPolarHBondContact O-CG 3.41Å; E270-Q274 PolarHBondContact O-N 2.75Å; A271-Q274 WeakPolarHBondContact O-CB 3.38Å; A271-Q274 PolarHBondContact O-N 2.7Å; I272-Q274 PolarHBondContact O-N 3.03Å; Q274-R276 PolarHBondContact O-N 2.05Å
275	I	68	Low	62	Low	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.234	C	C	.	.	S	Bend	trans	-78.5	84.8	175.3	-56.4	-179.8	0	0	0	107.9	L238 I241 N242 L245 F255 I272 I273 R277 F278	L238-I275 HydrophobicContact CD2-CD1 3.43Å; L238-I275 VanDerWaalsContact CD2-CD1 3.43Å; L238-I275 HydrophobicContact CD2-CG1 4.11Å; I241-I275 HydrophobicContact CG2-CD1 4.01Å; N242-I275 WeakPolarHBondContact OD1-CA 3.38Å; L245-I275 HydrophobicContact CD1-CG2 3.59Å; F255-I275 HydrophobicContact CE1-CD1 4.19Å; F255-I275 HydrophobicContact CZ-CD1 3.54Å; I272-I275 WeakPolarHBondContact O-CA 3.45Å; I272-I275 WeakPolarHBondContact O-CB 3.45Å; I272-I275 PolarHBondContact O-N 2.85Å; I273-I275 PolarHBondContact O-N 3.25Å; I275-R277 PolarHBondContact O-N 3.5Å; I275-F278 HydrophobicContact CB-CB 4.47Å; I275-F278 HydrophobicContact CG2-CB 4.03Å; I275-F278 WeakPolarHBondContact O-CD1 3.36Å
276	R	64.6	Low	60.9	Low	118 Å²	118	56.1 Å²	56.1	45%	0.445	26%	0.255	S	S	.	.	S	Bend	trans	-60.1	-9.6	-172.8	-61.5	-178.2	178.6	-177.5	-1.1	116.3	Q274 P307	Q274-R276 PolarHBondContact O-N 2.05Å; R276-P307 HydrophobicContact CB-CB 4.35Å
277	R	66.8	Low	59.8	Low	60 Å²	60	50.1 Å²	50.1	23%	0.226	24%	0.239	C	C	.	.	S	Bend	trans	-128.9	62.2	-173.3	-64.4	177.7	179	-171.6	-8.7	111.7	L245 P249 Y252 V253 I275 P307	L245-R277 HydrophobicContact CD1-CB 4.26Å; P249-R277 PolarHBondContact O-NH1 3.41Å; Y252-R277 WeakPolarHBondContact CA-O 3.43Å; Y252-R277 HydrophobicContact CD1-CB 4.04Å; Y252-R277 HydrophobicContact CE1-CB 4.48Å; V253-R277 PolarHBondContact N-O 3.3Å; I275-R277 PolarHBondContact O-N 3.5Å; R277-P307 HydrophobicContact CG-CB 3.75Å; R277-P307 HydrophobicContact CG-CG 3.93Å
278	F	61.1	Low	58.8	Low	11 Å²	11	48.1 Å²	48.1	5%	0.048	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	160.9	-172.1	75.7	-72.6	0	0	0	113.3	V253 F255 I272 I275 F280 A303	V253-F278 CarbonylContact O-C 3.5Å; V253-F278 WeakPolarHBondContact O-CA 3.05Å; F255-F278 HydrophobicContact CE2-CB 3.81Å; F255-F278 HydrophobicContact CE2-CD2 4.12Å; F255-F278 HydrophobicContact CE2-CG 4.31Å; F255-F278 HydrophobicContact CZ-CB 4.43Å; I272-F278 HydrophobicContact CG2-CD1 4.43Å; I272-F278 HydrophobicContact CG2-CD2 3.35Å; I272-F278 HydrophobicContact CG2-CE1 4.29Å; I272-F278 HydrophobicContact CG2-CE2 3.27Å; I272-F278 HydrophobicContact CG2-CG 3.95Å; I272-F278 HydrophobicContact CG2-CZ 3.73Å; I275-F278 HydrophobicContact CB-CB 4.47Å; I275-F278 HydrophobicContact CG2-CB 4.03Å; I275-F278 WeakPolarHBondContact O-CD1 3.36Å; F278-F280 HydrophobicContact CD2-CD2 4.14Å; F278-F280 AromaticContact CD2-CE2 3.95Å; F278-F280 HydrophobicContact CD2-CE2 3.95Å; F278-F280 AromaticContact CE2-CD2 3.89Å; F278-F280 HydrophobicContact CE2-CD2 3.89Å; F278-F280 AromaticContact CE2-CE2 3.45Å; F278-F280 HydrophobicContact CE2-CE2 3.45Å; F278-F280 VanDerWaalsContact CE2-CE2 3.45Å; F278-F280 HydrophobicContact CE2-CZ 4.23Å; F278-A303 HydrophobicContact CZ-CB 4.46Å
279	G	59	Low	57.7	Low	0 Å²	0	58 Å²	58	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	168.1	163.3	0	0	0	0	0	110.3	V253 T254 F255	V253-G279 PolarHBondContact O-N 3.45Å; T254-G279 WeakPolarHBondContact CA-O 3.31Å; F255-G279 PolarHBondContact N-O 2.93Å; F255-G279 VanDerWaalsContact N-O 3.14Å
280	F	54.4	Low	56.6	Low	11 Å²	11	58.2 Å²	58.2	5%	0.048	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	135.8	177	-74.5	-80.5	0	0	0	110.7	F55 L231 F255 F264 I272 F278 L299	F55-F280 WeakPolarHBondContact CD2-O 3.49Å; F55-F280 WeakPolarHBondContact CE2-O 3.32Å; L231-F280 HydrophobicContact CD1-CE1 4.24Å; F255-F280 HydrophobicContact CB-CD1 4.08Å; F255-F280 HydrophobicContact CB-CE1 4.41Å; F255-F280 HydrophobicContact CD2-CD1 4.01Å; F255-F280 AromaticContact CD2-CE1 3.91Å; F255-F280 HydrophobicContact CD2-CE1 3.91Å; F264-F280 AromaticContact CE1-CE1 3.93Å; F264-F280 HydrophobicContact CE1-CE1 3.93Å; F264-F280 HydrophobicContact CE1-CZ 4.33Å; F264-F280 HydrophobicContact CZ-CD1 4.3Å; F264-F280 AromaticContact CZ-CE1 3.72Å; F264-F280 HydrophobicContact CZ-CE1 3.72Å; F264-F280 HydrophobicContact CZ-CZ 4.23Å; I272-F280 HydrophobicContact CB-CZ 4.32Å; I272-F280 HydrophobicContact CD1-CE1 3.5Å; I272-F280 VanDerWaalsContact CD1-CE1 3.5Å; I272-F280 HydrophobicContact CD1-CZ 3.33Å; I272-F280 HydrophobicContact CG1-CZ 4.31Å; I272-F280 HydrophobicContact CG2-CE1 4.46Å; I272-F280 HydrophobicContact CG2-CE2 4.02Å; I272-F280 HydrophobicContact CG2-CZ 3.65Å; F278-F280 HydrophobicContact CD2-CD2 4.14Å; F278-F280 AromaticContact CD2-CE2 3.95Å; F278-F280 HydrophobicContact CD2-CE2 3.95Å; F278-F280 AromaticContact CE2-CD2 3.89Å; F278-F280 HydrophobicContact CE2-CD2 3.89Å; F278-F280 AromaticContact CE2-CE2 3.45Å; F278-F280 HydrophobicContact CE2-CE2 3.45Å; F278-F280 VanDerWaalsContact CE2-CE2 3.45Å; F278-F280 HydrophobicContact CE2-CZ 4.23Å; F280-L299 HydrophobicContact CE2-CD1 4.25Å; F280-L299 HydrophobicContact CE2-CD2 4.32Å
281	H	54.9	Low	55.5	Low	24 Å²	24	54.3 Å²	54.3	11%	0.111	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	97.3	165	-174.4	77.6	0	0	0	108.7	R79 D81 F255	R79-H281 PolarHBondContact NH2-ND1 2.95Å; R79-H281 VanDerWaalsContact NH2-ND1 3.15Å; D81-H281 IonicContact OD2-CE1 3.22Å; D81-H281 PolarHBondContact OD2-CE1 3.48Å; D81-H281 VanDerWaalsContact OD2-CE1 3.31Å; D81-H281 IonicContact OD2-ND1 3.41Å; F255-H281 PolarHBondContact O-N 3.48Å
282	Y	49.9	Very low	54.4	Low	12 Å²	12	60.7 Å²	60.7	5%	0.047	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	128.7	-179.5	-163.3	-94.4	0	0	0	111.7	D257 R260 E261 A284 Q290	D257-Y282 HydrophobicContact CB-CD2 4.21Å; D257-Y282 HydrophobicContact CB-CE2 4.22Å; R260-Y282 WeakPolarHBondContact CA-OH 3.29Å; R260-Y282 PolarHBondContact O-OH 2.99Å; E261-Y282 PolarHBondContact N-OH 3.07Å; Y282-A284 HydrophobicContact CD1-CB 3.77Å; Y282-A284 HydrophobicContact CE1-CB 4.01Å; Y282-A284 PolarHBondContact O-N 3.12Å; Y282-Q290 VanDerWaalsContact OH-CD 3.24Å; Y282-Q290 PolarHBondContact OH-NE2 3.06Å; Y282-Q290 PolarHBondContact OH-OE1 2.86Å
283	N	47.1	Very low	53.4	Low	36 Å²	36	64.7 Å²	64.7	19%	0.193	31%	0.307	C	S	.	.			trans	-88.6	74.5	175.1	-165.1	-10	0	0	0	110	R260 S285	R260-N283 HydrophobicContact CG-CB 4.38Å; R260-N283 VanDerWaalsContact CG-O 3.31Å; R260-N283 WeakPolarHBondContact CG-O 3.26Å; R260-N283 VanDerWaalsContact NE-CG 3.31Å; R260-N283 PolarHBondContact NE-ND2 2.92Å; R260-N283 PolarHBondContact NE-O 3.38Å; R260-N283 PolarHBondContact NE-OD1 3.24Å; R260-N283 PolarHBondContact NH2-ND2 3.06Å; R260-N283 PolarHBondContact NH2-OD1 3.22Å; N283-S285 PolarHBondContact O-N 2.99Å
284	A	44.1	Very low	52.5	Low	23 Å²	23	63.8 Å²	63.8	19%	0.19	30%	0.302	C	S	.	.			trans	-69.3	98.7	-177.1	0	0	0	0	0	111.9	Y282 R286	Y282-A284 HydrophobicContact CD1-CB 3.77Å; Y282-A284 HydrophobicContact CE1-CB 4.01Å; Y282-A284 PolarHBondContact O-N 3.12Å; A284-R286 VanDerWaalsContact C-N 3.28Å
285	S	41.2	Very low	51.4	Low	62 Å²	62	63.7 Å²	63.7	43%	0.434	30%	0.297	S	S	.	.	S	Bend	trans	-76.2	-17.5	162.3	-66	0	0	0	0	113.2	R260 N283 P287	R260-S285 WeakPolarHBondContact CD-OG 3.31Å; R260-S285 PolarHBondContact NE-OG 3.01Å; R260-S285 PolarHBondContact NH1-OG 2.59Å; N283-S285 PolarHBondContact O-N 2.99Å; S285-P287 WeakPolarHBondContact O-CD 3.17Å
286	R	43.4	Very low	50.3	Low	201 Å²	201	68.3 Å²	68.3	76%	0.758	33%	0.329	S	S	*	.			trans	-121.6	83.3	176.4	-67.1	-171.5	177.6	177	1.3	110.2	A284 A288	A284-R286 VanDerWaalsContact C-N 3.28Å; R286-A288 VanDerWaalsContact C-N 3.26Å; R286-A288 PolarHBondContact O-N 2.95Å
287	P	45.3	Very low	49.6	Very low	53 Å²	53	63.4 Å²	63.4	34%	0.344	32%	0.315	S	S	.	.	H	α-helix	trans	-57.7	-35	-176	-24.3	33	0	0	0	113.3	S285 S291	S285-P287 WeakPolarHBondContact O-CD 3.17Å; P287-S291 WeakPolarHBondContact O-CB 3.49Å; P287-S291 PolarHBondContact O-N 3.38Å; P287-S291 PolarHBondContact O-OG 3.33Å
288	A	48.4	Very low	48.6	Very low	81 Å²	81	64.2 Å²	64.2	67%	0.669	33%	0.328	S	S	*	.	H	α-helix	trans	-70.5	-47	-160.8	0	0	0	0	0	115.2	R286 K292	R286-A288 VanDerWaalsContact C-N 3.26Å; R286-A288 PolarHBondContact O-N 2.95Å; A288-K292 WeakPolarHBondContact O-CB 3.36Å
289	R	48.2	Very low	47.7	Very low	226 Å²	226	64 Å²	64	85%	0.853	33%	0.327	S	S	*	.	H	α-helix	trans	-84.7	-45.1	-169.4	-143.2	176	-171.2	171.8	2.1	112.7	M293	R289-M293 PolarHBondContact O-N 3.43Å
290	Q	46.6	Very low	46.8	Very low	29 Å²	29	67.2 Å²	67.2	14%	0.136	34%	0.341	C	S	.	.	H	α-helix	trans	-76.3	-38	179.2	-79.5	171.3	-20.5	0	0	112.7	R262 Y282 K292 M293 L294	R262-Q290 PolarHBondContact O-NE2 2.79Å; Y282-Q290 VanDerWaalsContact OH-CD 3.24Å; Y282-Q290 PolarHBondContact OH-NE2 3.06Å; Y282-Q290 PolarHBondContact OH-OE1 2.86Å; Q290-K292 VanDerWaalsContact C-N 3.26Å; Q290-K292 PolarHBondContact O-N 2.69Å; Q290-M293 PolarHBondContact O-N 3.06Å; Q290-M293 VanDerWaalsContact O-N 3.16Å; Q290-L294 WeakPolarHBondContact O-CG 3Å; Q290-L294 PolarHBondContact O-N 2.73Å
291	S	47.1	Very low	46.1	Very low	9 Å²	9	71.9 Å²	71.9	6%	0.063	37%	0.367	C	S	.	.	H	α-helix	trans	-63.4	-36.2	175	78.4	0	0	0	0	111.2	Q54 P287 M293 L294 R295	Q54-S291 VanDerWaalsContact NE2-CB 3.3Å; P287-S291 WeakPolarHBondContact O-CB 3.49Å; P287-S291 PolarHBondContact O-N 3.38Å; P287-S291 PolarHBondContact O-OG 3.33Å; S291-M293 VanDerWaalsContact C-N 3.35Å; S291-M293 PolarHBondContact O-N 3.15Å; S291-L294 CarbonylContact O-C 3.16Å; S291-L294 PolarHBondContact O-N 2.76Å; S291-R295 WeakPolarHBondContact O-CA 3.16Å; S291-R295 WeakPolarHBondContact O-CB 3.4Å; S291-R295 VanDerWaalsContact O-CD 3.3Å; S291-R295 WeakPolarHBondContact O-CD 3Å; S291-R295 WeakPolarHBondContact O-CG 3.17Å; S291-R295 PolarHBondContact O-N 3.14Å; S291-R295 PolarHBondContact OG-NE 3.33Å
292	K	48.5	Very low	45.4	Very low	150 Å²	150	75.3 Å²	75.3	65%	0.652	38%	0.38	S	S	*	.	H	α-helix	trans	-60.8	-45.2	174.2	-168.7	175.3	-178.5	179.2	0	111.1	A288 Q290 L294 R295 S296	A288-K292 WeakPolarHBondContact O-CB 3.36Å; Q290-K292 VanDerWaalsContact C-N 3.26Å; Q290-K292 PolarHBondContact O-N 2.69Å; K292-L294 PolarHBondContact O-N 2.93Å; K292-R295 PolarHBondContact O-N 3.13Å; K292-S296 PolarHBondContact O-N 3Å; K292-S296 PolarHBondContact O-OG 3.13Å
293	M	46.6	Very low	45	Very low	86 Å²	86	75.1 Å²	75.1	42%	0.424	38%	0.38	S	S	.	.	H	α-helix	trans	-64.1	-38.5	177.9	-149.4	174.9	111.6	0	0	112.7	F264 R289 Q290 S291 G297	F264-M293 HydrophobicContact CB-CE 4.46Å; R289-M293 PolarHBondContact O-N 3.43Å; Q290-M293 PolarHBondContact O-N 3.06Å; Q290-M293 VanDerWaalsContact O-N 3.16Å; S291-M293 VanDerWaalsContact C-N 3.35Å; S291-M293 PolarHBondContact O-N 3.15Å; M293-G297 WeakPolarHBondContact O-CA 3.3Å; M293-G297 PolarHBondContact O-N 3.33Å
294	L	49.6	Very low	44.4	Very low	25 Å²	25	77.9 Å²	77.9	13%	0.131	39%	0.394	C	S	.	.	H	α-helix	trans	-76.3	-23.3	173.7	-68.5	171.7	0	0	0	113.5	Q290 S291 K292 L299 F300	Q290-L294 WeakPolarHBondContact O-CG 3Å; Q290-L294 PolarHBondContact O-N 2.73Å; S291-L294 CarbonylContact O-C 3.16Å; S291-L294 PolarHBondContact O-N 2.76Å; K292-L294 PolarHBondContact O-N 2.93Å; L294-L299 HydrophobicContact CD2-CD1 3.52Å; L294-F300 VanDerWaalsContact O-CB 3.32Å; L294-F300 WeakPolarHBondContact O-CB 3.23Å; L294-F300 WeakPolarHBondContact O-CD2 3.12Å
295	R	44.2	Very low	43.9	Very low	121 Å²	121	82.3 Å²	82.3	46%	0.457	41%	0.411	S	S	.	.	H	α-helix	trans	-83.9	-30.7	178.4	-76.4	166.3	-170.6	-156.6	3.7	112.9	S291 K292	S291-R295 WeakPolarHBondContact O-CA 3.16Å; S291-R295 WeakPolarHBondContact O-CB 3.4Å; S291-R295 VanDerWaalsContact O-CD 3.3Å; S291-R295 WeakPolarHBondContact O-CD 3Å; S291-R295 WeakPolarHBondContact O-CG 3.17Å; S291-R295 PolarHBondContact O-N 3.14Å; S291-R295 PolarHBondContact OG-NE 3.33Å; K292-R295 PolarHBondContact O-N 3.13Å
296	S	46.3	Very low	43.7	Very low	96 Å²	96	87 Å²	87	67%	0.671	43%	0.426	S	S	*	.	H	α-helix	trans	-118.6	-4	-177.1	68.4	0	0	0	0	114.2	K292	K292-S296 PolarHBondContact O-N 3Å; K292-S296 PolarHBondContact O-OG 3.13Å
297	G	48.2	Very low	43.5	Very low	15 Å²	15	79 Å²	79	16%	0.155	40%	0.4	C	S	.	.	S	Bend	trans	-86.7	161.2	-179	0	0	0	0	0	113.1	M293 L299 F300	M293-G297 WeakPolarHBondContact O-CA 3.3Å; M293-G297 PolarHBondContact O-N 3.33Å; G297-L299 PolarHBondContact O-N 3.18Å; G297-L299 VanDerWaalsContact O-N 3.07Å; G297-F300 WeakPolarHBondContact O-CB 3.1Å; G297-F300 PolarHBondContact O-N 2.88Å
298	P	46.3	Very low	43	Very low	77 Å²	77	82.1 Å²	82.1	50%	0.5	41%	0.413	S	S	.	.	H	α-helix	trans	-49.3	-36.9	178.5	12	-25.1	0	0	0	113.3	F300 N301 Y302	P298-F300 PolarHBondContact O-N 2.74Å; P298-F300 VanDerWaalsContact O-N 3.1Å; P298-N301 PolarHBondContact O-N 3.05Å; P298-Y302 HydrophobicContact CB-CD2 4.08Å; P298-Y302 HydrophobicContact CB-CE2 3.73Å; P298-Y302 WeakPolarHBondContact O-CD2 2.81Å; P298-Y302 PolarHBondContact O-N 2.72Å
299	L	41.9	Very low	42.6	Very low	8 Å²	8	89.7 Å²	89.7	4%	0.042	42%	0.424	C	S	.	.	H	α-helix	trans	-49.5	-35.7	175.9	-81.6	-176.7	0	0	0	114.7	L269 I273 F280 L294 G297 N301 Y302 A303	L269-L299 HydrophobicContact CB-CD2 4.41Å; L269-L299 HydrophobicContact CB-CG 4.49Å; L269-L299 HydrophobicContact CD1-CD1 4.4Å; L269-L299 HydrophobicContact CD1-CG 4.22Å; L269-L299 HydrophobicContact CD2-CD1 3.16Å; L269-L299 HydrophobicContact CD2-CD2 3.87Å; L269-L299 HydrophobicContact CD2-CG 3.52Å; L269-L299 HydrophobicContact CG-CD1 4.32Å; L269-L299 HydrophobicContact CG-CG 4.28Å; I273-L299 HydrophobicContact CD1-CD2 4.32Å; I273-L299 HydrophobicContact CG1-CD2 4.12Å; F280-L299 HydrophobicContact CE2-CD1 4.25Å; F280-L299 HydrophobicContact CE2-CD2 4.32Å; L294-L299 HydrophobicContact CD2-CD1 3.52Å; G297-L299 PolarHBondContact O-N 3.18Å; G297-L299 VanDerWaalsContact O-N 3.07Å; L299-N301 VanDerWaalsContact C-N 3.29Å; L299-N301 PolarHBondContact O-N 3.26Å; L299-Y302 PolarHBondContact O-N 3Å; L299-A303 PolarHBondContact O-N 3.25Å
300	F	41.7	Very low	42.4	Very low	67 Å²	67	83.6 Å²	83.6	29%	0.294	41%	0.406	S	S	.	.	H	α-helix	trans	-62.2	-39.3	-179.6	-170.4	-102.4	0	0	0	111.9	Y76 L294 G297 P298 I304	Y76-F300 HydrophobicContact CE1-CZ 4.43Å; L294-F300 VanDerWaalsContact O-CB 3.32Å; L294-F300 WeakPolarHBondContact O-CB 3.23Å; L294-F300 WeakPolarHBondContact O-CD2 3.12Å; G297-F300 WeakPolarHBondContact O-CB 3.1Å; G297-F300 PolarHBondContact O-N 2.88Å; P298-F300 PolarHBondContact O-N 2.74Å; P298-F300 VanDerWaalsContact O-N 3.1Å; F300-I304 HydrophobicContact CE1-CD1 4.5Å; F300-I304 WeakPolarHBondContact O-CD1 3.38Å
301	N	39.4	Very low	42	Very low	109 Å²	109	93.4 Å²	93.4	58%	0.583	44%	0.441	S	S	*	.	H	α-helix	trans	-80.6	-26.3	-178.7	-69.5	-21.8	0	0	0	112.1	P298 L299	P298-N301 PolarHBondContact O-N 3.05Å; L299-N301 VanDerWaalsContact C-N 3.29Å; L299-N301 PolarHBondContact O-N 3.26Å
302	Y	40.1	Very low	42	Very low	96 Å²	96	96 Å²	96	38%	0.376	46%	0.459	S	S	.	.	H	α-helix	trans	-80.7	-34.9	-176.4	-74.2	-69.1	0	0	0	114.1	I273 P298 L299 I304 Q305	I273-Y302 HydrophobicContact CD1-CD2 3.5Å; I273-Y302 VanDerWaalsContact CD1-CD2 3.5Å; I273-Y302 HydrophobicContact CD1-CE2 3.9Å; I273-Y302 HydrophobicContact CD1-CG 4.03Å; I273-Y302 HydrophobicContact CG1-CD2 3.99Å; I273-Y302 HydrophobicContact CG1-CG 4.01Å; I273-Y302 HydrophobicContact CG2-CD1 3.88Å; I273-Y302 HydrophobicContact CG2-CD2 4.47Å; I273-Y302 HydrophobicContact CG2-CE1 4.27Å; I273-Y302 HydrophobicContact CG2-CG 4.02Å; P298-Y302 HydrophobicContact CB-CD2 4.08Å; P298-Y302 HydrophobicContact CB-CE2 3.73Å; P298-Y302 WeakPolarHBondContact O-CD2 2.81Å; P298-Y302 PolarHBondContact O-N 2.72Å; L299-Y302 PolarHBondContact O-N 3Å; Y302-I304 PolarHBondContact O-N 3Å; Y302-Q305 PolarHBondContact O-N 3.06Å
303	A	40.2	Very low	42.2	Very low	8 Å²	8	90.4 Å²	90.4	7%	0.066	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-16.1	176.1	0	0	0	0	0	113.2	C56 P59 F278 L299	C56-A303 HydrophobicContact CB-CB 4.03Å; P59-A303 WeakPolarHBondContact CD-O 3.35Å; F278-A303 HydrophobicContact CZ-CB 4.46Å; L299-A303 PolarHBondContact O-N 3.25Å
304	I	35.7	Very low	43.4	Very low	94 Å²	94	88.9 Å²	88.9	48%	0.482	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-11.3	-176.9	-56.2	173.9	0	0	0	112.3	F300 Y302 E306	F300-I304 HydrophobicContact CE1-CD1 4.5Å; F300-I304 WeakPolarHBondContact O-CD1 3.38Å; Y302-I304 PolarHBondContact O-N 3Å; I304-E306 PolarHBondContact O-N 3.48Å; I304-E306 VanDerWaalsContact O-N 3.14Å
305	Q	33.6	Very low	45	Very low	115 Å²	115	88 Å²	88	54%	0.537	44%	0.437	S	S	.	.	S	Bend	trans	-69.6	118.2	176	-67	-170.2	-3.8	0	0	108.7	Y302	Y302-Q305 PolarHBondContact O-N 3.06Å
306	E	35.7	Very low	46.8	Very low	160 Å²	160	86.7 Å²	86.7	75%	0.748	44%	0.439	S	S	*	.			trans	-46.2	132.2	163.2	-76	-172.8	163.5	0	0	106.9	I304 L308	I304-E306 PolarHBondContact O-N 3.48Å; I304-E306 VanDerWaalsContact O-N 3.14Å; E306-L308 VanDerWaalsContact C-N 3.3Å; E306-L308 PolarHBondContact O-N 3.16Å
307	P	39.8	Very low	48.7	Very low	34 Å²	34	89 Å²	89	22%	0.221	44%	0.439	C	S	.	.			trans	-56.3	107.6	174	23	-31.1	0	0	0	105.3	R276 R277 R309	R276-P307 HydrophobicContact CB-CB 4.35Å; R277-P307 HydrophobicContact CG-CB 3.75Å; R277-P307 HydrophobicContact CG-CG 3.93Å; P307-R309 PolarHBondContact O-N 3.43Å
308	L	36	Very low	50.5	Low	118 Å²	118	92.8 Å²	92.8	62%	0.618	45%	0.452	S	S	*	.			trans	-36.4	115.6	167.7	-86.6	163.2	0	0	0	103.8	E306 Q310	E306-L308 VanDerWaalsContact C-N 3.3Å; E306-L308 PolarHBondContact O-N 3.16Å; L308-Q310 PolarHBondContact O-N 3.48Å
309	R	39	Very low	52.6	Low	240 Å²	240	89.3 Å²	89.3	91%	0.906	43%	0.429	S	S	*	.			trans	-48.1	98	174.4	-81	-175.7	176.9	175.7	-0.9	104.2	P307 R311	P307-R309 PolarHBondContact O-N 3.43Å; R309-R311 PolarHBondContact O-N 3.14Å
310	Q	43.8	Very low	55.1	Low	99 Å²	99	92.9 Å²	92.9	46%	0.463	45%	0.446	S	S	.	.			trans	-56.8	133	176	-152.1	153.6	-16.2	0	0	101.5	L308 C312	L308-Q310 PolarHBondContact O-N 3.48Å; Q310-C312 PolarHBondContact O-N 2.83Å
311	R	38.8	Very low	57.5	Low	234 Å²	234	91.6 Å²	91.6	88%	0.883	44%	0.442	S	S	*	.			trans	-63.5	76.3	179.9	-70.2	-177.7	-146.1	172.3	6.1	107.1	R309 G313	R309-R311 PolarHBondContact O-N 3.14Å; R311-G313 PolarHBondContact O-N 3.35Å
312	C	47.2	Very low	60.2	Low	65 Å²	65	87.7 Å²	87.7	44%	0.439	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	11.9	171.6	-65.9	0	0	0	0	110	Q310	Q310-C312 PolarHBondContact O-N 2.83Å
313	G	51.6	Low	62.7	Low	32 Å²	32	86.4 Å²	86.4	33%	0.33	42%	0.421	S	S	.	.	H	α-helix	trans	-78	-42.9	178.7	0	0	0	0	0	112.6	R311 F315 L316 E317	R311-G313 PolarHBondContact O-N 3.35Å; G313-F315 PolarHBondContact O-N 3.01Å; G313-L316 PolarHBondContact O-N 3.16Å; G313-E317 VanDerWaalsContact O-CD 3.26Å; G313-E317 WeakPolarHBondContact O-CG 3.14Å; G313-E317 PolarHBondContact O-N 2.91Å
314	S	72.5	Confident	65.3	Low	54 Å²	54	88.6 Å²	88.6	38%	0.378	43%	0.429	S	S	.	.	H	α-helix	trans	-65.7	-38.9	-167.1	55.5	0	0	0	0	113.6	E317 E318	S314-E317 WeakPolarHBondContact O-CB 3.07Å; S314-E317 PolarHBondContact O-N 2.9Å; S314-E318 PolarHBondContact O-N 3.36Å
315	F	82.9	Confident	67.8	Low	6 Å²	6	93.3 Å²	93.3	3%	0.026	45%	0.452	C	S	.	.	H	α-helix	trans	-63.9	-48.6	-176.4	-174.7	-92.9	0	0	0	112.1	G313 E317 E318 W319 L321 H336 G338 D339 V341 L525	G313-F315 PolarHBondContact O-N 3.01Å; F315-E317 PolarHBondContact O-N 3.24Å; F315-E318 PolarHBondContact O-N 2.88Å; F315-W319 HydrophobicContact CD1-CB 4.13Å; F315-W319 AromaticContact CD2-CD1 3.56Å; F315-W319 HydrophobicContact CD2-CG 4.2Å; F315-W319 HydrophobicContact CE1-CB 3.68Å; F315-W319 HydrophobicContact CE1-CG 4.18Å; F315-W319 HydrophobicContact CE2-CB 4.13Å; F315-W319 AromaticContact CE2-CD1 3.41Å; F315-W319 VanDerWaalsContact CE2-CD1 3.41Å; F315-W319 HydrophobicContact CE2-CD2 4.37Å; F315-W319 AromaticContact CE2-CG 3.72Å; F315-W319 HydrophobicContact CE2-CG 3.72Å; F315-W319 AromaticContact CE2-NE1 3.89Å; F315-W319 HydrophobicContact CZ-CB 3.67Å; F315-W319 AromaticContact CZ-CD1 3.88Å; F315-W319 HydrophobicContact CZ-CD2 4.39Å; F315-W319 AromaticContact CZ-CG 3.7Å; F315-W319 HydrophobicContact CZ-CG 3.7Å; F315-W319 WeakPolarHBondContact O-CA 3.3Å; F315-W319 VanDerWaalsContact O-CB 3.29Å; F315-W319 WeakPolarHBondContact O-CB 3.4Å; F315-W319 PolarHBondContact O-N 2.9Å; F315-L321 HydrophobicContact CE1-CD1 3.65Å; F315-L321 HydrophobicContact CZ-CD1 4.39Å; F315-H336 HydrophobicContact CD1-CB 4.08Å; F315-H336 AromaticContact CD1-CG 3.87Å; F315-H336 AromaticContact CD1-ND1 3.54Å; F315-H336 HydrophobicContact CE1-CB 3.71Å; F315-H336 AromaticContact CE1-CG 3.95Å; F315-H336 HydrophobicContact CZ-CB 4.39Å; F315-G338 VanDerWaalsContact CG-O 3.31Å; F315-G338 WeakPolarHBondContact CG-O 3.25Å; F315-D339 HydrophobicContact CD2-CB 4.49Å; F315-V341 HydrophobicContact CE1-CG2 4.42Å; F315-V341 HydrophobicContact CE2-CG2 4.29Å; F315-V341 HydrophobicContact CZ-CG2 3.61Å; F315-L525 HydrophobicContact CE2-CD2 4.26Å; F315-L525 HydrophobicContact CZ-CD2 4.43Å
316	L	82.8	Confident	70.4	Confident	94 Å²	94	89.8 Å²	89.8	49%	0.492	44%	0.435	S	S	.	.	H	α-helix	trans	-75.3	-12.5	179.3	-68.8	177.7	0	0	0	113.6	G313 W319 L321	G313-L316 PolarHBondContact O-N 3.16Å; L316-W319 WeakPolarHBondContact CA-O 3.43Å; L316-L321 HydrophobicContact CD2-CD1 4.32Å
317	E	84.6	Confident	72.8	Confident	145 Å²	145	87.8 Å²	87.8	68%	0.678	44%	0.436	S	S	*	.	H	α-helix	trans	-73.1	-34.7	169.5	-73.4	162.3	-161.6	0	0	111.3	G313 S314 F315	G313-E317 VanDerWaalsContact O-CD 3.26Å; G313-E317 WeakPolarHBondContact O-CG 3.14Å; G313-E317 PolarHBondContact O-N 2.91Å; S314-E317 WeakPolarHBondContact O-CB 3.07Å; S314-E317 PolarHBondContact O-N 2.9Å; F315-E317 PolarHBondContact O-N 3.24Å
318	E	86.6	Confident	74.7	Confident	93 Å²	93	91.5 Å²	91.5	44%	0.435	45%	0.449	S	S	.	.	H	α-helix	trans	-98.1	-26.9	-178.7	-66.2	177.9	-172.8	0	0	113.4	S314 F315 H353 V354	S314-E318 PolarHBondContact O-N 3.36Å; F315-E318 PolarHBondContact O-N 2.88Å; E318-H353 PolarHBondContact O-CD2 2.76Å; E318-V354 WeakPolarHBondContact O-CG2 3.46Å; E318-V354 PolarHBondContact O-N 2.85Å
319	W	91.9	Very high	76.4	Confident	4 Å²	4	97.5 Å²	97.5	2%	0.015	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	132.8	-171	-62.5	93.6	0	0	0	112.7	F315 L316 V351 R352 H353 L367 I510 L525	F315-W319 HydrophobicContact CD1-CB 4.13Å; F315-W319 AromaticContact CD2-CD1 3.56Å; F315-W319 HydrophobicContact CD2-CG 4.2Å; F315-W319 HydrophobicContact CE1-CB 3.68Å; F315-W319 HydrophobicContact CE1-CG 4.18Å; F315-W319 HydrophobicContact CE2-CB 4.13Å; F315-W319 AromaticContact CE2-CD1 3.41Å; F315-W319 VanDerWaalsContact CE2-CD1 3.41Å; F315-W319 HydrophobicContact CE2-CD2 4.37Å; F315-W319 AromaticContact CE2-CG 3.72Å; F315-W319 HydrophobicContact CE2-CG 3.72Å; F315-W319 AromaticContact CE2-NE1 3.89Å; F315-W319 HydrophobicContact CZ-CB 3.67Å; F315-W319 AromaticContact CZ-CD1 3.88Å; F315-W319 HydrophobicContact CZ-CD2 4.39Å; F315-W319 AromaticContact CZ-CG 3.7Å; F315-W319 HydrophobicContact CZ-CG 3.7Å; F315-W319 WeakPolarHBondContact O-CA 3.3Å; F315-W319 VanDerWaalsContact O-CB 3.29Å; F315-W319 WeakPolarHBondContact O-CB 3.4Å; F315-W319 PolarHBondContact O-N 2.9Å; L316-W319 WeakPolarHBondContact CA-O 3.43Å; W319-V351 HydrophobicContact CB-CG1 4.29Å; W319-V351 HydrophobicContact CD2-CG1 4.3Å; W319-V351 HydrophobicContact CE3-CG1 3.62Å; W319-V351 HydrophobicContact CZ3-CG1 4.26Å; W319-R352 WeakPolarHBondContact CA-O 3.33Å; W319-H353 HydrophobicContact CD2-CB 4.46Å; W319-H353 AromaticContact CE2-CD2 3.95Å; W319-H353 HydrophobicContact CE3-CB 3.83Å; W319-H353 HydrophobicContact CH2-CB 3.89Å; W319-H353 HydrophobicContact CZ2-CB 4.49Å; W319-H353 HydrophobicContact CZ3-CB 3.54Å; W319-L367 HydrophobicContact CH2-CD1 3.55Å; W319-L367 HydrophobicContact CZ2-CD1 3.95Å; W319-I510 HydrophobicContact CH2-CD1 4.05Å; W319-I510 HydrophobicContact CZ3-CD1 3.94Å; W319-I510 HydrophobicContact CZ3-CG1 4.49Å; W319-L525 HydrophobicContact CD2-CD2 4.26Å; W319-L525 HydrophobicContact CE3-CD2 4.35Å; W319-L525 HydrophobicContact CH2-CD2 3.91Å; W319-L525 HydrophobicContact CH2-CG 4.21Å; W319-L525 HydrophobicContact CZ2-CD2 3.82Å; W319-L525 HydrophobicContact CZ2-CG 3.89Å; W319-L525 HydrophobicContact CZ3-CD2 4.17Å
320	Q	92.4	Very high	78.3	Confident	83 Å²	83	89.9 Å²	89.9	39%	0.388	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	122.9	174.7	-172.6	179.6	16.1	0	0	110.4	V322 V351 R352 V354	Q320-V322 HydrophobicContact CG-CG2 4.21Å; Q320-V351 WeakPolarHBondContact O-CA 3.4Å; Q320-R352 HydrophobicContact CB-CB 4.45Å; Q320-R352 PolarHBondContact N-O 3.49Å; Q320-R352 PolarHBondContact O-N 3.01Å; Q320-V354 HydrophobicContact CB-CG2 4.48Å
321	L	93.9	Very high	80.4	Confident	40 Å²	40	87.3 Å²	87.3	21%	0.209	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	122.4	173.5	-86.9	69.2	0	0	0	110	F315 L316 I334 H336 V351	F315-L321 HydrophobicContact CE1-CD1 3.65Å; F315-L321 HydrophobicContact CZ-CD1 4.39Å; L316-L321 HydrophobicContact CD2-CD1 4.32Å; L321-I334 HydrophobicContact CD2-CG2 4.09Å; L321-I334 HydrophobicContact CG-CG2 4.32Å; L321-H336 HydrophobicContact CD2-CB 4.03Å; L321-V351 HydrophobicContact CD1-CG1 4.07Å; L321-V351 HydrophobicContact CD1-CG2 4.36Å; L321-V351 HydrophobicContact CG-CG2 4.17Å
322	V	94.6	Very high	83	Confident	27 Å²	27	76.9 Å²	76.9	16%	0.164	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	118.9	175.3	-175.8	0	0	0	0	109.1	Q320 F324 G349 Y350	Q320-V322 HydrophobicContact CG-CG2 4.21Å; V322-F324 HydrophobicContact CG1-CD2 4.24Å; V322-F324 HydrophobicContact CG1-CE2 3.52Å; V322-F324 HydrophobicContact CG1-CZ 3.74Å; V322-G349 WeakPolarHBondContact O-CA 3.25Å; V322-Y350 HydrophobicContact CB-CD2 3.97Å; V322-Y350 HydrophobicContact CB-CE1 4.17Å; V322-Y350 HydrophobicContact CB-CE2 3.59Å; V322-Y350 HydrophobicContact CB-CG 4.41Å; V322-Y350 HydrophobicContact CG1-CE1 4.16Å; V322-Y350 HydrophobicContact CG1-CE2 4.29Å; V322-Y350 HydrophobicContact CG2-CD2 4.06Å; V322-Y350 HydrophobicContact CG2-CE2 3.37Å; V322-Y350 PolarHBondContact N-O 3.46Å; V322-Y350 PolarHBondContact O-N 3.36Å
323	N	94.3	Very high	85.3	Confident	69 Å²	69	76.5 Å²	76.5	37%	0.369	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	130.9	177.6	-80.6	-66.5	0	0	0	110.2	R333 I334	N323-R333 WeakPolarHBondContact OD1-CA 3Å; N323-I334 PolarHBondContact ND2-O 3.42Å; N323-I334 PolarHBondContact OD1-N 3.34Å
324	F	93	Very high	87.4	Confident	54 Å²	54	75.2 Å²	75.2	24%	0.237	37%	0.365	C	S	.	.			trans	-108.8	145.6	171.4	-60.2	-92.1	0	0	0	108.9	V322 H326 S348 Y350 S402 P404	V322-F324 HydrophobicContact CG1-CD2 4.24Å; V322-F324 HydrophobicContact CG1-CE2 3.52Å; V322-F324 HydrophobicContact CG1-CZ 3.74Å; F324-H326 PolarHBondContact O-N 2.74Å; F324-S348 WeakPolarHBondContact CA-O 3.46Å; F324-S348 WeakPolarHBondContact CB-O 3.3Å; F324-S348 PolarHBondContact N-O 3.26Å; F324-Y350 HydrophobicContact CE2-CD1 4.21Å; F324-Y350 AromaticContact CE2-CE1 3.77Å; F324-Y350 HydrophobicContact CE2-CE1 3.77Å; F324-Y350 HydrophobicContact CZ-CE1 4.17Å; F324-S402 WeakPolarHBondContact CE1-O 3.47Å; F324-P404 HydrophobicContact CD2-CB 3.77Å; F324-P404 HydrophobicContact CD2-CG 4.42Å; F324-P404 HydrophobicContact CE2-CB 4.27Å; F324-P404 HydrophobicContact CG-CB 4.26Å; F324-P404 HydrophobicContact CG-CG 4.45Å
325	M	88.5	Confident	88.5	Confident	194 Å²	194	72.8 Å²	72.8	96%	0.956	35%	0.348	S	S	*	.			trans	-67.6	125.5	171.4	-69.2	-166.6	178.2	0	0	109.8
326	H	88.1	Confident	89	Confident	41 Å²	41	74.7 Å²	74.7	19%	0.19	36%	0.357	C	S	.	.			trans	-83.6	139.8	176.7	-168.6	-95.5	0	0	0	110.9	F324 K328 R329 W346 S347	F324-H326 PolarHBondContact O-N 2.74Å; H326-K328 PolarHBondContact ND1-N 2.88Å; H326-K328 PolarHBondContact O-N 3.18Å; H326-K328 VanDerWaalsContact O-N 3.12Å; H326-R329 PolarHBondContact O-N 2.74Å; H326-W346 VanDerWaalsContact CE1-CB 3.43Å; H326-W346 WeakPolarHBondContact CE1-CB 3.32Å; H326-W346 AromaticContact CE1-CD1 3.87Å; H326-W346 AromaticContact CE1-CD2 3.65Å; H326-W346 AromaticContact CE1-CG 3.34Å; H326-W346 AromaticContact ND1-CD1 3.82Å; H326-W346 AromaticContact ND1-CG 3.63Å; H326-W346 WeakPolarHBondContact NE2-CB 3.22Å; H326-W346 AromaticContact NE2-CG 3.8Å; H326-S347 PolarHBondContact CD2-O 3.31Å
327	P	85.8	Confident	89.3	Confident	117 Å²	117	70.4 Å²	70.4	76%	0.76	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-29	-175.7	-27.5	35.1	0	0	0	115.3	R329	P327-R329 PolarHBondContact O-N 3.48Å
328	K	80.7	Confident	89.4	Confident	113 Å²	113	64.8 Å²	64.8	49%	0.491	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-1.7	-175.9	-69.5	-173.6	173.6	-175	0	114.9	H326 D330 W346	H326-K328 PolarHBondContact ND1-N 2.88Å; H326-K328 PolarHBondContact O-N 3.18Å; H326-K328 VanDerWaalsContact O-N 3.12Å; K328-D330 PolarHBondContact O-N 3.34Å; K328-W346 HydrophobicContact CD-CD2 4.09Å; K328-W346 VanDerWaalsContact CD-CE2 3.46Å; K328-W346 HydrophobicContact CD-CH2 4.21Å; K328-W346 HydrophobicContact CD-CZ2 3.56Å
329	R	70.3	Confident	89.5	Confident	243 Å²	243	64.1 Å²	64.1	92%	0.917	32%	0.315	S	S	*	.			trans	55.1	0.3	-177	-61.3	-170.6	179	-170.5	0.2	116.2	H326 P327	H326-R329 PolarHBondContact O-N 2.74Å; P327-R329 PolarHBondContact O-N 3.48Å
330	D	79.4	Confident	89.6	Confident	80 Å²	80	64.7 Å²	64.7	43%	0.428	32%	0.319	S	S	.	.	S	Bend	trans	-60.2	152.7	167	-59.2	-25.5	0	0	0	111.1	K328 S332 W346	K328-D330 PolarHBondContact O-N 3.34Å; D330-S332 VanDerWaalsContact C-N 3.31Å; D330-S332 PolarHBondContact O-N 3.47Å; D330-S332 PolarHBondContact O-OG 2.94Å; D330-W346 PolarHBondContact OD2-NE1 2.96Å
331	F	88.8	Confident	89.8	Confident	46 Å²	46	60.8 Å²	60.8	20%	0.202	30%	0.3	C	S	.	.			trans	-62.7	90.8	172.3	-168	-90.4	0	0	0	110.8	R216 Y219 R333 I335 L344	R216-F331 HydrophobicContact CB-CD1 4.23Å; R216-F331 HydrophobicContact CB-CE1 4.48Å; R216-F331 HydrophobicContact CB-CG 4.36Å; R216-F331 HydrophobicContact CG-CB 4.32Å; R216-F331 HydrophobicContact CG-CD1 3.51Å; R216-F331 HydrophobicContact CG-CE1 3.9Å; R216-F331 HydrophobicContact CG-CG 4.01Å; Y219-F331 HydrophobicContact CD1-CE2 4.19Å; Y219-F331 HydrophobicContact CD1-CZ 4.08Å; Y219-F331 HydrophobicContact CD2-CZ 4.23Å; Y219-F331 HydrophobicContact CG-CE2 4.08Å; Y219-F331 AromaticContact CG-CZ 3.68Å; Y219-F331 HydrophobicContact CG-CZ 3.68Å; F331-R333 HydrophobicContact CD1-CG 4.32Å; F331-R333 HydrophobicContact CE1-CG 3.79Å; F331-R333 HydrophobicContact CZ-CG 3.99Å; F331-I335 HydrophobicContact CE1-CD1 4.2Å; F331-I335 HydrophobicContact CZ-CD1 4.24Å; F331-L344 HydrophobicContact CD1-CB 4.41Å; F331-L344 HydrophobicContact CD1-CD1 4.28Å; F331-L344 HydrophobicContact CE1-CD1 3.69Å
332	S	93.6	Very high	90	Very high	14 Å²	14	58.9 Å²	58.9	10%	0.098	29%	0.29	C	S	.	.			trans	-124.7	105.1	-176.4	-53.4	0	0	0	0	109.3	D330 L344 W346 S348	D330-S332 VanDerWaalsContact C-N 3.31Å; D330-S332 PolarHBondContact O-N 3.47Å; D330-S332 PolarHBondContact O-OG 2.94Å; S332-L344 CarbonylContact C-O 3.55Å; S332-L344 WeakPolarHBondContact CA-O 3.27Å; S332-W346 PolarHBondContact OG-N 3.15Å; S332-S348 VanDerWaalsContact O-CB 3.3Å; S332-S348 WeakPolarHBondContact O-CB 3.21Å; S332-S348 PolarHBondContact O-OG 2.86Å
333	R	94.4	Very high	90.1	Very high	58 Å²	58	57.7 Å²	57.7	22%	0.219	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	160.2	-175	74.1	-165.6	-40.7	164.7	2.2	112.6	D220 N323 F331 I335 L344 S348	D220-R333 IonicContact OD1-CZ 3.53Å; D220-R333 IonicContact OD1-NH1 2.75Å; D220-R333 PolarHBondContact OD1-NH1 2.9Å; D220-R333 IonicContact OD1-NH2 2.96Å; D220-R333 IonicContact OD2-NH1 3.41Å; D220-R333 PolarHBondContact OD2-NH1 3.3Å; N323-R333 WeakPolarHBondContact OD1-CA 3Å; F331-R333 HydrophobicContact CD1-CG 4.32Å; F331-R333 HydrophobicContact CE1-CG 3.79Å; F331-R333 HydrophobicContact CZ-CG 3.99Å; R333-I335 HydrophobicContact CG-CD1 3.9Å; R333-I335 HydrophobicContact CG-CG1 3.8Å; R333-L344 PolarHBondContact N-O 2.84Å; R333-L344 PolarHBondContact O-N 3.27Å; R333-S348 WeakPolarHBondContact CA-OG 3.46Å; R333-S348 PolarHBondContact N-OG 3.05Å
334	I	96.1	Very high	90.1	Very high	4 Å²	4	54.4 Å²	54.4	2%	0.021	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	128.8	172	-52.8	178.4	0	0	0	108.7	L321 N323 V341 A342 M343 G349 Y350 V351	L321-I334 HydrophobicContact CD2-CG2 4.09Å; L321-I334 HydrophobicContact CG-CG2 4.32Å; N323-I334 PolarHBondContact ND2-O 3.42Å; N323-I334 PolarHBondContact OD1-N 3.34Å; I334-V341 HydrophobicContact CG2-CG1 3.57Å; I334-A342 CarbonylContact C-O 3.49Å; I334-A342 VanDerWaalsContact CA-O 3.25Å; I334-A342 WeakPolarHBondContact CA-O 3.18Å; I334-M343 HydrophobicContact CD1-CG 4.5Å; I334-M343 HydrophobicContact CG1-CB 4.5Å; I334-M343 HydrophobicContact CG1-CG 4.17Å; I334-M343 HydrophobicContact CG2-CG 4.31Å; I334-G349 VanDerWaalsContact CD1-C 3.45Å; I334-Y350 VanDerWaalsContact CD1-N 3.3Å; I334-V351 HydrophobicContact CD1-CG2 4.39Å; I334-V351 HydrophobicContact CG2-CG2 3.58Å
335	I	94.8	Very high	90	Very high	4 Å²	4	52 Å²	52	2%	0.021	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	149.2	-178.9	-55.9	167.1	0	0	0	107.7	L215 Y219 A247 F331 R333 V341 A342 L344	L215-I335 HydrophobicContact CD2-CD1 3.7Å; L215-I335 HydrophobicContact CG-CD1 4.35Å; Y219-I335 HydrophobicContact CD2-CD1 3.59Å; Y219-I335 HydrophobicContact CD2-CG1 4.42Å; Y219-I335 HydrophobicContact CE2-CB 4.44Å; Y219-I335 HydrophobicContact CE2-CD1 3.36Å; Y219-I335 HydrophobicContact CE2-CG1 3.7Å; Y219-I335 HydrophobicContact CE2-CG2 3.86Å; Y219-I335 HydrophobicContact CG-CD1 4.45Å; A247-I335 HydrophobicContact CB-CG2 4.27Å; F331-I335 HydrophobicContact CE1-CD1 4.2Å; F331-I335 HydrophobicContact CZ-CD1 4.24Å; R333-I335 HydrophobicContact CG-CD1 3.9Å; R333-I335 HydrophobicContact CG-CG1 3.8Å; I335-V341 CarbonylContact O-C 3.46Å; I335-V341 WeakPolarHBondContact O-CA 3.34Å; I335-A342 PolarHBondContact N-O 2.76Å; I335-A342 PolarHBondContact O-N 3.31Å; I335-L344 HydrophobicContact CD1-CD1 3.63Å
336	H	93.5	Very high	90.2	Very high	46 Å²	46	44.9 Å²	44.9	21%	0.213	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	153.2	171.5	77.7	105.5	0	0	0	111.6	F315 L321 D340	F315-H336 HydrophobicContact CD1-CB 4.08Å; F315-H336 AromaticContact CD1-CG 3.87Å; F315-H336 AromaticContact CD1-ND1 3.54Å; F315-H336 HydrophobicContact CE1-CB 3.71Å; F315-H336 AromaticContact CE1-CG 3.95Å; F315-H336 HydrophobicContact CZ-CB 4.39Å; L321-H336 HydrophobicContact CD2-CB 4.03Å; H336-D340 CarbonylContact C-O 3.56Å; H336-D340 WeakPolarHBondContact CA-O 3.43Å
337	A	90.4	Very high	90.4	Very high	4 Å²	4	45 Å²	45	3%	0.033	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	96.8	174.5	0	0	0	0	0	108.5	W243 L246 A247 D339 D340	W243-A337 HydrophobicContact CD2-CB 4.13Å; W243-A337 HydrophobicContact CG-CB 4.15Å; W243-A337 HydrophobicContact CZ2-CB 4.17Å; L246-A337 HydrophobicContact CB-CB 3.84Å; A247-A337 HydrophobicContact CB-CB 3.94Å; A337-D339 PolarHBondContact O-N 3.05Å; A337-D340 PolarHBondContact N-O 3.14Å; A337-D340 PolarHBondContact O-N 3.18Å
338	G	86.5	Confident	90.7	Very high	26 Å²	26	39.7 Å²	39.7	27%	0.268	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.2	-125.6	-164.5	0	0	0	0	0	110.1	F315 D340	F315-G338 VanDerWaalsContact CG-O 3.31Å; F315-G338 WeakPolarHBondContact CG-O 3.25Å; G338-D340 VanDerWaalsContact C-N 3.34Å
339	D	88.9	Confident	91.4	Very high	80 Å²	80	34.5 Å²	34.5	43%	0.428	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	5.7	179.6	-51.1	-34.3	0	0	0	112.9	F315 A337 L525	F315-D339 HydrophobicContact CD2-CB 4.49Å; A337-D339 PolarHBondContact O-N 3.05Å; D339-L525 WeakPolarHBondContact O-CB 3.04Å; D339-L525 PolarHBondContact O-N 2.82Å
340	D	93.4	Very high	92.6	Very high	15 Å²	15	23.4 Å²	23.4	8%	0.08	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	139.7	177.8	-65.9	-3	0	0	0	110	W243 H336 A337 G338 L521 V522 R523 H524	W243-D340 VanDerWaalsContact CD1-OD2 3.31Å; H336-D340 CarbonylContact C-O 3.56Å; H336-D340 WeakPolarHBondContact CA-O 3.43Å; A337-D340 PolarHBondContact N-O 3.14Å; A337-D340 PolarHBondContact O-N 3.18Å; G338-D340 VanDerWaalsContact C-N 3.34Å; D340-L521 HydrophobicContact CB-CD1 4.32Å; D340-V522 CarbonylContact C-O 3.49Å; D340-V522 WeakPolarHBondContact CA-O 3.24Å; D340-R523 WeakPolarHBondContact OD1-CA 3.3Å; D340-R523 IonicContact OD2-NE 3.57Å; D340-H524 PolarHBondContact OD1-N 2.87Å
341	V	96.5	Very high	93.4	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.006	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	119.8	179.2	175.8	0	0	0	0	109.6	F315 I334 I335 M343 V351 L521 V522 L525	F315-V341 HydrophobicContact CE1-CG2 4.42Å; F315-V341 HydrophobicContact CE2-CG2 4.29Å; F315-V341 HydrophobicContact CZ-CG2 3.61Å; I334-V341 HydrophobicContact CG2-CG1 3.57Å; I335-V341 CarbonylContact O-C 3.46Å; I335-V341 WeakPolarHBondContact O-CA 3.34Å; V341-M343 HydrophobicContact CG1-CE 4.07Å; V341-M343 HydrophobicContact CG1-CG 4.31Å; V341-V351 HydrophobicContact CG1-CG2 3.62Å; V341-V351 HydrophobicContact CG2-CG2 4.4Å; V341-L521 CarbonylContact O-C 3.49Å; V341-V522 HydrophobicContact CB-CB 4.44Å; V341-V522 PolarHBondContact N-O 3.43Å; V341-V522 PolarHBondContact O-N 3.42Å; V341-L525 HydrophobicContact CG2-CD2 3.98Å
342	A	97.4	Very high	93.6	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	129.6	170.6	0	0	0	0	0	110.9	L212 W243 I334 I335 L344 L520 L521	L212-A342 HydrophobicContact CD2-CB 4.38Å; W243-A342 HydrophobicContact CH2-CB 3.76Å; W243-A342 HydrophobicContact CZ2-CB 3.58Å; I334-A342 CarbonylContact C-O 3.49Å; I334-A342 VanDerWaalsContact CA-O 3.25Å; I334-A342 WeakPolarHBondContact CA-O 3.18Å; I335-A342 PolarHBondContact N-O 2.76Å; I335-A342 PolarHBondContact O-N 3.31Å; A342-L344 HydrophobicContact CB-CD2 4.04Å; A342-L344 HydrophobicContact CB-CG 4.25Å; A342-L520 CarbonylContact C-O 3.57Å; A342-L520 WeakPolarHBondContact CA-O 3.32Å; A342-L521 HydrophobicContact CB-CD1 4.09Å
343	M	96.6	Very high	93.5	Very high	3 Å²	3	17.9 Å²	17.9	2%	0.015	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	99.7	174	-53.8	-176.3	179.4	0	0	108.7	I334 V341 V351 L390 I510 K512 L520	I334-M343 HydrophobicContact CD1-CG 4.5Å; I334-M343 HydrophobicContact CG1-CB 4.5Å; I334-M343 HydrophobicContact CG1-CG 4.17Å; I334-M343 HydrophobicContact CG2-CG 4.31Å; V341-M343 HydrophobicContact CG1-CE 4.07Å; V341-M343 HydrophobicContact CG1-CG 4.31Å; M343-V351 HydrophobicContact CE-CG2 4.31Å; M343-L390 HydrophobicContact CE-CD1 4.27Å; M343-L390 HydrophobicContact SD-CD1 4.36Å; M343-I510 HydrophobicContact CE-CB 4.1Å; M343-I510 HydrophobicContact CE-CG2 3.56Å; M343-K512 HydrophobicContact CB-CB 3.96Å; M343-K512 HydrophobicContact CB-CD 3.99Å; M343-K512 HydrophobicContact CG-CB 4.49Å; M343-K512 HydrophobicContact SD-CB 3.73Å; M343-K512 PolarHBondContact SD-N 3.06Å; M343-K512 VanDerWaalsContact SD-N 3.41Å; M343-L520 HydrophobicContact CB-CB 4.27Å; M343-L520 PolarHBondContact N-O 3.4Å; M343-L520 PolarHBondContact O-N 3.12Å
344	L	94.7	Very high	92.8	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	142	-168.7	-54.6	179.3	0	0	0	111.2	L212 L215 F331 S332 R333 I335 A342 D519	L212-L344 HydrophobicContact CB-CD2 4.45Å; L212-L344 HydrophobicContact CD1-CD2 3.67Å; L212-L344 HydrophobicContact CD2-CD1 4.31Å; L212-L344 HydrophobicContact CD2-CD2 3.67Å; L212-L344 HydrophobicContact CG-CD2 4.12Å; L215-L344 HydrophobicContact CD2-CD1 4.47Å; F331-L344 HydrophobicContact CD1-CB 4.41Å; F331-L344 HydrophobicContact CD1-CD1 4.28Å; F331-L344 HydrophobicContact CE1-CD1 3.69Å; S332-L344 CarbonylContact C-O 3.55Å; S332-L344 WeakPolarHBondContact CA-O 3.27Å; R333-L344 PolarHBondContact N-O 2.84Å; R333-L344 PolarHBondContact O-N 3.27Å; I335-L344 HydrophobicContact CD1-CD1 3.63Å; A342-L344 HydrophobicContact CB-CD2 4.04Å; A342-L344 HydrophobicContact CB-CG 4.25Å; L344-D519 WeakPolarHBondContact CA-OD1 3.48Å; L344-D519 HydrophobicContact CD2-CB 3.92Å
345	G	92.2	Very high	91.6	Very high	2 Å²	2	18.8 Å²	18.8	2%	0.021	11%	0.11	C	C	.	.	S	Bend	trans	68.3	-138.2	174.2	0	0	0	0	0	112.6	K512 D519	G345-K512 WeakPolarHBondContact O-CE 3.4Å; G345-K512 PolarHBondContact O-NZ 3.5Å; G345-D519 PolarHBondContact N-OD1 3.21Å
346	W	92.5	Very high	90.4	Very high	45 Å²	45	20.2 Å²	20.2	17%	0.17	12%	0.119	C	C	.	.	S	Bend	trans	-74.1	161.7	179.3	-64.6	87.4	0	0	0	112.2	H326 K328 D330 S332 S348 D515 S516	H326-W346 VanDerWaalsContact CE1-CB 3.43Å; H326-W346 WeakPolarHBondContact CE1-CB 3.32Å; H326-W346 AromaticContact CE1-CD1 3.87Å; H326-W346 AromaticContact CE1-CD2 3.65Å; H326-W346 AromaticContact CE1-CG 3.34Å; H326-W346 AromaticContact ND1-CD1 3.82Å; H326-W346 AromaticContact ND1-CG 3.63Å; H326-W346 WeakPolarHBondContact NE2-CB 3.22Å; H326-W346 AromaticContact NE2-CG 3.8Å; K328-W346 HydrophobicContact CD-CD2 4.09Å; K328-W346 VanDerWaalsContact CD-CE2 3.46Å; K328-W346 HydrophobicContact CD-CH2 4.21Å; K328-W346 HydrophobicContact CD-CZ2 3.56Å; D330-W346 PolarHBondContact OD2-NE1 2.96Å; S332-W346 PolarHBondContact OG-N 3.15Å; W346-S348 PolarHBondContact O-N 2.66Å; W346-D515 HydrophobicContact CD2-CB 4.45Å; W346-D515 HydrophobicContact CE3-CB 3.89Å; W346-D515 HydrophobicContact CH2-CB 3.37Å; W346-D515 HydrophobicContact CZ2-CB 4.01Å; W346-D515 HydrophobicContact CZ3-CB 3.32Å; W346-S516 PolarHBondContact NE1-OG 2.94Å
347	S	91.5	Very high	89.2	Confident	44 Å²	44	25.9 Å²	25.9	31%	0.308	14%	0.143	S	C	.	.			trans	-58.3	108.6	170.9	58.1	0	0	0	0	110.6	H326 K512	H326-S347 PolarHBondContact CD2-O 3.31Å; S347-K512 WeakPolarHBondContact CB-O 3.23Å
348	S	92.4	Very high	88	Confident	6 Å²	6	30 Å²	30	4%	0.042	17%	0.171	C	C	.	.			trans	-122.3	7.8	-172.2	66.7	0	0	0	0	113.5	F324 S332 R333 W346	F324-S348 WeakPolarHBondContact CA-O 3.46Å; F324-S348 WeakPolarHBondContact CB-O 3.3Å; F324-S348 PolarHBondContact N-O 3.26Å; S332-S348 VanDerWaalsContact O-CB 3.3Å; S332-S348 WeakPolarHBondContact O-CB 3.21Å; S332-S348 PolarHBondContact O-OG 2.86Å; R333-S348 WeakPolarHBondContact CA-OG 3.46Å; R333-S348 PolarHBondContact N-OG 3.05Å; W346-S348 PolarHBondContact O-N 2.66Å
349	G	94.8	Very high	87.1	Confident	3 Å²	3	33.9 Å²	33.9	3%	0.031	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158.4	-149.1	-179.8	0	0	0	0	0	114.6	V322 I334 Q511	V322-G349 WeakPolarHBondContact O-CA 3.25Å; I334-G349 VanDerWaalsContact CD1-C 3.45Å; G349-Q511 PolarHBondContact O-NE2 3.14Å; G349-Q511 VanDerWaalsContact O-NE2 3.08Å
350	Y	96.2	Very high	86.3	Confident	10 Å²	10	32 Å²	32	4%	0.039	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	157.8	-177.5	53	-98.1	0	0	0	113	V322 F324 I334 R352 P401 V406 Y509 I510	V322-Y350 HydrophobicContact CB-CD2 3.97Å; V322-Y350 HydrophobicContact CB-CE1 4.17Å; V322-Y350 HydrophobicContact CB-CE2 3.59Å; V322-Y350 HydrophobicContact CB-CG 4.41Å; V322-Y350 HydrophobicContact CG1-CE1 4.16Å; V322-Y350 HydrophobicContact CG1-CE2 4.29Å; V322-Y350 HydrophobicContact CG2-CD2 4.06Å; V322-Y350 HydrophobicContact CG2-CE2 3.37Å; V322-Y350 PolarHBondContact N-O 3.46Å; V322-Y350 PolarHBondContact O-N 3.36Å; F324-Y350 HydrophobicContact CE2-CD1 4.21Å; F324-Y350 AromaticContact CE2-CE1 3.77Å; F324-Y350 HydrophobicContact CE2-CE1 3.77Å; F324-Y350 HydrophobicContact CZ-CE1 4.17Å; I334-Y350 VanDerWaalsContact CD1-N 3.3Å; Y350-R352 HydrophobicContact CD2-CB 4.09Å; Y350-R352 HydrophobicContact CE2-CB 4.2Å; Y350-P401 HydrophobicContact CE1-CB 3.99Å; Y350-P401 HydrophobicContact CE1-CG 3.77Å; Y350-P401 PolarHBondContact OH-O 2.78Å; Y350-V406 HydrophobicContact CD1-CG2 3.53Å; Y350-V406 HydrophobicContact CE1-CG2 4.09Å; Y350-V406 HydrophobicContact CG-CG2 3.91Å; Y350-Y509 HydrophobicContact CD1-CD1 4.45Å; Y350-Y509 AromaticContact CD2-CD1 3.46Å; Y350-Y509 HydrophobicContact CD2-CD1 3.46Å; Y350-Y509 VanDerWaalsContact CD2-CD1 3.46Å; Y350-Y509 AromaticContact CD2-CE1 3.71Å; Y350-Y509 HydrophobicContact CD2-CE1 3.71Å; Y350-Y509 AromaticContact CE2-CD1 3.83Å; Y350-Y509 HydrophobicContact CE2-CD1 3.83Å; Y350-Y509 AromaticContact CE2-CE1 3.54Å; Y350-Y509 HydrophobicContact CE2-CE1 3.54Å; Y350-Y509 AromaticContact CG-CD1 3.81Å; Y350-Y509 HydrophobicContact CG-CD1 3.81Å; Y350-Y509 HydrophobicContact CG-CE1 4.33Å; Y350-I510 CarbonylContact C-O 3.55Å; Y350-I510 WeakPolarHBondContact CA-O 3.32Å
351	V	95.7	Very high	85.5	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	128.4	163.2	-174	0	0	0	0	108.2	W319 Q320 L321 I334 V341 M343 Y509 I510	W319-V351 HydrophobicContact CB-CG1 4.29Å; W319-V351 HydrophobicContact CD2-CG1 4.3Å; W319-V351 HydrophobicContact CE3-CG1 3.62Å; W319-V351 HydrophobicContact CZ3-CG1 4.26Å; Q320-V351 WeakPolarHBondContact O-CA 3.4Å; L321-V351 HydrophobicContact CD1-CG1 4.07Å; L321-V351 HydrophobicContact CD1-CG2 4.36Å; L321-V351 HydrophobicContact CG-CG2 4.17Å; I334-V351 HydrophobicContact CD1-CG2 4.39Å; I334-V351 HydrophobicContact CG2-CG2 3.58Å; V341-V351 HydrophobicContact CG1-CG2 3.62Å; V341-V351 HydrophobicContact CG2-CG2 4.4Å; M343-V351 HydrophobicContact CE-CG2 4.31Å; V351-Y509 CarbonylContact O-C 3.58Å; V351-Y509 VanDerWaalsContact O-CA 3.3Å; V351-Y509 WeakPolarHBondContact O-CA 3.43Å; V351-I510 HydrophobicContact CB-CB 4.34Å; V351-I510 PolarHBondContact N-O 3.44Å; V351-I510 PolarHBondContact O-N 3.22Å
352	R	93.5	Very high	84.6	Confident	15 Å²	15	32 Å²	32	6%	0.057	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	129.2	-178.6	175.8	-176.4	-179.1	-97.6	-5.5	110	W319 Q320 Y350 A397 F400 S507 L508 Y509	W319-R352 WeakPolarHBondContact CA-O 3.33Å; Q320-R352 HydrophobicContact CB-CB 4.45Å; Q320-R352 PolarHBondContact N-O 3.49Å; Q320-R352 PolarHBondContact O-N 3.01Å; Y350-R352 HydrophobicContact CD2-CB 4.09Å; Y350-R352 HydrophobicContact CE2-CB 4.2Å; R352-A397 PolarHBondContact NH2-O 2.81Å; R352-F400 VanDerWaalsContact CZ-CE1 3.44Å; R352-S507 PolarHBondContact NH2-OG 2.88Å; R352-L508 WeakPolarHBondContact CA-O 3.13Å; R352-Y509 HydrophobicContact CB-CD1 4.09Å; R352-Y509 HydrophobicContact CB-CE1 3.95Å; R352-Y509 VanDerWaalsContact CD-OH 3.28Å; R352-Y509 WeakPolarHBondContact CD-OH 3.44Å; R352-Y509 HydrophobicContact CG-CD1 4.34Å; R352-Y509 HydrophobicContact CG-CE1 3.89Å; R352-Y509 HydrophobicContact CG-CE2 4.3Å; R352-Y509 PolarHBondContact NE-OH 3.33Å; R352-Y509 VanDerWaalsContact NE-OH 3.08Å
353	H	90.7	Very high	83.8	Confident	10 Å²	10	37.1 Å²	37.1	5%	0.046	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	129.4	166.3	-175.5	-100.8	0	0	0	109.3	E318 W319 A355 L508 Y527	E318-H353 PolarHBondContact O-CD2 2.76Å; W319-H353 HydrophobicContact CD2-CB 4.46Å; W319-H353 AromaticContact CE2-CD2 3.95Å; W319-H353 HydrophobicContact CE3-CB 3.83Å; W319-H353 HydrophobicContact CH2-CB 3.89Å; W319-H353 HydrophobicContact CZ2-CB 4.49Å; W319-H353 HydrophobicContact CZ3-CB 3.54Å; H353-A355 PolarHBondContact O-N 3.21Å; H353-L508 HydrophobicContact CB-CB 4.19Å; H353-L508 PolarHBondContact N-O 3.18Å; H353-Y527 AromaticContact CD2-CD1 3.86Å; H353-Y527 AromaticContact CD2-CG 3.6Å; H353-Y527 AromaticContact CE1-CD1 3.33Å; H353-Y527 WeakPolarHBondContact CE1-CD1 3.49Å; H353-Y527 AromaticContact CE1-CE1 3.21Å; H353-Y527 WeakPolarHBondContact CE1-CE1 3.31Å; H353-Y527 AromaticContact CE1-CE2 3.97Å; H353-Y527 AromaticContact CE1-CG 3.75Å; H353-Y527 AromaticContact CE1-CZ 3.52Å; H353-Y527 AromaticContact CG-CD2 3.97Å; H353-Y527 AromaticContact ND1-CE1 3.88Å; H353-Y527 AromaticContact ND1-CE2 3.8Å; H353-Y527 AromaticContact ND1-CZ 3.71Å; H353-Y527 AromaticContact NE2-CD1 3.16Å; H353-Y527 WeakPolarHBondContact NE2-CD1 3.38Å; H353-Y527 AromaticContact NE2-CE1 3.59Å; H353-Y527 AromaticContact NE2-CG 3.42Å
354	V	80.5	Confident	83.4	Confident	63 Å²	63	40.4 Å²	40.4	38%	0.382	21%	0.212	S	C	.	.			trans	-68.8	101.3	175.1	-178.7	0	0	0	0	107.7	E318 Q320	E318-V354 WeakPolarHBondContact O-CG2 3.46Å; E318-V354 PolarHBondContact O-N 2.85Å; Q320-V354 HydrophobicContact CB-CG2 4.48Å
355	A	71.2	Confident	83.1	Confident	17 Å²	17	40.6 Å²	40.6	14%	0.14	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-55.7	141.9	179.4	0	0	0	0	0	111.1	H353 A397	H353-A355 PolarHBondContact O-N 3.21Å; A355-A397 HydrophobicContact CB-CB 4.16Å
356	P	69	Low	83.1	Confident	34 Å²	34	40.8 Å²	40.8	22%	0.221	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-55	159.3	170.9	-22.4	31.3	0	0	0	111.9	I360 M362 P505	P356-I360 HydrophobicContact CB-CB 4.44Å; P356-I360 HydrophobicContact CB-CD1 3.92Å; P356-M362 HydrophobicContact CG-CE 3.79Å; P356-P505 HydrophobicContact CG-CB 4.4Å
357	K	68.2	Low	83.2	Confident	165 Å²	165	38.6 Å²	38.6	72%	0.717	21%	0.206	S	C	*	.	P	Polyproline II helix	trans	-52.1	146.6	175.9	-66	-176.8	-179.8	179.4	0	110.9	D359 I360	K357-D359 PolarHBondContact O-N 3.18Å; K357-I360 HydrophobicContact CB-CD1 4.43Å; K357-I360 WeakPolarHBondContact O-CB 3.48Å; K357-I360 PolarHBondContact O-N 3.15Å; K357-I360 VanDerWaalsContact O-N 3.14Å
358	S	65.6	Low	83.3	Confident	90 Å²	90	37.7 Å²	37.7	63%	0.629	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-18.6	-177	50.5	0	0	0	0	115.6	I360	S358-I360 VanDerWaalsContact C-N 3.27Å
359	D	68.7	Low	83.3	Confident	109 Å²	109	37.8 Å²	37.8	58%	0.583	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-0.8	-173.9	-48	-21.5	0	0	0	112.2	K357 V534	K357-D359 PolarHBondContact O-N 3.18Å; D359-V534 WeakPolarHBondContact O-CB 3.39Å; D359-V534 PolarHBondContact O-N 3.22Å
360	I	71.3	Confident	83.3	Confident	41 Å²	41	37.8 Å²	37.8	21%	0.21	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	129.7	178.9	-63.3	170.3	0	0	0	108.1	P356 K357 S358 P505 A531	P356-I360 HydrophobicContact CB-CB 4.44Å; P356-I360 HydrophobicContact CB-CD1 3.92Å; K357-I360 HydrophobicContact CB-CD1 4.43Å; K357-I360 WeakPolarHBondContact O-CB 3.48Å; K357-I360 PolarHBondContact O-N 3.15Å; K357-I360 VanDerWaalsContact O-N 3.14Å; S358-I360 VanDerWaalsContact C-N 3.27Å; I360-P505 WeakPolarHBondContact O-CD 3.43Å; I360-A531 HydrophobicContact CG2-CB 3.61Å
361	G	75.7	Confident	83.3	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	149.7	170.1	0	0	0	0	0	108.5	R503 A531 Y532	G361-R503 WeakPolarHBondContact CA-O 3.45Å; G361-A531 WeakPolarHBondContact O-CA 3.44Å; G361-Y532 VanDerWaalsContact C-CE1 3.44Å; G361-Y532 PolarHBondContact N-O 3.47Å; G361-Y532 WeakPolarHBondContact O-CD1 3.42Å; G361-Y532 PolarHBondContact O-N 2.94Å; G361-Y532 VanDerWaalsContact O-O 3.13Å
362	M	77.8	Confident	83.3	Confident	14 Å²	14	37.6 Å²	37.6	7%	0.069	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	124.2	-176.6	-171.6	176	-84	0	0	109.6	P356 W364 Q365 R503 P505 Y527	P356-M362 HydrophobicContact CG-CE 3.79Å; M362-W364 WeakPolarHBondContact CG-O 3.44Å; M362-Q365 HydrophobicContact SD-CB 3.6Å; M362-Q365 HydrophobicContact SD-CG 3.92Å; M362-R503 PolarHBondContact N-O 3.49Å; M362-P505 HydrophobicContact CE-CB 4.21Å; M362-Y527 WeakPolarHBondContact CE-OH 3.23Å
363	E	81.9	Confident	83.3	Confident	107 Å²	107	37.1 Å²	37.1	50%	0.5	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	-43	176.1	-65.8	-163.5	164.9	0	0	110.8	E530 Y532	E363-E530 PolarHBondContact N-O 3.44Å; E363-E530 VanDerWaalsContact N-O 3.13Å; E363-Y532 HydrophobicContact CG-CD1 3.87Å; E363-Y532 HydrophobicContact CG-CE1 3.73Å
364	W	87.5	Confident	83.5	Confident	73 Å²	73	37.1 Å²	37.1	28%	0.277	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	156.1	174.1	64.1	-90.3	0	0	0	112.3	M362 D458 R459 S528 S529 E530	M362-W364 WeakPolarHBondContact CG-O 3.44Å; W364-D458 CarbonylContact C-O 3.59Å; W364-D458 WeakPolarHBondContact CA-O 3.46Å; W364-R459 HydrophobicContact CB-CG 4.24Å; W364-S528 WeakPolarHBondContact CH2-OG 3.44Å; W364-S529 VanDerWaalsContact O-CA 3.31Å; W364-S529 WeakPolarHBondContact O-CA 3.39Å; W364-S529 WeakPolarHBondContact O-CB 3.46Å; W364-E530 HydrophobicContact CD2-CB 4.27Å; W364-E530 HydrophobicContact CG-CB 4.31Å; W364-E530 HydrophobicContact CZ2-CB 3.97Å; W364-E530 PolarHBondContact NE1-OE2 3.09Å; W364-E530 PolarHBondContact O-N 3.3Å
365	Q	89.2	Confident	83.9	Confident	3 Å²	3	35.8 Å²	35.8	1%	0.014	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	147.7	162.8	55.7	-174.5	-11.8	0	0	110.1	M362 T457 D458 R506 Y527 S528	M362-Q365 HydrophobicContact SD-CB 3.6Å; M362-Q365 HydrophobicContact SD-CG 3.92Å; Q365-T457 CarbonylContact O-C 3.5Å; Q365-T457 WeakPolarHBondContact O-CA 3.35Å; Q365-D458 HydrophobicContact CG-CB 3.64Å; Q365-D458 PolarHBondContact N-O 2.91Å; Q365-D458 PolarHBondContact NE2-OD2 3.32Å; Q365-D458 PolarHBondContact O-N 3.17Å; Q365-R506 PolarHBondContact NE2-O 2.93Å; Q365-R506 PolarHBondContact OE1-O 3.38Å; Q365-Y527 HydrophobicContact CB-CE2 3.79Å; Q365-Y527 HydrophobicContact CG-CE2 4.48Å; Q365-Y527 PolarHBondContact OE1-OH 3.39Å; Q365-S528 CarbonylContact C-O 3.57Å; Q365-S528 VanDerWaalsContact CA-O 3.3Å; Q365-S528 WeakPolarHBondContact CA-O 3.39Å
366	S	91.2	Very high	84.1	Confident	6 Å²	6	37.9 Å²	37.9	4%	0.042	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	142.1	178.2	-166.4	0	0	0	0	110.1	E455 M456 S528	S366-E455 WeakPolarHBondContact OG-CG 3.27Å; S366-E455 PolarHBondContact OG-OE1 2.78Å; S366-M456 CarbonylContact C-O 3.6Å; S366-M456 VanDerWaalsContact CA-O 3.29Å; S366-M456 WeakPolarHBondContact CA-O 3.35Å; S366-S528 PolarHBondContact N-O 2.87Å; S366-S528 PolarHBondContact O-N 2.82Å
367	L	93.9	Very high	84.1	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	123.4	173.4	-179.5	63.5	0	0	0	108.7	W319 I392 F454 E455 M456 L508 I510 L525	W319-L367 HydrophobicContact CH2-CD1 3.55Å; W319-L367 HydrophobicContact CZ2-CD1 3.95Å; L367-I392 HydrophobicContact CD2-CD1 4.15Å; L367-I392 HydrophobicContact CD2-CG2 3.86Å; L367-F454 HydrophobicContact CD2-CE2 4.44Å; L367-F454 HydrophobicContact CG-CE2 4.27Å; L367-E455 CarbonylContact O-C 3.54Å; L367-E455 WeakPolarHBondContact O-CA 3.42Å; L367-M456 PolarHBondContact N-O 3.42Å; L367-M456 PolarHBondContact O-N 2.76Å; L367-L508 HydrophobicContact CB-CD1 4.1Å; L367-L508 HydrophobicContact CD2-CD1 4.47Å; L367-I510 HydrophobicContact CD1-CD1 4.37Å; L367-I510 HydrophobicContact CD2-CD1 3.79Å; L367-I510 HydrophobicContact CD2-CG1 4.04Å; L367-L525 HydrophobicContact CD1-CD1 3.6Å; L367-L525 HydrophobicContact CD1-CG 4.27Å; L367-L525 HydrophobicContact CG-CD1 4.29Å
368	T	93.5	Very high	84	Confident	25 Å²	25	40.4 Å²	40.4	15%	0.153	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	147.8	-179.3	62.6	0	0	0	0	110.4	F454 E455 M482 H526	T368-F454 WeakPolarHBondContact CA-O 3.23Å; T368-E455 HydrophobicContact CG2-CB 4.06Å; T368-E455 HydrophobicContact CG2-CG 3.82Å; T368-M482 HydrophobicContact CG2-CE 3.72Å; T368-H526 PolarHBondContact N-O 3.13Å; T368-H526 PolarHBondContact O-N 3.4Å; T368-H526 PolarHBondContact OG1-O 3.23Å
369	G	93.9	Very high	83.7	Confident	8 Å²	8	45.3 Å²	45.3	8%	0.082	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.3	173.1	172.5	0	0	0	0	0	112.6	F454	G369-F454 PolarHBondContact N-O 2.81Å; G369-F454 VanDerWaalsContact N-O 3.11Å; G369-F454 WeakPolarHBondContact O-CD1 3.33Å; G369-F454 WeakPolarHBondContact O-CE1 3.39Å; G369-F454 PolarHBondContact O-N 3.46Å
370	R	94.1	Very high	83.6	Confident	3 Å²	3	41.6 Å²	41.6	1%	0.011	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	115.7	173.1	175.6	168.2	-65.8	175.8	-4.2	110.1	V372 Y452 D453 E474 V522 R523	R370-V372 HydrophobicContact CG-CG2 4.18Å; R370-Y452 CarbonylContact C-O 3.56Å; R370-Y452 WeakPolarHBondContact CA-O 3.43Å; R370-D453 WeakPolarHBondContact CA-OD1 3.38Å; R370-D453 WeakPolarHBondContact CB-OD1 3.24Å; R370-D453 VanDerWaalsContact CG-OD1 3.23Å; R370-D453 WeakPolarHBondContact CG-OD1 3.46Å; R370-D453 IonicContact CZ-OD1 2.95Å; R370-D453 IonicContact CZ-OD2 3.01Å; R370-D453 IonicContact NE-OD1 3.92Å; R370-D453 PolarHBondContact NE-OD1 2.77Å; R370-D453 IonicContact NE-OD2 2.96Å; R370-D453 IonicContact NH2-OD1 3.52Å; R370-D453 IonicContact NH2-OD2 3.02Å; R370-D453 PolarHBondContact NH2-OD2 3.41Å; R370-E474 PolarHBondContact NH1-O 2.74Å; R370-V522 CarbonylContact O-C 3.56Å; R370-V522 VanDerWaalsContact O-CA 3.27Å; R370-V522 WeakPolarHBondContact O-CA 3.37Å; R370-R523 HydrophobicContact CB-CB 4.19Å; R370-R523 PolarHBondContact N-O 3.21Å; R370-R523 PolarHBondContact O-N 3.24Å
371	L	96.7	Very high	82.9	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	121.9	173.3	179.2	60.1	0	0	0	110.4	F373 L390 I414 C451 Y452 F454 L520 V522	L371-F373 HydrophobicContact CD2-CD2 4.42Å; L371-F373 HydrophobicContact CD2-CE1 4.3Å; L371-F373 HydrophobicContact CD2-CE2 3.48Å; L371-F373 VanDerWaalsContact CD2-CE2 3.48Å; L371-F373 HydrophobicContact CD2-CZ 3.41Å; L371-F373 VanDerWaalsContact CD2-CZ 3.41Å; L371-F373 HydrophobicContact CG-CD2 4.26Å; L371-F373 HydrophobicContact CG-CE2 3.77Å; L371-F373 HydrophobicContact CG-CZ 4.04Å; L371-L390 HydrophobicContact CD1-CB 4.05Å; L371-L390 HydrophobicContact CD1-CD1 4.39Å; L371-L390 HydrophobicContact CD1-CD2 4.31Å; L371-L390 HydrophobicContact CD1-CG 4.5Å; L371-L390 HydrophobicContact CD2-CB 3.65Å; L371-L390 HydrophobicContact CD2-CD2 4.23Å; L371-L390 HydrophobicContact CG-CB 4.49Å; L371-I414 HydrophobicContact CD2-CB 3.78Å; L371-I414 HydrophobicContact CD2-CD1 4.34Å; L371-I414 HydrophobicContact CD2-CG2 3.72Å; L371-C451 VanDerWaalsContact O-CA 3.28Å; L371-C451 WeakPolarHBondContact O-CA 3.42Å; L371-Y452 PolarHBondContact N-O 3.06Å; L371-Y452 PolarHBondContact O-N 3.09Å; L371-F454 HydrophobicContact CB-CD1 4.27Å; L371-F454 HydrophobicContact CB-CE1 4.3Å; L371-L520 HydrophobicContact CD1-CB 4.1Å; L371-L520 HydrophobicContact CD1-CD1 4.49Å; L371-L520 HydrophobicContact CD1-CD2 4.28Å; L371-V522 HydrophobicContact CD1-CG2 4.14Å
372	V	95.3	Very high	82	Confident	5 Å²	5	52.3 Å²	52.3	3%	0.03	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	125.2	172.7	-173.5	0	0	0	0	108.8	R370 V374 D450 L521 R523	R370-V372 HydrophobicContact CG-CG2 4.18Å; V372-V374 HydrophobicContact CG1-CG2 4.07Å; V372-D450 WeakPolarHBondContact CA-O 3.48Å; V372-L521 HydrophobicContact CB-CB 4.13Å; V372-L521 WeakPolarHBondContact CB-O 3.5Å; V372-L521 PolarHBondContact N-O 3.29Å; V372-L521 PolarHBondContact O-N 3.41Å; V372-R523 HydrophobicContact CG2-CG 4.19Å
373	F	94.3	Very high	80.7	Confident	6 Å²	6	58.5 Å²	58.5	3%	0.026	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	116	173.4	-70	-85.2	0	0	0	110	L371 R380 G416 D450 Y452 V518 L520	L371-F373 HydrophobicContact CD2-CD2 4.42Å; L371-F373 HydrophobicContact CD2-CE1 4.3Å; L371-F373 HydrophobicContact CD2-CE2 3.48Å; L371-F373 VanDerWaalsContact CD2-CE2 3.48Å; L371-F373 HydrophobicContact CD2-CZ 3.41Å; L371-F373 VanDerWaalsContact CD2-CZ 3.41Å; L371-F373 HydrophobicContact CG-CD2 4.26Å; L371-F373 HydrophobicContact CG-CE2 3.77Å; L371-F373 HydrophobicContact CG-CZ 4.04Å; F373-R380 VanDerWaalsContact CG-NH1 3.32Å; F373-G416 VanDerWaalsContact CZ-CA 3.46Å; F373-D450 PolarHBondContact N-O 3.02Å; F373-Y452 HydrophobicContact CD2-CD2 4.14Å; F373-Y452 HydrophobicContact CD2-CE2 4.03Å; F373-Y452 AromaticContact CE2-CD2 3.63Å; F373-Y452 HydrophobicContact CE2-CD2 3.63Å; F373-Y452 AromaticContact CE2-CE2 3.58Å; F373-Y452 HydrophobicContact CE2-CE2 3.58Å; F373-V518 HydrophobicContact CB-CG1 4.2Å; F373-V518 HydrophobicContact CD1-CG1 3.89Å; F373-L520 HydrophobicContact CD1-CD2 3.42Å; F373-L520 VanDerWaalsContact CD1-CD2 3.42Å; F373-L520 HydrophobicContact CE1-CD2 3.52Å; F373-L520 HydrophobicContact CG-CD2 4.37Å
374	V	93.6	Very high	79.3	Confident	9 Å²	9	56 Å²	56	6%	0.055	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	109.9	-178.7	-173.1	0	0	0	0	109.4	W208 R209 L212 V372 V518 D519	W208-V374 HydrophobicContact CB-CG1 4.15Å; W208-V374 HydrophobicContact CB-CG2 3.74Å; W208-V374 HydrophobicContact CG-CG2 4.48Å; R209-V374 HydrophobicContact CB-CG1 3.69Å; L212-V374 HydrophobicContact CD1-CB 4.23Å; L212-V374 HydrophobicContact CD1-CG1 4.11Å; L212-V374 HydrophobicContact CD1-CG2 4.2Å; V372-V374 HydrophobicContact CG1-CG2 4.07Å; V374-V518 WeakPolarHBondContact O-CA 2.83Å; V374-D519 HydrophobicContact CB-CB 4.21Å; V374-D519 PolarHBondContact N-O 3.02Å; V374-D519 PolarHBondContact O-N 2.8Å
375	T	88.8	Confident	77.3	Confident	36 Å²	36	61.9 Å²	61.9	22%	0.221	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	156.9	-174.9	70.4	0	0	0	0	111.9	R209 G377 R380 V518	R209-T375 WeakPolarHBondContact CD-O 3.44Å; T375-G377 PolarHBondContact O-N 2.92Å; T375-G377 VanDerWaalsContact O-N 3.13Å; T375-R380 HydrophobicContact CG2-CG 3.64Å; T375-V518 HydrophobicContact CG2-CG2 4.29Å
376	D	77.1	Confident	75.7	Confident	60 Å²	60	68 Å²	68	32%	0.321	34%	0.336	S	S	.	.	S	Bend	trans	-73.7	14.5	173.2	69	-10.8	0	0	0	114.2	R378 S517	D376-R378 VanDerWaalsContact C-N 3.3Å; D376-R378 WeakPolarHBondContact OD1-CB 3.41Å; D376-R378 VanDerWaalsContact OD1-CG 3.23Å; D376-R378 WeakPolarHBondContact OD1-CG 3.32Å; D376-R378 PolarHBondContact OD1-N 2.81Å; D376-R378 WeakPolarHBondContact OD2-CD 3.47Å; D376-R378 IonicContact OD2-NE 3.6Å; D376-S517 PolarHBondContact N-O 3.26Å
377	G	68.9	Low	75	Confident	65 Å²	65	72 Å²	72	67%	0.67	35%	0.354	S	S	*	.	S	Bend	trans	87.3	-10.4	-172.6	0	0	0	0	0	113.8	T375 K379	T375-G377 PolarHBondContact O-N 2.92Å; T375-G377 VanDerWaalsContact O-N 3.13Å; G377-K379 PolarHBondContact O-N 2.8Å
378	R	64.3	Low	74.8	Confident	187 Å²	187	72.6 Å²	72.6	71%	0.706	36%	0.357	S	S	*	.	S	Bend	trans	-72	126.2	165.9	-61.5	175.9	178.3	-172.5	-0.4	108.2	D376 R380	D376-R378 VanDerWaalsContact C-N 3.3Å; D376-R378 WeakPolarHBondContact OD1-CB 3.41Å; D376-R378 VanDerWaalsContact OD1-CG 3.23Å; D376-R378 WeakPolarHBondContact OD1-CG 3.32Å; D376-R378 PolarHBondContact OD1-N 2.81Å; D376-R378 WeakPolarHBondContact OD2-CD 3.47Å; D376-R378 IonicContact OD2-NE 3.6Å; R378-R380 PolarHBondContact O-N 2.82Å; R378-R380 VanDerWaalsContact O-N 3.16Å
379	K	60.5	Low	74.9	Confident	193 Å²	193	71.4 Å²	71.4	84%	0.839	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-55.5	125.5	172	-72.2	-172.6	177.8	-177.5	0	108.6	G377 T381	G377-K379 PolarHBondContact O-N 2.8Å; K379-T381 PolarHBondContact O-N 3Å
380	R	65.9	Low	75	Confident	31 Å²	31	71 Å²	71	12%	0.117	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-55.2	124	167	-73.7	179.5	-67.8	155.5	5	107.2	F373 T375 R378 G416 M448 A449 D450 V518	F373-R380 VanDerWaalsContact CG-NH1 3.32Å; T375-R380 HydrophobicContact CG2-CG 3.64Å; R378-R380 PolarHBondContact O-N 2.82Å; R378-R380 VanDerWaalsContact O-N 3.16Å; R380-G416 PolarHBondContact NH1-O 3.2Å; R380-M448 HydrophobicContact CB-SD 3.93Å; R380-A449 PolarHBondContact NH1-O 3.14Å; R380-A449 PolarHBondContact NH2-O 2.77Å; R380-D450 IonicContact CZ-OD1 2.72Å; R380-D450 IonicContact NE-OD1 3.44Å; R380-D450 VanDerWaalsContact NH2-CA 3.27Å; R380-D450 IonicContact NH2-OD1 3.55Å; R380-D450 PolarHBondContact NH2-OD1 3.01Å; R380-V518 HydrophobicContact CG-CG2 4.4Å
381	T	57.9	Low	75.1	Confident	78 Å²	78	71.1 Å²	71.1	48%	0.479	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-99.3	137.8	175.7	59	0	0	0	0	107.9	K379 N383 S384	K379-T381 PolarHBondContact O-N 3Å; T381-N383 PolarHBondContact O-N 2.99Å; T381-S384 PolarHBondContact O-N 2.9Å; T381-S384 PolarHBondContact O-OG 2.64Å; T381-S384 PolarHBondContact OG1-N 3.09Å
382	R	55.5	Low	75.1	Confident	190 Å²	190	71.1 Å²	71.1	72%	0.717	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-25.6	174.1	-159.9	176.1	-173.6	-174.7	0.8	112.1
383	N	50.4	Low	75.1	Confident	143 Å²	143	72.3 Å²	72.3	77%	0.765	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-0.7	-179.3	-70	-7.2	0	0	0	114.5	T381 K385	T381-N383 PolarHBondContact O-N 2.99Å; N383-K385 PolarHBondContact O-N 3.21Å
384	S	52.8	Low	74.9	Confident	56 Å²	56	72 Å²	72	39%	0.392	35%	0.35	S	S	.	.			trans	-69.4	86.3	170.9	64.7	0	0	0	0	108.3	T381 K386	T381-S384 PolarHBondContact O-N 2.9Å; T381-S384 PolarHBondContact O-OG 2.64Å; T381-S384 PolarHBondContact OG1-N 3.09Å; S384-K386 CarbonylContact O-C 3.57Å; S384-K386 PolarHBondContact O-N 2.56Å
385	K	45.7	Very low	74.6	Confident	196 Å²	196	72 Å²	72	85%	0.852	35%	0.349	S	S	*	.			trans	-56.3	-0.8	168.8	-73.7	-174.2	174.7	-175.8	0	113.6	N383 E387	N383-K385 PolarHBondContact O-N 3.21Å; K385-E387 PolarHBondContact O-N 3.39Å; K385-E387 VanDerWaalsContact O-N 3.1Å
386	K	55	Low	74.4	Confident	131 Å²	131	74.5 Å²	74.5	57%	0.57	36%	0.361	S	S	*	.	S	Bend	trans	-80	84.2	161.4	-60.4	-169.8	-176.9	175.7	0	106.9	S384 T388 D515	S384-K386 CarbonylContact O-C 3.57Å; S384-K386 PolarHBondContact O-N 2.56Å; K386-T388 PolarHBondContact O-N 3.26Å; K386-D515 WeakPolarHBondContact CD-OD2 3.15Å; K386-D515 IonicContact NZ-OD2 2.9Å; K386-D515 PolarHBondContact NZ-OD2 3.2Å
387	E	77.9	Confident	74.6	Confident	91 Å²	91	72.9 Å²	72.9	43%	0.425	36%	0.357	S	S	.	.			trans	-61.2	66.8	-178	-71.8	173.7	175.1	0	0	111.9	K385 G389 Y413	K385-E387 PolarHBondContact O-N 3.39Å; K385-E387 VanDerWaalsContact O-N 3.1Å; E387-G389 PolarHBondContact O-N 3.39Å; E387-Y413 WeakPolarHBondContact CA-OH 3.43Å; E387-Y413 WeakPolarHBondContact CB-OH 3.36Å; E387-Y413 PolarHBondContact O-OH 3.48Å
388	T	89.7	Confident	75.1	Confident	12 Å²	12	74 Å²	74	7%	0.074	35%	0.354	C	S	.	.			trans	-71.7	120.6	174.7	-55.7	0	0	0	0	109.5	K386 G416 Q513 G514 D515 V518	K386-T388 PolarHBondContact O-N 3.26Å; T388-G416 PolarHBondContact O-N 3.29Å; T388-Q513 CarbonylContact C-O 3.56Å; T388-Q513 WeakPolarHBondContact CA-O 3.1Å; T388-Q513 WeakPolarHBondContact CG2-O 3.45Å; T388-G514 WeakPolarHBondContact OG1-CA 3.36Å; T388-D515 PolarHBondContact OG1-N 3.38Å; T388-V518 HydrophobicContact CG2-CB 3.76Å; T388-V518 HydrophobicContact CG2-CG1 4.28Å
389	G	94.4	Very high	76.1	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.5	166.6	-171.3	0	0	0	0	0	113.3	E387 I414 Q513 L520	E387-G389 PolarHBondContact O-N 3.39Å; G389-I414 CarbonylContact C-O 3.55Å; G389-I414 WeakPolarHBondContact CA-O 3.34Å; G389-Q513 PolarHBondContact N-O 2.74Å; G389-Q513 PolarHBondContact O-N 2.9Å; G389-L520 WeakPolarHBondContact O-CD1 3.48Å
390	L	97.2	Very high	77.2	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	131.1	174.1	-172.1	72.1	0	0	0	109	M343 L371 I392 Y413 I414 F454 I510 L520 V522	M343-L390 HydrophobicContact CE-CD1 4.27Å; M343-L390 HydrophobicContact SD-CD1 4.36Å; L371-L390 HydrophobicContact CD1-CB 4.05Å; L371-L390 HydrophobicContact CD1-CD1 4.39Å; L371-L390 HydrophobicContact CD1-CD2 4.31Å; L371-L390 HydrophobicContact CD1-CG 4.5Å; L371-L390 HydrophobicContact CD2-CB 3.65Å; L371-L390 HydrophobicContact CD2-CD2 4.23Å; L371-L390 HydrophobicContact CG-CB 4.49Å; L390-I392 HydrophobicContact CD2-CD1 4.11Å; L390-I392 HydrophobicContact CD2-CG1 4.19Å; L390-I392 HydrophobicContact CG-CG1 4.31Å; L390-Y413 CarbonylContact O-C 3.54Å; L390-Y413 WeakPolarHBondContact O-CA 3.45Å; L390-I414 HydrophobicContact CB-CB 4.31Å; L390-I414 HydrophobicContact CD2-CD1 4.26Å; L390-I414 PolarHBondContact N-O 3.05Å; L390-I414 PolarHBondContact O-N 3.35Å; L390-F454 HydrophobicContact CD2-CD1 4.33Å; L390-F454 HydrophobicContact CD2-CE1 3.73Å; L390-F454 HydrophobicContact CD2-CZ 3.85Å; L390-I510 HydrophobicContact CD1-CG2 3.51Å; L390-I510 HydrophobicContact CG-CG2 4.22Å; L390-L520 HydrophobicContact CB-CD1 4.31Å; L390-L520 HydrophobicContact CD1-CD1 4.37Å; L390-V522 HydrophobicContact CD1-CG2 3.67Å; L390-V522 HydrophobicContact CD2-CG2 4.31Å
391	V	96.2	Very high	78.3	Confident	4 Å²	4	63.9 Å²	63.9	2%	0.024	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	125.6	173.3	176.7	0	0	0	0	108.4	R393 T411 A412 Y413 I510 Q511 Q513	V391-R393 HydrophobicContact CG1-CG 3.9Å; V391-T411 HydrophobicContact CG1-CG2 4.08Å; V391-A412 CarbonylContact C-O 3.54Å; V391-A412 WeakPolarHBondContact CA-O 3.48Å; V391-Y413 HydrophobicContact CG2-CD2 3.81Å; V391-Y413 HydrophobicContact CG2-CE2 4.41Å; V391-I510 CarbonylContact O-C 3.58Å; V391-I510 WeakPolarHBondContact O-CA 3.41Å; V391-Q511 HydrophobicContact CB-CB 4.34Å; V391-Q511 PolarHBondContact N-O 2.63Å; V391-Q511 PolarHBondContact O-N 3.04Å; V391-Q513 HydrophobicContact CG2-CB 3.59Å
392	I	96.4	Very high	79.7	Confident	1 Å²	1	65.8 Å²	65.8	1%	0.005	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	125.9	173.1	-53.5	168.1	0	0	0	107.6	L367 L390 A412 F454 M456 M465 Y509 I510	L367-I392 HydrophobicContact CD2-CD1 4.15Å; L367-I392 HydrophobicContact CD2-CG2 3.86Å; L390-I392 HydrophobicContact CD2-CD1 4.11Å; L390-I392 HydrophobicContact CD2-CG1 4.19Å; L390-I392 HydrophobicContact CG-CG1 4.31Å; I392-A412 HydrophobicContact CB-CB 4.23Å; I392-A412 PolarHBondContact N-O 3.36Å; I392-A412 PolarHBondContact O-N 2.95Å; I392-F454 HydrophobicContact CD1-CD2 3.93Å; I392-F454 HydrophobicContact CD1-CE2 3.58Å; I392-F454 HydrophobicContact CD1-CZ 4.25Å; I392-M456 HydrophobicContact CB-CE 4.49Å; I392-M456 HydrophobicContact CB-SD 4.2Å; I392-M456 HydrophobicContact CG2-CE 3.41Å; I392-M456 VanDerWaalsContact CG2-CE 3.41Å; I392-M456 HydrophobicContact CG2-SD 3.73Å; I392-M465 HydrophobicContact CD1-CE 4.49Å; I392-Y509 CarbonylContact C-O 3.55Å; I392-Y509 VanDerWaalsContact CA-O 3.29Å; I392-Y509 WeakPolarHBondContact CA-O 3.43Å; I392-I510 HydrophobicContact CG1-CG2 4.45Å
393	R	93.7	Very high	81.3	Confident	30 Å²	30	58.8 Å²	58.8	11%	0.113	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	132	-177.9	-74.7	165.7	172.3	-78.1	-3.5	110.5	V391 V406 V410 T411 E425 L508 Y509	V391-R393 HydrophobicContact CG1-CG 3.9Å; R393-V406 HydrophobicContact CB-CG1 4.15Å; R393-V406 VanDerWaalsContact CD-O 3.31Å; R393-V406 WeakPolarHBondContact CD-O 3.27Å; R393-V406 PolarHBondContact NE-O 3.27Å; R393-V406 VanDerWaalsContact NE-O 3.09Å; R393-V406 PolarHBondContact NH1-O 3.15Å; R393-V410 VanDerWaalsContact CA-O 3.32Å; R393-V410 WeakPolarHBondContact CA-O 3.42Å; R393-T411 PolarHBondContact NH1-OG1 2.88Å; R393-E425 IonicContact CZ-OE1 3.72Å; R393-E425 IonicContact NH1-OE1 2.74Å; R393-E425 PolarHBondContact NH1-OE1 3.21Å; R393-E425 IonicContact NH1-OE2 3.67Å; R393-E425 PolarHBondContact NH1-OE2 2.78Å; R393-E425 IonicContact NH2-OE1 3.75Å; R393-E425 PolarHBondContact NH2-OE1 3.31Å; R393-L508 WeakPolarHBondContact O-CA 3.02Å; R393-Y509 PolarHBondContact N-O 3.04Å; R393-Y509 PolarHBondContact O-N 3.21Å
394	I	91.2	Very high	83	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	128.1	172	-43.1	-177.4	0	0	0	108.1	G408 D409 V410 M456 D458 V463 R506 L508	I394-G408 CarbonylContact O-C 3.57Å; I394-G408 WeakPolarHBondContact O-CA 3.32Å; I394-D409 PolarHBondContact O-N 2.84Å; I394-V410 HydrophobicContact CB-CB 4.07Å; I394-V410 HydrophobicContact CD1-CB 4.21Å; I394-V410 HydrophobicContact CD1-CG1 4.34Å; I394-V410 HydrophobicContact CG1-CB 4.13Å; I394-V410 PolarHBondContact N-O 2.79Å; I394-V410 PolarHBondContact O-N 3.18Å; I394-M456 HydrophobicContact CD1-CE 3.57Å; I394-M456 HydrophobicContact CD1-SD 4.11Å; I394-M456 HydrophobicContact CG1-CE 3.62Å; I394-M456 HydrophobicContact CG1-SD 4.33Å; I394-D458 HydrophobicContact CD1-CB 4.06Å; I394-V463 HydrophobicContact CD1-CG1 3.79Å; I394-V463 HydrophobicContact CD1-CG2 4.08Å; I394-R506 HydrophobicContact CG2-CB 3.58Å; I394-R506 HydrophobicContact CG2-CG 4.33Å; I394-R506 VanDerWaalsContact CG2-CZ 3.41Å; I394-L508 HydrophobicContact CB-CD2 4.31Å; I394-L508 HydrophobicContact CD1-CD2 4.29Å; I394-L508 HydrophobicContact CG1-CD2 3.72Å; I394-L508 HydrophobicContact CG2-CD2 4.15Å
395	T	88	Confident	84.6	Confident	8 Å²	8	56 Å²	56	5%	0.049	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	171.7	-175.2	-174.6	0	0	0	0	110.9	Y399 R407 R506 S507 Y509	T395-Y399 HydrophobicContact CG2-CD1 3.75Å; T395-Y399 WeakPolarHBondContact OG1-CD1 3.06Å; T395-R407 PolarHBondContact OG1-O 3.37Å; T395-R506 CarbonylContact O-C 3.52Å; T395-R506 WeakPolarHBondContact O-CA 3.3Å; T395-R506 VanDerWaalsContact O-CB 3.27Å; T395-R506 WeakPolarHBondContact O-CB 2.9Å; T395-S507 PolarHBondContact N-O 3.01Å; T395-S507 PolarHBondContact O-N 3.22Å; T395-Y509 HydrophobicContact CG2-CD2 3.45Å; T395-Y509 VanDerWaalsContact CG2-CD2 3.45Å; T395-Y509 HydrophobicContact CG2-CE2 3.12Å
396	N	83.4	Confident	86.7	Confident	88 Å²	88	46.6 Å²	46.6	47%	0.471	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	141.7	177.6	-168.3	-25.3	0	0	0	111.6	S398 Y399 S507	N396-S398 PolarHBondContact O-N 3.27Å; N396-S398 VanDerWaalsContact O-N 3.17Å; N396-S398 PolarHBondContact OD1-N 3.28Å; N396-S398 VanDerWaalsContact OD1-N 3.16Å; N396-S398 PolarHBondContact OD1-OG 3.12Å; N396-Y399 PolarHBondContact O-N 3.49Å; N396-Y399 VanDerWaalsContact O-N 3.12Å; N396-S507 PolarHBondContact O-OG 3.38Å
397	A	81.3	Confident	88.2	Confident	27 Å²	27	48.3 Å²	48.3	22%	0.223	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-33.9	173.6	0	0	0	0	0	113.6	R352 A355 P505 S507	R352-A397 PolarHBondContact NH2-O 2.81Å; A355-A397 HydrophobicContact CB-CB 4.16Å; A397-P505 WeakPolarHBondContact CB-O 3Å; A397-S507 WeakPolarHBondContact CA-OG 3.5Å; A397-S507 PolarHBondContact O-OG 2.88Å
398	S	80.8	Confident	88.5	Confident	87 Å²	87	44.4 Å²	44.4	61%	0.608	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-6.6	-177.7	62.6	0	0	0	0	115	N396 F400	N396-S398 PolarHBondContact O-N 3.27Å; N396-S398 VanDerWaalsContact O-N 3.17Å; N396-S398 PolarHBondContact OD1-N 3.28Å; N396-S398 VanDerWaalsContact OD1-N 3.16Å; N396-S398 PolarHBondContact OD1-OG 3.12Å; S398-F400 WeakPolarHBondContact O-CD2 3.5Å
399	Y	83.6	Confident	88.3	Confident	67 Å²	67	46.8 Å²	46.8	26%	0.263	26%	0.258	S	S	.	.			trans	-76.6	131.2	-179.2	178.1	-118.5	0	0	0	110.7	T395 N396 P401 V406 R407 Y509	T395-Y399 HydrophobicContact CG2-CD1 3.75Å; T395-Y399 WeakPolarHBondContact OG1-CD1 3.06Å; N396-Y399 PolarHBondContact O-N 3.49Å; N396-Y399 VanDerWaalsContact O-N 3.12Å; Y399-P401 HydrophobicContact CD1-CG 4.19Å; Y399-P401 HydrophobicContact CE1-CB 4.21Å; Y399-P401 HydrophobicContact CE1-CG 3.56Å; Y399-V406 HydrophobicContact CE1-CG1 3.93Å; Y399-R407 WeakPolarHBondContact CE1-O 3.2Å; Y399-R407 PolarHBondContact OH-N 3.37Å; Y399-Y509 PolarHBondContact O-OH 3.18Å
400	F	85.4	Confident	88.2	Confident	121 Å²	121	46.9 Å²	46.9	53%	0.531	26%	0.258	S	S	.	.			trans	-133.7	104	173.5	-71.9	-86.9	0	0	0	109.1	R352 S398	R352-F400 VanDerWaalsContact CZ-CE1 3.44Å; S398-F400 WeakPolarHBondContact O-CD2 3.5Å
401	P	87.6	Confident	88	Confident	11 Å²	11	46.9 Å²	46.9	7%	0.071	26%	0.258	C	S	.	.			trans	-63.4	137.8	177	-3.8	9	0	0	0	111.6	Y350 Y399 V406 Y509	Y350-P401 HydrophobicContact CE1-CB 3.99Å; Y350-P401 HydrophobicContact CE1-CG 3.77Å; Y350-P401 PolarHBondContact OH-O 2.78Å; Y399-P401 HydrophobicContact CD1-CG 4.19Å; Y399-P401 HydrophobicContact CE1-CB 4.21Å; Y399-P401 HydrophobicContact CE1-CG 3.56Å; P401-V406 HydrophobicContact CB-CG2 4.44Å; P401-V406 HydrophobicContact CG-CB 4.29Å; P401-V406 HydrophobicContact CG-CG1 4.27Å; P401-V406 HydrophobicContact CG-CG2 3.74Å; P401-Y509 HydrophobicContact CG-CD1 4.47Å; P401-Y509 HydrophobicContact CG-CE1 3.82Å
402	S	87.4	Confident	87.9	Confident	118 Å²	118	46.7 Å²	46.7	83%	0.825	26%	0.257	S	S	*	.	S	Bend	trans	-93	3.5	171	56.2	0	0	0	0	113.2	F324	F324-S402 WeakPolarHBondContact CE1-O 3.47Å
403	S	89	Confident	87.9	Confident	44 Å²	44	46.7 Å²	46.7	31%	0.308	26%	0.257	S	S	.	.	S	Bend	trans	-139.2	164.4	-175.2	91.6	0	0	0	0	110	V405	S403-V405 PolarHBondContact O-N 3.11Å; S403-V405 VanDerWaalsContact O-N 3.15Å; S403-V405 PolarHBondContact OG-N 3.34Å; S403-V405 VanDerWaalsContact OG-N 3.13Å; S403-V405 PolarHBondContact OG-O 3.03Å
404	P	86.9	Confident	88	Confident	48 Å²	48	45.3 Å²	45.3	31%	0.312	25%	0.252	S	S	.	.	S	Bend	trans	-65	-14.2	175.3	27.1	-35	0	0	0	113	F324 V406 Q511	F324-P404 HydrophobicContact CD2-CB 3.77Å; F324-P404 HydrophobicContact CD2-CG 4.42Å; F324-P404 HydrophobicContact CE2-CB 4.27Å; F324-P404 HydrophobicContact CG-CB 4.26Å; F324-P404 HydrophobicContact CG-CG 4.45Å; P404-V406 PolarHBondContact O-N 3.07Å; P404-Q511 PolarHBondContact O-NE2 2.98Å
405	V	87	Confident	88.1	Confident	91 Å²	91	45.3 Å²	45.3	55%	0.552	25%	0.252	S	S	*	.			trans	-85.6	113	174.7	-175.8	0	0	0	0	109.1	S403	S403-V405 PolarHBondContact O-N 3.11Å; S403-V405 VanDerWaalsContact O-N 3.15Å; S403-V405 PolarHBondContact OG-N 3.34Å; S403-V405 VanDerWaalsContact OG-N 3.13Å; S403-V405 PolarHBondContact OG-O 3.03Å
406	V	88.7	Confident	88.2	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.254	C	S	.	.			trans	-91.2	136.3	171.7	178.7	0	0	0	0	107.5	Y350 R393 Y399 P401 P404 Y509 Q511	Y350-V406 HydrophobicContact CD1-CG2 3.53Å; Y350-V406 HydrophobicContact CE1-CG2 4.09Å; Y350-V406 HydrophobicContact CG-CG2 3.91Å; R393-V406 HydrophobicContact CB-CG1 4.15Å; R393-V406 VanDerWaalsContact CD-O 3.31Å; R393-V406 WeakPolarHBondContact CD-O 3.27Å; R393-V406 PolarHBondContact NE-O 3.27Å; R393-V406 VanDerWaalsContact NE-O 3.09Å; R393-V406 PolarHBondContact NH1-O 3.15Å; Y399-V406 HydrophobicContact CE1-CG1 3.93Å; P401-V406 HydrophobicContact CB-CG2 4.44Å; P401-V406 HydrophobicContact CG-CB 4.29Å; P401-V406 HydrophobicContact CG-CG1 4.27Å; P401-V406 HydrophobicContact CG-CG2 3.74Å; P404-V406 PolarHBondContact O-N 3.07Å; V406-Y509 HydrophobicContact CB-CD1 4.45Å; V406-Y509 HydrophobicContact CG1-CD1 3.86Å; V406-Y509 HydrophobicContact CG1-CD2 3.93Å; V406-Y509 HydrophobicContact CG1-CE1 4.39Å; V406-Y509 HydrophobicContact CG1-CE2 4.47Å; V406-Y509 HydrophobicContact CG1-CG 3.61Å; V406-Y509 HydrophobicContact CG2-CD1 3.66Å; V406-Y509 HydrophobicContact CG2-CE1 4.31Å; V406-Y509 HydrophobicContact CG2-CG 4.12Å; V406-Q511 VanDerWaalsContact CB-OE1 3.32Å; V406-Q511 HydrophobicContact CG2-CG 4.3Å; V406-Q511 VanDerWaalsContact CG2-NE2 3.29Å
407	R	86.7	Confident	88.4	Confident	166 Å²	166	42.7 Å²	42.7	63%	0.626	24%	0.243	S	C	*	.			trans	-105.3	145.9	166.3	-63.4	-177	-177.4	173.8	-0.4	109.6	T395 Y399	T395-R407 PolarHBondContact OG1-O 3.37Å; Y399-R407 WeakPolarHBondContact CE1-O 3.2Å; Y399-R407 PolarHBondContact OH-N 3.37Å
408	G	84.1	Confident	88.8	Confident	10 Å²	10	41.4 Å²	41.4	10%	0.103	23%	0.232	C	C	.	.			trans	-149.4	168.9	-177.8	0	0	0	0	0	112.8	I394 V410 E425	I394-G408 CarbonylContact O-C 3.57Å; I394-G408 WeakPolarHBondContact O-CA 3.32Å; G408-V410 VanDerWaalsContact C-N 3.33Å; G408-E425 PolarHBondContact N-OE2 2.8Å; G408-E425 WeakPolarHBondContact O-CB 2.98Å; G408-E425 WeakPolarHBondContact O-CG 3.3Å
409	D	86.1	Confident	89.3	Confident	62 Å²	62	40.8 Å²	40.8	33%	0.332	22%	0.217	S	C	.	.	S	Bend	trans	-73.7	-34	175.9	-51	-35.5	0	0	0	110.3	I394 N424 E425 R506	I394-D409 PolarHBondContact O-N 2.84Å; D409-N424 CarbonylContact O-C 3.45Å; D409-N424 VanDerWaalsContact O-CA 3.27Å; D409-N424 WeakPolarHBondContact O-CA 3.15Å; D409-E425 PolarHBondContact O-N 3.42Å; D409-R506 IonicContact OD2-NH1 2.82Å
410	V	91	Very high	89.9	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.006	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	133.2	-179	-178.3	0	0	0	0	109.5	R393 I394 G408 I422 E423 V463 L496	R393-V410 VanDerWaalsContact CA-O 3.32Å; R393-V410 WeakPolarHBondContact CA-O 3.42Å; I394-V410 HydrophobicContact CB-CB 4.07Å; I394-V410 HydrophobicContact CD1-CB 4.21Å; I394-V410 HydrophobicContact CD1-CG1 4.34Å; I394-V410 HydrophobicContact CG1-CB 4.13Å; I394-V410 PolarHBondContact N-O 2.79Å; I394-V410 PolarHBondContact O-N 3.18Å; G408-V410 VanDerWaalsContact C-N 3.33Å; V410-I422 HydrophobicContact CG1-CD1 3.96Å; V410-I422 HydrophobicContact CG1-CG1 3.83Å; V410-E423 WeakPolarHBondContact CA-O 3.42Å; V410-V463 HydrophobicContact CG1-CB 4.48Å; V410-V463 HydrophobicContact CG1-CG1 4.33Å; V410-V463 HydrophobicContact CG1-CG2 4.46Å; V410-V463 HydrophobicContact CG2-CG2 4.09Å; V410-L496 HydrophobicContact CG1-CD2 3.84Å; V410-L496 HydrophobicContact CG2-CD2 4.28Å
411	T	93.4	Very high	90.3	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	124.4	173.4	-65	0	0	0	0	109	V391 R393 Y421 I422 E423 E425	V391-T411 HydrophobicContact CG1-CG2 4.08Å; R393-T411 PolarHBondContact NH1-OG1 2.88Å; T411-Y421 HydrophobicContact CG2-CE2 4.11Å; T411-I422 CarbonylContact O-C 3.49Å; T411-I422 VanDerWaalsContact O-CA 3.31Å; T411-I422 WeakPolarHBondContact O-CA 3.26Å; T411-E423 PolarHBondContact N-O 3.2Å; T411-E423 PolarHBondContact O-N 3.44Å; T411-E425 WeakPolarHBondContact OG1-CG 2.97Å; T411-E425 PolarHBondContact OG1-OE1 3.15Å
412	A	95.3	Very high	90.6	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.008	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	136.8	171.8	0	0	0	0	0	109.1	V391 I392 Y421 I422 M456 M465	V391-A412 CarbonylContact C-O 3.54Å; V391-A412 WeakPolarHBondContact CA-O 3.48Å; I392-A412 HydrophobicContact CB-CB 4.23Å; I392-A412 PolarHBondContact N-O 3.36Å; I392-A412 PolarHBondContact O-N 2.95Å; A412-Y421 CarbonylContact C-O 3.59Å; A412-Y421 WeakPolarHBondContact CA-O 3.29Å; A412-I422 HydrophobicContact CB-CG1 4.27Å; A412-M456 HydrophobicContact CB-SD 3.9Å; A412-M465 HydrophobicContact CB-CE 4.04Å; A412-M465 HydrophobicContact CB-SD 3.65Å
413	Y	95.3	Very high	90.8	Very high	1 Å²	1	28.5 Å²	28.5	0%	0.004	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	134.5	-176.3	175.7	-101.2	0	0	0	111.8	E387 L390 V391 G415 Y419 V420 Y421 Q513	E387-Y413 WeakPolarHBondContact CA-OH 3.43Å; E387-Y413 WeakPolarHBondContact CB-OH 3.36Å; E387-Y413 PolarHBondContact O-OH 3.48Å; L390-Y413 CarbonylContact O-C 3.54Å; L390-Y413 WeakPolarHBondContact O-CA 3.45Å; V391-Y413 HydrophobicContact CG2-CD2 3.81Å; V391-Y413 HydrophobicContact CG2-CE2 4.41Å; Y413-G415 VanDerWaalsContact CE1-N 3.31Å; Y413-G415 VanDerWaalsContact OH-CA 3.28Å; Y413-G415 WeakPolarHBondContact OH-CA 3.34Å; Y413-Y419 HydrophobicContact CD1-CD1 4.42Å; Y413-Y419 HydrophobicContact CE1-CD1 4.32Å; Y413-V420 VanDerWaalsContact O-CA 3.27Å; Y413-V420 WeakPolarHBondContact O-CA 3.34Å; Y413-Y421 VanDerWaalsContact CB-CZ 3.42Å; Y413-Y421 AromaticContact CD1-CD1 3.62Å; Y413-Y421 HydrophobicContact CD1-CD1 3.62Å; Y413-Y421 AromaticContact CD1-CE1 3.42Å; Y413-Y421 HydrophobicContact CD1-CE1 3.42Å; Y413-Y421 VanDerWaalsContact CD1-CE1 3.42Å; Y413-Y421 HydrophobicContact CD2-CE1 4.37Å; Y413-Y421 HydrophobicContact CE1-CE1 4.37Å; Y413-Y421 AromaticContact CG-CD1 3.92Å; Y413-Y421 HydrophobicContact CG-CD1 3.92Å; Y413-Y421 AromaticContact CG-CE1 3.42Å; Y413-Y421 HydrophobicContact CG-CE1 3.42Å; Y413-Y421 VanDerWaalsContact CG-CE1 3.42Å; Y413-Y421 AromaticContact CG-CZ 3.98Å; Y413-Y421 PolarHBondContact N-O 2.91Å; Y413-Y421 PolarHBondContact O-N 2.96Å; Y413-Y421 VanDerWaalsContact O-N 3.12Å; Y413-Q513 HydrophobicContact CE2-CB 4.36Å
414	I	95.4	Very high	90.8	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	103.7	171.6	-43	-177.6	0	0	0	109.2	L371 G389 L390 V420 Y452 F454 M465 I467	L371-I414 HydrophobicContact CD2-CB 3.78Å; L371-I414 HydrophobicContact CD2-CD1 4.34Å; L371-I414 HydrophobicContact CD2-CG2 3.72Å; G389-I414 CarbonylContact C-O 3.55Å; G389-I414 WeakPolarHBondContact CA-O 3.34Å; L390-I414 HydrophobicContact CB-CB 4.31Å; L390-I414 HydrophobicContact CD2-CD1 4.26Å; L390-I414 PolarHBondContact N-O 3.05Å; L390-I414 PolarHBondContact O-N 3.35Å; I414-V420 HydrophobicContact CG2-CG1 4Å; I414-Y452 HydrophobicContact CG2-CD2 4.48Å; I414-F454 HydrophobicContact CD1-CB 3.66Å; I414-F454 HydrophobicContact CD1-CD1 3.89Å; I414-F454 HydrophobicContact CD1-CG 3.78Å; I414-M465 HydrophobicContact CD1-CE 3.45Å; I414-M465 VanDerWaalsContact CD1-CE 3.45Å; I414-M465 HydrophobicContact CG1-CE 3.3Å; I414-I467 HydrophobicContact CD1-CD1 4.14Å; I414-I467 HydrophobicContact CD1-CG1 4.32Å; I414-I467 HydrophobicContact CG1-CD1 3.94Å; I414-I467 HydrophobicContact CG2-CG2 4.45Å
415	G	93.1	Very high	90.2	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	146.9	-177.1	0	0	0	0	0	114	Y413 S417 G418 Y419	Y413-G415 VanDerWaalsContact CE1-N 3.31Å; Y413-G415 VanDerWaalsContact OH-CA 3.28Å; Y413-G415 WeakPolarHBondContact OH-CA 3.34Å; G415-S417 PolarHBondContact O-N 2.78Å; G415-S417 VanDerWaalsContact O-N 3.1Å; G415-G418 PolarHBondContact O-N 3.27Å; G415-Y419 WeakPolarHBondContact CA-O 3.32Å; G415-Y419 PolarHBondContact N-O 2.82Å
416	G	90	Very high	89.1	Confident	9 Å²	9	26 Å²	26	9%	0.093	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-15.1	175.3	0	0	0	0	0	114.4	F373 R380 T388 G418	F373-G416 VanDerWaalsContact CZ-CA 3.46Å; R380-G416 PolarHBondContact NH1-O 3.2Å; T388-G416 PolarHBondContact O-N 3.29Å; G416-G418 VanDerWaalsContact C-N 3.31Å
417	S	87.8	Confident	87.3	Confident	33 Å²	33	29.7 Å²	29.7	23%	0.231	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-5.4	173.2	60.2	0	0	0	0	113.9	G415 Y419	G415-S417 PolarHBondContact O-N 2.78Å; G415-S417 VanDerWaalsContact O-N 3.1Å; S417-Y419 VanDerWaalsContact C-N 3.29Å; S417-Y419 PolarHBondContact OG-N 2.99Å
418	G	89.6	Confident	85.3	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.159	C	C	.	.	S	Bend	trans	84.7	-3.8	-169.6	0	0	0	0	0	113.8	G415 G416 T445 L446 Y452	G415-G418 PolarHBondContact O-N 3.27Å; G416-G418 VanDerWaalsContact C-N 3.31Å; G418-T445 WeakPolarHBondContact O-CA 3.35Å; G418-L446 PolarHBondContact O-N 3.02Å; G418-Y452 WeakPolarHBondContact CA-OH 3.22Å
419	Y	92.4	Very high	83.5	Confident	73 Å²	73	33.7 Å²	33.7	29%	0.286	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	129	171.6	-177	-109	0	0	0	110.4	Y413 G415 S417 Y421 T443	Y413-Y419 HydrophobicContact CD1-CD1 4.42Å; Y413-Y419 HydrophobicContact CE1-CD1 4.32Å; G415-Y419 WeakPolarHBondContact CA-O 3.32Å; G415-Y419 PolarHBondContact N-O 2.82Å; S417-Y419 VanDerWaalsContact C-N 3.29Å; S417-Y419 PolarHBondContact OG-N 2.99Å; Y419-Y421 HydrophobicContact CD1-CD1 4.22Å; Y419-Y421 AromaticContact CE1-CD1 3.6Å; Y419-Y421 HydrophobicContact CE1-CD1 3.6Å; Y419-Y421 HydrophobicContact CE1-CE1 4.3Å; Y419-T443 WeakPolarHBondContact OH-CG2 3.39Å
420	V	94.7	Very high	81.3	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	145.3	-177.4	-57.5	0	0	0	0	109.9	Y413 I414 T443 A444 L446 I467 V492 L494	Y413-V420 VanDerWaalsContact O-CA 3.27Å; Y413-V420 WeakPolarHBondContact O-CA 3.34Å; I414-V420 HydrophobicContact CG2-CG1 4Å; V420-T443 CarbonylContact O-C 3.55Å; V420-T443 WeakPolarHBondContact O-CA 3.32Å; V420-A444 HydrophobicContact CG2-CB 3.81Å; V420-A444 WeakPolarHBondContact CG2-O 3.44Å; V420-A444 PolarHBondContact N-O 2.8Å; V420-A444 PolarHBondContact O-N 3.41Å; V420-L446 HydrophobicContact CG1-CD1 4.23Å; V420-I467 HydrophobicContact CB-CD1 3.68Å; V420-I467 HydrophobicContact CG1-CD1 3.6Å; V420-I467 HydrophobicContact CG2-CD1 4.02Å; V420-V492 HydrophobicContact CG2-CG2 4.01Å; V420-L494 HydrophobicContact CB-CD1 4.45Å; V420-L494 HydrophobicContact CG2-CD1 4.06Å
421	Y	94.7	Very high	78.8	Confident	25 Å²	25	46.4 Å²	46.4	10%	0.098	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	159.3	175	69.9	-97.5	0	0	0	112.5	T411 A412 Y413 Y419 E423 M441 T442	T411-Y421 HydrophobicContact CG2-CE2 4.11Å; A412-Y421 CarbonylContact C-O 3.59Å; A412-Y421 WeakPolarHBondContact CA-O 3.29Å; Y413-Y421 VanDerWaalsContact CB-CZ 3.42Å; Y413-Y421 AromaticContact CD1-CD1 3.62Å; Y413-Y421 HydrophobicContact CD1-CD1 3.62Å; Y413-Y421 AromaticContact CD1-CE1 3.42Å; Y413-Y421 HydrophobicContact CD1-CE1 3.42Å; Y413-Y421 VanDerWaalsContact CD1-CE1 3.42Å; Y413-Y421 HydrophobicContact CD2-CE1 4.37Å; Y413-Y421 HydrophobicContact CE1-CE1 4.37Å; Y413-Y421 AromaticContact CG-CD1 3.92Å; Y413-Y421 HydrophobicContact CG-CD1 3.92Å; Y413-Y421 AromaticContact CG-CE1 3.42Å; Y413-Y421 HydrophobicContact CG-CE1 3.42Å; Y413-Y421 VanDerWaalsContact CG-CE1 3.42Å; Y413-Y421 AromaticContact CG-CZ 3.98Å; Y413-Y421 PolarHBondContact N-O 2.91Å; Y413-Y421 PolarHBondContact O-N 2.96Å; Y413-Y421 VanDerWaalsContact O-N 3.12Å; Y419-Y421 HydrophobicContact CD1-CD1 4.22Å; Y419-Y421 AromaticContact CE1-CD1 3.6Å; Y419-Y421 HydrophobicContact CE1-CD1 3.6Å; Y419-Y421 HydrophobicContact CE1-CE1 4.3Å; Y421-E423 HydrophobicContact CD2-CB 4.33Å; Y421-E423 HydrophobicContact CD2-CG 4.12Å; Y421-E423 HydrophobicContact CE2-CG 3.86Å; Y421-E423 WeakPolarHBondContact CE2-OE1 3.35Å; Y421-M441 HydrophobicContact CD2-CE 4.15Å; Y421-M441 HydrophobicContact CE2-CE 4.43Å; Y421-T442 CarbonylContact C-O 3.54Å; Y421-T442 VanDerWaalsContact CA-O 3.29Å; Y421-T442 WeakPolarHBondContact CA-O 3.42Å
422	I	94.6	Very high	76.1	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	132.8	164.7	-164.9	-179.4	0	0	0	108.4	V410 T411 A412 M441 T442 V463 M465 L494 L496	V410-I422 HydrophobicContact CG1-CD1 3.96Å; V410-I422 HydrophobicContact CG1-CG1 3.83Å; T411-I422 CarbonylContact O-C 3.49Å; T411-I422 VanDerWaalsContact O-CA 3.31Å; T411-I422 WeakPolarHBondContact O-CA 3.26Å; A412-I422 HydrophobicContact CB-CG1 4.27Å; I422-M441 CarbonylContact O-C 3.55Å; I422-M441 WeakPolarHBondContact O-CA 3.48Å; I422-T442 PolarHBondContact N-O 3.08Å; I422-T442 PolarHBondContact O-N 3.38Å; I422-V463 HydrophobicContact CD1-CB 3.88Å; I422-V463 HydrophobicContact CD1-CG1 3.58Å; I422-M465 HydrophobicContact CD1-CB 4.48Å; I422-L494 HydrophobicContact CB-CB 4.48Å; I422-L494 HydrophobicContact CB-CD1 4.44Å; I422-L494 HydrophobicContact CG2-CB 3.66Å; I422-L494 HydrophobicContact CG2-CD1 4.28Å; I422-L496 HydrophobicContact CD1-CB 3.94Å; I422-L496 HydrophobicContact CD1-CD2 4.21Å; I422-L496 HydrophobicContact CG1-CB 4.3Å; I422-L496 HydrophobicContact CG1-CD2 3.97Å; I422-L496 HydrophobicContact CG2-CB 4.05Å
423	E	91.7	Very high	73.6	Confident	35 Å²	35	63.4 Å²	63.4	16%	0.164	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	154.7	-178.5	69.3	-178.1	163.5	0	0	111.7	V410 T411 Y421 V440 M441 L496	V410-E423 WeakPolarHBondContact CA-O 3.42Å; T411-E423 PolarHBondContact N-O 3.2Å; T411-E423 PolarHBondContact O-N 3.44Å; Y421-E423 HydrophobicContact CD2-CB 4.33Å; Y421-E423 HydrophobicContact CD2-CG 4.12Å; Y421-E423 HydrophobicContact CE2-CG 3.86Å; Y421-E423 WeakPolarHBondContact CE2-OE1 3.35Å; E423-V440 WeakPolarHBondContact CA-O 3.46Å; E423-M441 HydrophobicContact CB-CB 4Å; E423-M441 HydrophobicContact CB-CE 3.93Å; E423-M441 HydrophobicContact CB-CG 4.04Å; E423-M441 HydrophobicContact CG-CE 4.34Å; E423-M441 WeakPolarHBondContact OE2-CE 3.49Å; E423-L496 VanDerWaalsContact C-CD2 3.47Å
424	N	87.6	Confident	71.1	Confident	13 Å²	13	67.4 Å²	67.4	7%	0.07	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	128.8	164.9	-75.5	-45.9	0	0	0	108.9	D409 V440 L496 P497 F499	D409-N424 CarbonylContact O-C 3.45Å; D409-N424 VanDerWaalsContact O-CA 3.27Å; D409-N424 WeakPolarHBondContact O-CA 3.15Å; N424-V440 PolarHBondContact N-O 3.45Å; N424-V440 VanDerWaalsContact N-O 3.13Å; N424-L496 HydrophobicContact CB-CD2 4.36Å; N424-L496 VanDerWaalsContact CG-CD2 3.49Å; N424-L496 VanDerWaalsContact OD1-CD2 3.24Å; N424-L496 WeakPolarHBondContact OD1-CD2 3.37Å; N424-P497 PolarHBondContact ND2-O 2.81Å; N424-F499 HydrophobicContact CB-CD2 4.28Å; N424-F499 HydrophobicContact CB-CE2 3.79Å; N424-F499 WeakPolarHBondContact ND2-CD2 3.33Å; N424-F499 WeakPolarHBondContact ND2-CE2 3.33Å
425	E	74.8	Confident	68.8	Low	45 Å²	45	75.8 Å²	75.8	21%	0.21	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-82.6	142.6	171.2	-52.1	-167.2	144.2	0	0	110.3	R393 G408 D409 T411 V427	R393-E425 IonicContact CZ-OE1 3.72Å; R393-E425 IonicContact NH1-OE1 2.74Å; R393-E425 PolarHBondContact NH1-OE1 3.21Å; R393-E425 IonicContact NH1-OE2 3.67Å; R393-E425 PolarHBondContact NH1-OE2 2.78Å; R393-E425 IonicContact NH2-OE1 3.75Å; R393-E425 PolarHBondContact NH2-OE1 3.31Å; G408-E425 PolarHBondContact N-OE2 2.8Å; G408-E425 WeakPolarHBondContact O-CB 2.98Å; G408-E425 WeakPolarHBondContact O-CG 3.3Å; D409-E425 PolarHBondContact O-N 3.42Å; T411-E425 WeakPolarHBondContact OG1-CG 2.97Å; T411-E425 PolarHBondContact OG1-OE1 3.15Å; E425-V427 PolarHBondContact O-N 2.97Å
426	P	64.1	Low	66.5	Low	72 Å²	72	83.9 Å²	83.9	47%	0.468	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-64.8	130.6	174.1	25.5	-31.8	0	0	0	110.4	F428	P426-F428 HydrophobicContact CG-CD2 4.28Å; P426-F428 HydrophobicContact CG-CE2 4.1Å; P426-F428 PolarHBondContact O-N 3.12Å
427	V	51.6	Low	64.8	Low	78 Å²	78	89 Å²	89	47%	0.473	46%	0.455	S	S	.	.			trans	-67.1	90.6	176.2	-176.2	0	0	0	0	109.6	E425 G429	E425-V427 PolarHBondContact O-N 2.97Å; V427-G429 PolarHBondContact O-N 2.77Å
428	F	44.5	Very low	63.6	Low	182 Å²	182	90.7 Å²	90.7	80%	0.798	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	114.3	174.9	-97.3	-88.3	0	0	0	110.6	P426	P426-F428 HydrophobicContact CG-CD2 4.28Å; P426-F428 HydrophobicContact CG-CE2 4.1Å; P426-F428 PolarHBondContact O-N 3.12Å
429	G	45.2	Very low	62.5	Low	77 Å²	77	94.6 Å²	94.6	79%	0.794	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	132.2	-16.9	172.7	0	0	0	0	0	114.9	V427	V427-G429 PolarHBondContact O-N 2.77Å
430	Q	41.3	Very low	62	Low	135 Å²	135	93.4 Å²	93.4	63%	0.631	50%	0.495	S	S	*	.	S	Bend	trans	-76.7	124.5	158.9	-74.7	-172.1	-27.8	0	0	107.4	R432	Q430-R432 PolarHBondContact O-N 2.72Å; Q430-R432 VanDerWaalsContact O-N 3.08Å
431	K	38.8	Very low	61.6	Low	196 Å²	196	97.2 Å²	97.2	85%	0.852	51%	0.514	S	S	*	.			trans	-39.5	122.5	166.8	-81.4	178	174.2	177.8	0	106.9	V433	K431-V433 VanDerWaalsContact C-N 3.28Å; K431-V433 WeakPolarHBondContact O-CG2 3.08Å; K431-V433 PolarHBondContact O-N 3.35Å
432	R	35.2	Very low	61.5	Low	246 Å²	246	98.2 Å²	98.2	93%	0.928	52%	0.522	S	S	*	.			trans	-27.8	93.3	176.2	-73	-179.8	177.4	158.4	-2.7	109.6	Q430 S434	Q430-R432 PolarHBondContact O-N 2.72Å; Q430-R432 VanDerWaalsContact O-N 3.08Å; R432-S434 VanDerWaalsContact C-N 3.26Å; R432-S434 PolarHBondContact O-N 2.87Å
433	V	42.5	Very low	61.4	Low	111 Å²	111	101.5 Å²	101.5	67%	0.673	54%	0.542	S	S	*	.			trans	-73.8	102.3	165.3	178.3	0	0	0	0	101.1	K431 D435	K431-V433 VanDerWaalsContact C-N 3.28Å; K431-V433 WeakPolarHBondContact O-CG2 3.08Å; K431-V433 PolarHBondContact O-N 3.35Å; V433-D435 PolarHBondContact O-N 2.87Å
434	S	43.2	Very low	61.5	Low	85 Å²	85	100.9 Å²	100.9	59%	0.594	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	9	103.9	167.3	49.9	0	0	0	0	115.2	R432 E436	R432-S434 VanDerWaalsContact C-N 3.26Å; R432-S434 PolarHBondContact O-N 2.87Å; S434-E436 PolarHBondContact O-N 3.29Å
435	D	47.1	Very low	61.7	Low	177 Å²	177	104 Å²	104	95%	0.947	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	32.2	9.9	152.7	-88.2	-11.9	0	0	0	122.9	V433	V433-D435 PolarHBondContact O-N 2.87Å
436	E	45.1	Very low	62.5	Low	169 Å²	169	102.1 Å²	102.1	79%	0.79	55%	0.554	S	S	*	*			trans	-120.8	-3.4	-165.3	-69.9	-171.2	167.1	0	0	116	S434 A438	S434-E436 PolarHBondContact O-N 3.29Å; E436-A438 VanDerWaalsContact C-N 3.29Å; E436-A438 PolarHBondContact O-N 2.93Å; E436-A438 VanDerWaalsContact O-N 3.17Å
437	Q	54.5	Low	63.8	Low	117 Å²	117	101.4 Å²	101.4	55%	0.547	55%	0.55	S	S	.	.			trans	-89	72.5	165.1	-73.7	-174.9	-4.6	0	0	109.9	V439	Q437-V439 PolarHBondContact O-N 3.34Å
438	A	61.6	Low	65.5	Low	69 Å²	69	102.3 Å²	102.3	57%	0.57	55%	0.55	S	S	*	*			trans	-55.8	135.1	167.9	0	0	0	0	0	109.5	E436 V440 F499	E436-A438 VanDerWaalsContact C-N 3.29Å; E436-A438 PolarHBondContact O-N 2.93Å; E436-A438 VanDerWaalsContact O-N 3.17Å; A438-V440 PolarHBondContact O-N 3.08Å; A438-F499 WeakPolarHBondContact O-CZ 3.47Å
439	V	68.3	Low	67.7	Low	82 Å²	82	94 Å²	94	50%	0.497	52%	0.515	S	S	.	.			trans	-61.9	110.6	170.5	173.8	0	0	0	0	107.4	Q437	Q437-V439 PolarHBondContact O-N 3.34Å
440	V	80.8	Confident	69.9	Low	48 Å²	48	94.7 Å²	94.7	29%	0.291	50%	0.5	S	S	.	.			trans	-89.1	124.5	171.1	179.6	0	0	0	0	107	E423 N424 A438 L496 P497 F499	E423-V440 WeakPolarHBondContact CA-O 3.46Å; N424-V440 PolarHBondContact N-O 3.45Å; N424-V440 VanDerWaalsContact N-O 3.13Å; A438-V440 PolarHBondContact O-N 3.08Å; V440-L496 HydrophobicContact CB-CD1 3.91Å; V440-L496 HydrophobicContact CG1-CD1 3.65Å; V440-L496 VanDerWaalsContact O-CD1 3.25Å; V440-L496 WeakPolarHBondContact O-CD1 3.02Å; V440-P497 HydrophobicContact CG1-CG 4.41Å; V440-F499 HydrophobicContact CB-CZ 4.32Å; V440-F499 HydrophobicContact CG2-CE1 4.33Å; V440-F499 HydrophobicContact CG2-CZ 3.66Å
441	M	87.4	Confident	72.4	Confident	80 Å²	80	88.3 Å²	88.3	39%	0.394	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	134.2	176.6	178.3	-172.3	-76.7	0	0	108.9	Y421 I422 E423 T443	Y421-M441 HydrophobicContact CD2-CE 4.15Å; Y421-M441 HydrophobicContact CE2-CE 4.43Å; I422-M441 CarbonylContact O-C 3.55Å; I422-M441 WeakPolarHBondContact O-CA 3.48Å; E423-M441 HydrophobicContact CB-CB 4Å; E423-M441 HydrophobicContact CB-CE 3.93Å; E423-M441 HydrophobicContact CB-CG 4.04Å; E423-M441 HydrophobicContact CG-CE 4.34Å; E423-M441 WeakPolarHBondContact OE2-CE 3.49Å; M441-T443 HydrophobicContact CG-CG2 3.6Å; M441-T443 HydrophobicContact SD-CG2 3.44Å; M441-T443 WeakPolarHBondContact SD-CG2 3.41Å
442	T	91.9	Very high	75	Confident	45 Å²	45	79 Å²	79	28%	0.276	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	127.1	170	-51	0	0	0	0	107.9	Y421 I422 L494 T495	Y421-T442 CarbonylContact C-O 3.54Å; Y421-T442 VanDerWaalsContact CA-O 3.29Å; Y421-T442 WeakPolarHBondContact CA-O 3.42Å; I422-T442 PolarHBondContact N-O 3.08Å; I422-T442 PolarHBondContact O-N 3.38Å; T442-L494 HydrophobicContact CG2-CB 4.22Å; T442-L494 HydrophobicContact CG2-CD2 3.88Å; T442-T495 PolarHBondContact OG1-O 3.38Å
443	T	93.2	Very high	77.8	Confident	69 Å²	69	67.6 Å²	67.6	42%	0.423	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	154.4	-176.4	69.4	0	0	0	0	110.3	Y419 V420 M441	Y419-T443 WeakPolarHBondContact OH-CG2 3.39Å; V420-T443 CarbonylContact O-C 3.55Å; V420-T443 WeakPolarHBondContact O-CA 3.32Å; M441-T443 HydrophobicContact CG-CG2 3.6Å; M441-T443 HydrophobicContact SD-CG2 3.44Å; M441-T443 WeakPolarHBondContact SD-CG2 3.41Å
444	A	93.4	Very high	80.3	Confident	22 Å²	22	62.6 Å²	62.6	18%	0.182	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	172	166.9	0	0	0	0	0	110.4	V420 V492 L494	V420-A444 HydrophobicContact CG2-CB 3.81Å; V420-A444 WeakPolarHBondContact CG2-O 3.44Å; V420-A444 PolarHBondContact N-O 2.8Å; V420-A444 PolarHBondContact O-N 3.41Å; A444-V492 HydrophobicContact CB-CB 3.99Å; A444-V492 HydrophobicContact CB-CG1 3.77Å; A444-V492 HydrophobicContact CB-CG2 4.32Å; A444-L494 HydrophobicContact CB-CD2 3.69Å
445	T	91.8	Very high	82.7	Confident	78 Å²	78	60.9 Å²	60.9	48%	0.479	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	120.8	173.5	-59.4	0	0	0	0	108.8	G418	G418-T445 WeakPolarHBondContact O-CA 3.35Å
446	L	91.1	Very high	85	Confident	6 Å²	6	52.6 Å²	52.6	3%	0.031	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-91.8	158.8	170.2	-72.3	164.3	0	0	0	110.3	G418 V420 Y452 I467 N490 V492	G418-L446 PolarHBondContact O-N 3.02Å; V420-L446 HydrophobicContact CG1-CD1 4.23Å; L446-Y452 HydrophobicContact CB-CE1 3.94Å; L446-Y452 HydrophobicContact CD1-CD1 3.85Å; L446-Y452 HydrophobicContact CD1-CE1 3.84Å; L446-I467 HydrophobicContact CD1-CB 3.91Å; L446-I467 HydrophobicContact CD1-CG2 3.49Å; L446-I467 VanDerWaalsContact CD1-CG2 3.49Å; L446-N490 WeakPolarHBondContact CD2-O 3.2Å; L446-V492 HydrophobicContact CD1-CG2 3.81Å; L446-V492 HydrophobicContact CD2-CB 4.36Å; L446-V492 HydrophobicContact CD2-CG1 3.69Å; L446-V492 HydrophobicContact CD2-CG2 3.94Å; L446-V492 HydrophobicContact CG-CG1 4.04Å; L446-V492 HydrophobicContact CG-CG2 3.83Å
447	P	90.7	Very high	87.3	Confident	58 Å²	58	45.2 Å²	45.2	38%	0.377	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-57.9	141.7	165.2	-21.2	34.2	0	0	0	110.6	A449 Y452 N490	P447-A449 PolarHBondContact O-N 3.2Å; P447-Y452 PolarHBondContact O-OH 3.08Å; P447-N490 HydrophobicContact CG-CB 4.03Å
448	M	88.9	Confident	89	Confident	97 Å²	97	40.1 Å²	40.1	48%	0.478	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-63.9	117.9	178.7	-172	-177.6	80.3	0	0	110.5	R380	R380-M448 HydrophobicContact CB-SD 3.93Å
449	A	90	Very high	90.2	Very high	7 Å²	7	43 Å²	43	6%	0.058	23%	0.234	C	C	.	.			trans	-132.9	155.5	178.9	0	0	0	0	0	112.2	R380 P447 C451 Y452 Q469	R380-A449 PolarHBondContact NH1-O 3.14Å; R380-A449 PolarHBondContact NH2-O 2.77Å; P447-A449 PolarHBondContact O-N 3.2Å; A449-C451 VanDerWaalsContact C-N 3.33Å; A449-Y452 HydrophobicContact CB-CE1 3.95Å; A449-Y452 HydrophobicContact CB-CE2 4.2Å; A449-Y452 PolarHBondContact N-OH 3.11Å; A449-Y452 WeakPolarHBondContact O-CE2 3.31Å; A449-Q469 HydrophobicContact CB-CB 4.4Å; A449-Q469 HydrophobicContact CB-CG 3.55Å
450	D	90.9	Very high	90.7	Very high	91 Å²	91	42.6 Å²	42.6	49%	0.487	23%	0.227	S	C	.	.	S	Bend	trans	-74.5	-26.3	173.7	-66.4	-37.1	0	0	0	112	V372 F373 R380	V372-D450 WeakPolarHBondContact CA-O 3.48Å; F373-D450 PolarHBondContact N-O 3.02Å; R380-D450 IonicContact CZ-OD1 2.72Å; R380-D450 IonicContact NE-OD1 3.44Å; R380-D450 VanDerWaalsContact NH2-CA 3.27Å; R380-D450 IonicContact NH2-OD1 3.55Å; R380-D450 PolarHBondContact NH2-OD1 3.01Å
451	C	93.3	Very high	90.8	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.007	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	139.2	-179.7	-71.4	0	0	0	0	113.5	L371 A449 M470 C472	L371-C451 VanDerWaalsContact O-CA 3.28Å; L371-C451 WeakPolarHBondContact O-CA 3.42Å; A449-C451 VanDerWaalsContact C-N 3.33Å; C451-M470 HydrophobicContact CB-CB 4.5Å; C451-M470 WeakPolarHBondContact CB-O 3.39Å; C451-M470 PolarHBondContact O-N 3.48Å; C451-M470 VanDerWaalsContact O-N 3.1Å; C451-C472 HydrophobicContact CB-CB 4.07Å; C451-C472 WeakPolarHBondContact CB-SG 3.09Å; C451-C472 WeakPolarHBondContact SG-CA 3.31Å; C451-C472 WeakPolarHBondContact SG-CB 3.41Å; C451-C472 CovalentContact SG-SG 2.03Å; C451-C472 PolarHBondContact SG-SG 2.91Å
452	Y	94.6	Very high	90.8	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	136.3	169.8	-56.4	-89.7	0	0	0	109.7	R370 L371 F373 I414 G418 L446 P447 A449 I467 Y468 Q469	R370-Y452 CarbonylContact C-O 3.56Å; R370-Y452 WeakPolarHBondContact CA-O 3.43Å; L371-Y452 PolarHBondContact N-O 3.06Å; L371-Y452 PolarHBondContact O-N 3.09Å; F373-Y452 HydrophobicContact CD2-CD2 4.14Å; F373-Y452 HydrophobicContact CD2-CE2 4.03Å; F373-Y452 AromaticContact CE2-CD2 3.63Å; F373-Y452 HydrophobicContact CE2-CD2 3.63Å; F373-Y452 AromaticContact CE2-CE2 3.58Å; F373-Y452 HydrophobicContact CE2-CE2 3.58Å; I414-Y452 HydrophobicContact CG2-CD2 4.48Å; G418-Y452 WeakPolarHBondContact CA-OH 3.22Å; L446-Y452 HydrophobicContact CB-CE1 3.94Å; L446-Y452 HydrophobicContact CD1-CD1 3.85Å; L446-Y452 HydrophobicContact CD1-CE1 3.84Å; P447-Y452 PolarHBondContact O-OH 3.08Å; A449-Y452 HydrophobicContact CB-CE1 3.95Å; A449-Y452 HydrophobicContact CB-CE2 4.2Å; A449-Y452 PolarHBondContact N-OH 3.11Å; A449-Y452 WeakPolarHBondContact O-CE2 3.31Å; Y452-I467 HydrophobicContact CD1-CG2 4.18Å; Y452-I467 HydrophobicContact CG-CG2 4.33Å; Y452-Y468 VanDerWaalsContact CA-O 3.32Å; Y452-Y468 WeakPolarHBondContact CA-O 3.45Å; Y452-Q469 HydrophobicContact CD1-CB 4.42Å; Y452-Q469 HydrophobicContact CE1-CB 4.45Å
453	D	93.9	Very high	90.8	Very high	8 Å²	8	39 Å²	39	4%	0.043	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	143.4	163.1	-74.7	-9.4	0	0	0	108.2	R370 I467 Y468 M470 P477	R370-D453 WeakPolarHBondContact CA-OD1 3.38Å; R370-D453 WeakPolarHBondContact CB-OD1 3.24Å; R370-D453 VanDerWaalsContact CG-OD1 3.23Å; R370-D453 WeakPolarHBondContact CG-OD1 3.46Å; R370-D453 IonicContact CZ-OD1 2.95Å; R370-D453 IonicContact CZ-OD2 3.01Å; R370-D453 IonicContact NE-OD1 3.92Å; R370-D453 PolarHBondContact NE-OD1 2.77Å; R370-D453 IonicContact NE-OD2 2.96Å; R370-D453 IonicContact NH2-OD1 3.52Å; R370-D453 IonicContact NH2-OD2 3.02Å; R370-D453 PolarHBondContact NH2-OD2 3.41Å; D453-I467 WeakPolarHBondContact O-CA 3.45Å; D453-Y468 HydrophobicContact CB-CD2 4.07Å; D453-Y468 HydrophobicContact CB-CE1 3.97Å; D453-Y468 HydrophobicContact CB-CE2 3.39Å; D453-Y468 WeakPolarHBondContact CB-OH 3.33Å; D453-Y468 PolarHBondContact N-O 2.87Å; D453-Y468 PolarHBondContact O-N 3.33Å; D453-M470 HydrophobicContact CB-CG 4.1Å; D453-P477 WeakPolarHBondContact OD2-CD 3.44Å
454	F	94.9	Very high	90.9	Very high	5 Å²	5	37.2 Å²	37.2	2%	0.022	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	149.4	178.5	69.1	-90.2	0	0	0	111.6	L367 T368 G369 L371 L390 I392 I414 V466 I467 V522	L367-F454 HydrophobicContact CD2-CE2 4.44Å; L367-F454 HydrophobicContact CG-CE2 4.27Å; T368-F454 WeakPolarHBondContact CA-O 3.23Å; G369-F454 PolarHBondContact N-O 2.81Å; G369-F454 VanDerWaalsContact N-O 3.11Å; G369-F454 WeakPolarHBondContact O-CD1 3.33Å; G369-F454 WeakPolarHBondContact O-CE1 3.39Å; G369-F454 PolarHBondContact O-N 3.46Å; L371-F454 HydrophobicContact CB-CD1 4.27Å; L371-F454 HydrophobicContact CB-CE1 4.3Å; L390-F454 HydrophobicContact CD2-CD1 4.33Å; L390-F454 HydrophobicContact CD2-CE1 3.73Å; L390-F454 HydrophobicContact CD2-CZ 3.85Å; I392-F454 HydrophobicContact CD1-CD2 3.93Å; I392-F454 HydrophobicContact CD1-CE2 3.58Å; I392-F454 HydrophobicContact CD1-CZ 4.25Å; I414-F454 HydrophobicContact CD1-CB 3.66Å; I414-F454 HydrophobicContact CD1-CD1 3.89Å; I414-F454 HydrophobicContact CD1-CG 3.78Å; F454-V466 CarbonylContact C-O 3.6Å; F454-V466 VanDerWaalsContact CA-O 3.27Å; F454-V466 WeakPolarHBondContact CA-O 3.27Å; F454-I467 HydrophobicContact CB-CG1 4.32Å; F454-V522 HydrophobicContact CE1-CG1 4.07Å; F454-V522 HydrophobicContact CZ-CG1 4.02Å
455	E	94.4	Very high	91	Very high	50 Å²	50	36.2 Å²	36.2	23%	0.234	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	124.3	168.2	176.5	166.8	-161.7	0	0	108.4	S366 L367 T368 M465 V466 M482	S366-E455 WeakPolarHBondContact OG-CG 3.27Å; S366-E455 PolarHBondContact OG-OE1 2.78Å; L367-E455 CarbonylContact O-C 3.54Å; L367-E455 WeakPolarHBondContact O-CA 3.42Å; T368-E455 HydrophobicContact CG2-CB 4.06Å; T368-E455 HydrophobicContact CG2-CG 3.82Å; E455-M465 CarbonylContact O-C 3.57Å; E455-M465 WeakPolarHBondContact O-CA 3.09Å; E455-V466 PolarHBondContact N-O 2.78Å; E455-V466 PolarHBondContact O-N 2.93Å; E455-M482 HydrophobicContact CB-CE 4.38Å; E455-M482 HydrophobicContact CG-CE 4.48Å; E455-M482 WeakPolarHBondContact OE2-CE 3.23Å
456	M	94.2	Very high	91.1	Very high	3 Å²	3	33.3 Å²	33.3	2%	0.015	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	115.9	172.7	-171.1	-176.1	75.8	0	0	108.8	S366 L367 I392 I394 A412 V463 E464 L508	S366-M456 CarbonylContact C-O 3.6Å; S366-M456 VanDerWaalsContact CA-O 3.29Å; S366-M456 WeakPolarHBondContact CA-O 3.35Å; L367-M456 PolarHBondContact N-O 3.42Å; L367-M456 PolarHBondContact O-N 2.76Å; I392-M456 HydrophobicContact CB-CE 4.49Å; I392-M456 HydrophobicContact CB-SD 4.2Å; I392-M456 HydrophobicContact CG2-CE 3.41Å; I392-M456 VanDerWaalsContact CG2-CE 3.41Å; I392-M456 HydrophobicContact CG2-SD 3.73Å; I394-M456 HydrophobicContact CD1-CE 3.57Å; I394-M456 HydrophobicContact CD1-SD 4.11Å; I394-M456 HydrophobicContact CG1-CE 3.62Å; I394-M456 HydrophobicContact CG1-SD 4.33Å; A412-M456 HydrophobicContact CB-SD 3.9Å; M456-V463 HydrophobicContact CG-CG1 4.13Å; M456-V463 HydrophobicContact SD-CG1 4.49Å; M456-E464 CarbonylContact C-O 3.6Å; M456-E464 WeakPolarHBondContact CA-O 3.32Å; M456-L508 HydrophobicContact CE-CD2 3.63Å
457	T	92.6	Very high	91.2	Very high	14 Å²	14	33 Å²	33	9%	0.086	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	123.3	179.2	-46	0	0	0	0	110.1	Q365 R459 V463 E464	Q365-T457 CarbonylContact O-C 3.5Å; Q365-T457 WeakPolarHBondContact O-CA 3.35Å; T457-R459 HydrophobicContact CG2-CG 3.85Å; T457-V463 CarbonylContact O-C 3.42Å; T457-V463 WeakPolarHBondContact O-CA 3.34Å; T457-E464 PolarHBondContact N-O 2.89Å; T457-E464 PolarHBondContact O-N 2.87Å
458	D	90.8	Very high	91.2	Very high	9 Å²	9	30.8 Å²	30.8	5%	0.048	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	110.3	175.2	175.7	18.3	0	0	0	109.4	W364 Q365 I394 K498 R506	W364-D458 CarbonylContact C-O 3.59Å; W364-D458 WeakPolarHBondContact CA-O 3.46Å; Q365-D458 HydrophobicContact CG-CB 3.64Å; Q365-D458 PolarHBondContact N-O 2.91Å; Q365-D458 PolarHBondContact NE2-OD2 3.32Å; Q365-D458 PolarHBondContact O-N 3.17Å; I394-D458 HydrophobicContact CD1-CB 4.06Å; D458-K498 WeakPolarHBondContact OD1-CE 3.39Å; D458-K498 IonicContact OD1-NZ 2.62Å; D458-K498 PolarHBondContact OD1-NZ 3.04Å; D458-R506 IonicContact OD1-CZ 3.72Å; D458-R506 IonicContact OD1-NE 3.81Å; D458-R506 IonicContact OD1-NH2 3.66Å; D458-R506 PolarHBondContact OD1-NH2 2.83Å; D458-R506 IonicContact OD2-CZ 3.82Å; D458-R506 VanDerWaalsContact OD2-CZ 3.28Å; D458-R506 IonicContact OD2-NE 2.67Å; D458-R506 PolarHBondContact OD2-NE 3.2Å; D458-R506 IonicContact OD2-NH2 3.28Å; D458-R506 PolarHBondContact OD2-NH2 2.83Å
459	R	88.3	Confident	91.3	Very high	130 Å²	130	29 Å²	29	49%	0.491	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	161.4	-179.6	-57.4	-175.7	178.2	-162.8	-1.7	110.8	W364 T457 A461 S462 K498	W364-R459 HydrophobicContact CB-CG 4.24Å; T457-R459 HydrophobicContact CG2-CG 3.85Å; R459-A461 PolarHBondContact O-N 3.03Å; R459-S462 PolarHBondContact N-O 2.72Å; R459-S462 PolarHBondContact O-N 2.88Å; R459-K498 VanDerWaalsContact O-CD 3.3Å; R459-K498 WeakPolarHBondContact O-CD 3.39Å; R459-K498 WeakPolarHBondContact O-CE 3.31Å; R459-K498 PolarHBondContact O-NZ 3.01Å
460	E	78.2	Confident	91.2	Very high	74 Å²	74	29.5 Å²	29.5	35%	0.346	15%	0.153	S	C	.	.	S	Bend	trans	-47.3	-39.7	-177.9	-171.9	173.3	-166.3	0	0	115	K498 A501 R503	E460-K498 WeakPolarHBondContact O-CD 3.45Å; E460-A501 HydrophobicContact CG-CB 4.16Å; E460-R503 IonicContact OE1-CZ 3.27Å; E460-R503 VanDerWaalsContact OE1-CZ 3.27Å; E460-R503 IonicContact OE1-NE 2.73Å; E460-R503 PolarHBondContact OE1-NE 2.8Å; E460-R503 IonicContact OE1-NH2 2.92Å; E460-R503 PolarHBondContact OE1-NH2 2.88Å; E460-R503 IonicContact OE2-CZ 3.78Å; E460-R503 IonicContact OE2-NE 3.7Å; E460-R503 IonicContact OE2-NH2 3.2Å; E460-R503 PolarHBondContact OE2-NH2 3.2Å
461	A	81.8	Confident	91	Very high	74 Å²	74	29 Å²	29	61%	0.612	15%	0.151	S	C	*	.	S	Bend	trans	-96.7	-24.9	-175.7	0	0	0	0	0	115.1	R459 K498	R459-A461 PolarHBondContact O-N 3.03Å; A461-K498 PolarHBondContact O-N 3.45Å
462	S	88.9	Confident	90.6	Very high	22 Å²	22	30.2 Å²	30.2	15%	0.154	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	155.3	-169.9	54.6	0	0	0	0	112.3	R459 L496	R459-S462 PolarHBondContact N-O 2.72Å; R459-S462 PolarHBondContact O-N 2.88Å; S462-L496 CarbonylContact C-O 3.6Å; S462-L496 VanDerWaalsContact CA-O 3.22Å; S462-L496 WeakPolarHBondContact CA-O 3.24Å; S462-L496 WeakPolarHBondContact CB-O 3.39Å
463	V	92	Very high	89.9	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.006	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	128.7	165.3	-173.1	0	0	0	0	107.8	I394 V410 I422 M456 T457 L496 K498	I394-V463 HydrophobicContact CD1-CG1 3.79Å; I394-V463 HydrophobicContact CD1-CG2 4.08Å; V410-V463 HydrophobicContact CG1-CB 4.48Å; V410-V463 HydrophobicContact CG1-CG1 4.33Å; V410-V463 HydrophobicContact CG1-CG2 4.46Å; V410-V463 HydrophobicContact CG2-CG2 4.09Å; I422-V463 HydrophobicContact CD1-CB 3.88Å; I422-V463 HydrophobicContact CD1-CG1 3.58Å; M456-V463 HydrophobicContact CG-CG1 4.13Å; M456-V463 HydrophobicContact SD-CG1 4.49Å; T457-V463 CarbonylContact O-C 3.42Å; T457-V463 WeakPolarHBondContact O-CA 3.34Å; V463-L496 PolarHBondContact N-O 2.95Å; V463-L496 PolarHBondContact O-N 2.78Å; V463-K498 HydrophobicContact CG2-CG 4.48Å
464	E	93.5	Very high	89	Confident	32 Å²	32	40 Å²	40	15%	0.15	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	140.8	178.2	-57.9	-166.9	146.4	0	0	109.5	M456 T457 K493 L494 T495	M456-E464 CarbonylContact C-O 3.6Å; M456-E464 WeakPolarHBondContact CA-O 3.32Å; T457-E464 PolarHBondContact N-O 2.89Å; T457-E464 PolarHBondContact O-N 2.87Å; E464-K493 VanDerWaalsContact OE1-CE 3.27Å; E464-K493 WeakPolarHBondContact OE1-CE 3.38Å; E464-K493 IonicContact OE1-NZ 2.85Å; E464-K493 PolarHBondContact OE1-NZ 2.9Å; E464-K493 WeakPolarHBondContact OE2-CE 3.4Å; E464-K493 IonicContact OE2-NZ 2.86Å; E464-K493 PolarHBondContact OE2-NZ 3.46Å; E464-L494 CarbonylContact C-O 3.57Å; E464-L494 WeakPolarHBondContact CA-O 3.43Å; E464-T495 HydrophobicContact CG-CG2 4.27Å
465	M	95.2	Very high	87.6	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	119.2	174.6	-171.3	-177.4	-165.2	0	0	109	I392 A412 I414 I422 E455 I467 K493 L494	I392-M465 HydrophobicContact CD1-CE 4.49Å; A412-M465 HydrophobicContact CB-CE 4.04Å; A412-M465 HydrophobicContact CB-SD 3.65Å; I414-M465 HydrophobicContact CD1-CE 3.45Å; I414-M465 VanDerWaalsContact CD1-CE 3.45Å; I414-M465 HydrophobicContact CG1-CE 3.3Å; I422-M465 HydrophobicContact CD1-CB 4.48Å; E455-M465 CarbonylContact O-C 3.57Å; E455-M465 WeakPolarHBondContact O-CA 3.09Å; M465-I467 HydrophobicContact CE-CD1 3.65Å; M465-I467 HydrophobicContact CE-CG1 3.99Å; M465-I467 HydrophobicContact CG-CD1 4.13Å; M465-I467 HydrophobicContact CG-CG1 3.96Å; M465-I467 HydrophobicContact SD-CD1 3.82Å; M465-I467 HydrophobicContact SD-CG1 4.28Å; M465-K493 CarbonylContact O-C 3.59Å; M465-K493 WeakPolarHBondContact O-CA 3.41Å; M465-L494 HydrophobicContact CB-CB 4.38Å; M465-L494 PolarHBondContact N-O 3.06Å; M465-L494 PolarHBondContact O-N 3.37Å
466	V	94.1	Very high	85.9	Confident	18 Å²	18	45.1 Å²	45.1	11%	0.109	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	129.3	176	-178.5	0	0	0	0	107.9	F454 E455 Y468 P485 V492 K493	F454-V466 CarbonylContact C-O 3.6Å; F454-V466 VanDerWaalsContact CA-O 3.27Å; F454-V466 WeakPolarHBondContact CA-O 3.27Å; E455-V466 PolarHBondContact N-O 2.78Å; E455-V466 PolarHBondContact O-N 2.93Å; V466-Y468 HydrophobicContact CG1-CD1 4.37Å; V466-P485 HydrophobicContact CG1-CB 3.92Å; V466-P485 HydrophobicContact CG1-CG 4.02Å; V466-V492 WeakPolarHBondContact CA-O 3.18Å; V466-K493 HydrophobicContact CG2-CB 4.4Å; V466-K493 HydrophobicContact CG2-CD 4.45Å; V466-K493 HydrophobicContact CG2-CG 4.15Å
467	I	94.4	Very high	84.2	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	136.6	-179.9	-47.6	167.1	0	0	0	108.1	I414 V420 L446 Y452 D453 F454 M465 Y491 V492	I414-I467 HydrophobicContact CD1-CD1 4.14Å; I414-I467 HydrophobicContact CD1-CG1 4.32Å; I414-I467 HydrophobicContact CG1-CD1 3.94Å; I414-I467 HydrophobicContact CG2-CG2 4.45Å; V420-I467 HydrophobicContact CB-CD1 3.68Å; V420-I467 HydrophobicContact CG1-CD1 3.6Å; V420-I467 HydrophobicContact CG2-CD1 4.02Å; L446-I467 HydrophobicContact CD1-CB 3.91Å; L446-I467 HydrophobicContact CD1-CG2 3.49Å; L446-I467 VanDerWaalsContact CD1-CG2 3.49Å; Y452-I467 HydrophobicContact CD1-CG2 4.18Å; Y452-I467 HydrophobicContact CG-CG2 4.33Å; D453-I467 WeakPolarHBondContact O-CA 3.45Å; F454-I467 HydrophobicContact CB-CG1 4.32Å; M465-I467 HydrophobicContact CE-CD1 3.65Å; M465-I467 HydrophobicContact CE-CG1 3.99Å; M465-I467 HydrophobicContact CG-CD1 4.13Å; M465-I467 HydrophobicContact CG-CG1 3.96Å; M465-I467 HydrophobicContact SD-CD1 3.82Å; M465-I467 HydrophobicContact SD-CG1 4.28Å; I467-Y491 WeakPolarHBondContact O-CA 3.14Å; I467-V492 HydrophobicContact CB-CG2 3.96Å; I467-V492 PolarHBondContact N-O 3.36Å; I467-V492 PolarHBondContact O-N 3.41Å
468	Y	91.4	Very high	82.4	Confident	10 Å²	10	48.7 Å²	48.7	4%	0.039	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	147.1	174.2	52.7	-86.7	0	0	0	111.6	Y452 D453 V466 M470 P477	Y452-Y468 VanDerWaalsContact CA-O 3.32Å; Y452-Y468 WeakPolarHBondContact CA-O 3.45Å; D453-Y468 HydrophobicContact CB-CD2 4.07Å; D453-Y468 HydrophobicContact CB-CE1 3.97Å; D453-Y468 HydrophobicContact CB-CE2 3.39Å; D453-Y468 WeakPolarHBondContact CB-OH 3.33Å; D453-Y468 PolarHBondContact N-O 2.87Å; D453-Y468 PolarHBondContact O-N 3.33Å; V466-Y468 HydrophobicContact CG1-CD1 4.37Å; Y468-M470 HydrophobicContact CD2-CG 3.74Å; Y468-M470 HydrophobicContact CD2-SD 3.76Å; Y468-M470 HydrophobicContact CE2-CG 3.74Å; Y468-M470 HydrophobicContact CE2-SD 3.73Å; Y468-P477 VanDerWaalsContact OH-CG 3.28Å; Y468-P477 WeakPolarHBondContact OH-CG 3.18Å
469	Q	90.9	Very high	80.5	Confident	61 Å²	61	56.5 Å²	56.5	29%	0.285	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	142.1	176.6	173.9	174.2	9.8	0	0	111	A449 Y452 N490	A449-Q469 HydrophobicContact CB-CB 4.4Å; A449-Q469 HydrophobicContact CB-CG 3.55Å; Y452-Q469 HydrophobicContact CD1-CB 4.42Å; Y452-Q469 HydrophobicContact CE1-CB 4.45Å; Q469-N490 HydrophobicContact CB-CB 4.25Å; Q469-N490 PolarHBondContact N-O 3.49Å; Q469-N490 PolarHBondContact OE1-ND2 3.11Å; Q469-N490 VanDerWaalsContact OE1-ND2 3.15Å
470	M	86.9	Confident	78.6	Confident	16 Å²	16	60.1 Å²	60.1	8%	0.079	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	153.2	178.2	-72.4	-58.2	-71.5	0	0	112.5	C451 D453 Y468 E474 R488	C451-M470 HydrophobicContact CB-CB 4.5Å; C451-M470 WeakPolarHBondContact CB-O 3.39Å; C451-M470 PolarHBondContact O-N 3.48Å; C451-M470 VanDerWaalsContact O-N 3.1Å; D453-M470 HydrophobicContact CB-CG 4.1Å; Y468-M470 HydrophobicContact CD2-CG 3.74Å; Y468-M470 HydrophobicContact CD2-SD 3.76Å; Y468-M470 HydrophobicContact CE2-CG 3.74Å; Y468-M470 HydrophobicContact CE2-SD 3.73Å; M470-E474 HydrophobicContact CE-CB 4.02Å; M470-E474 WeakPolarHBondContact CE-OE2 3.22Å; M470-R488 PolarHBondContact SD-NH1 2.94Å
471	D	86.1	Confident	77.3	Confident	82 Å²	82	58.5 Å²	58.5	44%	0.439	31%	0.313	S	S	.	.			trans	-70.6	134.8	158.5	-169.5	-31	0	0	0	108.6	N473 E474	D471-N473 PolarHBondContact O-N 3.42Å; D471-N473 PolarHBondContact OD1-N 2.93Å; D471-E474 HydrophobicContact CB-CB 4.31Å; D471-E474 HydrophobicContact CB-CG 3.91Å; D471-E474 PolarHBondContact O-N 3.14Å
472	C	85.9	Confident	75.8	Confident	25 Å²	25	57 Å²	57	17%	0.169	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-26	177.6	-61.7	0	0	0	0	113.6	C451	C451-C472 HydrophobicContact CB-CB 4.07Å; C451-C472 WeakPolarHBondContact CB-SG 3.09Å; C451-C472 WeakPolarHBondContact SG-CA 3.31Å; C451-C472 WeakPolarHBondContact SG-CB 3.41Å; C451-C472 CovalentContact SG-SG 2.03Å; C451-C472 PolarHBondContact SG-SG 2.91Å
473	N	78.9	Confident	73.9	Confident	114 Å²	114	64.5 Å²	64.5	61%	0.61	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-11.2	-179.4	-57.6	-50.7	0	0	0	113.4	K205 D471	K205-N473 PolarHBondContact NZ-OD1 2.75Å; D471-N473 PolarHBondContact O-N 3.42Å; D471-N473 PolarHBondContact OD1-N 2.93Å
474	E	75.1	Confident	72.3	Confident	101 Å²	101	71 Å²	71	47%	0.472	34%	0.343	S	S	.	.	S	Bend	trans	-68.2	139.3	176.4	-85.6	178.9	-158.6	0	0	110.1	R370 M470 D471	R370-E474 PolarHBondContact NH1-O 2.74Å; M470-E474 HydrophobicContact CE-CB 4.02Å; M470-E474 WeakPolarHBondContact CE-OE2 3.22Å; D471-E474 HydrophobicContact CB-CB 4.31Å; D471-E474 HydrophobicContact CB-CG 3.91Å; D471-E474 PolarHBondContact O-N 3.14Å
475	S	66.4	Low	70.6	Confident	98 Å²	98	70.2 Å²	70.2	69%	0.685	34%	0.341	S	S	*	.	P	Polyproline II helix	trans	-57.9	147.8	173.2	51.2	0	0	0	0	111
476	P	59.3	Low	68.7	Low	64 Å²	64	77.3 Å²	77.3	42%	0.416	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-53.3	137.1	171.1	22.7	-31.8	0	0	0	109.6	S478	P476-S478 PolarHBondContact O-N 2.63Å
477	P	57.7	Low	67	Low	20 Å²	20	82.6 Å²	82.6	13%	0.13	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-49.5	140.3	173.9	4	-12.3	0	0	0	110.6	D453 Y468 S481 M482	D453-P477 WeakPolarHBondContact OD2-CD 3.44Å; Y468-P477 VanDerWaalsContact OH-CG 3.28Å; Y468-P477 WeakPolarHBondContact OH-CG 3.18Å; P477-S481 VanDerWaalsContact CA-OG 3.27Å; P477-S481 WeakPolarHBondContact CA-OG 3.37Å; P477-S481 WeakPolarHBondContact CB-OG 3.4Å; P477-M482 HydrophobicContact CB-CG 4.26Å; P477-M482 HydrophobicContact CG-CG 4.07Å
478	S	54.5	Low	65.6	Low	71 Å²	71	85.8 Å²	85.8	50%	0.497	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-55	147.9	165.2	72.9	0	0	0	0	108.6	P476 W480 S481 M482	P476-S478 PolarHBondContact O-N 2.63Å; S478-W480 PolarHBondContact O-N 3.05Å; S478-S481 PolarHBondContact N-OG 2.88Å; S478-S481 PolarHBondContact O-N 3.24Å; S478-S481 PolarHBondContact O-OG 2.87Å; S478-S481 PolarHBondContact OG-N 2.83Å; S478-S481 PolarHBondContact OG-OG 3.05Å; S478-M482 PolarHBondContact O-N 2.78Å
479	R	51.8	Low	64.5	Low	173 Å²	173	89.9 Å²	89.9	65%	0.653	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.8	-31.3	179.4	-168.5	-178	-86.4	171.3	-7.3	112.2	H526	R479-H526 PolarHBondContact NH2-NE2 2.94Å
480	W	47.1	Very low	64.1	Low	207 Å²	207	90.5 Å²	90.5	78%	0.784	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-31.8	176.2	-58.8	102.6	0	0	0	114.7	S478 W483	S478-W480 PolarHBondContact O-N 3.05Å; W480-W483 PolarHBondContact O-N 3.45Å
481	S	51.8	Low	64.2	Low	40 Å²	40	94.8 Å²	94.8	28%	0.28	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-77.4	-21.8	178.1	59.5	0	0	0	0	113.6	P477 S478 W483 W484	P477-S481 VanDerWaalsContact CA-OG 3.27Å; P477-S481 WeakPolarHBondContact CA-OG 3.37Å; P477-S481 WeakPolarHBondContact CB-OG 3.4Å; S478-S481 PolarHBondContact N-OG 2.88Å; S478-S481 PolarHBondContact O-N 3.24Å; S478-S481 PolarHBondContact O-OG 2.87Å; S478-S481 PolarHBondContact OG-N 2.83Å; S478-S481 PolarHBondContact OG-OG 3.05Å; S481-W483 PolarHBondContact O-N 3.07Å; S481-W484 PolarHBondContact O-N 2.96Å
482	M	49.8	Very low	64.5	Low	42 Å²	42	92 Å²	92	21%	0.207	44%	0.443	C	S	.	.	G	3₁₀ helix	trans	-65.6	-23.5	168.6	-87.5	177.2	50.4	0	0	113.3	T368 E455 P477 S478 W484 P485	T368-M482 HydrophobicContact CG2-CE 3.72Å; E455-M482 HydrophobicContact CB-CE 4.38Å; E455-M482 HydrophobicContact CG-CE 4.48Å; E455-M482 WeakPolarHBondContact OE2-CE 3.23Å; P477-M482 HydrophobicContact CB-CG 4.26Å; P477-M482 HydrophobicContact CG-CG 4.07Å; S478-M482 PolarHBondContact O-N 2.78Å; M482-W484 PolarHBondContact O-N 3.18Å; M482-P485 VanDerWaalsContact O-CD 3.23Å; M482-P485 WeakPolarHBondContact O-CD 3.22Å; M482-P485 VanDerWaalsContact O-CG 3.31Å; M482-P485 WeakPolarHBondContact O-CG 3.38Å
483	W	49	Very low	64.8	Low	180 Å²	180	95.9 Å²	95.9	68%	0.682	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-70.8	-9.5	-179.7	-77.4	51.9	0	0	0	113.4	W480 S481 P485	W480-W483 PolarHBondContact O-N 3.45Å; S481-W483 PolarHBondContact O-N 3.07Å; W483-P485 VanDerWaalsContact C-CD 3.48Å
484	W	57.7	Low	65.5	Low	137 Å²	137	90.6 Å²	90.6	52%	0.519	43%	0.429	S	S	.	.			trans	-126.2	60.4	177.8	-48.2	92.6	0	0	0	112.6	S481 M482 W486 I487	S481-W484 PolarHBondContact O-N 2.96Å; M482-W484 PolarHBondContact O-N 3.18Å; W484-W486 HydrophobicContact CD2-CZ2 4.08Å; W484-W486 AromaticContact CE3-CE2 3.57Å; W484-W486 AromaticContact CE3-CH2 3.91Å; W484-W486 HydrophobicContact CE3-CH2 3.91Å; W484-W486 AromaticContact CE3-CZ2 3.07Å; W484-W486 HydrophobicContact CE3-CZ2 3.07Å; W484-W486 AromaticContact CE3-NE1 3.75Å; W484-W486 HydrophobicContact CZ3-CH2 4.21Å; W484-W486 AromaticContact CZ3-CZ2 3.4Å; W484-W486 HydrophobicContact CZ3-CZ2 3.4Å; W484-W486 VanDerWaalsContact CZ3-CZ2 3.4Å; W484-W486 PolarHBondContact O-N 3.18Å; W484-W486 VanDerWaalsContact O-N 3.16Å; W484-I487 HydrophobicContact CB-CD1 3.48Å; W484-I487 VanDerWaalsContact CB-CD1 3.48Å; W484-I487 HydrophobicContact CB-CG1 3.91Å; W484-I487 HydrophobicContact CG-CD1 4.06Å; W484-I487 PolarHBondContact O-N 2.97Å
485	P	58.1	Low	66.3	Low	16 Å²	16	88.4 Å²	88.4	10%	0.104	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-59.4	-30.5	-177.9	-19.3	30.9	0	0	0	113	V466 M482 W483 I487 R488	V466-P485 HydrophobicContact CG1-CB 3.92Å; V466-P485 HydrophobicContact CG1-CG 4.02Å; M482-P485 VanDerWaalsContact O-CD 3.23Å; M482-P485 WeakPolarHBondContact O-CD 3.22Å; M482-P485 VanDerWaalsContact O-CG 3.31Å; M482-P485 WeakPolarHBondContact O-CG 3.38Å; W483-P485 VanDerWaalsContact C-CD 3.48Å; P485-I487 PolarHBondContact O-N 2.83Å; P485-R488 WeakPolarHBondContact O-CB 3.28Å; P485-R488 PolarHBondContact O-N 2.84Å
486	W	56.7	Low	67.4	Low	149 Å²	149	83.8 Å²	83.8	56%	0.564	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-68.6	-10.7	-178	55.2	84.1	0	0	0	114.9	W484 Y491	W484-W486 HydrophobicContact CD2-CZ2 4.08Å; W484-W486 AromaticContact CE3-CE2 3.57Å; W484-W486 AromaticContact CE3-CH2 3.91Å; W484-W486 HydrophobicContact CE3-CH2 3.91Å; W484-W486 AromaticContact CE3-CZ2 3.07Å; W484-W486 HydrophobicContact CE3-CZ2 3.07Å; W484-W486 AromaticContact CE3-NE1 3.75Å; W484-W486 HydrophobicContact CZ3-CH2 4.21Å; W484-W486 AromaticContact CZ3-CZ2 3.4Å; W484-W486 HydrophobicContact CZ3-CZ2 3.4Å; W484-W486 VanDerWaalsContact CZ3-CZ2 3.4Å; W484-W486 PolarHBondContact O-N 3.18Å; W484-W486 VanDerWaalsContact O-N 3.16Å; W486-Y491 HydrophobicContact CB-CE1 3.88Å; W486-Y491 HydrophobicContact CB-CE2 4.45Å
487	I	56.9	Low	68.6	Low	129 Å²	129	84 Å²	84	66%	0.662	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-74.2	-18.8	172	-59.8	178	0	0	0	110.5	W484 P485	W484-I487 HydrophobicContact CB-CD1 3.48Å; W484-I487 VanDerWaalsContact CB-CD1 3.48Å; W484-I487 HydrophobicContact CB-CG1 3.91Å; W484-I487 HydrophobicContact CG-CD1 4.06Å; W484-I487 PolarHBondContact O-N 2.97Å; P485-I487 PolarHBondContact O-N 2.83Å
488	R	65.8	Low	69.5	Low	66 Å²	66	84.9 Å²	84.9	25%	0.249	39%	0.393	C	S	.	.	S	Bend	trans	-89.4	138	-178.9	-58.4	-169	178.9	-156.4	-8.5	111.2	M470 P485	M470-R488 PolarHBondContact SD-NH1 2.94Å; P485-R488 WeakPolarHBondContact O-CB 3.28Å; P485-R488 PolarHBondContact O-N 2.84Å
489	S	67.7	Low	70.1	Confident	96 Å²	96	86.3 Å²	86.3	67%	0.671	39%	0.391	S	S	*	.	S	Bend	trans	-65.2	141.5	166.1	54.2	0	0	0	0	109.7
490	N	83.2	Confident	70.8	Confident	75 Å²	75	82.1 Å²	82.1	40%	0.401	39%	0.388	S	S	.	.	S	Bend	trans	67.4	51.9	175.8	-46.4	-32.4	0	0	0	114.3	L446 P447 Q469	L446-N490 WeakPolarHBondContact CD2-O 3.2Å; P447-N490 HydrophobicContact CG-CB 4.03Å; Q469-N490 HydrophobicContact CB-CB 4.25Å; Q469-N490 PolarHBondContact N-O 3.49Å; Q469-N490 PolarHBondContact OE1-ND2 3.11Å; Q469-N490 VanDerWaalsContact OE1-ND2 3.15Å
491	Y	88.4	Confident	71.6	Confident	106 Å²	106	75.7 Å²	75.7	42%	0.416	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	151.6	167.7	87.2	-82.2	0	0	0	111	I467 W486	I467-Y491 WeakPolarHBondContact O-CA 3.14Å; W486-Y491 HydrophobicContact CB-CE1 3.88Å; W486-Y491 HydrophobicContact CB-CE2 4.45Å
492	V	92	Very high	72.5	Confident	23 Å²	23	75.9 Å²	75.9	14%	0.139	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	141.5	170.5	-65.7	0	0	0	0	109.4	V420 A444 L446 V466 I467	V420-V492 HydrophobicContact CG2-CG2 4.01Å; A444-V492 HydrophobicContact CB-CB 3.99Å; A444-V492 HydrophobicContact CB-CG1 3.77Å; A444-V492 HydrophobicContact CB-CG2 4.32Å; L446-V492 HydrophobicContact CD1-CG2 3.81Å; L446-V492 HydrophobicContact CD2-CB 4.36Å; L446-V492 HydrophobicContact CD2-CG1 3.69Å; L446-V492 HydrophobicContact CD2-CG2 3.94Å; L446-V492 HydrophobicContact CG-CG1 4.04Å; L446-V492 HydrophobicContact CG-CG2 3.83Å; V466-V492 WeakPolarHBondContact CA-O 3.18Å; I467-V492 HydrophobicContact CB-CG2 3.96Å; I467-V492 PolarHBondContact N-O 3.36Å; I467-V492 PolarHBondContact O-N 3.41Å
493	K	92.8	Very high	73.5	Confident	107 Å²	107	80.4 Å²	80.4	47%	0.465	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	118.9	170.3	177.5	174.1	174.9	171	0	108	E464 M465 V466	E464-K493 VanDerWaalsContact OE1-CE 3.27Å; E464-K493 WeakPolarHBondContact OE1-CE 3.38Å; E464-K493 IonicContact OE1-NZ 2.85Å; E464-K493 PolarHBondContact OE1-NZ 2.9Å; E464-K493 WeakPolarHBondContact OE2-CE 3.4Å; E464-K493 IonicContact OE2-NZ 2.86Å; E464-K493 PolarHBondContact OE2-NZ 3.46Å; M465-K493 CarbonylContact O-C 3.59Å; M465-K493 WeakPolarHBondContact O-CA 3.41Å; V466-K493 HydrophobicContact CG2-CB 4.4Å; V466-K493 HydrophobicContact CG2-CD 4.45Å; V466-K493 HydrophobicContact CG2-CG 4.15Å
494	L	93.6	Very high	74.8	Confident	3 Å²	3	80.9 Å²	80.9	2%	0.016	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	138.6	172.4	-49.5	177.5	0	0	0	108.2	V420 I422 T442 A444 E464 M465	V420-L494 HydrophobicContact CB-CD1 4.45Å; V420-L494 HydrophobicContact CG2-CD1 4.06Å; I422-L494 HydrophobicContact CB-CB 4.48Å; I422-L494 HydrophobicContact CB-CD1 4.44Å; I422-L494 HydrophobicContact CG2-CB 3.66Å; I422-L494 HydrophobicContact CG2-CD1 4.28Å; T442-L494 HydrophobicContact CG2-CB 4.22Å; T442-L494 HydrophobicContact CG2-CD2 3.88Å; A444-L494 HydrophobicContact CB-CD2 3.69Å; E464-L494 CarbonylContact C-O 3.57Å; E464-L494 WeakPolarHBondContact CA-O 3.43Å; M465-L494 HydrophobicContact CB-CB 4.38Å; M465-L494 PolarHBondContact N-O 3.06Å; M465-L494 PolarHBondContact O-N 3.37Å
495	T	91.8	Very high	75.7	Confident	55 Å²	55	74.6 Å²	74.6	34%	0.337	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	137.9	176.5	-61.4	0	0	0	0	108.4	T442 E464	T442-T495 PolarHBondContact OG1-O 3.38Å; E464-T495 HydrophobicContact CG-CG2 4.27Å
496	L	89.6	Confident	77	Confident	1 Å²	1	74.8 Å²	74.8	1%	0.005	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	117.5	178	-173	67.7	0	0	0	109.2	V410 I422 E423 N424 V440 S462 V463	V410-L496 HydrophobicContact CG1-CD2 3.84Å; V410-L496 HydrophobicContact CG2-CD2 4.28Å; I422-L496 HydrophobicContact CD1-CB 3.94Å; I422-L496 HydrophobicContact CD1-CD2 4.21Å; I422-L496 HydrophobicContact CG1-CB 4.3Å; I422-L496 HydrophobicContact CG1-CD2 3.97Å; I422-L496 HydrophobicContact CG2-CB 4.05Å; E423-L496 VanDerWaalsContact C-CD2 3.47Å; N424-L496 HydrophobicContact CB-CD2 4.36Å; N424-L496 VanDerWaalsContact CG-CD2 3.49Å; N424-L496 VanDerWaalsContact OD1-CD2 3.24Å; N424-L496 WeakPolarHBondContact OD1-CD2 3.37Å; V440-L496 HydrophobicContact CB-CD1 3.91Å; V440-L496 HydrophobicContact CG1-CD1 3.65Å; V440-L496 VanDerWaalsContact O-CD1 3.25Å; V440-L496 WeakPolarHBondContact O-CD1 3.02Å; S462-L496 CarbonylContact C-O 3.6Å; S462-L496 VanDerWaalsContact CA-O 3.22Å; S462-L496 WeakPolarHBondContact CA-O 3.24Å; S462-L496 WeakPolarHBondContact CB-O 3.39Å; V463-L496 PolarHBondContact N-O 2.95Å; V463-L496 PolarHBondContact O-N 2.78Å
497	P	84.6	Confident	78.5	Confident	69 Å²	69	67.7 Å²	67.7	45%	0.448	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	142.9	173.5	28.8	-33.6	0	0	0	110.4	N424 V440	N424-P497 PolarHBondContact ND2-O 2.81Å; V440-P497 HydrophobicContact CG1-CG 4.41Å
498	K	75.4	Confident	80.2	Confident	37 Å²	37	61.6 Å²	61.6	16%	0.161	31%	0.314	C	S	.	.			trans	-84.4	135.2	174.4	-74.6	175.2	167.3	-172.7	0	110.7	D458 R459 E460 A461 V463 S500	D458-K498 WeakPolarHBondContact OD1-CE 3.39Å; D458-K498 IonicContact OD1-NZ 2.62Å; D458-K498 PolarHBondContact OD1-NZ 3.04Å; R459-K498 VanDerWaalsContact O-CD 3.3Å; R459-K498 WeakPolarHBondContact O-CD 3.39Å; R459-K498 WeakPolarHBondContact O-CE 3.31Å; R459-K498 PolarHBondContact O-NZ 3.01Å; E460-K498 WeakPolarHBondContact O-CD 3.45Å; A461-K498 PolarHBondContact O-N 3.45Å; V463-K498 HydrophobicContact CG2-CG 4.48Å; K498-S500 VanDerWaalsContact C-N 3.3Å
499	F	67.5	Low	81.6	Confident	101 Å²	101	58.5 Å²	58.5	44%	0.443	30%	0.302	S	S	.	.	S	Bend	trans	-76.9	-17.7	170.5	-62.2	-66	0	0	0	113.2	N424 A438 V440	N424-F499 HydrophobicContact CB-CD2 4.28Å; N424-F499 HydrophobicContact CB-CE2 3.79Å; N424-F499 WeakPolarHBondContact ND2-CD2 3.33Å; N424-F499 WeakPolarHBondContact ND2-CE2 3.33Å; A438-F499 WeakPolarHBondContact O-CZ 3.47Å; V440-F499 HydrophobicContact CB-CZ 4.32Å; V440-F499 HydrophobicContact CG2-CE1 4.33Å; V440-F499 HydrophobicContact CG2-CZ 3.66Å
500	S	66.7	Low	83	Confident	86 Å²	86	54 Å²	54	60%	0.601	27%	0.271	S	S	*	.	S	Bend	trans	-140.9	124.2	-179.7	178.5	0	0	0	0	110.9	K498 S502	K498-S500 VanDerWaalsContact C-N 3.3Å; S500-S502 VanDerWaalsContact C-N 3.32Å; S500-S502 PolarHBondContact O-N 2.98Å
501	A	65	Low	83.6	Confident	71 Å²	71	51 Å²	51	59%	0.587	26%	0.255	S	S	*	.			trans	-76	83.1	172.1	0	0	0	0	0	109.5	E460	E460-A501 HydrophobicContact CG-CB 4.16Å
502	S	69.2	Low	84	Confident	45 Å²	45	46.5 Å²	46.5	32%	0.315	24%	0.237	S	C	.	.			trans	-90.7	121.7	168.3	179.1	0	0	0	0	109.9	S500 R504	S500-S502 VanDerWaalsContact C-N 3.32Å; S500-S502 PolarHBondContact O-N 2.98Å; S502-R504 VanDerWaalsContact C-N 3.34Å; S502-R504 PolarHBondContact OG-N 3.07Å
503	R	72.8	Confident	84	Confident	136 Å²	136	48.5 Å²	48.5	51%	0.513	25%	0.245	S	C	.	.			trans	-90.3	3.1	170.8	-61.6	-173.1	179.5	-159.4	-11.9	113.6	G361 M362 E460 Y532	G361-R503 WeakPolarHBondContact CA-O 3.45Å; M362-R503 PolarHBondContact N-O 3.49Å; E460-R503 IonicContact OE1-CZ 3.27Å; E460-R503 VanDerWaalsContact OE1-CZ 3.27Å; E460-R503 IonicContact OE1-NE 2.73Å; E460-R503 PolarHBondContact OE1-NE 2.8Å; E460-R503 IonicContact OE1-NH2 2.92Å; E460-R503 PolarHBondContact OE1-NH2 2.88Å; E460-R503 IonicContact OE2-CZ 3.78Å; E460-R503 IonicContact OE2-NE 3.7Å; E460-R503 IonicContact OE2-NH2 3.2Å; E460-R503 PolarHBondContact OE2-NH2 3.2Å; R503-Y532 WeakPolarHBondContact CD-OH 3.4Å
504	R	75.7	Confident	83.8	Confident	191 Å²	191	44.5 Å²	44.5	72%	0.721	23%	0.234	S	C	*	.	S	Bend	trans	-81.4	147.2	178	-67.8	-174.7	179.4	175.8	0.8	110.2	S502 R506	S502-R504 VanDerWaalsContact C-N 3.34Å; S502-R504 PolarHBondContact OG-N 3.07Å; R504-R506 PolarHBondContact O-N 3.21Å
505	P	76	Confident	83.5	Confident	4 Å²	4	45 Å²	45	3%	0.026	24%	0.236	C	C	.	.			trans	-57.5	138.4	174.5	23.5	-33.6	0	0	0	109.6	P356 I360 M362 A397	P356-P505 HydrophobicContact CG-CB 4.4Å; I360-P505 WeakPolarHBondContact O-CD 3.43Å; M362-P505 HydrophobicContact CE-CB 4.21Å; A397-P505 WeakPolarHBondContact CB-O 3Å
506	R	85.6	Confident	83.3	Confident	21 Å²	21	44.4 Å²	44.4	8%	0.079	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	144.6	176.3	-63.1	-163.4	-67.4	169.4	1.2	109.2	Q365 I394 T395 D409 D458 R504	Q365-R506 PolarHBondContact NE2-O 2.93Å; Q365-R506 PolarHBondContact OE1-O 3.38Å; I394-R506 HydrophobicContact CG2-CB 3.58Å; I394-R506 HydrophobicContact CG2-CG 4.33Å; I394-R506 VanDerWaalsContact CG2-CZ 3.41Å; T395-R506 CarbonylContact O-C 3.52Å; T395-R506 WeakPolarHBondContact O-CA 3.3Å; T395-R506 VanDerWaalsContact O-CB 3.27Å; T395-R506 WeakPolarHBondContact O-CB 2.9Å; D409-R506 IonicContact OD2-NH1 2.82Å; D458-R506 IonicContact OD1-CZ 3.72Å; D458-R506 IonicContact OD1-NE 3.81Å; D458-R506 IonicContact OD1-NH2 3.66Å; D458-R506 PolarHBondContact OD1-NH2 2.83Å; D458-R506 IonicContact OD2-CZ 3.82Å; D458-R506 VanDerWaalsContact OD2-CZ 3.28Å; D458-R506 IonicContact OD2-NE 2.67Å; D458-R506 PolarHBondContact OD2-NE 3.2Å; D458-R506 IonicContact OD2-NH2 3.28Å; D458-R506 PolarHBondContact OD2-NH2 2.83Å; R504-R506 PolarHBondContact O-N 3.21Å
507	S	88.4	Confident	83.2	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	137.3	175.2	-65.6	0	0	0	0	109.6	R352 T395 N396 A397 Y509	R352-S507 PolarHBondContact NH2-OG 2.88Å; T395-S507 PolarHBondContact N-O 3.01Å; T395-S507 PolarHBondContact O-N 3.22Å; N396-S507 PolarHBondContact O-OG 3.38Å; A397-S507 WeakPolarHBondContact CA-OG 3.5Å; A397-S507 PolarHBondContact O-OG 2.88Å; S507-Y509 VanDerWaalsContact CB-CE2 3.41Å
508	L	92.8	Very high	83.5	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	131.4	171	-63.6	176.7	0	0	0	109.6	R352 H353 L367 R393 I394 M456 Y527	R352-L508 WeakPolarHBondContact CA-O 3.13Å; H353-L508 HydrophobicContact CB-CB 4.19Å; H353-L508 PolarHBondContact N-O 3.18Å; L367-L508 HydrophobicContact CB-CD1 4.1Å; L367-L508 HydrophobicContact CD2-CD1 4.47Å; R393-L508 WeakPolarHBondContact O-CA 3.02Å; I394-L508 HydrophobicContact CB-CD2 4.31Å; I394-L508 HydrophobicContact CD1-CD2 4.29Å; I394-L508 HydrophobicContact CG1-CD2 3.72Å; I394-L508 HydrophobicContact CG2-CD2 4.15Å; M456-L508 HydrophobicContact CE-CD2 3.63Å; L508-Y527 HydrophobicContact CD1-CD2 3.67Å; L508-Y527 HydrophobicContact CD1-CE2 3.6Å
509	Y	95.2	Very high	84.4	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	134	175	-68	-103.2	0	0	0	109.4	Y350 V351 R352 I392 R393 T395 Y399 P401 V406 S507	Y350-Y509 HydrophobicContact CD1-CD1 4.45Å; Y350-Y509 AromaticContact CD2-CD1 3.46Å; Y350-Y509 HydrophobicContact CD2-CD1 3.46Å; Y350-Y509 VanDerWaalsContact CD2-CD1 3.46Å; Y350-Y509 AromaticContact CD2-CE1 3.71Å; Y350-Y509 HydrophobicContact CD2-CE1 3.71Å; Y350-Y509 AromaticContact CE2-CD1 3.83Å; Y350-Y509 HydrophobicContact CE2-CD1 3.83Å; Y350-Y509 AromaticContact CE2-CE1 3.54Å; Y350-Y509 HydrophobicContact CE2-CE1 3.54Å; Y350-Y509 AromaticContact CG-CD1 3.81Å; Y350-Y509 HydrophobicContact CG-CD1 3.81Å; Y350-Y509 HydrophobicContact CG-CE1 4.33Å; V351-Y509 CarbonylContact O-C 3.58Å; V351-Y509 VanDerWaalsContact O-CA 3.3Å; V351-Y509 WeakPolarHBondContact O-CA 3.43Å; R352-Y509 HydrophobicContact CB-CD1 4.09Å; R352-Y509 HydrophobicContact CB-CE1 3.95Å; R352-Y509 VanDerWaalsContact CD-OH 3.28Å; R352-Y509 WeakPolarHBondContact CD-OH 3.44Å; R352-Y509 HydrophobicContact CG-CD1 4.34Å; R352-Y509 HydrophobicContact CG-CE1 3.89Å; R352-Y509 HydrophobicContact CG-CE2 4.3Å; R352-Y509 PolarHBondContact NE-OH 3.33Å; R352-Y509 VanDerWaalsContact NE-OH 3.08Å; I392-Y509 CarbonylContact C-O 3.55Å; I392-Y509 VanDerWaalsContact CA-O 3.29Å; I392-Y509 WeakPolarHBondContact CA-O 3.43Å; R393-Y509 PolarHBondContact N-O 3.04Å; R393-Y509 PolarHBondContact O-N 3.21Å; T395-Y509 HydrophobicContact CG2-CD2 3.45Å; T395-Y509 VanDerWaalsContact CG2-CD2 3.45Å; T395-Y509 HydrophobicContact CG2-CE2 3.12Å; Y399-Y509 PolarHBondContact O-OH 3.18Å; P401-Y509 HydrophobicContact CG-CD1 4.47Å; P401-Y509 HydrophobicContact CG-CE1 3.82Å; V406-Y509 HydrophobicContact CB-CD1 4.45Å; V406-Y509 HydrophobicContact CG1-CD1 3.86Å; V406-Y509 HydrophobicContact CG1-CD2 3.93Å; V406-Y509 HydrophobicContact CG1-CE1 4.39Å; V406-Y509 HydrophobicContact CG1-CE2 4.47Å; V406-Y509 HydrophobicContact CG1-CG 3.61Å; V406-Y509 HydrophobicContact CG2-CD1 3.66Å; V406-Y509 HydrophobicContact CG2-CE1 4.31Å; V406-Y509 HydrophobicContact CG2-CG 4.12Å; S507-Y509 VanDerWaalsContact CB-CE2 3.41Å
510	I	97.2	Very high	85.8	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	127.8	176.8	-46.3	176.7	0	0	0	107.5	W319 M343 Y350 V351 L367 L390 V391 I392 L525	W319-I510 HydrophobicContact CH2-CD1 4.05Å; W319-I510 HydrophobicContact CZ3-CD1 3.94Å; W319-I510 HydrophobicContact CZ3-CG1 4.49Å; M343-I510 HydrophobicContact CE-CB 4.1Å; M343-I510 HydrophobicContact CE-CG2 3.56Å; Y350-I510 CarbonylContact C-O 3.55Å; Y350-I510 WeakPolarHBondContact CA-O 3.32Å; V351-I510 HydrophobicContact CB-CB 4.34Å; V351-I510 PolarHBondContact N-O 3.44Å; V351-I510 PolarHBondContact O-N 3.22Å; L367-I510 HydrophobicContact CD1-CD1 4.37Å; L367-I510 HydrophobicContact CD2-CD1 3.79Å; L367-I510 HydrophobicContact CD2-CG1 4.04Å; L390-I510 HydrophobicContact CD1-CG2 3.51Å; L390-I510 HydrophobicContact CG-CG2 4.22Å; V391-I510 CarbonylContact O-C 3.58Å; V391-I510 WeakPolarHBondContact O-CA 3.41Å; I392-I510 HydrophobicContact CG1-CG2 4.45Å; I510-L525 HydrophobicContact CD1-CD1 3.64Å; I510-L525 HydrophobicContact CD1-CD2 3.61Å; I510-L525 HydrophobicContact CD1-CG 4.23Å
511	Q	96.3	Very high	87.3	Confident	14 Å²	14	32.7 Å²	32.7	7%	0.065	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	164.3	-175.6	-42.5	-162.5	-88.9	0	0	111.5	G349 V391 P404 V406	G349-Q511 PolarHBondContact O-NE2 3.14Å; G349-Q511 VanDerWaalsContact O-NE2 3.08Å; V391-Q511 HydrophobicContact CB-CB 4.34Å; V391-Q511 PolarHBondContact N-O 2.63Å; V391-Q511 PolarHBondContact O-N 3.04Å; P404-Q511 PolarHBondContact O-NE2 2.98Å; V406-Q511 VanDerWaalsContact CB-OE1 3.32Å; V406-Q511 HydrophobicContact CG2-CG 4.3Å; V406-Q511 VanDerWaalsContact CG2-NE2 3.29Å
512	K	95.3	Very high	88.8	Confident	11 Å²	11	29.3 Å²	29.3	5%	0.048	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	131.2	166.8	176.8	171.4	-175.8	-72.6	0	109.1	M343 G345 S347 D515 V518 L520	M343-K512 HydrophobicContact CB-CB 3.96Å; M343-K512 HydrophobicContact CB-CD 3.99Å; M343-K512 HydrophobicContact CG-CB 4.49Å; M343-K512 HydrophobicContact SD-CB 3.73Å; M343-K512 PolarHBondContact SD-N 3.06Å; M343-K512 VanDerWaalsContact SD-N 3.41Å; G345-K512 WeakPolarHBondContact O-CE 3.4Å; G345-K512 PolarHBondContact O-NZ 3.5Å; S347-K512 WeakPolarHBondContact CB-O 3.23Å; K512-D515 PolarHBondContact NZ-O 2.94Å; K512-V518 WeakPolarHBondContact CE-O 3.23Å; K512-V518 PolarHBondContact NZ-O 3.49Å; K512-L520 HydrophobicContact CB-CD1 3.93Å; K512-L520 HydrophobicContact CD-CD1 4.14Å; K512-L520 HydrophobicContact CD-CG 4.02Å; K512-L520 HydrophobicContact CG-CD1 3.73Å; K512-L520 HydrophobicContact CG-CG 4.15Å
513	Q	92.8	Very high	89.9	Confident	65 Å²	65	27.7 Å²	27.7	30%	0.304	13%	0.13	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	147.5	161.5	177.4	169.4	-27.2	0	0	108.6	T388 G389 V391 Y413	T388-Q513 CarbonylContact C-O 3.56Å; T388-Q513 WeakPolarHBondContact CA-O 3.1Å; T388-Q513 WeakPolarHBondContact CG2-O 3.45Å; G389-Q513 PolarHBondContact N-O 2.74Å; G389-Q513 PolarHBondContact O-N 2.9Å; V391-Q513 HydrophobicContact CG2-CB 3.59Å; Y413-Q513 HydrophobicContact CE2-CB 4.36Å
514	G	89	Confident	90.8	Very high	22 Å²	22	24.7 Å²	24.7	23%	0.227	12%	0.122	C	C	.	.	S	Bend	trans	108.6	-165	176.1	0	0	0	0	0	115.1	T388	T388-G514 WeakPolarHBondContact OG1-CA 3.36Å
515	D	86.8	Confident	91.6	Very high	14 Å²	14	15.9 Å²	15.9	8%	0.075	9%	0.089	C	C	.	.			trans	-106.7	-180	-170.2	72	7.7	0	0	0	114	W346 K386 T388 K512 S517	W346-D515 HydrophobicContact CD2-CB 4.45Å; W346-D515 HydrophobicContact CE3-CB 3.89Å; W346-D515 HydrophobicContact CH2-CB 3.37Å; W346-D515 HydrophobicContact CZ2-CB 4.01Å; W346-D515 HydrophobicContact CZ3-CB 3.32Å; K386-D515 WeakPolarHBondContact CD-OD2 3.15Å; K386-D515 IonicContact NZ-OD2 2.9Å; K386-D515 PolarHBondContact NZ-OD2 3.2Å; T388-D515 PolarHBondContact OG1-N 3.38Å; K512-D515 PolarHBondContact NZ-O 2.94Å; D515-S517 PolarHBondContact O-N 3.33Å; D515-S517 VanDerWaalsContact OD1-CB 3.3Å; D515-S517 WeakPolarHBondContact OD1-CB 3.49Å; D515-S517 PolarHBondContact OD1-N 2.97Å; D515-S517 VanDerWaalsContact OD1-N 3.13Å; D515-S517 PolarHBondContact OD1-OG 3.22Å
516	S	88.3	Confident	92.3	Very high	42 Å²	42	19.5 Å²	19.5	29%	0.294	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-0.6	-177.8	55.7	0	0	0	0	115.6	W346 V518	W346-S516 PolarHBondContact NE1-OG 2.94Å; S516-V518 VanDerWaalsContact C-N 3.29Å; S516-V518 PolarHBondContact O-N 2.87Å
517	S	86.9	Confident	92.5	Very high	36 Å²	36	19.4 Å²	19.4	25%	0.252	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-22.5	-178.6	66.4	0	0	0	0	113.7	D376 D515	D376-S517 PolarHBondContact N-O 3.26Å; D515-S517 PolarHBondContact O-N 3.33Å; D515-S517 VanDerWaalsContact OD1-CB 3.3Å; D515-S517 WeakPolarHBondContact OD1-CB 3.49Å; D515-S517 PolarHBondContact OD1-N 2.97Å; D515-S517 VanDerWaalsContact OD1-N 3.13Å; D515-S517 PolarHBondContact OD1-OG 3.22Å
518	V	91.5	Very high	92.5	Very high	12 Å²	12	21.7 Å²	21.7	7%	0.073	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	123.9	180	-177.4	0	0	0	0	108.7	F373 V374 T375 R380 T388 K512 S516 L520	F373-V518 HydrophobicContact CB-CG1 4.2Å; F373-V518 HydrophobicContact CD1-CG1 3.89Å; V374-V518 WeakPolarHBondContact O-CA 2.83Å; T375-V518 HydrophobicContact CG2-CG2 4.29Å; R380-V518 HydrophobicContact CG-CG2 4.4Å; T388-V518 HydrophobicContact CG2-CB 3.76Å; T388-V518 HydrophobicContact CG2-CG1 4.28Å; K512-V518 WeakPolarHBondContact CE-O 3.23Å; K512-V518 PolarHBondContact NZ-O 3.49Å; S516-V518 VanDerWaalsContact C-N 3.29Å; S516-V518 PolarHBondContact O-N 2.87Å; V518-L520 HydrophobicContact CG1-CD2 4.31Å
519	D	94.3	Very high	92.1	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	150.2	169.1	-59.6	-51	0	0	0	109.6	R209 L212 R216 L344 G345 V374	R209-D519 IonicContact NH1-OD2 2.79Å; R209-D519 PolarHBondContact NH1-OD2 2.97Å; L212-D519 HydrophobicContact CD1-CB 4.04Å; R216-D519 IonicContact CZ-OD1 2.91Å; R216-D519 IonicContact CZ-OD2 3.31Å; R216-D519 VanDerWaalsContact CZ-OD2 3.27Å; R216-D519 IonicContact NH1-OD2 3.79Å; R216-D519 PolarHBondContact NH1-OD2 2.67Å; R216-D519 IonicContact NH2-OD1 3.79Å; R216-D519 PolarHBondContact NH2-OD1 2.77Å; R216-D519 IonicContact NH2-OD2 3.98Å; R216-D519 PolarHBondContact NH2-OD2 3.19Å; L344-D519 WeakPolarHBondContact CA-OD1 3.48Å; L344-D519 HydrophobicContact CD2-CB 3.92Å; G345-D519 PolarHBondContact N-OD1 3.21Å; V374-D519 HydrophobicContact CB-CB 4.21Å; V374-D519 PolarHBondContact N-O 3.02Å; V374-D519 PolarHBondContact O-N 2.8Å
520	L	96.4	Very high	91.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	133.4	175	-51.7	-178.6	0	0	0	109.3	A342 M343 L371 F373 G389 L390 K512 V518	A342-L520 CarbonylContact C-O 3.57Å; A342-L520 WeakPolarHBondContact CA-O 3.32Å; M343-L520 HydrophobicContact CB-CB 4.27Å; M343-L520 PolarHBondContact N-O 3.4Å; M343-L520 PolarHBondContact O-N 3.12Å; L371-L520 HydrophobicContact CD1-CB 4.1Å; L371-L520 HydrophobicContact CD1-CD1 4.49Å; L371-L520 HydrophobicContact CD1-CD2 4.28Å; F373-L520 HydrophobicContact CD1-CD2 3.42Å; F373-L520 VanDerWaalsContact CD1-CD2 3.42Å; F373-L520 HydrophobicContact CE1-CD2 3.52Å; F373-L520 HydrophobicContact CG-CD2 4.37Å; G389-L520 WeakPolarHBondContact O-CD1 3.48Å; L390-L520 HydrophobicContact CB-CD1 4.31Å; L390-L520 HydrophobicContact CD1-CD1 4.37Å; K512-L520 HydrophobicContact CB-CD1 3.93Å; K512-L520 HydrophobicContact CD-CD1 4.14Å; K512-L520 HydrophobicContact CD-CG 4.02Å; K512-L520 HydrophobicContact CG-CD1 3.73Å; K512-L520 HydrophobicContact CG-CG 4.15Å; V518-L520 HydrophobicContact CG1-CD2 4.31Å
521	L	97.1	Very high	90.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	114.5	168.7	171.6	70.4	0	0	0	108	W208 W243 D340 V341 A342 V372 R523	W208-L521 HydrophobicContact CD2-CD2 3.5Å; W208-L521 HydrophobicContact CE3-CD2 3.51Å; W208-L521 HydrophobicContact CG-CD2 4.19Å; W208-L521 HydrophobicContact CH2-CD2 3.79Å; W208-L521 HydrophobicContact CZ2-CD2 3.78Å; W208-L521 HydrophobicContact CZ3-CD2 3.66Å; W243-L521 HydrophobicContact CZ2-CD1 3.89Å; D340-L521 HydrophobicContact CB-CD1 4.32Å; V341-L521 CarbonylContact O-C 3.49Å; A342-L521 HydrophobicContact CB-CD1 4.09Å; V372-L521 HydrophobicContact CB-CB 4.13Å; V372-L521 WeakPolarHBondContact CB-O 3.5Å; V372-L521 PolarHBondContact N-O 3.29Å; V372-L521 PolarHBondContact O-N 3.41Å; L521-R523 HydrophobicContact CD1-CG 4.32Å; L521-R523 HydrophobicContact CD2-CG 3.8Å; L521-R523 HydrophobicContact CG-CG 3.68Å
522	V	96.9	Very high	89	Confident	1 Å²	1	34 Å²	34	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	107.5	174.4	-175.6	0	0	0	0	107.7	D340 V341 R370 L371 L390 F454 L525	D340-V522 CarbonylContact C-O 3.49Å; D340-V522 WeakPolarHBondContact CA-O 3.24Å; V341-V522 HydrophobicContact CB-CB 4.44Å; V341-V522 PolarHBondContact N-O 3.43Å; V341-V522 PolarHBondContact O-N 3.42Å; R370-V522 CarbonylContact O-C 3.56Å; R370-V522 VanDerWaalsContact O-CA 3.27Å; R370-V522 WeakPolarHBondContact O-CA 3.37Å; L371-V522 HydrophobicContact CD1-CG2 4.14Å; L390-V522 HydrophobicContact CD1-CG2 3.67Å; L390-V522 HydrophobicContact CD2-CG2 4.31Å; F454-V522 HydrophobicContact CE1-CG1 4.07Å; F454-V522 HydrophobicContact CZ-CG1 4.02Å; V522-L525 HydrophobicContact CG1-CB 4.46Å; V522-L525 HydrophobicContact CG1-CD1 3.9Å
523	R	93.5	Very high	87.4	Confident	11 Å²	11	39.7 Å²	39.7	4%	0.042	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	152	-178.4	-54.4	-176.2	59.4	-156.2	-2.6	111.8	E239 D340 R370 V372 L521 L525	E239-R523 VanDerWaalsContact CD-CZ 3.43Å; E239-R523 VanDerWaalsContact CD-NH1 3.32Å; E239-R523 IonicContact OE1-CZ 2.63Å; E239-R523 IonicContact OE1-NH1 3.51Å; E239-R523 PolarHBondContact OE1-NH1 2.67Å; E239-R523 IonicContact OE1-NH2 3.01Å; E239-R523 PolarHBondContact OE1-NH2 3.37Å; E239-R523 IonicContact OE2-CZ 3.19Å; E239-R523 IonicContact OE2-NH1 2.61Å; E239-R523 PolarHBondContact OE2-NH1 3.27Å; E239-R523 IonicContact OE2-NH2 3.5Å; E239-R523 PolarHBondContact OE2-NH2 2.83Å; D340-R523 WeakPolarHBondContact OD1-CA 3.3Å; D340-R523 IonicContact OD2-NE 3.57Å; R370-R523 HydrophobicContact CB-CB 4.19Å; R370-R523 PolarHBondContact N-O 3.21Å; R370-R523 PolarHBondContact O-N 3.24Å; V372-R523 HydrophobicContact CG2-CG 4.19Å; L521-R523 HydrophobicContact CD1-CG 4.32Å; L521-R523 HydrophobicContact CD2-CG 3.8Å; L521-R523 HydrophobicContact CG-CG 3.68Å; R523-L525 PolarHBondContact O-N 3.08Å
524	H	90	Very high	85.7	Confident	72 Å²	72	40.4 Å²	40.4	33%	0.333	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	53.1	43.6	176.8	-50.6	-56.4	0	0	0	112.1	D340 H526	D340-H524 PolarHBondContact OD1-N 2.87Å; H524-H526 PolarHBondContact O-N 2.74Å
525	L	92.8	Very high	83.8	Confident	6 Å²	6	43.7 Å²	43.7	3%	0.031	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	120.2	-179.8	-172.7	65.6	0	0	0	109.1	F315 W319 D339 V341 L367 I510 V522 R523	F315-L525 HydrophobicContact CE2-CD2 4.26Å; F315-L525 HydrophobicContact CZ-CD2 4.43Å; W319-L525 HydrophobicContact CD2-CD2 4.26Å; W319-L525 HydrophobicContact CE3-CD2 4.35Å; W319-L525 HydrophobicContact CH2-CD2 3.91Å; W319-L525 HydrophobicContact CH2-CG 4.21Å; W319-L525 HydrophobicContact CZ2-CD2 3.82Å; W319-L525 HydrophobicContact CZ2-CG 3.89Å; W319-L525 HydrophobicContact CZ3-CD2 4.17Å; D339-L525 WeakPolarHBondContact O-CB 3.04Å; D339-L525 PolarHBondContact O-N 2.82Å; V341-L525 HydrophobicContact CG2-CD2 3.98Å; L367-L525 HydrophobicContact CD1-CD1 3.6Å; L367-L525 HydrophobicContact CD1-CG 4.27Å; L367-L525 HydrophobicContact CG-CD1 4.29Å; I510-L525 HydrophobicContact CD1-CD1 3.64Å; I510-L525 HydrophobicContact CD1-CD2 3.61Å; I510-L525 HydrophobicContact CD1-CG 4.23Å; V522-L525 HydrophobicContact CG1-CB 4.46Å; V522-L525 HydrophobicContact CG1-CD1 3.9Å; R523-L525 PolarHBondContact O-N 3.08Å
526	H	90.4	Very high	81.9	Confident	80 Å²	80	46.3 Å²	46.3	37%	0.37	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	129.7	-177.5	-177.9	-30.7	0	0	0	109.8	T368 R479 H524	T368-H526 PolarHBondContact N-O 3.13Å; T368-H526 PolarHBondContact O-N 3.4Å; T368-H526 PolarHBondContact OG1-O 3.23Å; R479-H526 PolarHBondContact NH2-NE2 2.94Å; H524-H526 PolarHBondContact O-N 2.74Å
527	Y	90.2	Very high	80	Confident	20 Å²	20	48.7 Å²	48.7	8%	0.078	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	136.8	170.4	176.9	-96.7	0	0	0	110.5	H353 M362 Q365 L508	H353-Y527 AromaticContact CD2-CD1 3.86Å; H353-Y527 AromaticContact CD2-CG 3.6Å; H353-Y527 AromaticContact CE1-CD1 3.33Å; H353-Y527 WeakPolarHBondContact CE1-CD1 3.49Å; H353-Y527 AromaticContact CE1-CE1 3.21Å; H353-Y527 WeakPolarHBondContact CE1-CE1 3.31Å; H353-Y527 AromaticContact CE1-CE2 3.97Å; H353-Y527 AromaticContact CE1-CG 3.75Å; H353-Y527 AromaticContact CE1-CZ 3.52Å; H353-Y527 AromaticContact CG-CD2 3.97Å; H353-Y527 AromaticContact ND1-CE1 3.88Å; H353-Y527 AromaticContact ND1-CE2 3.8Å; H353-Y527 AromaticContact ND1-CZ 3.71Å; H353-Y527 AromaticContact NE2-CD1 3.16Å; H353-Y527 WeakPolarHBondContact NE2-CD1 3.38Å; H353-Y527 AromaticContact NE2-CE1 3.59Å; H353-Y527 AromaticContact NE2-CG 3.42Å; M362-Y527 WeakPolarHBondContact CE-OH 3.23Å; Q365-Y527 HydrophobicContact CB-CE2 3.79Å; Q365-Y527 HydrophobicContact CG-CE2 4.48Å; Q365-Y527 PolarHBondContact OE1-OH 3.39Å; L508-Y527 HydrophobicContact CD1-CD2 3.67Å; L508-Y527 HydrophobicContact CD1-CE2 3.6Å
528	S	88.4	Confident	78	Confident	47 Å²	47	56.2 Å²	56.2	33%	0.329	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	149.8	173.3	-167.9	0	0	0	0	109.8	W364 Q365 S366	W364-S528 WeakPolarHBondContact CH2-OG 3.44Å; Q365-S528 CarbonylContact C-O 3.57Å; Q365-S528 VanDerWaalsContact CA-O 3.3Å; Q365-S528 WeakPolarHBondContact CA-O 3.39Å; S366-S528 PolarHBondContact N-O 2.87Å; S366-S528 PolarHBondContact O-N 2.82Å
529	S	85.9	Confident	75.9	Confident	41 Å²	41	62 Å²	62	29%	0.287	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	152.8	177.7	63.1	0	0	0	0	111.7	W364	W364-S529 VanDerWaalsContact O-CA 3.31Å; W364-S529 WeakPolarHBondContact O-CA 3.39Å; W364-S529 WeakPolarHBondContact O-CB 3.46Å
530	E	81.8	Confident	73.7	Confident	98 Å²	98	66.6 Å²	66.6	46%	0.458	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	110.9	164.8	-175.3	160.9	-162.2	0	0	109.4	E363 W364	E363-E530 PolarHBondContact N-O 3.44Å; E363-E530 VanDerWaalsContact N-O 3.13Å; W364-E530 HydrophobicContact CD2-CB 4.27Å; W364-E530 HydrophobicContact CG-CB 4.31Å; W364-E530 HydrophobicContact CZ2-CB 3.97Å; W364-E530 PolarHBondContact NE1-OE2 3.09Å; W364-E530 PolarHBondContact O-N 3.3Å
531	A	70.7	Confident	71.6	Confident	56 Å²	56	70.2 Å²	70.2	46%	0.463	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	138.6	-175.7	0	0	0	0	0	110.2	I360 G361	I360-A531 HydrophobicContact CG2-CB 3.61Å; G361-A531 WeakPolarHBondContact O-CA 3.44Å
532	Y	70.5	Confident	69.3	Low	79 Å²	79	74.8 Å²	74.8	31%	0.31	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	151.2	169.7	63	-87.8	0	0	0	109.2	G361 E363 R503 V534	G361-Y532 VanDerWaalsContact C-CE1 3.44Å; G361-Y532 PolarHBondContact N-O 3.47Å; G361-Y532 WeakPolarHBondContact O-CD1 3.42Å; G361-Y532 PolarHBondContact O-N 2.94Å; G361-Y532 VanDerWaalsContact O-O 3.13Å; E363-Y532 HydrophobicContact CG-CD1 3.87Å; E363-Y532 HydrophobicContact CG-CE1 3.73Å; R503-Y532 WeakPolarHBondContact CD-OH 3.4Å; Y532-V534 HydrophobicContact CE2-CG2 4.46Å; Y532-V534 PolarHBondContact O-N 3.39Å
533	L	60.5	Low	67.1	Low	132 Å²	132	78.1 Å²	78.1	69%	0.691	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.6	125.6	172.8	-72.5	167.9	0	0	0	108.2	T535	L533-T535 PolarHBondContact O-N 3.28Å
534	V	58.6	Low	65.1	Low	79 Å²	79	79.9 Å²	79.9	48%	0.479	44%	0.442	S	S	.	.			trans	-68.7	92.5	161.8	-172.4	0	0	0	0	104.7	D359 Y532 S536	D359-V534 WeakPolarHBondContact O-CB 3.39Å; D359-V534 PolarHBondContact O-N 3.22Å; Y532-V534 HydrophobicContact CE2-CG2 4.46Å; Y532-V534 PolarHBondContact O-N 3.39Å; V534-S536 PolarHBondContact O-N 3.28Å
535	T	48.8	Very low	63.3	Low	92 Å²	92	81.3 Å²	81.3	56%	0.564	45%	0.452	S	S	*	.			trans	-59.4	100.1	166.2	51.1	0	0	0	0	105.4	L533 S537	L533-T535 PolarHBondContact O-N 3.28Å; T535-S537 PolarHBondContact O-N 3.11Å
536	S	47.4	Very low	61.5	Low	69 Å²	69	85 Å²	85	48%	0.483	47%	0.474	S	S	.	.			trans	-48.7	132.6	164.7	73.2	0	0	0	0	105.4	V534 R538 F539	V534-S536 PolarHBondContact O-N 3.28Å; S536-R538 PolarHBondContact O-N 3.12Å; S536-F539 PolarHBondContact O-N 3.34Å; S536-F539 VanDerWaalsContact O-N 3.1Å
537	S	48.6	Very low	59.8	Low	92 Å²	92	86.3 Å²	86.3	64%	0.643	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-1.9	-172.7	68.4	0	0	0	0	114.2	T535 F539 V540 T541	T535-S537 PolarHBondContact O-N 3.11Å; S537-F539 VanDerWaalsContact C-N 3.29Å; S537-F539 PolarHBondContact O-N 2.86Å; S537-V540 PolarHBondContact O-N 3.12Å; S537-T541 PolarHBondContact O-N 3.36Å; S537-T541 VanDerWaalsContact O-N 3.1Å
538	R	43.3	Very low	58.1	Low	193 Å²	193	89.9 Å²	89.9	73%	0.728	51%	0.506	S	S	*	.	H	α-helix	trans	-60.6	-29	168.9	-62.4	-162.3	175.7	-160.1	0.1	114.5	S536 T541 L542	S536-R538 PolarHBondContact O-N 3.12Å; R538-T541 VanDerWaalsContact C-OG1 3.25Å; R538-T541 VanDerWaalsContact CA-OG1 3.23Å; R538-T541 WeakPolarHBondContact CA-OG1 3.46Å; R538-T541 PolarHBondContact O-N 2.86Å; R538-T541 PolarHBondContact O-OG1 2.72Å; R538-L542 PolarHBondContact O-N 3.46Å; R538-L542 VanDerWaalsContact O-N 3.11Å
539	F	48.2	Very low	56.3	Low	134 Å²	134	91.2 Å²	91.2	59%	0.588	52%	0.515	S	S	*	.	H	α-helix	trans	-78.1	-33.6	174.2	-90	-78.4	0	0	0	112.8	S536 S537 T541 L542 S543	S536-F539 PolarHBondContact O-N 3.34Å; S536-F539 VanDerWaalsContact O-N 3.1Å; S537-F539 VanDerWaalsContact C-N 3.29Å; S537-F539 PolarHBondContact O-N 2.86Å; F539-T541 PolarHBondContact O-N 3.25Å; F539-L542 PolarHBondContact O-N 2.89Å; F539-S543 PolarHBondContact O-N 3.46Å; F539-S543 PolarHBondContact O-OG 3.44Å; F539-S543 VanDerWaalsContact O-OG 3.08Å
540	V	48.7	Very low	54.5	Low	96 Å²	96	93.5 Å²	93.5	58%	0.582	53%	0.528	S	S	*	.	H	α-helix	trans	-63.6	-34.7	170.3	-179.4	0	0	0	0	110.1	S537 L542 A544	S537-V540 PolarHBondContact O-N 3.12Å; V540-L542 VanDerWaalsContact C-N 3.34Å; V540-L542 PolarHBondContact O-N 3.44Å; V540-A544 WeakPolarHBondContact O-CB 3.13Å; V540-A544 PolarHBondContact O-N 3.27Å
541	T	51.2	Low	53.2	Low	76 Å²	76	94.3 Å²	94.3	47%	0.466	54%	0.539	S	S	.	.	H	α-helix	trans	-69.6	-27.4	170.8	53	0	0	0	0	113.6	S537 R538 F539 L545	S537-T541 PolarHBondContact O-N 3.36Å; S537-T541 VanDerWaalsContact O-N 3.1Å; R538-T541 VanDerWaalsContact C-OG1 3.25Å; R538-T541 VanDerWaalsContact CA-OG1 3.23Å; R538-T541 WeakPolarHBondContact CA-OG1 3.46Å; R538-T541 PolarHBondContact O-N 2.86Å; R538-T541 PolarHBondContact O-OG1 2.72Å; F539-T541 PolarHBondContact O-N 3.25Å; T541-L545 WeakPolarHBondContact O-CB 3.16Å; T541-L545 WeakPolarHBondContact O-CD1 3.42Å; T541-L545 VanDerWaalsContact O-CG 3.28Å; T541-L545 WeakPolarHBondContact O-CG 3.49Å; T541-L545 PolarHBondContact O-N 3.28Å
542	L	48.7	Very low	52.4	Low	96 Å²	96	95.3 Å²	95.3	50%	0.503	55%	0.547	S	S	.	.	H	α-helix	trans	-78	-38.6	176.8	-119.5	141.5	0	0	0	111.7	R538 F539 V540 L545 V546	R538-L542 PolarHBondContact O-N 3.46Å; R538-L542 VanDerWaalsContact O-N 3.11Å; F539-L542 PolarHBondContact O-N 2.89Å; V540-L542 VanDerWaalsContact C-N 3.34Å; V540-L542 PolarHBondContact O-N 3.44Å; L542-L545 PolarHBondContact O-N 2.96Å; L542-V546 WeakPolarHBondContact O-CB 3.34Å; L542-V546 VanDerWaalsContact O-CG2 3.26Å; L542-V546 WeakPolarHBondContact O-CG2 3.41Å; L542-V546 PolarHBondContact O-N 3.3Å
543	S	50.5	Low	51.5	Low	72 Å²	72	96.7 Å²	96.7	50%	0.503	56%	0.564	S	S	.	*	H	α-helix	trans	-64	-41.8	169.3	-45.7	0	0	0	0	111.2	F539 V546 I547	F539-S543 PolarHBondContact O-N 3.46Å; F539-S543 PolarHBondContact O-OG 3.44Å; F539-S543 VanDerWaalsContact O-OG 3.08Å; S543-V546 PolarHBondContact O-N 3.47Å; S543-I547 VanDerWaalsContact O-CG1 3.27Å; S543-I547 WeakPolarHBondContact O-CG1 3.32Å; S543-I547 PolarHBondContact O-N 2.81Å
544	A	51.8	Low	50.6	Low	48 Å²	48	100.9 Å²	100.9	40%	0.397	57%	0.572	S	S	.	*	H	α-helix	trans	-66.9	-37.8	174.4	0	0	0	0	0	112.1	V540 I547 V548	V540-A544 WeakPolarHBondContact O-CB 3.13Å; V540-A544 PolarHBondContact O-N 3.27Å; A544-I547 PolarHBondContact O-N 3.06Å; A544-V548 WeakPolarHBondContact O-CB 3.42Å; A544-V548 WeakPolarHBondContact O-CG2 3.18Å; A544-V548 PolarHBondContact O-N 3.43Å
545	L	52	Low	49.9	Very low	101 Å²	101	101.5 Å²	101.5	53%	0.529	58%	0.578	S	S	.	*	H	α-helix	trans	-70.4	-35.9	175.9	-88.9	158	0	0	0	112.4	T541 L542 V548 C549	T541-L545 WeakPolarHBondContact O-CB 3.16Å; T541-L545 WeakPolarHBondContact O-CD1 3.42Å; T541-L545 VanDerWaalsContact O-CG 3.28Å; T541-L545 WeakPolarHBondContact O-CG 3.49Å; T541-L545 PolarHBondContact O-N 3.28Å; L542-L545 PolarHBondContact O-N 2.96Å; L545-V548 PolarHBondContact O-N 3.19Å; L545-C549 VanDerWaalsContact O-CB 3.24Å; L545-C549 WeakPolarHBondContact O-CB 3.45Å; L545-C549 PolarHBondContact O-N 2.81Å; L545-C549 PolarHBondContact O-SG 3.5Å
546	V	55.9	Low	49.5	Very low	84 Å²	84	105.8 Å²	105.8	51%	0.509	60%	0.596	S	S	.	*	H	α-helix	trans	-67.3	-41	174.1	172.5	0	0	0	0	110.2	L542 S543 C549 T550	L542-V546 WeakPolarHBondContact O-CB 3.34Å; L542-V546 VanDerWaalsContact O-CG2 3.26Å; L542-V546 WeakPolarHBondContact O-CG2 3.41Å; L542-V546 PolarHBondContact O-N 3.3Å; S543-V546 PolarHBondContact O-N 3.47Å; V546-C549 PolarHBondContact O-N 2.95Å; V546-T550 WeakPolarHBondContact O-CG2 3.5Å; V546-T550 PolarHBondContact O-N 2.93Å; V546-T550 PolarHBondContact O-OG1 3.06Å
547	I	54.3	Low	49.5	Very low	108 Å²	108	112.1 Å²	112.1	55%	0.554	63%	0.631	S	S	*	*	H	α-helix	trans	-64.4	-43.3	174.9	-66.9	167.7	0	0	0	110.7	S543 A544 T550 V551	S543-I547 VanDerWaalsContact O-CG1 3.27Å; S543-I547 WeakPolarHBondContact O-CG1 3.32Å; S543-I547 PolarHBondContact O-N 2.81Å; A544-I547 PolarHBondContact O-N 3.06Å; I547-T550 WeakPolarHBondContact CA-OG1 3.42Å; I547-T550 PolarHBondContact O-N 3.11Å; I547-T550 PolarHBondContact O-OG1 3.02Å; I547-V551 VanDerWaalsContact O-CG2 3.28Å; I547-V551 WeakPolarHBondContact O-CG2 3.38Å; I547-V551 PolarHBondContact O-N 3.19Å
548	V	53.9	Low	49.5	Very low	94 Å²	94	113.2 Å²	113.2	57%	0.57	63%	0.631	S	S	*	*	H	α-helix	trans	-66.8	-37.3	177.1	172.4	0	0	0	0	111.9	A544 L545 V551 A552	A544-V548 WeakPolarHBondContact O-CB 3.42Å; A544-V548 WeakPolarHBondContact O-CG2 3.18Å; A544-V548 PolarHBondContact O-N 3.43Å; L545-V548 PolarHBondContact O-N 3.19Å; V548-V551 PolarHBondContact O-N 3Å; V548-A552 WeakPolarHBondContact O-CB 3.49Å; V548-A552 PolarHBondContact O-N 2.58Å; V548-A552 VanDerWaalsContact O-N 3.09Å
549	C	50.7	Low	49.9	Very low	75 Å²	75	108.9 Å²	108.9	51%	0.507	63%	0.626	S	S	.	*	H	α-helix	trans	-71.9	-33.6	176	-74.7	0	0	0	0	112.7	L545 V546 V553	L545-C549 VanDerWaalsContact O-CB 3.24Å; L545-C549 WeakPolarHBondContact O-CB 3.45Å; L545-C549 PolarHBondContact O-N 2.81Å; L545-C549 PolarHBondContact O-SG 3.5Å; V546-C549 PolarHBondContact O-N 2.95Å; C549-V553 WeakPolarHBondContact O-CG2 3.48Å; C549-V553 PolarHBondContact O-N 3.42Å
550	T	49.5	Very low	50	Low	90 Å²	90	107.6 Å²	107.6	55%	0.552	63%	0.628	S	S	*	*	H	α-helix	trans	-72.8	-30.1	174.8	50.6	0	0	0	0	112.9	V546 I547	V546-T550 WeakPolarHBondContact O-CG2 3.5Å; V546-T550 PolarHBondContact O-N 2.93Å; V546-T550 PolarHBondContact O-OG1 3.06Å; I547-T550 WeakPolarHBondContact CA-OG1 3.42Å; I547-T550 PolarHBondContact O-N 3.11Å; I547-T550 PolarHBondContact O-OG1 3.02Å
551	V	53.5	Low	50	Low	115 Å²	115	108.2 Å²	108.2	70%	0.697	63%	0.63	S	S	*	*	H	α-helix	trans	-79.4	-24.6	177.1	176.6	0	0	0	0	111.7	I547 V548	I547-V551 VanDerWaalsContact O-CG2 3.28Å; I547-V551 WeakPolarHBondContact O-CG2 3.38Å; I547-V551 PolarHBondContact O-N 3.19Å; V548-V551 PolarHBondContact O-N 3Å
552	A	54.4	Low	50	Low	77 Å²	77	110.3 Å²	110.3	64%	0.636	64%	0.641	S	S	*	*	H	α-helix	trans	-87.6	-7.4	179.7	0	0	0	0	0	115.3	V548	V548-A552 WeakPolarHBondContact O-CB 3.49Å; V548-A552 PolarHBondContact O-N 2.58Å; V548-A552 VanDerWaalsContact O-N 3.09Å
553	V	52	Low	50.1	Low	108 Å²	108	111.2 Å²	111.2	66%	0.655	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.3	32.3	-177	-164.9	0	0	0	0	112.7	C549	C549-V553 WeakPolarHBondContact O-CG2 3.48Å; C549-V553 PolarHBondContact O-N 3.42Å
554	Y	40.8	Very low	50	Low	219 Å²	219	114 Å²	114	86%	0.859	66%	0.66	S	S	*	*	S	Bend	trans	-111.7	101	155.8	-110	-90.9	0	0	0	109.5
555	P	44.6	Very low	49.9	Very low	93 Å²	93	119.1 Å²	119.1	60%	0.604	68%	0.681	S	S	*	*			trans	-91.4	151.8	-156.7	35.7	-34.8	0	0	0	112.7	V557	P555-V557 VanDerWaalsContact C-N 3.32Å; P555-V557 PolarHBondContact O-N 3.22Å; P555-V557 VanDerWaalsContact O-N 3.08Å
556	L	40.1	Very low	49.7	Very low	181 Å²	181	120.6 Å²	120.6	95%	0.948	69%	0.693	S	S	*	*			trans	-58.5	95.2	145	-83.8	130.7	0	0	0	108.9
557	V	47.2	Very low	49.2	Very low	203 Å²	203	123.9 Å²	123.9	100%	1.23	71%	0.71	S	S	*	*			trans	-141.5	0	145	-179.4	0	0	0	0	108	P555	P555-V557 VanDerWaalsContact C-N 3.32Å; P555-V557 PolarHBondContact O-N 3.22Å; P555-V557 VanDerWaalsContact O-N 3.08Å

Retrieved 557 of 557 residues in 211.9 ms (Link to these results)

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